PDB_id,complex_type,uniprot_id,seq1,seq2,prot_SEQRES,pep_SEQRES,len_seq1,len_seq2,ligand_SMILES,affinity_measure,affinity,affinity_download,ligand_aaseq_exist,twoseq_A/M,twoseqM_aff_S/T,ligand_SMILES_exist,SMILES_A/M,SMILES_M_aff_S/T,MHC_family,source,pep_rep_chain,prot_rep_chain,note,exist_structure,contact_map,len_seq1_seqres,len_seq2_seqres,pep_x,Fasta2SMILES,REACT_SMILES,Merge_SMILES,wt_confidence_score,smiles_confidence_score,wt_complex_plddt_score,smiles_complex_plddt_score,wt_complex_pde_score,smiles_complex_pde_score,wt_ptm_score,smiles_ptm_score,wt_iptm_score,smiles_iptm_score,wt_sequence,affinity_class,aff_bin,split
2P8Q,protein-peptide,Q14974 O95149,MELITILEKTVSPDRLELEAAQKFLERAAVENLPTFLVELSRVLANPGNSQVARVAAGLQIKNSLTSKDPDIKAQYQQRWLAIDANARREVKNYVLQTLGTETYRPSSASQCVAGIACAEIPVNQWPELIPQLVANVTNPNSTEHMKESTLEAIGYICQDIDPEQLQDKSNEILTAIIQGMRKEEPSNNVKLAATNALLNSLEFTKANFDKESERHFIMQVVCEATQCPDTRVRVAALQNLVKIMSLYYQYMETYMGPALFAITIEAMKSDIDEVALQGIEFWSNVCDEEMDLAIEASEAAEQGRPPEHTSKFYAKGALQYLVPILTQTLTKQDENDDDDDWNPCKAAGVCLMLLATCCEDDIVPHVLPFIKEHIKNPDWRYRDAAVMAFGCILEGPEPSQLKPLVIQAMPTLIELMKDPSVVVRDTAAWTVGRICELLPEAAINDVYLAPLLQCLIEGLSAEPRVASNVCWAFSSLAEAAYEAADVADDQEEPATYCLSSSFELIVQKLLETTDRPDGHQNNLRSSAYESLMEIVKNSAKDCYPAVQKTTLVIMERLQQVLQMESHIQSTSDRIQFNDLQSLLCATLQNVLRKVQHQDALQISDVVMASLLRMFQSTAGSGGVQEDALMAVSTLVEVLGGEFLKYMEAFKPFLGIGLKNYAEYQVCLAAVGLVGDLCRALQSNIIPFCDEVMQLLLENLGNENVHRSVKPQILSVFGDIALAIGGEFKKYLEVVLNTLQQASQAQVDKSDYDMVDYLNELRESCLEAYTGIVQGLKGDQENVHPDVMLVQPRVEFILSFIDHIAGDEDHTDGVVACAAGLIGDLCTAFGKDVLKLVEARPMIHELLTEGRRSKTNKAKTLATWATKELRKLKNQA,HPRLSQYKSKYSSLEQSERRRRLLELQKSKRLDYVNHARR,MET-GLU-LEU-ILE-THR-ILE-LEU-GLU-LYS-THR-VAL-SER-PRO-ASP-ARG-LEU-GLU-LEU-GLU-ALA-ALA-GLN-LYS-PHE-LEU-GLU-ARG-ALA-ALA-VAL-GLU-ASN-LEU-PRO-THR-PHE-LEU-VAL-GLU-LEU-SER-ARG-VAL-LEU-ALA-ASN-PRO-GLY-ASN-SER-GLN-VAL-ALA-ARG-VAL-ALA-ALA-GLY-LEU-GLN-ILE-LYS-ASN-SER-LEU-THR-SER-LYS-ASP-PRO-ASP-ILE-LYS-ALA-GLN-TYR-GLN-GLN-ARG-TRP-LEU-ALA-ILE-ASP-ALA-ASN-ALA-ARG-ARG-GLU-VAL-LYS-ASN-TYR-VAL-LEU-GLN-THR-LEU-GLY-THR-GLU-THR-TYR-ARG-PRO-SER-SER-ALA-SER-GLN-CYS-VAL-ALA-GLY-ILE-ALA-CYS-ALA-GLU-ILE-PRO-VAL-ASN-GLN-TRP-PRO-GLU-LEU-ILE-PRO-GLN-LEU-VAL-ALA-ASN-VAL-THR-ASN-PRO-ASN-SER-THR-GLU-HIS-MET-LYS-GLU-SER-THR-LEU-GLU-ALA-ILE-GLY-TYR-ILE-CYS-GLN-ASP-ILE-ASP-PRO-GLU-GLN-LEU-GLN-ASP-LYS-SER-ASN-GLU-ILE-LEU-THR-ALA-ILE-ILE-GLN-GLY-MET-ARG-LYS-GLU-GLU-PRO-SER-ASN-ASN-VAL-LYS-LEU-ALA-ALA-THR-ASN-ALA-LEU-LEU-ASN-SER-LEU-GLU-PHE-THR-LYS-ALA-ASN-PHE-ASP-LYS-GLU-SER-GLU-ARG-HIS-PHE-ILE-MET-GLN-VAL-VAL-CYS-GLU-ALA-THR-GLN-CYS-PRO-ASP-THR-ARG-VAL-ARG-VAL-ALA-ALA-LEU-GLN-ASN-LEU-VAL-LYS-ILE-MET-SER-LEU-TYR-TYR-GLN-TYR-MET-GLU-THR-TYR-MET-GLY-PRO-ALA-LEU-PHE-ALA-ILE-THR-ILE-GLU-ALA-MET-LYS-SER-ASP-ILE-ASP-GLU-VAL-ALA-LEU-GLN-GLY-ILE-GLU-PHE-TRP-SER-ASN-VAL-CYS-ASP-GLU-GLU-MET-ASP-LEU-ALA-ILE-GLU-ALA-SER-GLU-ALA-ALA-GLU-GLN-GLY-ARG-PRO-PRO-GLU-HIS-THR-SER-LYS-PHE-TYR-ALA-LYS-GLY-ALA-LEU-GLN-TYR-LEU-VAL-PRO-ILE-LEU-THR-GLN-THR-LEU-THR-LYS-GLN-ASP-GLU-ASN-ASP-ASP-ASP-ASP-ASP-TRP-ASN-PRO-CYS-LYS-ALA-ALA-GLY-VAL-CYS-LEU-MET-LEU-LEU-ALA-THR-CYS-CYS-GLU-ASP-ASP-ILE-VAL-PRO-HIS-VAL-LEU-PRO-PHE-ILE-LYS-GLU-HIS-ILE-LYS-ASN-PRO-ASP-TRP-ARG-TYR-ARG-ASP-ALA-ALA-VAL-MET-ALA-PHE-GLY-CYS-ILE-LEU-GLU-GLY-PRO-GLU-PRO-SER-GLN-LEU-LYS-PRO-LEU-VAL-ILE-GLN-ALA-MET-PRO-THR-LEU-ILE-GLU-LEU-MET-LYS-ASP-PRO-SER-VAL-VAL-VAL-ARG-ASP-THR-ALA-ALA-TRP-THR-VAL-GLY-ARG-ILE-CYS-GLU-LEU-LEU-PRO-GLU-ALA-ALA-ILE-ASN-ASP-VAL-TYR-LEU-ALA-PRO-LEU-LEU-GLN-CYS-LEU-ILE-GLU-GLY-LEU-SER-ALA-GLU-PRO-ARG-VAL-ALA-SER-ASN-VAL-CYS-TRP-ALA-PHE-SER-SER-LEU-ALA-GLU-ALA-ALA-TYR-GLU-ALA-ALA-ASP-VAL-ALA-ASP-ASP-GLN-GLU-GLU-PRO-ALA-THR-TYR-CYS-LEU-SER-SER-SER-PHE-GLU-LEU-ILE-VAL-GLN-LYS-LEU-LEU-GLU-THR-THR-ASP-ARG-PRO-ASP-GLY-HIS-GLN-ASN-ASN-LEU-ARG-SER-SER-ALA-TYR-GLU-SER-LEU-MET-GLU-ILE-VAL-LYS-ASN-SER-ALA-LYS-ASP-CYS-TYR-PRO-ALA-VAL-GLN-LYS-THR-THR-LEU-VAL-ILE-MET-GLU-ARG-LEU-GLN-GLN-VAL-LEU-GLN-MET-GLU-SER-HIS-ILE-GLN-SER-THR-SER-ASP-ARG-ILE-GLN-PHE-ASN-ASP-LEU-GLN-SER-LEU-LEU-CYS-ALA-THR-LEU-GLN-ASN-VAL-LEU-ARG-LYS-VAL-GLN-HIS-GLN-ASP-ALA-LEU-GLN-ILE-SER-ASP-VAL-VAL-MET-ALA-SER-LEU-LEU-ARG-MET-PHE-GLN-SER-THR-ALA-GLY-SER-GLY-GLY-VAL-GLN-GLU-ASP-ALA-LEU-MET-ALA-VAL-SER-THR-LEU-VAL-GLU-VAL-LEU-GLY-GLY-GLU-PHE-LEU-LYS-TYR-MET-GLU-ALA-PHE-LYS-PRO-PHE-LEU-GLY-ILE-GLY-LEU-LYS-ASN-TYR-ALA-GLU-TYR-GLN-VAL-CYS-LEU-ALA-ALA-VAL-GLY-LEU-VAL-GLY-ASP-LEU-CYS-ARG-ALA-LEU-GLN-SER-ASN-ILE-ILE-PRO-PHE-CYS-ASP-GLU-VAL-MET-GLN-LEU-LEU-LEU-GLU-ASN-LEU-GLY-ASN-GLU-ASN-VAL-HIS-ARG-SER-VAL-LYS-PRO-GLN-ILE-LEU-SER-VAL-PHE-GLY-ASP-ILE-ALA-LEU-ALA-ILE-GLY-GLY-GLU-PHE-LYS-LYS-TYR-LEU-GLU-VAL-VAL-LEU-ASN-THR-LEU-GLN-GLN-ALA-SER-GLN-ALA-GLN-VAL-ASP-LYS-SER-ASP-TYR-ASP-MET-VAL-ASP-TYR-LEU-ASN-GLU-LEU-ARG-GLU-SER-CYS-LEU-GLU-ALA-TYR-THR-GLY-ILE-VAL-GLN-GLY-LEU-LYS-GLY-ASP-GLN-GLU-ASN-VAL-HIS-PRO-ASP-VAL-MET-LEU-VAL-GLN-PRO-ARG-VAL-GLU-PHE-ILE-LEU-SER-PHE-ILE-ASP-HIS-ILE-ALA-GLY-ASP-GLU-ASP-HIS-THR-ASP-GLY-VAL-VAL-ALA-CYS-ALA-ALA-GLY-LEU-ILE-GLY-ASP-LEU-CYS-THR-ALA-PHE-GLY-LYS-ASP-VAL-LEU-LYS-LEU-VAL-GLU-ALA-ARG-PRO-MET-ILE-HIS-GLU-LEU-LEU-THR-GLU-GLY-ARG-ARG-SER-LYS-THR-ASN-LYS-ALA-LYS-THR-LEU-ALA-THR-TRP-ALA-THR-LYS-GLU-LEU-ARG-LYS-LEU-LYS-ASN-GLN-ALA,HIS-PRO-ARG-LEU-SER-GLN-TYR-LYS-SER-LYS-TYR-SER-SER-LEU-GLU-GLN-SER-GLU-ARG-ARG-ARG-ARG-LEU-LEU-GLU-LEU-GLN-LYS-SER-LYS-ARG-LEU-ASP-TYR-VAL-ASN-HIS-ALA-ARG-ARG,876,40,,Kd=15.6nM,7.806875,7.81,1,M,S,0,M,S,0,,B,A,,1,1,876,40,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.6298828721046448,0.5096946954727173,61.68162536621094,56.04314041137695,0.5743774175643921,1.8596996068954468,0.7803274393081665,0.6891876459121704,0.5656614899635315,0.4648214280605316,HPRLSQYKSKYSSLEQSERRRRLLELQKSKRLDYVNHARR,Moderate,"(7.523, 7.921]",train
4DM6,protein-peptide,Q15788 P10826,MGSSHHHHHHSSGLVPRGSHMESYEMTAELDDLTEKIRKAHQETFPSLCQLGKYTTNSSADHRVRLDLGLWDKFSELATKCIIKIVEFAKRLPGFTGLTIADQITLLKAACLDILILRICTRYTPEQDTMTFSDGLTLNRTQMHNAGFGPLTDLVFTFANQLLPLEMDDTETGLLSAICLICGDRQDLEEPTKVDKLQEPLLEALKIYIRKRRPSKPHMFPKILMKITDLRSISAKGAERVITLKMEIPGSMPPLIQEMLENSEGHE,CPSSHSSLTERHKILHRLLQEGSPS,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-GLU-SER-TYR-GLU-MET-THR-ALA-GLU-LEU-ASP-ASP-LEU-THR-GLU-LYS-ILE-ARG-LYS-ALA-HIS-GLN-GLU-THR-PHE-PRO-SER-LEU-CYS-GLN-LEU-GLY-LYS-TYR-THR-THR-ASN-SER-SER-ALA-ASP-HIS-ARG-VAL-ARG-LEU-ASP-LEU-GLY-LEU-TRP-ASP-LYS-PHE-SER-GLU-LEU-ALA-THR-LYS-CYS-ILE-ILE-LYS-ILE-VAL-GLU-PHE-ALA-LYS-ARG-LEU-PRO-GLY-PHE-THR-GLY-LEU-THR-ILE-ALA-ASP-GLN-ILE-THR-LEU-LEU-LYS-ALA-ALA-CYS-LEU-ASP-ILE-LEU-ILE-LEU-ARG-ILE-CYS-THR-ARG-TYR-THR-PRO-GLU-GLN-ASP-THR-MET-THR-PHE-SER-ASP-GLY-LEU-THR-LEU-ASN-ARG-THR-GLN-MET-HIS-ASN-ALA-GLY-PHE-GLY-PRO-LEU-THR-ASP-LEU-VAL-PHE-THR-PHE-ALA-ASN-GLN-LEU-LEU-PRO-LEU-GLU-MET-ASP-ASP-THR-GLU-THR-GLY-LEU-LEU-SER-ALA-ILE-CYS-LEU-ILE-CYS-GLY-ASP-ARG-GLN-ASP-LEU-GLU-GLU-PRO-THR-LYS-VAL-ASP-LYS-LEU-GLN-GLU-PRO-LEU-LEU-GLU-ALA-LEU-LYS-ILE-TYR-ILE-ARG-LYS-ARG-ARG-PRO-SER-LYS-PRO-HIS-MET-PHE-PRO-LYS-ILE-LEU-MET-LYS-ILE-THR-ASP-LEU-ARG-SER-ILE-SER-ALA-LYS-GLY-ALA-GLU-ARG-VAL-ILE-THR-LEU-LYS-MET-GLU-ILE-PRO-GLY-SER-MET-PRO-PRO-LEU-ILE-GLN-GLU-MET-LEU-GLU-ASN-SER-GLU-GLY-HIS-GLU,CYS-PRO-SER-SER-HIS-SER-SER-LEU-THR-GLU-ARG-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-GLU-GLY-SER-PRO-SER,267,25,,Kd=1.5uM,5.823909,5.82,1,M,S,0,M,S,0,,E,A,,1,1,267,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O,0.8757614493370056,0.6696943640708923,76.969482421875,69.55729675292969,0.4582322835922241,1.09611976146698,0.8465487957000732,0.7467027902603149,0.7781845331192017,0.5942624807357788,CPSSHSSLTERHKILHRLLQEGSPS,Low,"(5.821, 5.959]",train
1FMO,protein-peptide,P61926 P05132,GNAAAAKKGSEQESVKEFLAKAKEDFLKKWETPSQNTAQLDQFDRIKTLGTGSFGRVMLVKHKESGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVAGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGRRNAIHD,GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SER-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-ASP-PHE-LEU-LYS-LYS-TRP-GLU-THR-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-GLN-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-SER-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-ALA-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SER-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-ARG-ARG-ASN-ALA-ILE-HIS-ASP,350,20,,Ki=2.3nM,8.638272,8.64,1,M,S,0,M,S,0,,I,E,,0,1,350,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9562020301818848,0.7529705762863159,90.45220947265624,80.77127075195312,0.3790321946144104,0.9253080487251282,0.9288762211799622,0.8767560124397278,0.9258712530136108,0.7220242023468018,TTYADFIASGRTGRRNAIHD,Moderate,"(8.383, 8.824]",val
2KWJ,protein-peptide,Q92784 P68431,GSYCDFCLGGSNMNKKSGRPEELVSCADCGRSGHPTCLQFTLNMTEAVKTYKWQCIECKSCILCGTSENDDQLLFCDDCDRGYHMYCLNPPVAEPPEGSWSCHLCWELLKEKAS,ARTKQTARKSTGGKAPRKQL,GLY-SER-TYR-CYS-ASP-PHE-CYS-LEU-GLY-GLY-SER-ASN-MET-ASN-LYS-LYS-SER-GLY-ARG-PRO-GLU-GLU-LEU-VAL-SER-CYS-ALA-ASP-CYS-GLY-ARG-SER-GLY-HIS-PRO-THR-CYS-LEU-GLN-PHE-THR-LEU-ASN-MET-THR-GLU-ALA-VAL-LYS-THR-TYR-LYS-TRP-GLN-CYS-ILE-GLU-CYS-LYS-SER-CYS-ILE-LEU-CYS-GLY-THR-SER-GLU-ASN-ASP-ASP-GLN-LEU-LEU-PHE-CYS-ASP-ASP-CYS-ASP-ARG-GLY-TYR-HIS-MET-TYR-CYS-LEU-ASN-PRO-PRO-VAL-ALA-GLU-PRO-PRO-GLU-GLY-SER-TRP-SER-CYS-HIS-LEU-CYS-TRP-GLU-LEU-LEU-LYS-GLU-LYS-ALA-SER,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN-LEU,114,20,,Kd=0.5uM,6.30103,6.3,1,M,T,0,M,T,0,,B,A,,1,1,114,20,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9197825193405152,0.6596791744232178,88.2654800415039,86.53099060058594,0.4000897109508514,0.9951555132865906,0.8718869686126709,0.762615978717804,0.838472843170166,0.6339449286460876,ARTKQTARKSTGGKAPRKQL,Low,"(6.26, 6.398]",train
3G7Z,protein-peptide,P62554 P62552,MQFKVYTYKRESRYRLFVDVQSDIIDTPGRRMVIPLASARLLSDKVSRELYPVVHIGDESWRMMTTDMASVPVSVIGEEVADLSHRENDIKNAINLMFWGI,RRLRAERWKAENQEGMAEVARFIEMNGSFADENRDW,MET-GLN-PHE-LYS-VAL-TYR-THR-TYR-LYS-ARG-GLU-SER-ARG-TYR-ARG-LEU-PHE-VAL-ASP-VAL-GLN-SER-ASP-ILE-ILE-ASP-THR-PRO-GLY-ARG-ARG-MET-VAL-ILE-PRO-LEU-ALA-SER-ALA-ARG-LEU-LEU-SER-ASP-LYS-VAL-SER-ARG-GLU-LEU-TYR-PRO-VAL-VAL-HIS-ILE-GLY-ASP-GLU-SER-TRP-ARG-MET-MET-THR-THR-ASP-MET-ALA-SER-VAL-PRO-VAL-SER-VAL-ILE-GLY-GLU-GLU-VAL-ALA-ASP-LEU-SER-HIS-ARG-GLU-ASN-ASP-ILE-LYS-ASN-ALA-ILE-ASN-LEU-MET-PHE-TRP-GLY-ILE,ARG-ARG-LEU-ARG-ALA-GLU-ARG-TRP-LYS-ALA-GLU-ASN-GLN-GLU-GLY-MET-ALA-GLU-VAL-ALA-ARG-PHE-ILE-GLU-MET-ASN-GLY-SER-PHE-ALA-ASP-GLU-ASN-ARG-ASP-TRP,101,36,,Kd=20pM,10.69897,10.7,1,M,T,0,M,T,0,,C,A,dimer,1,1,101,36,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,0.8864612579345703,0.5990166664123535,83.68980407714844,70.50870513916016,0.4279148578643799,1.2562062740325928,0.873167872428894,0.6697984337806702,0.7848576307296753,0.5813212394714355,RRLRAERWKAENQEGMAEVARFIEMNGSFADENRDW,High,"(8.824, 12.12]",train
4NM3,protein-peptide,P49841 O15169,MSGRPRTTSFAESCKPVQQPSAFGSMKVSRDKDGSKVTTVVATPGQGPDRPQEVSYTDTKVIGNGSFGVVYQAKLCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRYFFYSSGEKKDEVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKLYMYQLFRSLAYIHSFGICHRDIKPQNLLLDPDTAVLKLCDFGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDVWSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQIREMNPNYTEFKFPQIKAHPWTKVFRPRTPPEAIALCSRLLEYTPTARLTPLEACAHSFFDELRDPNVKLPNGRDTPALFNFTTQELSSNPPLATILIPPHARHHHHHH,GGILVEPQKFAEELIHRLEAVQRT,MET-SER-GLY-ARG-PRO-ARG-THR-THR-SEP-PHE-ALA-GLU-SER-CYS-LYS-PRO-VAL-GLN-GLN-PRO-SER-ALA-PHE-GLY-SER-MET-LYS-VAL-SER-ARG-ASP-LYS-ASP-GLY-SER-LYS-VAL-THR-THR-VAL-VAL-ALA-THR-PRO-GLY-GLN-GLY-PRO-ASP-ARG-PRO-GLN-GLU-VAL-SER-TYR-THR-ASP-THR-LYS-VAL-ILE-GLY-ASN-GLY-SER-PHE-GLY-VAL-VAL-TYR-GLN-ALA-LYS-LEU-CYS-ASP-SER-GLY-GLU-LEU-VAL-ALA-ILE-LYS-LYS-VAL-LEU-GLN-ASP-LYS-ARG-PHE-LYS-ASN-ARG-GLU-LEU-GLN-ILE-MET-ARG-LYS-LEU-ASP-HIS-CYS-ASN-ILE-VAL-ARG-LEU-ARG-TYR-PHE-PHE-TYR-SER-SER-GLY-GLU-LYS-LYS-ASP-GLU-VAL-TYR-LEU-ASN-LEU-VAL-LEU-ASP-TYR-VAL-PRO-GLU-THR-VAL-TYR-ARG-VAL-ALA-ARG-HIS-TYR-SER-ARG-ALA-LYS-GLN-THR-LEU-PRO-VAL-ILE-TYR-VAL-LYS-LEU-TYR-MET-TYR-GLN-LEU-PHE-ARG-SER-LEU-ALA-TYR-ILE-HIS-SER-PHE-GLY-ILE-CYS-HIS-ARG-ASP-ILE-LYS-PRO-GLN-ASN-LEU-LEU-LEU-ASP-PRO-ASP-THR-ALA-VAL-LEU-LYS-LEU-CYS-ASP-PHE-GLY-SER-ALA-LYS-GLN-LEU-VAL-ARG-GLY-GLU-PRO-ASN-VAL-SER-TYR-ILE-CYS-SER-ARG-TYR-TYR-ARG-ALA-PRO-GLU-LEU-ILE-PHE-GLY-ALA-THR-ASP-TYR-THR-SER-SER-ILE-ASP-VAL-TRP-SER-ALA-GLY-CYS-VAL-LEU-ALA-GLU-LEU-LEU-LEU-GLY-GLN-PRO-ILE-PHE-PRO-GLY-ASP-SER-GLY-VAL-ASP-GLN-LEU-VAL-GLU-ILE-ILE-LYS-VAL-LEU-GLY-THR-PRO-THR-ARG-GLU-GLN-ILE-ARG-GLU-MET-ASN-PRO-ASN-TYR-THR-GLU-PHE-LYS-PHE-PRO-GLN-ILE-LYS-ALA-HIS-PRO-TRP-THR-LYS-VAL-PHE-ARG-PRO-ARG-THR-PRO-PRO-GLU-ALA-ILE-ALA-LEU-CYS-SER-ARG-LEU-LEU-GLU-TYR-THR-PRO-THR-ALA-ARG-LEU-THR-PRO-LEU-GLU-ALA-CYS-ALA-HIS-SER-PHE-PHE-ASP-GLU-LEU-ARG-ASP-PRO-ASN-VAL-LYS-LEU-PRO-ASN-GLY-ARG-ASP-THR-PRO-ALA-LEU-PHE-ASN-PHE-THR-THR-GLN-GLU-LEU-SER-SER-ASN-PRO-PRO-LEU-ALA-THR-ILE-LEU-ILE-PRO-PRO-HIS-ALA-ARG-HIS-HIS-HIS-HIS-HIS-HIS,GLY-GLY-ILE-LEU-VAL-GLU-PRO-GLN-LYS-PHE-ALA-GLU-GLU-LEU-ILE-HIS-ARG-LEU-GLU-ALA-VAL-GLN-ARG-THR,389,24,,Ki=60uM,4.221849,4.22,1,M,S,0,M,S,0,,B,A,,0,1,389,24,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.9064227342605592,0.7339679002761841,83.76901245117188,78.75421905517578,0.6373783946037292,1.2246092557907104,0.8613578081130981,0.8193548917770386,0.843536376953125,0.6708473563194275,GGILVEPQKFAEELIHRLEAVQRT,Low,"(4.155, 4.319]",train
3KJ1,protein-peptide,O43521 Q07820,GSDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGG,RPEIWAAQELRRIGDEFNAYYR,GLY-SER-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY-GLY,ARG-PRO-GLU-ILE-TRP-ALA-ALA-GLN-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-PHE-ASN-ALA-TYR-TYR-ARG,158,22,,Kd=2nM,8.69897,8.7,1,A,A,0,M,S,0,,B,A,,1,1,158,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9904386401176452,0.6961708068847656,92.11456298828124,83.46333312988281,0.325971245765686,1.0212817192077637,0.9385332465171814,0.787448525428772,0.9443871974945068,0.6733513474464417,RPEIWAAQELRRIGDEFNAYYR,Moderate,"(8.383, 8.824]",train
3KJ2,protein-peptide,O43521 Q07820,GSDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGG,RPEIWIAQELRRIGDEENAYYR,GLY-SER-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY-GLY,ARG-PRO-GLU-ILE-TRP-ILE-ALA-GLN-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-GLU-ASN-ALA-TYR-TYR-ARG,158,22,,Kd=2nM,8.69897,8.7,1,A,A,0,M,S,0,,B,A,,1,1,158,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9871140122413636,0.7137735486030579,90.71988677978516,83.48186492919922,0.349418967962265,1.0000977516174316,0.9277110695838928,0.7896534204483032,0.9359924793243408,0.6789807677268982,RPEIWIAQELRRIGDEENAYYR,Moderate,"(8.383, 8.824]",train
1AN1,protein-peptide,P80424 P00761,IVGGYTCAANSIPYQVSLNSGSHFCGGSLINSQWVVSAAHCYKSRIQVRLGEHNIDVLEGNEQFINAAKIITHPNFNGNTLDNDIMLIKLSSPATLDSRVATVSLPRSCAAAGTECLISGWGNTKSSGSSYPSLLQCLKAPVLSDSSCKSSYPGQITGNMICVGFLEGGKDSCQGDSGGPVVCNGQLQGIVSWGYGCAQKNKPGVYTKVCNYVNWIQQTIAAN,KKVCACPKILKPVCGSDGRTYANSCIARCNGVSIKSEGSCPTGILN,ILE-VAL-GLY-GLY-TYR-THR-CYS-ALA-ALA-ASN-SER-ILE-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-SER-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-ARG-ILE-GLN-VAL-ARG-LEU-GLY-GLU-HIS-ASN-ILE-ASP-VAL-LEU-GLU-GLY-ASN-GLU-GLN-PHE-ILE-ASN-ALA-ALA-LYS-ILE-ILE-THR-HIS-PRO-ASN-PHE-ASN-GLY-ASN-THR-LEU-ASP-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-SER-SER-PRO-ALA-THR-LEU-DAS-SER-ARG-VAL-ALA-THR-VAL-SER-LEU-PRO-ARG-SER-CYS-ALA-ALA-ALA-GLY-THR-GLU-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-SER-SER-TYR-PRO-SER-LEU-LEU-GLN-CYS-LEU-LYS-ALA-PRO-VAL-LEU-SER-ASP-SER-SER-CYS-LYS-SER-SER-TYR-PRO-GLY-GLN-ILE-THR-GLY-ASN-MET-ILE-CYS-VAL-GLY-PHE-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-ASN-GLY-GLN-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-TYR-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-ASN-TRP-ILE-GLN-GLN-THR-ILE-ALA-ALA-ASN,LYS-LYS-VAL-CYS-ALA-CYS-PRO-LYS-ILE-LEU-LYS-PRO-VAL-CYS-GLY-SER-ASP-GLY-ARG-THR-TYR-ALA-ASN-SER-CYS-ILE-ALA-ARG-CYS-ASN-GLY-VAL-SER-ILE-LYS-SER-GLU-GLY-SER-CYS-PRO-THR-GLY-ILE-LEU-ASN,223,46,,Ki=0.9nM,9.045757,9.05,1,A,A,0,M,T,0,,I,E,,1,1,223,46,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C,0.8143096566200256,0.5705450773239136,87.30482482910156,85.10478210449219,0.4889582693576813,1.3294482231140137,0.910636067390442,0.7068986296653748,0.7530532479286194,0.5364567041397095,KKVCACPKILKPVCGSDGRTYANSCIARCNGVSIKSEGSCPTGILN,High,"(8.824, 12.12]",train
1DPJ,protein-peptide,P01094 P07267,GGHDVPLTNYLNAQYYTDITLGTPPQNFKVILDTGSSNLWVPSNECGSLACFLHSKYDHEASSSYKANGTEFAIQYGTGSLEGYISQDTLSIGDLTIPKQDFAEATSEPGLTFAFGKFDGILGLGYDTISVDKVVPPFYNAIQQDLLDEKRFAFYLGDTSKDTENGGEATFGGIDESKFKGDITWLPVRRKAYWEVKFEGIGLGDEYAELESHGAAIDTGTSLITLPSGLAEMINAEIGAKKGWTGQYTLDCNTRDNLPDLIFNFNGYNFTIGPYDYTLEVSGSCISAITPMDFPEPVGPLAIVGDAFLRKYYSIYDLGNNAVGLAKAI,NTDQQKVSEIFQSSKEKLQGDAKVVSDAFKKMA,GLY-GLY-HIS-ASP-VAL-PRO-LEU-THR-ASN-TYR-LEU-ASN-ALA-GLN-TYR-TYR-THR-ASP-ILE-THR-LEU-GLY-THR-PRO-PRO-GLN-ASN-PHE-LYS-VAL-ILE-LEU-ASP-THR-GLY-SER-SER-ASN-LEU-TRP-VAL-PRO-SER-ASN-GLU-CYS-GLY-SER-LEU-ALA-CYS-PHE-LEU-HIS-SER-LYS-TYR-ASP-HIS-GLU-ALA-SER-SER-SER-TYR-LYS-ALA-ASN-GLY-THR-GLU-PHE-ALA-ILE-GLN-TYR-GLY-THR-GLY-SER-LEU-GLU-GLY-TYR-ILE-SER-GLN-ASP-THR-LEU-SER-ILE-GLY-ASP-LEU-THR-ILE-PRO-LYS-GLN-ASP-PHE-ALA-GLU-ALA-THR-SER-GLU-PRO-GLY-LEU-THR-PHE-ALA-PHE-GLY-LYS-PHE-ASP-GLY-ILE-LEU-GLY-LEU-GLY-TYR-ASP-THR-ILE-SER-VAL-ASP-LYS-VAL-VAL-PRO-PRO-PHE-TYR-ASN-ALA-ILE-GLN-GLN-ASP-LEU-LEU-ASP-GLU-LYS-ARG-PHE-ALA-PHE-TYR-LEU-GLY-ASP-THR-SER-LYS-ASP-THR-GLU-ASN-GLY-GLY-GLU-ALA-THR-PHE-GLY-GLY-ILE-ASP-GLU-SER-LYS-PHE-LYS-GLY-ASP-ILE-THR-TRP-LEU-PRO-VAL-ARG-ARG-LYS-ALA-TYR-TRP-GLU-VAL-LYS-PHE-GLU-GLY-ILE-GLY-LEU-GLY-ASP-GLU-TYR-ALA-GLU-LEU-GLU-SER-HIS-GLY-ALA-ALA-ILE-ASP-THR-GLY-THR-SER-LEU-ILE-THR-LEU-PRO-SER-GLY-LEU-ALA-GLU-MET-ILE-ASN-ALA-GLU-ILE-GLY-ALA-LYS-LYS-GLY-TRP-THR-GLY-GLN-TYR-THR-LEU-ASP-CYS-ASN-THR-ARG-ASP-ASN-LEU-PRO-ASP-LEU-ILE-PHE-ASN-PHE-ASN-GLY-TYR-ASN-PHE-THR-ILE-GLY-PRO-TYR-ASP-TYR-THR-LEU-GLU-VAL-SER-GLY-SER-CYS-ILE-SER-ALA-ILE-THR-PRO-MET-ASP-PHE-PRO-GLU-PRO-VAL-GLY-PRO-LEU-ALA-ILE-VAL-GLY-ASP-ALA-PHE-LEU-ARG-LYS-TYR-TYR-SER-ILE-TYR-ASP-LEU-GLY-ASN-ASN-ALA-VAL-GLY-LEU-ALA-LYS-ALA-ILE,ASN-THR-ASP-GLN-GLN-LYS-VAL-SER-GLU-ILE-PHE-GLN-SER-SER-LYS-GLU-LYS-LEU-GLN-GLY-ASP-ALA-LYS-VAL-VAL-SER-ASP-ALA-PHE-LYS-LYS-MET-ALA,329,33,,Ki=3nM,8.522879,8.52,1,A,A,0,M,T,0,,B,A,,1,1,329,33,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)N)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)N)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O,0.9114662408828736,0.6865975856781006,93.4500961303711,83.64559173583984,0.3853181302547455,1.1801729202270508,0.9355098605155944,0.8175193071365356,0.8778310418128967,0.6538671255111694,NTDQQKVSEIFQSSKEKLQGDAKVVSDAFKKMA,Moderate,"(8.383, 8.824]",train
1G9I,protein-peptide,P01062 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,EPCCDSCRCTKSIPPQCHCANI,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLU-PRO-CYS-CYS-ASP-SER-CYS-ARG-CYS-THR-LYS-SER-ILE-PRO-PRO-GLN-CYS-HIS-CYS-ALA-ASN-ILE,223,22,,Kd=0.12uM,6.920819,6.92,1,A,A,0,M,S,0,,I,E,,1,1,223,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)O,0.9492682814598083,0.6648070812225342,96.0413818359375,90.39539337158205,0.3168331980705261,0.990644872188568,0.95741206407547,0.8213840126991272,0.9089670181274414,0.6256628036499023,EPCCDSCRCTKSIPPQCHCANI,Low,"(6.824, 7.049]",train
1GL0,protein-peptide,P80060 P00766,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,EEKCTPGQVKQQDCNTCTCTPTGVWGCTLMGCQPA,CYS-GLY-VAL-PRO-ALA-ILE-GLN-PRO-VAL-LEU-SER-GLY-LEU-SER-ARG-ILE-VAL-ASN-GLY-GLU-GLU-ALA-VAL-PRO-GLY-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-GLN-ASP-LYS-THR-GLY-PHE-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-GLU-ASN-TRP-VAL-VAL-THR-ALA-ALA-HIS-CYS-GLY-VAL-THR-THR-SER-ASP-VAL-VAL-VAL-ALA-GLY-GLU-PHE-ASP-GLN-GLY-SER-SER-SER-GLU-LYS-ILE-GLN-LYS-LEU-LYS-ILE-ALA-LYS-VAL-PHE-LYS-ASN-SER-LYS-TYR-ASN-SER-LEU-THR-ILE-ASN-ASN-ASP-ILE-THR-LEU-LEU-LYS-LEU-SER-THR-ALA-ALA-SER-PHE-SER-GLN-THR-VAL-SER-ALA-VAL-CYS-LEU-PRO-SER-ALA-SER-ASP-ASP-PHE-ALA-ALA-GLY-THR-THR-CYS-VAL-THR-THR-GLY-TRP-GLY-LEU-THR-ARG-TYR-THR-ASN-ALA-ASN-THR-PRO-ASP-ARG-LEU-GLN-GLN-ALA-SER-LEU-PRO-LEU-LEU-SER-ASN-THR-ASN-CYS-LYS-LYS-TYR-TRP-GLY-THR-LYS-ILE-LYS-ASP-ALA-MET-ILE-CYS-ALA-GLY-ALA-SER-GLY-VAL-SER-SER-CYS-MET-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-LYS-LYS-ASN-GLY-ALA-TRP-THR-LEU-VAL-GLY-ILE-VAL-SER-TRP-GLY-SER-SER-THR-CYS-SER-THR-SER-THR-PRO-GLY-VAL-TYR-ALA-ARG-VAL-THR-ALA-LEU-VAL-ASN-TRP-VAL-GLN-GLN-THR-LEU-ALA-ALA-ASN,GLU-GLU-LYS-CYS-THR-PRO-GLY-GLN-VAL-LYS-GLN-GLN-ASP-CYS-ASN-THR-CYS-THR-CYS-THR-PRO-THR-GLY-VAL-TRP-GLY-CYS-THR-LEU-MET-GLY-CYS-GLN-PRO-ALA,245,35,,Ki=0.8nM,9.09691,9.1,1,A,A,0,M,T,0,,I,E,,1,1,245,35,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,0.7916850447654724,0.5690383911132812,86.70677185058594,85.5328369140625,0.5990737676620483,1.3452627658843994,0.9182108044624328,0.7309356927871704,0.7555893063545227,0.5285640358924866,EEKCTPGQVKQQDCNTCTCTPTGVWGCTLMGCQPA,High,"(8.824, 12.12]",train
1GL1,protein-peptide,P80060 P00766,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,EISCEPGKTFKDKCNTCRCGADGKSAACTLKACPNQ,CYS-GLY-VAL-PRO-ALA-ILE-GLN-PRO-VAL-LEU-SER-GLY-LEU-SER-ARG-ILE-VAL-ASN-GLY-GLU-GLU-ALA-VAL-PRO-GLY-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-GLN-ASP-LYS-THR-GLY-PHE-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-GLU-ASN-TRP-VAL-VAL-THR-ALA-ALA-HIS-CYS-GLY-VAL-THR-THR-SER-ASP-VAL-VAL-VAL-ALA-GLY-GLU-PHE-ASP-GLN-GLY-SER-SER-SER-GLU-LYS-ILE-GLN-LYS-LEU-LYS-ILE-ALA-LYS-VAL-PHE-LYS-ASN-SER-LYS-TYR-ASN-SER-LEU-THR-ILE-ASN-ASN-ASP-ILE-THR-LEU-LEU-LYS-LEU-SER-THR-ALA-ALA-SER-PHE-SER-GLN-THR-VAL-SER-ALA-VAL-CYS-LEU-PRO-SER-ALA-SER-ASP-ASP-PHE-ALA-ALA-GLY-THR-THR-CYS-VAL-THR-THR-GLY-TRP-GLY-LEU-THR-ARG-TYR-THR-ASN-ALA-ASN-THR-PRO-ASP-ARG-LEU-GLN-GLN-ALA-SER-LEU-PRO-LEU-LEU-SER-ASN-THR-ASN-CYS-LYS-LYS-TYR-TRP-GLY-THR-LYS-ILE-LYS-ASP-ALA-MET-ILE-CYS-ALA-GLY-ALA-SER-GLY-VAL-SER-SER-CYS-MET-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-LYS-LYS-ASN-GLY-ALA-TRP-THR-LEU-VAL-GLY-ILE-VAL-SER-TRP-GLY-SER-SER-THR-CYS-SER-THR-SER-THR-PRO-GLY-VAL-TYR-ALA-ARG-VAL-THR-ALA-LEU-VAL-ASN-TRP-VAL-GLN-GLN-THR-LEU-ALA-ALA-ASN,GLU-ILE-SER-CYS-GLU-PRO-GLY-LYS-THR-PHE-LYS-ASP-LYS-CYS-ASN-THR-CYS-ARG-CYS-GLY-ALA-ASP-GLY-LYS-SER-ALA-ALA-CYS-THR-LEU-LYS-ALA-CYS-PRO-ASN-GLN,245,36,,Ki=0.13nM,9.886057,9.89,1,A,A,0,M,T,0,,I,A,,1,1,245,36,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,0.8009755611419678,0.6660524606704712,86.7251205444336,87.14137268066406,0.5836178064346313,1.034308671951294,0.9161470532417296,0.7878599762916565,0.7521648406982422,0.6356006264686584,EISCEPGKTFKDKCNTCRCGADGKSAACTLKACPNQ,High,"(8.824, 12.12]",train
1JGN,protein-peptide,Q9BPZ3 P11940,GPLGSPLTASMLASAPPQEQKQMLGERLFPLIQAMHPTLAGKITGMLLEIDNSELLHMLESPESLRSKVDEAVAVLQAHQAKEAAQKAVNSATGVPTV,VVKSNLNPNAKEFVPGVKYGNI,GLY-PRO-LEU-GLY-SER-PRO-LEU-THR-ALA-SER-MET-LEU-ALA-SER-ALA-PRO-PRO-GLN-GLU-GLN-LYS-GLN-MET-LEU-GLY-GLU-ARG-LEU-PHE-PRO-LEU-ILE-GLN-ALA-MET-HIS-PRO-THR-LEU-ALA-GLY-LYS-ILE-THR-GLY-MET-LEU-LEU-GLU-ILE-ASP-ASN-SER-GLU-LEU-LEU-HIS-MET-LEU-GLU-SER-PRO-GLU-SER-LEU-ARG-SER-LYS-VAL-ASP-GLU-ALA-VAL-ALA-VAL-LEU-GLN-ALA-HIS-GLN-ALA-LYS-GLU-ALA-ALA-GLN-LYS-ALA-VAL-ASN-SER-ALA-THR-GLY-VAL-PRO-THR-VAL,VAL-VAL-LYS-SER-ASN-LEU-ASN-PRO-ASN-ALA-LYS-GLU-PHE-VAL-PRO-GLY-VAL-LYS-TYR-GLY-ASN-ILE,98,22,,Kd=0.35uM,6.455932,6.46,1,A,A,0,M,T,0,,B,A,,1,1,98,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,1.0537514686584473,0.9072951674461364,74.93843841552734,78.35802459716797,0.4177455306053161,0.7573615908622742,0.816699743270874,0.8068461418151855,0.8525976538658142,0.7602135539054871,VVKSNLNPNAKEFVPGVKYGNI,Low,"(6.398, 6.523]",train
1JH4,protein-peptide,P11940 Q9H074,GPLGSPLTASMLASAPPQEQKQMLGERLFPLIQAMHPTLAGKITGMLLEIDNSELLHMLESPESLRSKVDEAVAVLQAHQAKEAAQKAVNSATGVPTV,VLMSKLSVNAPEFYPSGYSSSY,GLY-PRO-LEU-GLY-SER-PRO-LEU-THR-ALA-SER-MET-LEU-ALA-SER-ALA-PRO-PRO-GLN-GLU-GLN-LYS-GLN-MET-LEU-GLY-GLU-ARG-LEU-PHE-PRO-LEU-ILE-GLN-ALA-MET-HIS-PRO-THR-LEU-ALA-GLY-LYS-ILE-THR-GLY-MET-LEU-LEU-GLU-ILE-ASP-ASN-SER-GLU-LEU-LEU-HIS-MET-LEU-GLU-SER-PRO-GLU-SER-LEU-ARG-SER-LYS-VAL-ASP-GLU-ALA-VAL-ALA-VAL-LEU-GLN-ALA-HIS-GLN-ALA-LYS-GLU-ALA-ALA-GLN-LYS-ALA-VAL-ASN-SER-ALA-THR-GLY-VAL-PRO-THR-VAL,VAL-LEU-MET-SER-LYS-LEU-SER-VAL-ASN-ALA-PRO-GLU-PHE-TYR-PRO-SER-GLY-TYR-SER-SER-SER-TYR,98,22,,Kd=1.5uM,5.823909,5.82,1,A,A,0,M,T,0,,B,A,,1,1,98,22,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,0.9959495067596436,0.8993796110153198,67.89038848876953,79.05206298828125,0.4696951508522033,0.7600964307785034,0.7599136829376221,0.8159360289573669,0.7737085223197937,0.7671792507171631,VLMSKLSVNAPEFYPSGYSSSY,Low,"(5.821, 5.959]",train
1KBH,protein-peptide,Q9Y6Q9 P45481,PNRSISPSALQDLLRTLKSPSSPQQQQQVLNILKSNPQLMAAFIKQRTAKYVANQPGMQ,EGQSDERALLDQLHTLLSNTDATGLEEIDRALGIPELVNQGQALEPK,PRO-ASN-ARG-SER-ILE-SER-PRO-SER-ALA-LEU-GLN-ASP-LEU-LEU-ARG-THR-LEU-LYS-SER-PRO-SER-SER-PRO-GLN-GLN-GLN-GLN-GLN-VAL-LEU-ASN-ILE-LEU-LYS-SER-ASN-PRO-GLN-LEU-MET-ALA-ALA-PHE-ILE-LYS-GLN-ARG-THR-ALA-LYS-TYR-VAL-ALA-ASN-GLN-PRO-GLY-MET-GLN,GLU-GLY-GLN-SER-ASP-GLU-ARG-ALA-LEU-LEU-ASP-GLN-LEU-HIS-THR-LEU-LEU-SER-ASN-THR-ASP-ALA-THR-GLY-LEU-GLU-GLU-ILE-ASP-ARG-ALA-LEU-GLY-ILE-PRO-GLU-LEU-VAL-ASN-GLN-GLY-GLN-ALA-LEU-GLU-PRO-LYS,59,47,,Kd=34nM,7.468521,7.47,1,A,A,0,M,T,0,,A,B,,1,1,59,47,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O,0.939504086971283,0.5113013982772827,87.29277801513672,53.83538436889648,0.4005177915096283,1.6877949237823486,0.8437718749046326,0.4648893177509308,0.8396163582801819,0.4381586909294128,EGQSDERALLDQLHTLLSNTDATGLEEIDRALGIPELVNQGQALEPK,Moderate,"(7.268, 7.523]",val
1LDT,protein-peptide,P80424 P00761,IVGGYTCAANSIPYQVSLNSGSHFCGGSLINSQWVVSAAHCYKSRIQVRLGEHNIDVLEGNEQFINAAKIITHPNFNGNTLDNDIMLIKLSSPATLNSRVATVSLPRSCAAAGTECLISGWGNTKSSGSSYPSLLQCLKAPVLSDSSCKSSYPGQITGNMICVGFLEGGKDSCQGDSGGPVVCNGQLQGIVSWGYGCAQKNKPGVYTKVCNYVNWIQQTIAAN,KKVCACPKILKPVCGSDGRTYANSCIARCNGVSIKSEGSCPTGILN,ILE-VAL-GLY-GLY-TYR-THR-CYS-ALA-ALA-ASN-SER-ILE-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-SER-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-ARG-ILE-GLN-VAL-ARG-LEU-GLY-GLU-HIS-ASN-ILE-ASP-VAL-LEU-GLU-GLY-ASN-GLU-GLN-PHE-ILE-ASN-ALA-ALA-LYS-ILE-ILE-THR-HIS-PRO-ASN-PHE-ASN-GLY-ASN-THR-LEU-ASP-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-SER-SER-PRO-ALA-THR-LEU-ASN-SER-ARG-VAL-ALA-THR-VAL-SER-LEU-PRO-ARG-SER-CYS-ALA-ALA-ALA-GLY-THR-GLU-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-SER-SER-TYR-PRO-SER-LEU-LEU-GLN-CYS-LEU-LYS-ALA-PRO-VAL-LEU-SER-ASP-SER-SER-CYS-LYS-SER-SER-TYR-PRO-GLY-GLN-ILE-THR-GLY-ASN-MET-ILE-CYS-VAL-GLY-PHE-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-ASN-GLY-GLN-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-TYR-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-ASN-TRP-ILE-GLN-GLN-THR-ILE-ALA-ALA-ASN,LYS-LYS-VAL-CYS-ALA-CYS-PRO-LYS-ILE-LEU-LYS-PRO-VAL-CYS-GLY-SER-ASP-GLY-ARG-THR-TYR-ALA-ASN-SER-CYS-ILE-ALA-ARG-CYS-ASN-GLY-VAL-SER-ILE-LYS-SER-GLU-GLY-SER-CYS-PRO-THR-GLY-ILE-LEU-ASN,223,46,,Ki=1.8nM,8.744727,8.74,1,A,A,0,M,T,0,,L,T,,1,1,223,46,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C,0.7655007243156433,0.5445234775543213,86.16670989990234,83.10210418701172,0.5394721031188965,1.3504565954208374,0.8947129845619202,0.685702919960022,0.7006697058677673,0.5092285871505737,KKVCACPKILKPVCGSDGRTYANSCIARCNGVSIKSEGSCPTGILN,Moderate,"(8.383, 8.824]",train
1OTR,protein-peptide,P36075 P0CG63,MQIFVKTLTGKTITLEVESSDTIDNVKSKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,NDDHESKLSILMDMFPAISKSKLQVHLLENNNDLDLTIGLLLKENDDKS,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-SER-SER-ASP-THR-ILE-ASP-ASN-VAL-LYS-SER-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,ASN-ASP-ASP-HIS-GLU-SER-LYS-LEU-SER-ILE-LEU-MET-ASP-MET-PHE-PRO-ALA-ILE-SER-LYS-SER-LYS-LEU-GLN-VAL-HIS-LEU-LEU-GLU-ASN-ASN-ASN-ASP-LEU-ASP-LEU-THR-ILE-GLY-LEU-LEU-LEU-LYS-GLU-ASN-ASP-ASP-LYS-SER,76,49,,Kd=155uM,3.809668,3.81,1,A,A,0,M,T,0,,A,B,,1,1,76,49,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8079814314842224,,85.41055297851562,,0.3867828845977783,,0.8526061773300171,,0.7968251705169678,,NDDHESKLSILMDMFPAISKSKLQVHLLENNNDLDLTIGLLLKENDDKS,Low,"(3.548, 3.924]",train
1PJM,protein-peptide,P06400 P52293,NQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,CGKRSAEGSNPPKPLKKLRG,ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,CYS-GLY-LYS-ARG-SER-ALA-GLU-GLY-SER-ASN-PRO-PRO-LYS-PRO-LEU-LYS-LYS-LEU-ARG-GLY,460,20,,Kd=180nM,6.744727,6.74,1,A,A,0,M,T,0,,A,B,,1,1,460,20,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,0.9305348992347716,0.770910918712616,87.98169708251953,86.67568969726562,0.4089003503322601,0.9736676812171936,0.8837960362434387,0.8389976620674133,0.8784174919128418,0.713128387928009,CGKRSAEGSNPPKPLKKLRG,Low,"(6.696, 6.824]",train
1PJN,protein-peptide,P06180 P52293,NQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,RKKRKTEEESPLKDKAKKSKG,ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,ARG-LYS-LYS-ARG-LYS-THR-GLU-GLU-GLU-SER-PRO-LEU-LYS-ASP-LYS-ALA-LYS-LYS-SER-LYS-GLY,460,21,,Kd=22nM,7.657577,7.66,1,A,A,0,M,T,0,,A,B,,1,1,460,21,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8927906155586243,0.8470422625541687,87.37107849121094,87.10652923583984,0.4217934012413025,0.7472296357154846,0.882440447807312,0.8624414205551147,0.8291099071502686,0.8037903308868408,RKKRKTEEESPLKDKAKKSKG,Moderate,"(7.523, 7.921]",train
1PPE,protein-peptide,P01074 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,RVCPRILMECKKDSDCLAECVCLEHGYCG,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,ARG-VAL-CYS-PRO-ARG-ILE-LEU-MET-GLU-CYS-LYS-LYS-ASP-SER-ASP-CYS-LEU-ALA-GLU-CYS-VAL-CYS-LEU-GLU-HIS-GLY-TYR-CYS-GLY,223,29,,Kd=3pM,11.522879,11.52,1,A,A,0,M,T,0,,I,E,,1,1,223,29,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,0.8377469778060913,0.63179612159729,87.71471405029297,87.82273864746094,0.4366251826286316,1.0703002214431765,0.9335041642189026,0.7757641077041626,0.7518036961555481,0.5958040952682495,RVCPRILMECKKDSDCLAECVCLEHGYCG,High,"(8.824, 12.12]",val
1Q0W,protein-peptide,P40343 P0CG63,MQIFVKTLTGKTITLEVESSDTIDNVKSKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,YPEDEEELIRKAIELSLKESRNSA,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-SER-SER-ASP-THR-ILE-ASP-ASN-VAL-LYS-SER-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,TYR-PRO-GLU-ASP-GLU-GLU-GLU-LEU-ILE-ARG-LYS-ALA-ILE-GLU-LEU-SER-LEU-LYS-GLU-SER-ARG-ASN-SER-ALA,76,24,,Kd=277uM,3.55752,3.56,1,A,A,0,M,T,0,,A,B,,1,1,76,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.7102068066596985,0.6774993538856506,61.85928726196289,76.00772094726562,0.6481542587280273,0.9456852674484252,0.6667944192886353,0.7398232221603394,0.5710598826408386,0.6619183421134949,YPEDEEELIRKAIELSLKESRNSA,Low,"(3.548, 3.924]",val
1Q5W,protein-peptide,Q9ES54 P0CG48,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GSTSAMWACQHCTFMNQPGTGHCEMCSLPRT,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-SER-THR-SER-ALA-MET-TRP-ALA-CYS-GLN-HIS-CYS-THR-PHE-MET-ASN-GLN-PRO-GLY-THR-GLY-HIS-CYS-GLU-MET-CYS-SER-LEU-PRO-ARG-THR,76,31,,Kd=126uM,3.899629,3.9,1,A,A,0,M,T,0,,A,B,,1,1,76,31,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8466806411743164,0.583609402179718,70.07646179199219,69.5459976196289,0.4338794946670532,1.1327521800994873,0.8338009715080261,0.6570271253585815,0.6688258051872253,0.5652549266815186,GSTSAMWACQHCTFMNQPGTGHCEMCSLPRT,Low,"(3.548, 3.924]",train
1R8U,protein-peptide,Q99967 P45481,ATGPTADPEKRKLIQQQLVLLLHAHKCQRREQANGEVRACSLPHCRTMKNVLNHMTHCQAGKACQVAHCASSRQIISHWKNCTRHDCPVCLPLKNASDKR,TDFIDEEVLMSLVIEMGLDRIKELPELWLGQNEFDFMTDFVCKQQPSRVS,ALA-THR-GLY-PRO-THR-ALA-ASP-PRO-GLU-LYS-ARG-LYS-LEU-ILE-GLN-GLN-GLN-LEU-VAL-LEU-LEU-LEU-HIS-ALA-HIS-LYS-CYS-GLN-ARG-ARG-GLU-GLN-ALA-ASN-GLY-GLU-VAL-ARG-ALA-CYS-SER-LEU-PRO-HIS-CYS-ARG-THR-MET-LYS-ASN-VAL-LEU-ASN-HIS-MET-THR-HIS-CYS-GLN-ALA-GLY-LYS-ALA-CYS-GLN-VAL-ALA-HIS-CYS-ALA-SER-SER-ARG-GLN-ILE-ILE-SER-HIS-TRP-LYS-ASN-CYS-THR-ARG-HIS-ASP-CYS-PRO-VAL-CYS-LEU-PRO-LEU-LYS-ASN-ALA-SER-ASP-LYS-ARG,THR-ASP-PHE-ILE-ASP-GLU-GLU-VAL-LEU-MET-SER-LEU-VAL-ILE-GLU-MET-GLY-LEU-ASP-ARG-ILE-LYS-GLU-LEU-PRO-GLU-LEU-TRP-LEU-GLY-GLN-ASN-GLU-PHE-ASP-PHE-MET-THR-ASP-PHE-VAL-CYS-LYS-GLN-GLN-PRO-SER-ARG-VAL-SER,100,50,,Kd=13nM,7.886057,7.89,1,A,A,0,M,T,0,,A,B,,1,1,100,50,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O)[C@@H](C)CC)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,1.02958345413208,,80.35991668701172,,0.4226707518100738,,0.8700597882270813,,0.8402976989746094,,TDFIDEEVLMSLVIEMGLDRIKELPELWLGQNEFDFMTDFVCKQQPSRVS,Moderate,"(7.523, 7.921]",val
1RKC,protein-peptide,P54939 P18206,HHHHMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,YTKKELIESARKVSEKVSHVLAALQA,HIS-HIS-HIS-HIS-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,TYR-THR-LYS-LYS-GLU-LEU-ILE-GLU-SER-ALA-ARG-LYS-VAL-SER-GLU-LYS-VAL-SER-HIS-VAL-LEU-ALA-ALA-LEU-GLN-ALA,262,26,,Kd=39nM,7.408935,7.41,1,A,A,0,M,T,0,,B,A,,1,1,262,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O,0.9391085505485536,0.6373884677886963,85.6161880493164,80.57131958007812,0.446927011013031,1.1666865348815918,0.8615689873695374,0.7586835026741028,0.9129205346107484,0.6070647239685059,YTKKELIESARKVSEKVSHVLAALQA,Moderate,"(7.268, 7.523]",train
1SB0,protein-peptide,P45481 P06876,GVRKGWHEHVTQDLRSHLVHKLVQAIFPTPDPAALKDRRMENLVAYAKKVEGDMYESANSRDEYYHLLAEKIYKIQKELEEKRRSRL,KEKRIKELELLLMSTENELKGQQAL,GLY-VAL-ARG-LYS-GLY-TRP-HIS-GLU-HIS-VAL-THR-GLN-ASP-LEU-ARG-SER-HIS-LEU-VAL-HIS-LYS-LEU-VAL-GLN-ALA-ILE-PHE-PRO-THR-PRO-ASP-PRO-ALA-ALA-LEU-LYS-ASP-ARG-ARG-MET-GLU-ASN-LEU-VAL-ALA-TYR-ALA-LYS-LYS-VAL-GLU-GLY-ASP-MET-TYR-GLU-SER-ALA-ASN-SER-ARG-ASP-GLU-TYR-TYR-HIS-LEU-LEU-ALA-GLU-LYS-ILE-TYR-LYS-ILE-GLN-LYS-GLU-LEU-GLU-GLU-LYS-ARG-ARG-SER-ARG-LEU,LYS-GLU-LYS-ARG-ILE-LYS-GLU-LEU-GLU-LEU-LEU-LEU-MET-SER-THR-GLU-ASN-GLU-LEU-LYS-GLY-GLN-GLN-ALA-LEU,87,25,,Kd=15uM,4.823909,4.82,1,A,A,0,M,S,0,,B,A,,1,1,87,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9303167462348938,0.6695410013198853,88.82411193847656,84.93478393554688,0.380218893289566,0.9949129819869996,0.8463389277458191,0.7343599200248718,0.8118022680282593,0.653336226940155,KEKRIKELELLLMSTENELKGQQAL,Low,"(4.745, 4.866]",val
1SMF,protein-peptide,P01062 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,EPCCDSCRCTKSIPPECHCANI,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLU-PRO-CYS-CYS-ASP-SER-CYS-ARG-CYS-THR-LYS-SER-ILE-PRO-PRO-GLU-CYS-HIS-CYS-ALA-ASN-ILE,223,22,,Ki=0.12uM,6.920819,6.92,1,A,A,0,M,S,0,,I,E,,1,1,223,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,0.9438334107398988,0.6559646725654602,96.01141357421876,90.2236099243164,0.318101555109024,1.015877366065979,0.9571341276168824,0.8169015645980835,0.907344937324524,0.6157304644584656,EPCCDSCRCTKSIPPECHCANI,Low,"(6.824, 7.049]",train
1T5Z,protein-peptide,Q13772 P10275,CQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,RETSEKFKLLFQSYN,CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,ARG-GLU-THR-SER-GLU-LYS-PHE-LYS-LEU-LEU-PHE-GLN-SER-TYR-ASN,251,15,,Kd=33uM,4.481486,4.48,1,A,A,0,M,T,0,,B,A,,1,1,251,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9499213695526124,0.7257328629493713,95.1578140258789,91.85184478759766,0.3267790973186493,0.847734272480011,0.9487346410751344,0.8573072552680969,0.9149736762046814,0.6928392052650452,RETSEKFKLLFQSYN,Low,"(4.456, 4.606]",train
1T63,protein-peptide,P10275 Q15596,CQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,KENALLRYLLDKDD,CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,LYS-GLU-ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP-LYS-ASP-ASP,251,14,,Kd=15uM,4.823909,4.82,1,A,A,0,M,T,0,,B,A,,1,1,251,14,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9583748579025269,0.739554762840271,95.6656265258789,92.31607055664062,0.3234624564647674,0.8245055079460144,0.948597013950348,0.8700392246246338,0.9278003573417664,0.7069336175918579,KENALLRYLLDKDD,Low,"(4.745, 4.866]",train
1V18,protein-peptide,P25054 Q02248,HAVVNLINYQDDAELATRAIPELTKLLNDEDQVVVNKAAVMVHQLSKKEASRHAIMRSPQMVSAIVRTMQNTNDVETARCTAGTLHNLSHHREGLLAIFKSGGIPALVKMLGSPVDSVLFYAITTLHNLLLHQEGAKMAVRLAGGLQKMVALLNKTNVKFLAITTDCLQILAYGNQESKLIILASGGPQALVNIMRTYTYEKLLWTTSRVLKVLSVCSSNKPAIVEAGGMQALGLHLTDPSQRLVQNCLWTLRNLSDAATKQEGMEGLLGTLVQLLGSDDINVVTCAAGILSNLTCNNYKNKMMVCQVGGIEALVRTVLRAGDREDITEPAICALRHLTSRHQEAEMAQNAVRLHYGLPVVVKLLHPPSHWPLIKATVGLIRNLALCPANHAPLREQGAIPRLVQLLVRAHQDTQRRTSMGGTQQQFVEGVRMEEIVEGCTGALHILARDVHNRIVIRGLNTIPLFVQLLYSPIENIQRVAAGVLCELAQDKEAAEAIEAEGATAPLTELLHSRNEGVATYAAAVLFRMSEDKPQDYK,LPDADTLLHFATESTPDGFSCSSSLSALSLDEPFIQKDVELRIMPPV,HIS-ALA-VAL-VAL-ASN-LEU-ILE-ASN-TYR-GLN-ASP-ASP-ALA-GLU-LEU-ALA-THR-ARG-ALA-ILE-PRO-GLU-LEU-THR-LYS-LEU-LEU-ASN-ASP-GLU-ASP-GLN-VAL-VAL-VAL-ASN-LYS-ALA-ALA-VAL-MET-VAL-HIS-GLN-LEU-SER-LYS-LYS-GLU-ALA-SER-ARG-HIS-ALA-ILE-MET-ARG-SER-PRO-GLN-MET-VAL-SER-ALA-ILE-VAL-ARG-THR-MET-GLN-ASN-THR-ASN-ASP-VAL-GLU-THR-ALA-ARG-CYS-THR-ALA-GLY-THR-LEU-HIS-ASN-LEU-SER-HIS-HIS-ARG-GLU-GLY-LEU-LEU-ALA-ILE-PHE-LYS-SER-GLY-GLY-ILE-PRO-ALA-LEU-VAL-LYS-MET-LEU-GLY-SER-PRO-VAL-ASP-SER-VAL-LEU-PHE-TYR-ALA-ILE-THR-THR-LEU-HIS-ASN-LEU-LEU-LEU-HIS-GLN-GLU-GLY-ALA-LYS-MET-ALA-VAL-ARG-LEU-ALA-GLY-GLY-LEU-GLN-LYS-MET-VAL-ALA-LEU-LEU-ASN-LYS-THR-ASN-VAL-LYS-PHE-LEU-ALA-ILE-THR-THR-ASP-CYS-LEU-GLN-ILE-LEU-ALA-TYR-GLY-ASN-GLN-GLU-SER-LYS-LEU-ILE-ILE-LEU-ALA-SER-GLY-GLY-PRO-GLN-ALA-LEU-VAL-ASN-ILE-MET-ARG-THR-TYR-THR-TYR-GLU-LYS-LEU-LEU-TRP-THR-THR-SER-ARG-VAL-LEU-LYS-VAL-LEU-SER-VAL-CYS-SER-SER-ASN-LYS-PRO-ALA-ILE-VAL-GLU-ALA-GLY-GLY-MET-GLN-ALA-LEU-GLY-LEU-HIS-LEU-THR-ASP-PRO-SER-GLN-ARG-LEU-VAL-GLN-ASN-CYS-LEU-TRP-THR-LEU-ARG-ASN-LEU-SER-ASP-ALA-ALA-THR-LYS-GLN-GLU-GLY-MET-GLU-GLY-LEU-LEU-GLY-THR-LEU-VAL-GLN-LEU-LEU-GLY-SER-ASP-ASP-ILE-ASN-VAL-VAL-THR-CYS-ALA-ALA-GLY-ILE-LEU-SER-ASN-LEU-THR-CYS-ASN-ASN-TYR-LYS-ASN-LYS-MET-MET-VAL-CYS-GLN-VAL-GLY-GLY-ILE-GLU-ALA-LEU-VAL-ARG-THR-VAL-LEU-ARG-ALA-GLY-ASP-ARG-GLU-ASP-ILE-THR-GLU-PRO-ALA-ILE-CYS-ALA-LEU-ARG-HIS-LEU-THR-SER-ARG-HIS-GLN-GLU-ALA-GLU-MET-ALA-GLN-ASN-ALA-VAL-ARG-LEU-HIS-TYR-GLY-LEU-PRO-VAL-VAL-VAL-LYS-LEU-LEU-HIS-PRO-PRO-SER-HIS-TRP-PRO-LEU-ILE-LYS-ALA-THR-VAL-GLY-LEU-ILE-ARG-ASN-LEU-ALA-LEU-CYS-PRO-ALA-ASN-HIS-ALA-PRO-LEU-ARG-GLU-GLN-GLY-ALA-ILE-PRO-ARG-LEU-VAL-GLN-LEU-LEU-VAL-ARG-ALA-HIS-GLN-ASP-THR-GLN-ARG-ARG-THR-SER-MET-GLY-GLY-THR-GLN-GLN-GLN-PHE-VAL-GLU-GLY-VAL-ARG-MET-GLU-GLU-ILE-VAL-GLU-GLY-CYS-THR-GLY-ALA-LEU-HIS-ILE-LEU-ALA-ARG-ASP-VAL-HIS-ASN-ARG-ILE-VAL-ILE-ARG-GLY-LEU-ASN-THR-ILE-PRO-LEU-PHE-VAL-GLN-LEU-LEU-TYR-SER-PRO-ILE-GLU-ASN-ILE-GLN-ARG-VAL-ALA-ALA-GLY-VAL-LEU-CYS-GLU-LEU-ALA-GLN-ASP-LYS-GLU-ALA-ALA-GLU-ALA-ILE-GLU-ALA-GLU-GLY-ALA-THR-ALA-PRO-LEU-THR-GLU-LEU-LEU-HIS-SER-ARG-ASN-GLU-GLY-VAL-ALA-THR-TYR-ALA-ALA-ALA-VAL-LEU-PHE-ARG-MET-SER-GLU-ASP-LYS-PRO-GLN-ASP-TYR-LYS,LEU-PRO-ASP-ALA-ASP-THR-LEU-LEU-HIS-PHE-ALA-THR-GLU-SER-THR-PRO-ASP-GLY-PHE-SER-CYS-SER-SEP-SEP-LEU-SEP-ALA-LEU-SEP-LEU-ASP-GLU-PRO-PHE-ILE-GLN-LYS-ASP-VAL-GLU-LEU-ARG-ILE-MET-PRO-PRO-VAL,538,47,,Kd=10nM,8.0,8.0,1,A,A,0,M,T,0,,B,A,,1,1,538,47,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NC(COP(=O)(O)O)C(=O)NC(COP(=O)(O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NC(COP(=O)(O)O)C(=O)NC(COP(=O)(O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)O)C(C)C,0.693091630935669,0.6163915991783142,78.76972961425781,77.67378234863281,0.6128993034362793,1.4205023050308228,0.8437987565994263,0.7655255794525146,0.6052011251449585,0.5791080594062805,LPDADTLLHFATESTPDGFSCSSSLSALSLDEPFIQKDVELRIMPPV,Moderate,"(7.921, 8.383]",train
1VPP,protein-peptide,P15692,GQNHHEVVKFMDVYQRSYCHPIETLVDIFQEYPDEIEYIFKPSCVPLMRCGGCCNDEGLECVPTEESNITMQIMRIKPHQGQHIGEMSFLQHNKCECRPKKD,RGWVEICAADDYGRCLTEAQ,GLY-GLN-ASN-HIS-HIS-GLU-VAL-VAL-LYS-PHE-MET-ASP-VAL-TYR-GLN-ARG-SER-TYR-CYS-HIS-PRO-ILE-GLU-THR-LEU-VAL-ASP-ILE-PHE-GLN-GLU-TYR-PRO-ASP-GLU-ILE-GLU-TYR-ILE-PHE-LYS-PRO-SER-CYS-VAL-PRO-LEU-MET-ARG-CYS-GLY-GLY-CYS-CYS-ASN-ASP-GLU-GLY-LEU-GLU-CYS-VAL-PRO-THR-GLU-GLU-SER-ASN-ILE-THR-MET-GLN-ILE-MET-ARG-ILE-LYS-PRO-HIS-GLN-GLY-GLN-HIS-ILE-GLY-GLU-MET-SER-PHE-LEU-GLN-HIS-ASN-LYS-CYS-GLU-CYS-ARG-PRO-LYS-LYS-ASP,ARG-GLY-TRP-VAL-GLU-ILE-CYS-ALA-ALA-ASP-ASP-TYR-GLY-ARG-CYS-LEU-THR-GLU-ALA-GLN,102,20,,IC50=8.2uM,5.086186,5.09,1,A,A,0,M,T,0,,X,V,,1,1,102,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)O,0.9513744115829468,0.5956538319587708,84.18641662597656,80.04145050048828,0.3932136595249176,1.1338210105895996,0.8225844502449036,0.6516551375389099,0.8145145177841187,0.501996636390686,RGWVEICAADDYGRCLTEAQ,Low,"(5.014, 5.105]",train
2GWW,protein-peptide,P18206 P18010,MEHHHHHHMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,NNDITAENNNIYKAAKDVTTSLSKVLKNIN,MET-GLU-HIS-HIS-HIS-HIS-HIS-HIS-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,ASN-ASN-ASP-ILE-THR-ALA-GLU-ASN-ASN-ASN-ILE-TYR-LYS-ALA-ALA-LYS-ASP-VAL-THR-THR-SER-LEU-SER-LYS-VAL-LEU-LYS-ASN-ILE-ASN,266,30,,Kd=0.11nM,9.958607,9.96,1,A,A,0,M,T,0,,B,A,,1,1,266,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,0.9064350724220276,0.5940619111061096,81.60824584960938,74.55027770996094,0.4835551381111145,1.4510291814804075,0.8426049947738647,0.7081639170646667,0.8548250198364258,0.546739399433136,NNDITAENNNIYKAAKDVTTSLSKVLKNIN,High,"(8.824, 12.12]",train
2HQW,protein-peptide,Q05586 P0DP29,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,KKKATFRAITSTLASSFKRRRSSK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,LYS-LYS-LYS-ALA-THR-PHE-ARG-ALA-ILE-THR-SER-THR-LEU-ALA-SER-SER-PHE-LYS-ARG-ARG-ARG-SER-SER-LYS,148,24,,Kd=2nM,8.69897,8.7,1,A,A,0,M,T,0,,B,A,,1,1,148,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.8330670595169067,0.6340732574462891,64.38485717773438,49.380184173583984,0.5143054723739624,1.2272361516952517,0.7622644901275635,0.6871236562728882,0.7635583877563477,0.6208106875419617,KKKATFRAITSTLASSFKRRRSSK,Moderate,"(8.383, 8.824]",train
2HSQ,protein-peptide,Q6XVZ2 P18206 P18010,MEHHHHHHMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,AIYEKAKEVSSALSKVLSKIDDT,MET-GLU-HIS-HIS-HIS-HIS-HIS-HIS-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,ALA-ILE-TYR-GLU-LYS-ALA-LYS-GLU-VAL-SER-SER-ALA-LEU-SER-LYS-VAL-LEU-SER-LYS-ILE-ASP-ASP-THR,266,23,,Kd=6.61nM,8.179799,8.18,1,A,A,0,M,T,0,,B,A,,1,1,266,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(C)C)C(C)C,0.971018135547638,0.6309877038002014,83.84928131103516,76.12749481201172,0.4081691801548004,1.3104783296585083,0.8730838298797607,0.7364038228988647,0.92846018075943,0.58583664894104,AIYEKAKEVSSALSKVLSKIDDT,Moderate,"(7.921, 8.383]",train
2K8F,protein-peptide,Q09472 P04637,ATQSPGDSRRLSIQRAIQSLVHAAQCRNANCSLPSCQKMKRVVQHTKGCKRKTNGGCPICKQLIALAAYHAKHCQENKCPVPFCLNIKQK,MEEPQSDPSVEPPLSQETFSDLWKLLPENNVLSPLPSQA,ALA-THR-GLN-SER-PRO-GLY-ASP-SER-ARG-ARG-LEU-SER-ILE-GLN-ARG-ALA-ILE-GLN-SER-LEU-VAL-HIS-ALA-ALA-GLN-CYS-ARG-ASN-ALA-ASN-CYS-SER-LEU-PRO-SER-CYS-GLN-LYS-MET-LYS-ARG-VAL-VAL-GLN-HIS-THR-LYS-GLY-CYS-LYS-ARG-LYS-THR-ASN-GLY-GLY-CYS-PRO-ILE-CYS-LYS-GLN-LEU-ILE-ALA-LEU-ALA-ALA-TYR-HIS-ALA-LYS-HIS-CYS-GLN-GLU-ASN-LYS-CYS-PRO-VAL-PRO-PHE-CYS-LEU-ASN-ILE-LYS-GLN-LYS,MET-GLU-GLU-PRO-GLN-SER-ASP-PRO-SER-VAL-GLU-PRO-PRO-LEU-SER-GLN-GLU-THR-PHE-SER-ASP-LEU-TRP-LYS-LEU-LEU-PRO-GLU-ASN-ASN-VAL-LEU-SER-PRO-LEU-PRO-SER-GLN-ALA,90,39,,Kd=2.7uM,5.568636,5.57,1,A,A,0,M,T,0,,B,A,,1,1,90,39,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,0.9389325380325316,0.6274234056472778,77.94873809814453,70.07910919189453,0.4556223452091217,1.1681084632873535,0.8175826072692871,0.6846095323562622,0.775471568107605,0.6131268739700317,MEEPQSDPSVEPPLSQETFSDLWKLLPENNVLSPLPSQA,Low,"(5.463, 5.6]",train
2KJ4,protein-peptide,Q6V4L8,YVEFSEECMHGSGENYDGKISKTMSGLECQAWDSQSPHAHGYIPSKFPNKNLKKNYCRNPDRDLRPWCFTTDPNKRWEYCDIPRCAA,GSVEKLTADAELQRLKNERHEEAELERLKSEY,TYR-VAL-GLU-PHE-SER-GLU-GLU-CYS-MET-HIS-GLY-SER-GLY-GLU-ASN-TYR-ASP-GLY-LYS-ILE-SER-LYS-THR-MET-SER-GLY-LEU-GLU-CYS-GLN-ALA-TRP-ASP-SER-GLN-SER-PRO-HIS-ALA-HIS-GLY-TYR-ILE-PRO-SER-LYS-PHE-PRO-ASN-LYS-ASN-LEU-LYS-LYS-ASN-TYR-CYS-ARG-ASN-PRO-ASP-ARG-ASP-LEU-ARG-PRO-TRP-CYS-PHE-THR-THR-ASP-PRO-ASN-LYS-ARG-TRP-GLU-TYR-CYS-ASP-ILE-PRO-ARG-CYS-ALA-ALA,GLY-SER-VAL-GLU-LYS-LEU-THR-ALA-ASP-ALA-GLU-LEU-GLN-ARG-LEU-LYS-ASN-GLU-ARG-HIS-GLU-GLU-ALA-GLU-LEU-GLU-ARG-LEU-LYS-SER-GLU-TYR,87,32,,Kd=65nM,7.187087,7.19,1,A,A,0,M,T,0,,B,A,,1,1,87,32,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.978326976299286,0.6103759407997131,83.89753723144531,72.0937728881836,0.3668121695518493,1.0399458408355713,0.8876768350601196,0.6790505647659302,0.8486785888671875,0.5932072997093201,GSVEKLTADAELQRLKNERHEEAELERLKSEY,Moderate,"(7.049, 7.268]",train
2KTF,protein-peptide,Q9UNA4 P62979,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GHMFPSDIDPQVFYELPEAVQKELLAEWKRTG,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-HIS-MET-PHE-PRO-SER-ASP-ILE-ASP-PRO-GLN-VAL-PHE-TYR-GLU-LEU-PRO-GLU-ALA-VAL-GLN-LYS-GLU-LEU-LEU-ALA-GLU-TRP-LYS-ARG-THR-GLY,76,32,,Kd=23uM,4.638272,4.64,1,A,A,0,M,T,0,,B,A,,1,1,76,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9249821901321412,0.5828238725662231,88.12013244628906,71.19385528564453,0.3557973504066467,1.1093865633010864,0.8887545466423035,0.6502453684806824,0.8240852952003479,0.5659685134887695,GHMFPSDIDPQVFYELPEAVQKELLAEWKRTG,Low,"(4.606, 4.745]",train
2KWO,protein-peptide,Q92784 P62805,GSYCDFCLGGSNMNKKSGRPEELVSCADCGRSGHPTCLQFTLNMTEAVKTYKWQCIECKSCILCGTSENDDQLLFCDDCDRGYHMYCLNPPVAEPPEGSWSCHLCWELLKEKAS,SGRGKGGKGLGKGGAKRHRK,GLY-SER-TYR-CYS-ASP-PHE-CYS-LEU-GLY-GLY-SER-ASN-MET-ASN-LYS-LYS-SER-GLY-ARG-PRO-GLU-GLU-LEU-VAL-SER-CYS-ALA-ASP-CYS-GLY-ARG-SER-GLY-HIS-PRO-THR-CYS-LEU-GLN-PHE-THR-LEU-ASN-MET-THR-GLU-ALA-VAL-LYS-THR-TYR-LYS-TRP-GLN-CYS-ILE-GLU-CYS-LYS-SER-CYS-ILE-LEU-CYS-GLY-THR-SER-GLU-ASN-ASP-ASP-GLN-LEU-LEU-PHE-CYS-ASP-ASP-CYS-ASP-ARG-GLY-TYR-HIS-MET-TYR-CYS-LEU-ASN-PRO-PRO-VAL-ALA-GLU-PRO-PRO-GLU-GLY-SER-TRP-SER-CYS-HIS-LEU-CYS-TRP-GLU-LEU-LEU-LYS-GLU-LYS-ALA-SER,SAC-GLY-ARG-GLY-LYS-GLY-GLY-LYS-GLY-LEU-GLY-LYS-GLY-GLY-ALA-LYS-ARG-HIS-ARG-LYS,114,20,,Kd=46.9uM,4.328827,4.33,1,A,A,0,M,T,0,,B,A,,1,1,114,20,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(=O)NC(CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(=O)NC(CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.8606389760971069,0.6693828701972961,76.31228637695312,87.31077575683594,0.4490367472171783,1.013020634651184,0.8610036373138428,0.7735739946365356,0.767264187335968,0.6433350443840027,SGRGKGGKGLGKGGAKRHRK,Low,"(4.319, 4.456]",val
2KWU,protein-peptide,Q6R3M4 P62979,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GSPEFDSAEEKLPFPPDIDPQVFYELPEEVQKELMAEWERAGAARPSAHR,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-SER-PRO-GLU-PHE-ASP-SER-ALA-GLU-GLU-LYS-LEU-PRO-PHE-PRO-PRO-ASP-ILE-ASP-PRO-GLN-VAL-PHE-TYR-GLU-LEU-PRO-GLU-GLU-VAL-GLN-LYS-GLU-LEU-MET-ALA-GLU-TRP-GLU-ARG-ALA-GLY-ALA-ALA-ARG-PRO-SER-ALA-HIS-ARG,76,50,,Kd=51uM,4.29243,4.29,1,A,A,0,M,T,0,,A,B,,1,1,76,50,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.7872412800788879,0.4139352142810821,74.45459747314453,57.78718566894531,0.4258374869823456,1.6675430536270142,0.841497540473938,0.4826309084892273,0.753835916519165,0.3967612981796264,GSPEFDSAEEKLPFPPDIDPQVFYELPEEVQKELMAEWERAGAARPSAHR,Low,"(4.155, 4.319]",train
2KWV,protein-peptide,Q6R3M4 P62979,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GSDTSDLPLQALPEGVDQEVFKQLPADIQEEILSGKSRENLKGKGSLS,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-SER-ASP-THR-SER-ASP-LEU-PRO-LEU-GLN-ALA-LEU-PRO-GLU-GLY-VAL-ASP-GLN-GLU-VAL-PHE-LYS-GLN-LEU-PRO-ALA-ASP-ILE-GLN-GLU-GLU-ILE-LEU-SER-GLY-LYS-SER-ARG-GLU-ASN-LEU-LYS-GLY-LYS-GLY-SER-LEU-SER,76,48,,Kd=90uM,4.045757,4.05,1,A,A,0,M,T,0,,A,B,,1,1,76,48,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,0.8621813058853149,0.4185348153114319,81.21681213378906,59.699703216552734,0.4212761521339416,1.580982685089111,0.844748318195343,0.494279682636261,0.7959750294685364,0.3995985686779022,GSDTSDLPLQALPEGVDQEVFKQLPADIQEEILSGKSRENLKGKGSLS,Low,"(3.924, 4.155]",train
2L0F,protein-peptide,Q9UNA4 P62979,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GHMDEKITFPSDIDPQVFYELAEAVQKELLAEWKRTGSDFHIGHK,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-HIS-MET-ASP-GLU-LYS-ILE-THR-PHE-PRO-SER-ASP-ILE-ASP-PRO-GLN-VAL-PHE-TYR-GLU-LEU-ALA-GLU-ALA-VAL-GLN-LYS-GLU-LEU-LEU-ALA-GLU-TRP-LYS-ARG-THR-GLY-SER-ASP-PHE-HIS-ILE-GLY-HIS-LYS,76,45,,Kd=172uM,3.764472,3.76,1,A,A,0,M,T,0,,B,A,,1,1,76,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)O,0.9078798294067384,0.4562913775444031,82.52567291259766,61.49121856689453,0.4181852042675018,1.627808928489685,0.847806990146637,0.5247519016265869,0.7731046676635742,0.4391762316226959,GHMDEKITFPSDIDPQVFYELAEAVQKELLAEWKRTGSDFHIGHK,Low,"(3.548, 3.924]",train
2L14,protein-peptide,P45481 P04637,PNRSISPSALQDLLRTLKSPSSPQQQQQVLNILKSNPQLMAAFIKQRTAKYVANQPGMQ,PLSQETFSDLWKLLPENNVLSPLPSQAMDDLMLSPDDIEQWFTEDPGPD,PRO-ASN-ARG-SER-ILE-SER-PRO-SER-ALA-LEU-GLN-ASP-LEU-LEU-ARG-THR-LEU-LYS-SER-PRO-SER-SER-PRO-GLN-GLN-GLN-GLN-GLN-VAL-LEU-ASN-ILE-LEU-LYS-SER-ASN-PRO-GLN-LEU-MET-ALA-ALA-PHE-ILE-LYS-GLN-ARG-THR-ALA-LYS-TYR-VAL-ALA-ASN-GLN-PRO-GLY-MET-GLN,PRO-LEU-SER-GLN-GLU-THR-PHE-SER-ASP-LEU-TRP-LYS-LEU-LEU-PRO-GLU-ASN-ASN-VAL-LEU-SER-PRO-LEU-PRO-SER-GLN-ALA-MET-ASP-ASP-LEU-MET-LEU-SER-PRO-ASP-ASP-ILE-GLU-GLN-TRP-PHE-THR-GLU-ASP-PRO-GLY-PRO-ASP,59,49,,Kd=3.1uM,5.508638,5.51,1,A,A,0,M,T,0,,B,A,,1,1,59,49,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9332800507545472,,80.45145416259766,,0.4910157024860382,,0.7556697726249695,,0.7114788889884949,,PLSQETFSDLWKLLPENNVLSPLPSQAMDDLMLSPDDIEQWFTEDPGPD,Low,"(5.463, 5.6]",train
2M0J,protein-peptide,Q00195 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,TPRRGRGGFQRIVRLVGVIRDWANKNFR,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,THR-PRO-ARG-ARG-GLY-ARG-GLY-GLY-PHE-GLN-ARG-ILE-VAL-ARG-LEU-VAL-GLY-VAL-ILE-ARG-ASP-TRP-ALA-ASN-LYS-ASN-PHE-ARG,148,28,,Kd=12nM,7.920819,7.92,1,A,A,0,M,T,0,,B,A,,1,1,148,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)C(C)C,0.8592777252197266,0.565180778503418,65.30303192138672,46.7506217956543,0.4725540578365326,1.3775018453598022,0.791533887386322,0.62172931432724,0.7767818570137024,0.5510436296463013,TPRRGRGGFQRIVRLVGVIRDWANKNFR,Moderate,"(7.523, 7.921]",train
2M55,protein-peptide,P37840 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,MDVFMKGLSKAKEGVVAAA,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ACE-MET-ASP-VAL-PHE-MET-LYS-GLY-LEU-SER-LYS-ALA-LYS-GLU-GLY-VAL-VAL-ALA-ALA-ALA-NH2,148,21,,Kd=35uM,4.455932,4.46,1,A,A,0,M,T,0,,B,A,,1,1,148,21,0,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C,,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C,0.7050580978393555,0.6060847043991089,54.14093017578125,55.09849166870117,0.7855201959609985,1.216314435005188,0.5653575658798218,0.6652817726135254,0.668875515460968,0.5912854075431824,MDVFMKGLSKAKEGVVAAA,Low,"(4.319, 4.456]",train
2MRO,protein-peptide,P40087 P0CG47,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GSATFPEQTIKQLMDLGFPRDAVVKALKQTNGNAEFAASLLFQS,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-SER-ALA-THR-PHE-PRO-GLU-GLN-THR-ILE-LYS-GLN-LEU-MET-ASP-LEU-GLY-PHE-PRO-ARG-ASP-ALA-VAL-VAL-LYS-ALA-LEU-LYS-GLN-THR-ASN-GLY-ASN-ALA-GLU-PHE-ALA-ALA-SER-LEU-LEU-PHE-GLN-SER,76,44,,Kd=150uM,3.823909,3.82,1,A,A,0,M,T,0,,B,A,,1,1,76,44,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8040045499801636,0.5078509449958801,81.93384552001953,64.25745391845703,0.3429105281829834,1.504716157913208,0.8775562047958374,0.5750064849853516,0.7856166362762451,0.4910620152950287,GSATFPEQTIKQLMDLGFPRDAVVKALKQTNGNAEFAASLLFQS,Low,"(3.548, 3.924]",train
2MZD,protein-peptide,Q09472 P04637,ATQSPGDSRRLSIQRAIQSLVHAAQCRNANCSLPSCQKMKRVVQHTKGCKRKTNGGCPICKQLIALAAYHAKHCQENKCPVPFCLNIKQK,LPSQAMDDLMLSPDDIEQWFTEDPG,ALA-THR-GLN-SER-PRO-GLY-ASP-SER-ARG-ARG-LEU-SER-ILE-GLN-ARG-ALA-ILE-GLN-SER-LEU-VAL-HIS-ALA-ALA-GLN-CYS-ARG-ASN-ALA-ASN-CYS-SER-LEU-PRO-SER-CYS-GLN-LYS-MET-LYS-ARG-VAL-VAL-GLN-HIS-THR-LYS-GLY-CYS-LYS-ARG-LYS-THR-ASN-GLY-GLY-CYS-PRO-ILE-CYS-LYS-GLN-LEU-ILE-ALA-LEU-ALA-ALA-TYR-HIS-ALA-LYS-HIS-CYS-GLN-GLU-ASN-LYS-CYS-PRO-VAL-PRO-PHE-CYS-LEU-ASN-ILE-LYS-GLN-LYS,LEU-PRO-SER-GLN-ALA-MET-ASP-ASP-LEU-MET-LEU-SER-PRO-ASP-ASP-ILE-GLU-GLN-TRP-PHE-THR-GLU-ASP-PRO-GLY,90,25,,Kd=0.877uM,6.057,6.06,1,A,A,0,M,T,0,,B,A,,1,1,90,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.895193874835968,0.7128366827964783,80.0584716796875,77.576904296875,0.4395561516284942,0.95794415473938,0.8342080116271973,0.7637638449668884,0.7745707631111145,0.6931604146957397,LPSQAMDDLMLSPDDIEQWFTEDPG,Low,"(5.959, 6.097]",train
2N8J,protein-peptide,P29474 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,TRKKTFKEVANAVKISASLMGT,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,THR-ARG-LYS-LYS-THR-PHE-LYS-GLU-VAL-ALA-ASN-ALA-VAL-LYS-ILE-SER-ALA-SER-LEU-MET-GLY-THR,148,22,,Kd=10.7nM,7.970616,7.97,1,A,A,0,M,T,0,,B,A,,1,1,148,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)C)C(C)C,0.9109623432159424,0.679609477519989,68.20803833007812,55.79985809326172,0.4263353645801544,1.071669340133667,0.8368319272994995,0.7270082831382751,0.8486125469207764,0.655090868473053,TRKKTFKEVANAVKISASLMGT,Moderate,"(7.921, 8.383]",train
2RUK,protein-peptide,P32780 P04637,GSMATSSEEVLLIVKKVRQKKQDGALYLMAERIAWAPEGKDRFTISHMYADIKCQKISPEGKAKIQLQLVLHAGDTTNFHFSNESTAVKERDAVKDLLQQLLPKFKRKAN,DDLMLSPDDIEQWFTEDPGPDE,GLY-SER-MET-ALA-THR-SER-SER-GLU-GLU-VAL-LEU-LEU-ILE-VAL-LYS-LYS-VAL-ARG-GLN-LYS-LYS-GLN-ASP-GLY-ALA-LEU-TYR-LEU-MET-ALA-GLU-ARG-ILE-ALA-TRP-ALA-PRO-GLU-GLY-LYS-ASP-ARG-PHE-THR-ILE-SER-HIS-MET-TYR-ALA-ASP-ILE-LYS-CYS-GLN-LYS-ILE-SER-PRO-GLU-GLY-LYS-ALA-LYS-ILE-GLN-LEU-GLN-LEU-VAL-LEU-HIS-ALA-GLY-ASP-THR-THR-ASN-PHE-HIS-PHE-SER-ASN-GLU-SER-THR-ALA-VAL-LYS-GLU-ARG-ASP-ALA-VAL-LYS-ASP-LEU-LEU-GLN-GLN-LEU-LEU-PRO-LYS-PHE-LYS-ARG-LYS-ALA-ASN,ASP-ASP-LEU-MET-LEU-SEP-PRO-ASP-ASP-ILE-GLU-GLN-TRP-PHE-TPO-GLU-ASP-PRO-GLY-PRO-ASP-GLU,110,22,,Kd=24.21uM,4.616005,4.62,1,A,A,0,M,T,0,,A,B,,1,1,110,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.929009735584259,0.7537078261375427,89.46724700927734,87.08828735351562,0.3905037939548492,0.809662401676178,0.8926959037780762,0.8083010315895081,0.8291866183280945,0.740059494972229,DDLMLSPDDIEQWFTEDPGPDE,Low,"(4.606, 4.745]",train
2V52,protein-peptide,Q8K4J6 P68135,MCDEDETTALVCDNGSGLVKAGFAGDDAPRAVFPSIVGRPRHQGVMVGMGQKDSYVGDEAQSKRGILTLKYPIEHGIITNWDDMEKIWHHTFYNELRVAPEEHPTLLTEAPLNPKANREKMTQIMFETFNVPAMYVAIQAVLSLYASGRTTGIVLDSGDGVTHNVPIYEGYALPHAIMRLDLAGRDLTDYLMKILTERGYSFVTTAEREIVRDIKEKLCYVALDFENEMATAASSSSLEKSYELPDGQVITIGNERFRCPETLFQPSFIGMESAGIHETTYNSIMKCDIDIRKDLYANNVMSGGTTMYPGIADRMQKEITALAPSTMKIKIIAPPERKYSVWIGGSILASLSTFQQMWITKQEYDEAGPSIVHRKCF,RARTEDYLKRKIRSRPERAELVRMHILEETSA,MET-CYS-ASP-GLU-ASP-GLU-THR-THR-ALA-LEU-VAL-CYS-ASP-ASN-GLY-SER-GLY-LEU-VAL-LYS-ALA-GLY-PHE-ALA-GLY-ASP-ASP-ALA-PRO-ARG-ALA-VAL-PHE-PRO-SER-ILE-VAL-GLY-ARG-PRO-ARG-HIS-GLN-GLY-VAL-MET-VAL-GLY-MET-GLY-GLN-LYS-ASP-SER-TYR-VAL-GLY-ASP-GLU-ALA-GLN-SER-LYS-ARG-GLY-ILE-LEU-THR-LEU-LYS-TYR-PRO-ILE-GLU-HIS-GLY-ILE-ILE-THR-ASN-TRP-ASP-ASP-MET-GLU-LYS-ILE-TRP-HIS-HIS-THR-PHE-TYR-ASN-GLU-LEU-ARG-VAL-ALA-PRO-GLU-GLU-HIS-PRO-THR-LEU-LEU-THR-GLU-ALA-PRO-LEU-ASN-PRO-LYS-ALA-ASN-ARG-GLU-LYS-MET-THR-GLN-ILE-MET-PHE-GLU-THR-PHE-ASN-VAL-PRO-ALA-MET-TYR-VAL-ALA-ILE-GLN-ALA-VAL-LEU-SER-LEU-TYR-ALA-SER-GLY-ARG-THR-THR-GLY-ILE-VAL-LEU-ASP-SER-GLY-ASP-GLY-VAL-THR-HIS-ASN-VAL-PRO-ILE-TYR-GLU-GLY-TYR-ALA-LEU-PRO-HIS-ALA-ILE-MET-ARG-LEU-ASP-LEU-ALA-GLY-ARG-ASP-LEU-THR-ASP-TYR-LEU-MET-LYS-ILE-LEU-THR-GLU-ARG-GLY-TYR-SER-PHE-VAL-THR-THR-ALA-GLU-ARG-GLU-ILE-VAL-ARG-ASP-ILE-LYS-GLU-LYS-LEU-CYS-TYR-VAL-ALA-LEU-ASP-PHE-GLU-ASN-GLU-MET-ALA-THR-ALA-ALA-SER-SER-SER-SER-LEU-GLU-LYS-SER-TYR-GLU-LEU-PRO-ASP-GLY-GLN-VAL-ILE-THR-ILE-GLY-ASN-GLU-ARG-PHE-ARG-CYS-PRO-GLU-THR-LEU-PHE-GLN-PRO-SER-PHE-ILE-GLY-MET-GLU-SER-ALA-GLY-ILE-HIS-GLU-THR-THR-TYR-ASN-SER-ILE-MET-LYS-CYS-ASP-ILE-ASP-ILE-ARG-LYS-ASP-LEU-TYR-ALA-ASN-ASN-VAL-MET-SER-GLY-GLY-THR-THR-MET-TYR-PRO-GLY-ILE-ALA-ASP-ARG-MET-GLN-LYS-GLU-ILE-THR-ALA-LEU-ALA-PRO-SER-THR-MET-LYS-ILE-LYS-ILE-ILE-ALA-PRO-PRO-GLU-ARG-LYS-TYR-SER-VAL-TRP-ILE-GLY-GLY-SER-ILE-LEU-ALA-SER-LEU-SER-THR-PHE-GLN-GLN-MET-TRP-ILE-THR-LYS-GLN-GLU-TYR-ASP-GLU-ALA-GLY-PRO-SER-ILE-VAL-HIS-ARG-LYS-CYS-PHE,ARG-ALA-ARG-THR-GLU-ASP-TYR-LEU-LYS-ARG-LYS-ILE-ARG-SER-ARG-PRO-GLU-ARG-ALA-GLU-LEU-VAL-ARG-MET-HIS-ILE-LEU-GLU-GLU-THR-SER-ALA,377,32,,Kd=1.9uM,5.721246,5.72,1,A,A,0,M,T,0,,M,B,,1,1,377,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7113575339317322,0.6182859539985657,80.94563293457031,78.3684310913086,0.5042642951011658,1.5113762617111206,0.8708991408348083,0.7694494128227234,0.6225723624229431,0.5804950594902039,RARTEDYLKRKIRSRPERAELVRMHILEETSA,Low,"(5.699, 5.821]",train
2VOG,protein-peptide,Q07440 Q91ZE9,GPLGSMAESELMHIHSLAEHYLQYVLQVPAFESAPSQACRVLQRVAFSVQKEVEKNLKSYLDDFHVESIDTARIIFNQVMEKEFEDGIINWGRIVTIFAFGGVLLKKLKQEQIALDVSAYKQVSSFVAEFIMNNTGEWIRQNGGWEDGFIKKFEPKS,LQHRAEVQIARKLQCIADQFHRLHTQQ,GLY-PRO-LEU-GLY-SER-MET-ALA-GLU-SER-GLU-LEU-MET-HIS-ILE-HIS-SER-LEU-ALA-GLU-HIS-TYR-LEU-GLN-TYR-VAL-LEU-GLN-VAL-PRO-ALA-PHE-GLU-SER-ALA-PRO-SER-GLN-ALA-CYS-ARG-VAL-LEU-GLN-ARG-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-TYR-LEU-ASP-ASP-PHE-HIS-VAL-GLU-SER-ILE-ASP-THR-ALA-ARG-ILE-ILE-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLY-GLY-VAL-LEU-LEU-LYS-LYS-LEU-LYS-GLN-GLU-GLN-ILE-ALA-LEU-ASP-VAL-SER-ALA-TYR-LYS-GLN-VAL-SER-SER-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASP-GLY-PHE-ILE-LYS-LYS-PHE-GLU-PRO-LYS-SER,LEU-GLN-HIS-ARG-ALA-GLU-VAL-GLN-ILE-ALA-ARG-LYS-LEU-GLN-CYS-ILE-ALA-ASP-GLN-PHE-HIS-ARG-LEU-HIS-THR-GLN-GLN,157,27,,Kd=210nM,6.677781,6.68,1,A,A,0,M,T,0,,B,A,,1,1,157,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,0.9346667528152466,0.650783360004425,92.2301788330078,85.38108825683594,0.3761914074420929,1.0089452266693115,0.9134494662284852,0.7511224746704102,0.8482590913772583,0.6256985664367676,LQHRAEVQIARKLQCIADQFHRLHTQQ,Low,"(6.523, 6.696]",val
2VOH,protein-peptide,O08734 Q07440,GPLGSMAESELMHIHSLAEHYLQYVLQVPAFESAPSQACRVLQRVAFSVQKEVEKNLKSYLDDFHVESIDTARIIFNQVMEKEFEDGIINWGRIVTIFAFGGVLLKKLKQEQIALDVSAYKQVSSFVAEFIMNNTGEWIRQNGGWEDGFIKKFEPKS,PNSILGQVGRQLALIGDDINRRYDTE,GLY-PRO-LEU-GLY-SER-MET-ALA-GLU-SER-GLU-LEU-MET-HIS-ILE-HIS-SER-LEU-ALA-GLU-HIS-TYR-LEU-GLN-TYR-VAL-LEU-GLN-VAL-PRO-ALA-PHE-GLU-SER-ALA-PRO-SER-GLN-ALA-CYS-ARG-VAL-LEU-GLN-ARG-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-TYR-LEU-ASP-ASP-PHE-HIS-VAL-GLU-SER-ILE-ASP-THR-ALA-ARG-ILE-ILE-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLY-GLY-VAL-LEU-LEU-LYS-LYS-LEU-LYS-GLN-GLU-GLN-ILE-ALA-LEU-ASP-VAL-SER-ALA-TYR-LYS-GLN-VAL-SER-SER-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASP-GLY-PHE-ILE-LYS-LYS-PHE-GLU-PRO-LYS-SER,PRO-ASN-SER-ILE-LEU-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-LEU-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-THR-GLU,157,26,,Kd=1nM,9.0,9.0,1,A,A,0,M,T,0,,B,A,,1,1,157,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.972962498664856,0.8094028830528259,93.14810180664062,88.83148956298828,0.3560238778591156,0.757696270942688,0.927678406238556,0.860894501209259,0.9262233972549438,0.7965299487113953,PNSILGQVGRQLALIGDDINRRYDTE,High,"(8.824, 12.12]",train
2VOI,protein-peptide,P70444 Q07440,GPLGSMAESELMHIHSLAEHYLQYVLQVPAFESAPSQACRVLQRVAFSVQKEVEKNLKSYLDDFHVESIDTARIIFNQVMEKEFEDGIINWGRIVTIFAFGGVLLKKLKQEQIALDVSAYKQVSSFVAEFIMNNTGEWIRQNGGWEDGFIKKFEPKS,SESQEEIIHNIARHLAQIGDEMDHNIQPTLVRQL,GLY-PRO-LEU-GLY-SER-MET-ALA-GLU-SER-GLU-LEU-MET-HIS-ILE-HIS-SER-LEU-ALA-GLU-HIS-TYR-LEU-GLN-TYR-VAL-LEU-GLN-VAL-PRO-ALA-PHE-GLU-SER-ALA-PRO-SER-GLN-ALA-CYS-ARG-VAL-LEU-GLN-ARG-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-TYR-LEU-ASP-ASP-PHE-HIS-VAL-GLU-SER-ILE-ASP-THR-ALA-ARG-ILE-ILE-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLY-GLY-VAL-LEU-LEU-LYS-LYS-LEU-LYS-GLN-GLU-GLN-ILE-ALA-LEU-ASP-VAL-SER-ALA-TYR-LYS-GLN-VAL-SER-SER-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASP-GLY-PHE-ILE-LYS-LYS-PHE-GLU-PRO-LYS-SER,SER-GLU-SER-GLN-GLU-GLU-ILE-ILE-HIS-ASN-ILE-ALA-ARG-HIS-LEU-ALA-GLN-ILE-GLY-ASP-GLU-MET-ASP-HIS-ASN-ILE-GLN-PRO-THR-LEU-VAL-ARG-GLN-LEU,157,34,,Kd=1.1nM,8.958607,8.96,1,A,A,0,M,T,0,,B,A,,1,1,157,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC,0.9155353903770448,0.6457849740982056,91.82386779785156,83.0855484008789,0.3733343780040741,1.0672649145126345,0.924665868282318,0.7352808713912964,0.9067082405090332,0.6234109997749329,SESQEEIIHNIARHLAQIGDEMDHNIQPTLVRQL,Moderate,"(8.824, 12.12]",train
2WH6,protein-peptide,P0C6Z1 O43521,MGSHHHHHHSQDPMAYSTREILLALCIRDSRVHGNGTLHPVLELAARETPLRLSPEDTVVLRYHVLLEEIIERNSETFTETWNRFITHTEHVDLDFNSVFLEIFHRGDPSLGRALAWMAWCMHACRTLCCNQSTPYYVVDLSVRGMLEASEGLDGWIHQQGGWSTLIEDNIPG,DMRPEIWIAQELRRIGDEFNAYYARR,MET-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-MET-ALA-TYR-SER-THR-ARG-GLU-ILE-LEU-LEU-ALA-LEU-CYS-ILE-ARG-ASP-SER-ARG-VAL-HIS-GLY-ASN-GLY-THR-LEU-HIS-PRO-VAL-LEU-GLU-LEU-ALA-ALA-ARG-GLU-THR-PRO-LEU-ARG-LEU-SER-PRO-GLU-ASP-THR-VAL-VAL-LEU-ARG-TYR-HIS-VAL-LEU-LEU-GLU-GLU-ILE-ILE-GLU-ARG-ASN-SER-GLU-THR-PHE-THR-GLU-THR-TRP-ASN-ARG-PHE-ILE-THR-HIS-THR-GLU-HIS-VAL-ASP-LEU-ASP-PHE-ASN-SER-VAL-PHE-LEU-GLU-ILE-PHE-HIS-ARG-GLY-ASP-PRO-SER-LEU-GLY-ARG-ALA-LEU-ALA-TRP-MET-ALA-TRP-CYS-MET-HIS-ALA-CYS-ARG-THR-LEU-CYS-CYS-ASN-GLN-SER-THR-PRO-TYR-TYR-VAL-VAL-ASP-LEU-SER-VAL-ARG-GLY-MET-LEU-GLU-ALA-SER-GLU-GLY-LEU-ASP-GLY-TRP-ILE-HIS-GLN-GLN-GLY-GLY-TRP-SER-THR-LEU-ILE-GLU-ASP-ASN-ILE-PRO-GLY,ASP-MET-ARG-PRO-GLU-ILE-TRP-ILE-ALA-GLN-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-PHE-ASN-ALA-TYR-TYR-ALA-ARG-ARG,173,26,,Kd=18nM,7.744727,7.74,1,A,A,0,M,T,0,,B,A,,0,1,173,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.849364697933197,0.6032577157020569,70.8227310180664,59.37310409545898,0.5288723111152649,1.2645695209503174,0.8268339037895203,0.644752025604248,0.7827611565589905,0.5603696703910828,DMRPEIWIAQELRRIGDEFNAYYARR,Moderate,"(7.523, 7.921]",train
2WX0,protein-peptide,Q9NYJ8 P0CH28,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,DEGAQWNCTACTFLNHPALIRCEQCEMPRHF,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,ASP-GLU-GLY-ALA-GLN-TRP-ASN-CYS-THR-ALA-CYS-THR-PHE-LEU-ASN-HIS-PRO-ALA-LEU-ILE-ARG-CYS-GLU-GLN-CYS-GLU-MET-PRO-ARG-HIS-PHE,76,31,,Kd=8uM,5.09691,5.1,1,A,A,0,M,T,0,,C,A,dimer,1,1,76,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8895244002342224,0.5301605463027954,80.59902954101562,71.70166015625,0.3794266879558563,1.1950918436050415,0.8753520846366882,0.6116691827774048,0.8112917542457581,0.5097833871841431,DEGAQWNCTACTFLNHPALIRCEQCEMPRHF,Low,"(5.014, 5.105]",train
2XPX,protein-peptide,P03182 Q16611,MGSHHHHHHSQDPMAYSTREILLALCIRDSRVHGNGTLHPVLELAARETPLRLSPEDTVVLRYHVLLEEIIERNSETFTETWNRFITHTEHVDLDFNSVFLEIFHRGDPSLGRALAWMAWCMHACRTLCCNQSTPYYVVDLSVRGMLEASEGLDGWIHQQGGWSTLIEDNIPG,PSSTMGQVGRQLAIIGDDINRRYDSE,MET-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-MET-ALA-TYR-SER-THR-ARG-GLU-ILE-LEU-LEU-ALA-LEU-CYS-ILE-ARG-ASP-SER-ARG-VAL-HIS-GLY-ASN-GLY-THR-LEU-HIS-PRO-VAL-LEU-GLU-LEU-ALA-ALA-ARG-GLU-THR-PRO-LEU-ARG-LEU-SER-PRO-GLU-ASP-THR-VAL-VAL-LEU-ARG-TYR-HIS-VAL-LEU-LEU-GLU-GLU-ILE-ILE-GLU-ARG-ASN-SER-GLU-THR-PHE-THR-GLU-THR-TRP-ASN-ARG-PHE-ILE-THR-HIS-THR-GLU-HIS-VAL-ASP-LEU-ASP-PHE-ASN-SER-VAL-PHE-LEU-GLU-ILE-PHE-HIS-ARG-GLY-ASP-PRO-SER-LEU-GLY-ARG-ALA-LEU-ALA-TRP-MET-ALA-TRP-CYS-MET-HIS-ALA-CYS-ARG-THR-LEU-CYS-CYS-ASN-GLN-SER-THR-PRO-TYR-TYR-VAL-VAL-ASP-LEU-SER-VAL-ARG-GLY-MET-LEU-GLU-ALA-SER-GLU-GLY-LEU-ASP-GLY-TRP-ILE-HIS-GLN-GLN-GLY-GLY-TRP-SER-THR-LEU-ILE-GLU-ASP-ASN-ILE-PRO-GLY,PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU,173,26,,Kd=150nM,6.823909,6.82,1,A,A,0,M,T,0,,B,A,,1,1,173,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9145542979240416,0.6457191705703735,80.87215423583984,61.54975128173828,0.4497787356376648,1.1216140985488892,0.8689190149307251,0.6984480619430542,0.8757117986679077,0.6000224351882935,PSSTMGQVGRQLAIIGDDINRRYDSE,Low,"(6.696, 6.824]",train
2XTT,protein-peptide,O46162 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,EQECEPGQTKKQDCNTCRCGSDGVWACTRMGCPPHA,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLU-GLN-GLU-CYS-GLU-PRO-GLY-GLN-THR-LYS-LYS-GLN-ASP-CYS-ASN-THR-CYS-ARG-CYS-GLY-SER-ASP-GLY-VAL-TRP-ALA-CYS-THR-ARG-MET-GLY-CYS-PRO-PRO-HIS-ALA,223,36,,Ki=20pM,10.69897,10.7,1,A,A,0,M,T,0,,A,B,,1,1,223,36,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O,0.9469187259674072,0.6373294591903687,92.39492797851562,86.69186401367188,0.3112495243549347,1.134982943534851,0.95967698097229,0.7667304873466492,0.9268372058868408,0.6049792170524597,EQECEPGQTKKQDCNTCRCGSDGVWACTRMGCPPHA,High,"(8.824, 12.12]",train
2Z7F,protein-peptide,P03973 P08246,IVGGRRARPHAWPFMVSLQLRGGHFCGATLIAPNFVMSAAHCVANVNVRAVRVVLGAHNLSRREPTRQVFAVQRIFENGYDPVNLLNDIVILQLNGSATINANVQVAQLPAQGRRLGNGVQCLAMGWGLLGRNRGIASVLQELNVTVVTSLCRRSNVCTLVRGRQAGVCFGDSGSPLVCNGLIHGIASFVRGGCASGLYPDAFAPVAQFVNWIDSIIQ,RRKPGKCPVTYGQCLMLNPPNFCEMDGQCKRDLKCCMGMCGKSCVSPVKA,ILE-VAL-GLY-GLY-ARG-ARG-ALA-ARG-PRO-HIS-ALA-TRP-PRO-PHE-MET-VAL-SER-LEU-GLN-LEU-ARG-GLY-GLY-HIS-PHE-CYS-GLY-ALA-THR-LEU-ILE-ALA-PRO-ASN-PHE-VAL-MET-SER-ALA-ALA-HIS-CYS-VAL-ALA-ASN-VAL-ASN-VAL-ARG-ALA-VAL-ARG-VAL-VAL-LEU-GLY-ALA-HIS-ASN-LEU-SER-ARG-ARG-GLU-PRO-THR-ARG-GLN-VAL-PHE-ALA-VAL-GLN-ARG-ILE-PHE-GLU-ASN-GLY-TYR-ASP-PRO-VAL-ASN-LEU-LEU-ASN-ASP-ILE-VAL-ILE-LEU-GLN-LEU-ASN-GLY-SER-ALA-THR-ILE-ASN-ALA-ASN-VAL-GLN-VAL-ALA-GLN-LEU-PRO-ALA-GLN-GLY-ARG-ARG-LEU-GLY-ASN-GLY-VAL-GLN-CYS-LEU-ALA-MET-GLY-TRP-GLY-LEU-LEU-GLY-ARG-ASN-ARG-GLY-ILE-ALA-SER-VAL-LEU-GLN-GLU-LEU-ASN-VAL-THR-VAL-VAL-THR-SER-LEU-CYS-ARG-ARG-SER-ASN-VAL-CYS-THR-LEU-VAL-ARG-GLY-ARG-GLN-ALA-GLY-VAL-CYS-PHE-GLY-ASP-SER-GLY-SER-PRO-LEU-VAL-CYS-ASN-GLY-LEU-ILE-HIS-GLY-ILE-ALA-SER-PHE-VAL-ARG-GLY-GLY-CYS-ALA-SER-GLY-LEU-TYR-PRO-ASP-ALA-PHE-ALA-PRO-VAL-ALA-GLN-PHE-VAL-ASN-TRP-ILE-ASP-SER-ILE-ILE-GLN,ARG-ARG-LYS-PRO-GLY-LYS-CYS-PRO-VAL-THR-TYR-GLY-GLN-CYS-LEU-MET-LEU-ASN-PRO-PRO-ASN-PHE-CYS-GLU-MET-ASP-GLY-GLN-CYS-LYS-ARG-ASP-LEU-LYS-CYS-CYS-MET-GLY-MET-CYS-GLY-LYS-SER-CYS-VAL-SER-PRO-VAL-LYS-ALA,218,50,,IC50=13nM,7.886057,7.89,1,A,A,0,M,T,0,,I,E,,1,1,218,50,0,CSCC[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,0.7756814956665039,,81.27396392822266,,0.5287755727767944,,0.9049479961395264,,0.7410327196121216,,RRKPGKCPVTYGQCLMLNPPNFCEMDGQCKRDLKCCMGMCGKSCVSPVKA,Moderate,"(7.523, 7.921]",train
2ZVK,protein-peptide,P12004,MFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,CKRPRPEGMQTLESFFKPLTH,MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,CYS-LYS-ARG-PRO-ARG-PRO-GLU-GLY-MET-GLN-THR-LEU-GLU-SER-PHE-PHE-LYS-PRO-LEU-THR-HIS,261,21,,Kd=0.4uM,6.39794,6.4,1,A,A,0,M,T,0,,U,A,,1,1,261,21,0,CSCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8376375436782837,0.6679810881614685,88.30555725097656,82.65403747558594,0.4915951192378998,1.0299423933029177,0.8790714740753174,0.7997884750366211,0.7807364463806152,0.6350291967391968,CKRPRPEGMQTLESFFKPLTH,Low,"(6.26, 6.398]",train
3C4M,protein-peptide,P01270 Q03431 P0AEX9,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFDDVMTKEEQIFLLHRAQAQCEKRLKEVLQRPASIMESDKGWTSASTSGKPRKDKASGKLYPESEEDKEAPTGSRYRGRPCLPEWDHILCWPLGAPGEVVAVPCPDYIYDFNHKGHAYRRCDRNGSWELVPGHNRTWANYSECVKFLTNETREREVFDRLHHHHHH,LNSMERVEWLRKKLQDVHNF,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-ASP-ASP-VAL-MET-THR-LYS-GLU-GLU-GLN-ILE-PHE-LEU-LEU-HIS-ARG-ALA-GLN-ALA-GLN-CYS-GLU-LYS-ARG-LEU-LYS-GLU-VAL-LEU-GLN-ARG-PRO-ALA-SER-ILE-MET-GLU-SER-ASP-LYS-GLY-TRP-THR-SER-ALA-SER-THR-SER-GLY-LYS-PRO-ARG-LYS-ASP-LYS-ALA-SER-GLY-LYS-LEU-TYR-PRO-GLU-SER-GLU-GLU-ASP-LYS-GLU-ALA-PRO-THR-GLY-SER-ARG-TYR-ARG-GLY-ARG-PRO-CYS-LEU-PRO-GLU-TRP-ASP-HIS-ILE-LEU-CYS-TRP-PRO-LEU-GLY-ALA-PRO-GLY-GLU-VAL-VAL-ALA-VAL-PRO-CYS-PRO-ASP-TYR-ILE-TYR-ASP-PHE-ASN-HIS-LYS-GLY-HIS-ALA-TYR-ARG-ARG-CYS-ASP-ARG-ASN-GLY-SER-TRP-GLU-LEU-VAL-PRO-GLY-HIS-ASN-ARG-THR-TRP-ALA-ASN-TYR-SER-GLU-CYS-VAL-LYS-PHE-LEU-THR-ASN-GLU-THR-ARG-GLU-ARG-GLU-VAL-PHE-ASP-ARG-LEU-HIS-HIS-HIS-HIS-HIS-HIS,LEU-ASN-SER-MET-GLU-ARG-VAL-GLU-TRP-LEU-ARG-LYS-LYS-LEU-GLN-ASP-VAL-HIS-ASN-PHE-NH2,539,21,,Kd=0.98uM,6.008774,6.01,1,A,A,0,M,T,0,,C,A,,1,1,539,21,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.7101805210113525,0.664705216884613,54.81378173828125,57.96792984008789,0.8286919593811035,1.2388310432434082,0.6413975954055786,0.7139725089073181,0.6591740846633911,0.5955702066421509,LNSMERVEWLRKKLQDVHNF,Low,"(5.959, 6.097]",train
3C59,protein-peptide,P26349 P43220,RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLY,DLSKQMEEEAVRMFIEWLKNGGPSSGAPPPS,ARG-PRO-GLN-GLY-ALA-THR-VAL-SER-LEU-TRP-GLU-THR-VAL-GLN-LYS-TRP-ARG-GLU-TYR-ARG-ARG-GLN-CYS-GLN-ARG-SER-LEU-THR-GLU-ASP-PRO-PRO-PRO-ALA-THR-ASP-LEU-PHE-CYS-ASN-ARG-THR-PHE-ASP-GLU-TYR-ALA-CYS-TRP-PRO-ASP-GLY-GLU-PRO-GLY-SER-PHE-VAL-ASN-VAL-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-ALA-SER-SER-VAL-PRO-GLN-GLY-HIS-VAL-TYR-ARG-PHE-CYS-THR-ALA-GLU-GLY-LEU-TRP-LEU-GLN-LYS-ASP-ASN-SER-SER-LEU-PRO-TRP-ARG-ASP-LEU-SER-GLU-CYS-GLU-GLU-SER-LYS-ARG-GLY-GLU-ARG-SER-SER-PRO-GLU-GLU-GLN-LEU-LEU-PHE-LEU-TYR,ASP-LEU-SER-LYS-GLN-MSE-GLU-GLU-GLU-ALA-VAL-ARG-MSE-PHE-ILE-GLU-TRP-LEU-LYS-ASN-GLY-GLY-PRO-SER-SER-GLY-ALA-PRO-PRO-PRO-SER,122,31,,IC50=5nM,8.30103,8.3,1,A,A,0,M,T,0,,B,A,,1,1,122,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CC[Se]C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NC(CC[Se]C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CC[Se]C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NC(CC[Se]C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.9455564618110656,0.724719226360321,79.61225128173828,77.78265380859375,0.4762116968631744,0.951561450958252,0.8048217296600342,0.7486267685890198,0.8132564425468445,0.6726357340812683,DLSKQMEEEAVRMFIEWLKNGGPSSGAPPPS,Moderate,"(7.921, 8.383]",val
3C5T,protein-peptide,P26349 P43220,RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLY,DLSKQMEEEAVRLFIEWLKNGGPSSGAPPPS,ARG-PRO-GLN-GLY-ALA-THR-VAL-SER-LEU-TRP-GLU-THR-VAL-GLN-LYS-TRP-ARG-GLU-TYR-ARG-ARG-GLN-CYS-GLN-ARG-SER-LEU-THR-GLU-ASP-PRO-PRO-PRO-ALA-THR-ASP-LEU-PHE-CYS-ASN-ARG-THR-PHE-ASP-GLU-TYR-ALA-CYS-TRP-PRO-ASP-GLY-GLU-PRO-GLY-SER-PHE-VAL-ASN-VAL-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-ALA-SER-SER-VAL-PRO-GLN-GLY-HIS-VAL-TYR-ARG-PHE-CYS-THR-ALA-GLU-GLY-LEU-TRP-LEU-GLN-LYS-ASP-ASN-SER-SER-LEU-PRO-TRP-ARG-ASP-LEU-SER-GLU-CYS-GLU-GLU-SER-LYS-ARG-GLY-GLU-ARG-SER-SER-PRO-GLU-GLU-GLN-LEU-LEU-PHE-LEU-TYR,ASP-LEU-SER-LYS-GLN-MET-GLU-GLU-GLU-ALA-VAL-ARG-LEU-PHE-ILE-GLU-TRP-LEU-LYS-ASN-GLY-GLY-PRO-SER-SER-GLY-ALA-PRO-PRO-PRO-SER,122,31,,IC50=0.6nM,9.221849,9.22,1,A,A,0,M,T,0,,B,A,,1,1,122,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.9367396831512452,0.7464038729667664,79.26119232177734,78.60770416259766,0.473376989364624,0.891807496547699,0.8072030544281006,0.7678900361061096,0.813895046710968,0.7000486254692078,DLSKQMEEEAVRLFIEWLKNGGPSSGAPPPS,High,"(8.824, 12.12]",train
3DVM,protein-peptide,P27884 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,HMGKIYAAMMIMEYYRQSKAKK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,HIS-MET-GLY-LYS-ILE-TYR-ALA-ALA-MET-MET-ILE-MET-GLU-TYR-TYR-ARG-GLN-SER-LYS-ALA-LYS-LYS,148,22,,Kd=4.32nM,8.364516,8.36,1,A,A,0,M,T,0,,B,A,,1,1,148,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.7573390603065491,0.6921825408935547,67.51201629638672,57.42667770385742,0.5773248672485352,1.007280945777893,0.7203419208526611,0.7444180250167847,0.6746765971183777,0.6791236996650696,HMGKIYAAMMIMEYYRQSKAKK,Moderate,"(7.921, 8.383]",train
3DVU,protein-peptide,P89884 Q14457,MASHKKSGTYWATLITAFLKTVSKVEELDCVDSAVLVDVSKIITLTQEFRRHYDSVYRADYGPALKNWKRDLSKLFTSLFVDVINSGRIVGFFDVGRYVCEEVLCPGSWTEDHELLNDCMTHFFIENNLMNHFPLEDHHHHHH,DGGTMENLSRRLKVTGDLFDIMSGQT,MET-ALA-SER-HIS-LYS-LYS-SER-GLY-THR-TYR-TRP-ALA-THR-LEU-ILE-THR-ALA-PHE-LEU-LYS-THR-VAL-SER-LYS-VAL-GLU-GLU-LEU-ASP-CYS-VAL-ASP-SER-ALA-VAL-LEU-VAL-ASP-VAL-SER-LYS-ILE-ILE-THR-LEU-THR-GLN-GLU-PHE-ARG-ARG-HIS-TYR-ASP-SER-VAL-TYR-ARG-ALA-ASP-TYR-GLY-PRO-ALA-LEU-LYS-ASN-TRP-LYS-ARG-ASP-LEU-SER-LYS-LEU-PHE-THR-SER-LEU-PHE-VAL-ASP-VAL-ILE-ASN-SER-GLY-ARG-ILE-VAL-GLY-PHE-PHE-ASP-VAL-GLY-ARG-TYR-VAL-CYS-GLU-GLU-VAL-LEU-CYS-PRO-GLY-SER-TRP-THR-GLU-ASP-HIS-GLU-LEU-LEU-ASN-ASP-CYS-MET-THR-HIS-PHE-PHE-ILE-GLU-ASN-ASN-LEU-MET-ASN-HIS-PHE-PRO-LEU-GLU-ASP-HIS-HIS-HIS-HIS-HIS-HIS,ASP-GLY-GLY-THR-MET-GLU-ASN-LEU-SER-ARG-ARG-LEU-LYS-VAL-THR-GLY-ASP-LEU-PHE-ASP-ILE-MET-SER-GLY-GLN-THR,143,26,,Kd=0.2uM,6.69897,6.7,1,A,A,0,M,T,0,,C,A,,1,1,143,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.7101762890815735,0.6711265444755554,85.19026184082031,77.59062957763672,0.7312828898429871,0.9997512698173524,0.6969122886657715,0.7458978295326233,0.6173384189605713,0.6524336934089661,DGGTMENLSRRLKVTGDLFDIMSGQT,Low,"(6.696, 6.824]",train
3DXD,protein-peptide,O00213 P05067,APKNELVQKFQVYYLGNVPVAKPVGVDVINGALESVLSSSSREQWTPSHVSVAPATLTILHQQTEAVLGECRVRFLSFLAVGRDVHTFAFIMAAGPASFCCHMFWCEPNAASLSEAVQAACMLRYQKCLDARSQHHHHHH,GAMDAAVEPEERHLSKMQQNGYENPTYKFFEQMQN,ALA-PRO-LYS-ASN-GLU-LEU-VAL-GLN-LYS-PHE-GLN-VAL-TYR-TYR-LEU-GLY-ASN-VAL-PRO-VAL-ALA-LYS-PRO-VAL-GLY-VAL-ASP-VAL-ILE-ASN-GLY-ALA-LEU-GLU-SER-VAL-LEU-SER-SER-SER-SER-ARG-GLU-GLN-TRP-THR-PRO-SER-HIS-VAL-SER-VAL-ALA-PRO-ALA-THR-LEU-THR-ILE-LEU-HIS-GLN-GLN-THR-GLU-ALA-VAL-LEU-GLY-GLU-CYS-ARG-VAL-ARG-PHE-LEU-SER-PHE-LEU-ALA-VAL-GLY-ARG-ASP-VAL-HIS-THR-PHE-ALA-PHE-ILE-MET-ALA-ALA-GLY-PRO-ALA-SER-PHE-CYS-CYS-HIS-MET-PHE-TRP-CYS-GLU-PRO-ASN-ALA-ALA-SER-LEU-SER-GLU-ALA-VAL-GLN-ALA-ALA-CYS-MET-LEU-ARG-TYR-GLN-LYS-CYS-LEU-ASP-ALA-ARG-SER-GLN-HIS-HIS-HIS-HIS-HIS-HIS,GLY-ALA-MET-ASP-ALA-ALA-VAL-GLU-PRO-GLU-GLU-ARG-HIS-LEU-SER-LYS-MET-GLN-GLN-ASN-GLY-TYR-GLU-ASN-PRO-THR-TYR-LYS-PHE-PHE-GLU-GLN-MET-GLN-ASN,140,35,,Kd=0.34uM,6.468521,6.47,1,A,A,0,M,T,0,,B,A,,1,1,140,35,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9012262225151062,0.6732030510902405,78.2859115600586,77.19432067871094,0.4545139372348785,1.1535104513168335,0.8658891916275024,0.7203386425971985,0.749346137046814,0.6257048845291138,GAMDAAVEPEERHLSKMQQNGYENPTYKFFEQMQN,Low,"(6.398, 6.523]",train
3DXE,protein-peptide,O00213 P05067,APKNELVQKFQVYYLGNVPVAKPVGVDVINGALESVLSSSSREQWTPSHVSVAPATLTILHQQTEAVLGECRVRFLSFLAVGRDVHTFAFIMAAGPASFCCHMFWCEPNAASLSEAVQAACMLRYQKCLDARSQHHHHHH,GAMDAAVAPEERHLSKMQQNGYENPTYKFFEQMQN,ALA-PRO-LYS-ASN-GLU-LEU-VAL-GLN-LYS-PHE-GLN-VAL-TYR-TYR-LEU-GLY-ASN-VAL-PRO-VAL-ALA-LYS-PRO-VAL-GLY-VAL-ASP-VAL-ILE-ASN-GLY-ALA-LEU-GLU-SER-VAL-LEU-SER-SER-SER-SER-ARG-GLU-GLN-TRP-THR-PRO-SER-HIS-VAL-SER-VAL-ALA-PRO-ALA-THR-LEU-THR-ILE-LEU-HIS-GLN-GLN-THR-GLU-ALA-VAL-LEU-GLY-GLU-CYS-ARG-VAL-ARG-PHE-LEU-SER-PHE-LEU-ALA-VAL-GLY-ARG-ASP-VAL-HIS-THR-PHE-ALA-PHE-ILE-MET-ALA-ALA-GLY-PRO-ALA-SER-PHE-CYS-CYS-HIS-MET-PHE-TRP-CYS-GLU-PRO-ASN-ALA-ALA-SER-LEU-SER-GLU-ALA-VAL-GLN-ALA-ALA-CYS-MET-LEU-ARG-TYR-GLN-LYS-CYS-LEU-ASP-ALA-ARG-SER-GLN-HIS-HIS-HIS-HIS-HIS-HIS,GLY-ALA-MET-ASP-ALA-ALA-VAL-ALA-PRO-GLU-GLU-ARG-HIS-LEU-SER-LYS-MET-GLN-GLN-ASN-GLY-TYR-GLU-ASN-PRO-THR-TYR-LYS-PHE-PHE-GLU-GLN-MET-GLN-ASN,140,35,,Kd=0.33uM,6.481486,6.48,1,A,A,0,M,T,0,,B,A,,1,1,140,35,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O,0.8936238288879395,0.7049668431282043,78.52291107177734,78.04956817626953,0.4409350156784057,1.1081804037094116,0.8700247406959534,0.7604582905769348,0.7745234966278076,0.6732367873191833,GAMDAAVAPEERHLSKMQQNGYENPTYKFFEQMQN,Low,"(6.398, 6.523]",train
3FII,protein-peptide,A7GBG3 P63027,MPVVINSFNYNDPVNDDTILYMQIPYEEKSKKYYKAFEIMRNVWIIPERNTIGTDPSDFDPPASLENGSSAYYDPNYLTTDAEKDRYLKTTIKLFKRINSNPAGEVLLQEISYAKPYLGNEHTPINEFHPVTRTTSVNIKSSTNVKSSIILNLLVLGAGPDIFENSSYPVRKLMDSGGVYDPSNDGFGSINIVTFSPEYEYTFNDISGGYNSSTESFIADPAISLAHELIHALHGLYGARGVTYKETIKVKQAPLMIAEKPIRLEEFLTFGGQDLNIITSAMKEKIYNNLLANYEKIATRLSRVNSAPPEYDINEYKDYFQWKYGLDKNADGSYTVNENKFNEIYKKLYSFTEIDLANKFKVKCRNTYFIKYGFLKVPNLLDDDIYTVSEGFNIGNLAVNNRGQNIKLNPKIIDSIPDKLEHHHHHH,TSNRRLQQTQAQVDEVVDIMRVNVDKVLERDC,MET-PRO-VAL-VAL-ILE-ASN-SER-PHE-ASN-TYR-ASN-ASP-PRO-VAL-ASN-ASP-ASP-THR-ILE-LEU-TYR-MET-GLN-ILE-PRO-TYR-GLU-GLU-LYS-SER-LYS-LYS-TYR-TYR-LYS-ALA-PHE-GLU-ILE-MET-ARG-ASN-VAL-TRP-ILE-ILE-PRO-GLU-ARG-ASN-THR-ILE-GLY-THR-ASP-PRO-SER-ASP-PHE-ASP-PRO-PRO-ALA-SER-LEU-GLU-ASN-GLY-SER-SER-ALA-TYR-TYR-ASP-PRO-ASN-TYR-LEU-THR-THR-ASP-ALA-GLU-LYS-ASP-ARG-TYR-LEU-LYS-THR-THR-ILE-LYS-LEU-PHE-LYS-ARG-ILE-ASN-SER-ASN-PRO-ALA-GLY-GLU-VAL-LEU-LEU-GLN-GLU-ILE-SER-TYR-ALA-LYS-PRO-TYR-LEU-GLY-ASN-GLU-HIS-THR-PRO-ILE-ASN-GLU-PHE-HIS-PRO-VAL-THR-ARG-THR-THR-SER-VAL-ASN-ILE-LYS-SER-SER-THR-ASN-VAL-LYS-SER-SER-ILE-ILE-LEU-ASN-LEU-LEU-VAL-LEU-GLY-ALA-GLY-PRO-ASP-ILE-PHE-GLU-ASN-SER-SER-TYR-PRO-VAL-ARG-LYS-LEU-MET-ASP-SER-GLY-GLY-VAL-TYR-ASP-PRO-SER-ASN-ASP-GLY-PHE-GLY-SER-ILE-ASN-ILE-VAL-THR-PHE-SER-PRO-GLU-TYR-GLU-TYR-THR-PHE-ASN-ASP-ILE-SER-GLY-GLY-TYR-ASN-SER-SER-THR-GLU-SER-PHE-ILE-ALA-ASP-PRO-ALA-ILE-SER-LEU-ALA-HIS-GLU-LEU-ILE-HIS-ALA-LEU-HIS-GLY-LEU-TYR-GLY-ALA-ARG-GLY-VAL-THR-TYR-LYS-GLU-THR-ILE-LYS-VAL-LYS-GLN-ALA-PRO-LEU-MET-ILE-ALA-GLU-LYS-PRO-ILE-ARG-LEU-GLU-GLU-PHE-LEU-THR-PHE-GLY-GLY-GLN-ASP-LEU-ASN-ILE-ILE-THR-SER-ALA-MET-LYS-GLU-LYS-ILE-TYR-ASN-ASN-LEU-LEU-ALA-ASN-TYR-GLU-LYS-ILE-ALA-THR-ARG-LEU-SER-ARG-VAL-ASN-SER-ALA-PRO-PRO-GLU-TYR-ASP-ILE-ASN-GLU-TYR-LYS-ASP-TYR-PHE-GLN-TRP-LYS-TYR-GLY-LEU-ASP-LYS-ASN-ALA-ASP-GLY-SER-TYR-THR-VAL-ASN-GLU-ASN-LYS-PHE-ASN-GLU-ILE-TYR-LYS-LYS-LEU-TYR-SER-PHE-THR-GLU-ILE-ASP-LEU-ALA-ASN-LYS-PHE-LYS-VAL-LYS-CYS-ARG-ASN-THR-TYR-PHE-ILE-LYS-TYR-GLY-PHE-LEU-LYS-VAL-PRO-ASN-LEU-LEU-ASP-ASP-ASP-ILE-TYR-THR-VAL-SER-GLU-GLY-PHE-ASN-ILE-GLY-ASN-LEU-ALA-VAL-ASN-ASN-ARG-GLY-GLN-ASN-ILE-LYS-LEU-ASN-PRO-LYS-ILE-ILE-ASP-SER-ILE-PRO-ASP-LYS-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,THR-SER-ASN-ARG-ARG-LEU-GLN-GLN-THR-GLN-ALA-GLN-VAL-ASP-GLU-VAL-VAL-ASP-ILE-MET-ARG-VAL-ASN-VAL-ASP-LYS-VAL-LEU-GLU-ARG-ASP-00C-NH2,427,33,,Ki=1.9nM,8.721246,8.72,1,A,A,0,M,T,0,,B,A,,1,1,427,33,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)C(N)CS(=O)(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)C(N)CS(=O)(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(C)C)C(=O)O,0.6704738140106201,0.5703169703483582,46.250396728515625,34.50991439819336,1.051680564880371,1.7815039157867432,0.7894217371940613,0.6599099636077881,0.5917172431945801,0.5288905501365662,TSNRRLQQTQAQVDEVVDIMRVNVDKVLERDC,Moderate,"(8.383, 8.824]",train
3GJ4,protein-peptide,P49791 P62826,GPHMASAAQGEPQVQFKLVLVGDGGTGKTTFVKRHLTGESEKKYVATLGVEVHPLVFHTNRGPIKFNVWDTAGQEKFGGLRDGYYIQAQCAIIMFDVTSRVTYKNVPNWHRDLVRVCENIPIVLCGNKVDIKDRKVKAKSIVFHRKKNLQYYDISAKSNYNFEKPFLWLARKLIGDPNLEFVAMPALAPPEVVMDPALAAQYEHDLEVAQTTALPDEDDDL,GPLGSVGSWECPVCCVSNKAEDSRCVSCTSEKP,GLY-PRO-HIS-MET-ALA-SER-ALA-ALA-GLN-GLY-GLU-PRO-GLN-VAL-GLN-PHE-LYS-LEU-VAL-LEU-VAL-GLY-ASP-GLY-GLY-THR-GLY-LYS-THR-THR-PHE-VAL-LYS-ARG-HIS-LEU-THR-GLY-GLU-SER-GLU-LYS-LYS-TYR-VAL-ALA-THR-LEU-GLY-VAL-GLU-VAL-HIS-PRO-LEU-VAL-PHE-HIS-THR-ASN-ARG-GLY-PRO-ILE-LYS-PHE-ASN-VAL-TRP-ASP-THR-ALA-GLY-GLN-GLU-LYS-PHE-GLY-GLY-LEU-ARG-ASP-GLY-TYR-TYR-ILE-GLN-ALA-GLN-CYS-ALA-ILE-ILE-MET-PHE-ASP-VAL-THR-SER-ARG-VAL-THR-TYR-LYS-ASN-VAL-PRO-ASN-TRP-HIS-ARG-ASP-LEU-VAL-ARG-VAL-CYS-GLU-ASN-ILE-PRO-ILE-VAL-LEU-CYS-GLY-ASN-LYS-VAL-ASP-ILE-LYS-ASP-ARG-LYS-VAL-LYS-ALA-LYS-SER-ILE-VAL-PHE-HIS-ARG-LYS-LYS-ASN-LEU-GLN-TYR-TYR-ASP-ILE-SER-ALA-LYS-SER-ASN-TYR-ASN-PHE-GLU-LYS-PRO-PHE-LEU-TRP-LEU-ALA-ARG-LYS-LEU-ILE-GLY-ASP-PRO-ASN-LEU-GLU-PHE-VAL-ALA-MET-PRO-ALA-LEU-ALA-PRO-PRO-GLU-VAL-VAL-MET-ASP-PRO-ALA-LEU-ALA-ALA-GLN-TYR-GLU-HIS-ASP-LEU-GLU-VAL-ALA-GLN-THR-THR-ALA-LEU-PRO-ASP-GLU-ASP-ASP-ASP-LEU,GLY-PRO-LEU-GLY-SER-VAL-GLY-SER-TRP-GLU-CYS-PRO-VAL-CYS-CYS-VAL-SER-ASN-LYS-ALA-GLU-ASP-SER-ARG-CYS-VAL-SER-CYS-THR-SER-GLU-LYS-PRO,221,33,,Kd=6.6uM,5.180456,5.18,1,A,A,0,M,T,0,,B,A,,1,1,221,33,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(C)C,0.549273669719696,0.6311177611351013,63.51493835449219,66.37213134765625,1.0230998992919922,1.5341503620147705,0.692026674747467,0.6318925023078918,0.3118137717247009,0.4951774775981903,GPLGSVGSWECPVCCVSNKAEDSRCVSCTSEKP,Low,"(5.105, 5.222]",train
3GJ5,protein-peptide,P49791 P62826,GPHMASAAQGEPQVQFKLVLVGDGGTGKTTFVKRHLTGESEKKYVATLGVEVHPLVFHTNRGPIKFNVWDTAGQEKFGGLRDGYYIQAQCAIIMFDVTSRVTYKNVPNWHRDLVRVCENIPIVLCGNKVDIKDRKVKAKSIVFHRKKNLQYYDISAKSNYNFEKPFLWLARKLIGDPNLEFVAMPALAPPEVVMDPALAAQYEHDLEVAQTTALPDEDDDL,GPLGSGSWDCEVCLVQNKADSTKCIACESAKPGT,GLY-PRO-HIS-MET-ALA-SER-ALA-ALA-GLN-GLY-GLU-PRO-GLN-VAL-GLN-PHE-LYS-LEU-VAL-LEU-VAL-GLY-ASP-GLY-GLY-THR-GLY-LYS-THR-THR-PHE-VAL-LYS-ARG-HIS-LEU-THR-GLY-GLU-SER-GLU-LYS-LYS-TYR-VAL-ALA-THR-LEU-GLY-VAL-GLU-VAL-HIS-PRO-LEU-VAL-PHE-HIS-THR-ASN-ARG-GLY-PRO-ILE-LYS-PHE-ASN-VAL-TRP-ASP-THR-ALA-GLY-GLN-GLU-LYS-PHE-GLY-GLY-LEU-ARG-ASP-GLY-TYR-TYR-ILE-GLN-ALA-GLN-CYS-ALA-ILE-ILE-MET-PHE-ASP-VAL-THR-SER-ARG-VAL-THR-TYR-LYS-ASN-VAL-PRO-ASN-TRP-HIS-ARG-ASP-LEU-VAL-ARG-VAL-CYS-GLU-ASN-ILE-PRO-ILE-VAL-LEU-CYS-GLY-ASN-LYS-VAL-ASP-ILE-LYS-ASP-ARG-LYS-VAL-LYS-ALA-LYS-SER-ILE-VAL-PHE-HIS-ARG-LYS-LYS-ASN-LEU-GLN-TYR-TYR-ASP-ILE-SER-ALA-LYS-SER-ASN-TYR-ASN-PHE-GLU-LYS-PRO-PHE-LEU-TRP-LEU-ALA-ARG-LYS-LEU-ILE-GLY-ASP-PRO-ASN-LEU-GLU-PHE-VAL-ALA-MET-PRO-ALA-LEU-ALA-PRO-PRO-GLU-VAL-VAL-MET-ASP-PRO-ALA-LEU-ALA-ALA-GLN-TYR-GLU-HIS-ASP-LEU-GLU-VAL-ALA-GLN-THR-THR-ALA-LEU-PRO-ASP-GLU-ASP-ASP-ASP-LEU,GLY-PRO-LEU-GLY-SER-GLY-SER-TRP-ASP-CYS-GLU-VAL-CYS-LEU-VAL-GLN-ASN-LYS-ALA-ASP-SER-THR-LYS-CYS-ILE-ALA-CYS-GLU-SER-ALA-LYS-PRO-GLY-THR,221,34,,Kd=47uM,4.327902,4.33,1,A,A,0,M,T,0,,B,A,,1,1,221,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,0.532682478427887,0.6462634205818176,67.24687957763672,65.88526916503906,0.8464533686637878,1.4480748176574707,0.7553266882896423,0.6339989900588989,0.3593743443489074,0.5079268217086792,GPLGSGSWDCEVCLVQNKADSTKCIACESAKPGT,Low,"(4.319, 4.456]",train
3GJ6,protein-peptide,P49791 P62826,GPHMASAAQGEPQVQFKLVLVGDGGTGKTTFVKRHLTGESEKKYVATLGVEVHPLVFHTNRGPIKFNVWDTAGQEKFGGLRDGYYIQAQCAIIMFDVTSRVTYKNVPNWHRDLVRVCENIPIVLCGNKVDIKDRKVKAKSIVFHRKKNLQYYDISAKSNYNFEKPFLWLARKLIGDPNLEFVAMPALAPPEVVMDPALAAQYEHDLEVAQTTALPDEDDDL,GPLGSAGSSWQCDTCLLQNKVTDNKCIACQAAKL,GLY-PRO-HIS-MET-ALA-SER-ALA-ALA-GLN-GLY-GLU-PRO-GLN-VAL-GLN-PHE-LYS-LEU-VAL-LEU-VAL-GLY-ASP-GLY-GLY-THR-GLY-LYS-THR-THR-PHE-VAL-LYS-ARG-HIS-LEU-THR-GLY-GLU-SER-GLU-LYS-LYS-TYR-VAL-ALA-THR-LEU-GLY-VAL-GLU-VAL-HIS-PRO-LEU-VAL-PHE-HIS-THR-ASN-ARG-GLY-PRO-ILE-LYS-PHE-ASN-VAL-TRP-ASP-THR-ALA-GLY-GLN-GLU-LYS-PHE-GLY-GLY-LEU-ARG-ASP-GLY-TYR-TYR-ILE-GLN-ALA-GLN-CYS-ALA-ILE-ILE-MET-PHE-ASP-VAL-THR-SER-ARG-VAL-THR-TYR-LYS-ASN-VAL-PRO-ASN-TRP-HIS-ARG-ASP-LEU-VAL-ARG-VAL-CYS-GLU-ASN-ILE-PRO-ILE-VAL-LEU-CYS-GLY-ASN-LYS-VAL-ASP-ILE-LYS-ASP-ARG-LYS-VAL-LYS-ALA-LYS-SER-ILE-VAL-PHE-HIS-ARG-LYS-LYS-ASN-LEU-GLN-TYR-TYR-ASP-ILE-SER-ALA-LYS-SER-ASN-TYR-ASN-PHE-GLU-LYS-PRO-PHE-LEU-TRP-LEU-ALA-ARG-LYS-LEU-ILE-GLY-ASP-PRO-ASN-LEU-GLU-PHE-VAL-ALA-MET-PRO-ALA-LEU-ALA-PRO-PRO-GLU-VAL-VAL-MET-ASP-PRO-ALA-LEU-ALA-ALA-GLN-TYR-GLU-HIS-ASP-LEU-GLU-VAL-ALA-GLN-THR-THR-ALA-LEU-PRO-ASP-GLU-ASP-ASP-ASP-LEU,GLY-PRO-LEU-GLY-SER-ALA-GLY-SER-SER-TRP-GLN-CYS-ASP-THR-CYS-LEU-LEU-GLN-ASN-LYS-VAL-THR-ASP-ASN-LYS-CYS-ILE-ALA-CYS-GLN-ALA-ALA-LYS-LEU,221,34,,Kd=6.5uM,5.187087,5.19,1,A,A,0,M,T,0,,B,A,,1,1,221,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,0.5962302088737488,0.6056617498397827,65.24562072753906,64.39996337890625,0.8732640147209167,1.528305172920227,0.6939355731010437,0.6198787689208984,0.4173920750617981,0.466360867023468,GPLGSAGSSWQCDTCLLQNKVTDNKCIACQAAKL,Low,"(5.105, 5.222]",train
3GS2,protein-peptide,O95931 Q99496,ASEIELVFRPHPTLMEKDDSAQTRYIKTSGNATVDHLSKYLAVRLALEELRSKGESNQMNLDTASEKQYTIYIATASGQFTVLDGSFSLELVSEKYWKVNKPMELYYAPTK,EVTVTDITANSITVTFREAQAAEGFFRDRS,ALA-SER-GLU-ILE-GLU-LEU-VAL-PHE-ARG-PRO-HIS-PRO-THR-LEU-MET-GLU-LYS-ASP-ASP-SER-ALA-GLN-THR-ARG-TYR-ILE-LYS-THR-SER-GLY-ASN-ALA-THR-VAL-ASP-HIS-LEU-SER-LYS-TYR-LEU-ALA-VAL-ARG-LEU-ALA-LEU-GLU-GLU-LEU-ARG-SER-LYS-GLY-GLU-SER-ASN-GLN-MET-ASN-LEU-ASP-THR-ALA-SER-GLU-LYS-GLN-TYR-THR-ILE-TYR-ILE-ALA-THR-ALA-SER-GLY-GLN-PHE-THR-VAL-LEU-ASP-GLY-SER-PHE-SER-LEU-GLU-LEU-VAL-SER-GLU-LYS-TYR-TRP-LYS-VAL-ASN-LYS-PRO-MET-GLU-LEU-TYR-TYR-ALA-PRO-THR-LYS,GLU-VAL-THR-VAL-THR-ASP-ILE-THR-ALA-ASN-SER-ILE-THR-VAL-THR-PHE-ARG-GLU-ALA-GLN-ALA-ALA-GLU-GLY-PHE-PHE-ARG-ASP-ARG-SER,111,30,,Kd=9.2nM,8.036212,8.04,1,A,A,0,M,T,0,,B,A,dimer,1,1,111,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)O,0.9246346354484558,0.6928520202636719,91.59759521484376,78.00507354736328,0.4307289719581604,0.9700936079025269,0.8772458434104919,0.7434583902359009,0.8168009519577026,0.6802003383636475,EVTVTDITANSITVTFREAQAAEGFFRDRS,Moderate,"(7.921, 8.383]",train
3H3G,protein-peptide,P12272 Q03431 P0AEX9,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFDDVMTKEEQIFLLHRAQAQCEKRLKEVLQRPASIMESDKGWTSASTSGKPRKDKASGKLYPESEEDKEAPTGSRYRGRPCLPEWDHILCWPLGAPGEVVAVPCPDYIYDFNHKGHAYRRCDRNGSWELVPGHNRTWANYSECVKFLTNETREREVFDRLHHHHHH,GKSIQDLRRRFFLHHLIAEIHTA,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-ASP-ASP-VAL-MET-THR-LYS-GLU-GLU-GLN-ILE-PHE-LEU-LEU-HIS-ARG-ALA-GLN-ALA-GLN-CYS-GLU-LYS-ARG-LEU-LYS-GLU-VAL-LEU-GLN-ARG-PRO-ALA-SER-ILE-MET-GLU-SER-ASP-LYS-GLY-TRP-THR-SER-ALA-SER-THR-SER-GLY-LYS-PRO-ARG-LYS-ASP-LYS-ALA-SER-GLY-LYS-LEU-TYR-PRO-GLU-SER-GLU-GLU-ASP-LYS-GLU-ALA-PRO-THR-GLY-SER-ARG-TYR-ARG-GLY-ARG-PRO-CYS-LEU-PRO-GLU-TRP-ASP-HIS-ILE-LEU-CYS-TRP-PRO-LEU-GLY-ALA-PRO-GLY-GLU-VAL-VAL-ALA-VAL-PRO-CYS-PRO-ASP-TYR-ILE-TYR-ASP-PHE-ASN-HIS-LYS-GLY-HIS-ALA-TYR-ARG-ARG-CYS-ASP-ARG-ASN-GLY-SER-TRP-GLU-LEU-VAL-PRO-GLY-HIS-ASN-ARG-THR-TRP-ALA-ASN-TYR-SER-GLU-CYS-VAL-LYS-PHE-LEU-THR-ASN-GLU-THR-ARG-GLU-ARG-GLU-VAL-PHE-ASP-ARG-LEU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-LYS-SER-ILE-GLN-ASP-LEU-ARG-ARG-ARG-PHE-PHE-LEU-HIS-HIS-LEU-ILE-ALA-GLU-ILE-HIS-THR-ALA-NH2,539,24,,Kd=0.99uM,6.004365,6.0,1,A,A,0,M,T,0,,B,A,,1,1,539,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CN)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)O,0.6521908044815063,0.6460263133049011,54.99199295043945,57.07302474975586,0.8463205099105835,1.4781043529510498,0.6403677463531494,0.6801506280899048,0.5817479491233826,0.5760388374328613,GKSIQDLRRRFFLHHLIAEIHTA,Low,"(5.959, 6.097]",train
3KJ0,protein-peptide,O43521 Q07820,GSDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGG,GSGGRPEIWYAQELRRIGDEFNAYYAR,GLY-SER-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY-GLY,GLY-SER-GLY-GLY-ARG-PRO-GLU-ILE-TRP-TYR-ALA-GLN-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-PHE-ASN-ALA-TYR-TYR-ALA-ARG,158,27,,Kd=2nM,8.69897,8.7,1,A,A,0,M,S,0,,B,A,,1,1,158,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9644153714179992,0.7187395095825195,89.69757843017578,83.22135925292969,0.4003172516822815,0.9819619655609132,0.9020740389823914,0.7957568168640137,0.8651358485221863,0.699485182762146,GSGGRPEIWYAQELRRIGDEFNAYYAR,Moderate,"(8.383, 8.824]",train
3KZ0,protein-peptide,Q07820,GSDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGG,RPEIWAAQEIRRIGDENNAYYAR,GLY-SER-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY-GLY,ARG-PRO-GLU-ILE-TRP-ALA-ALA-GLN-GLU-ILE-ARG-ARG-ILE-GLY-ASP-GLU-ASN-ASN-ALA-TYR-TYR-ALA-ARG,158,23,,Ki=273nM,6.563837,6.56,1,A,A,0,M,T,0,,C,A,,1,1,158,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)O,1.028346061706543,0.7299119830131531,92.30235290527344,84.17487335205078,0.3347338438034057,0.9389379620552064,0.9349493384361268,0.8067747950553894,0.9446510672569276,0.710696280002594,RPEIWAAQEIRRIGDENNAYYAR,Low,"(6.523, 6.696]",train
3UKW,protein-peptide,P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,GSRRRRPRKRPLEWDEDEEPPRKRKRLW,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLY-SER-ARG-ARG-ARG-ARG-PRO-ARG-LYS-ARG-PRO-LEU-GLU-TRP-ASP-GLU-ASP-GLU-GLU-PRO-PRO-ARG-LYS-ARG-LYS-ARG-LEU-TRP,510,28,,Kd=0.11nM,9.958607,9.96,1,A,A,0,M,T,0,,C,B,,1,1,510,28,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.926702320575714,0.8882232308387756,81.0485610961914,80.71516418457031,0.4621465802192688,0.8646149039268494,0.8236082792282104,0.8286927342414856,0.829334557056427,0.8099686503410339,GSRRRRPRKRPLEWDEDEEPPRKRKRLW,High,"(8.824, 12.12]",train
3UKX,protein-peptide,P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,GSRRRRRRKRKREWDDDDDPPKKRRRLD,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLY-SER-ARG-ARG-ARG-ARG-ARG-ARG-LYS-ARG-LYS-ARG-GLU-TRP-ASP-ASP-ASP-ASP-ASP-PRO-PRO-LYS-LYS-ARG-ARG-ARG-LEU-ASP,510,28,,Kd=0.03nM,10.522879,10.52,1,A,A,0,M,T,0,,C,B,,1,1,510,28,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.8732643723487854,0.8560071587562561,79.1942138671875,80.57071685791016,0.4837208390235901,0.9553470611572266,0.8149182200431824,0.8117236495018005,0.767033040523529,0.7751662135124207,GSRRRRRRKRKREWDDDDDPPKKRRRLD,High,"(8.824, 12.12]",train
3UKZ,protein-peptide,Q3UYV9 P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,GSMSRRRHSYENDGGQPHKRRKTSD,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLY-SER-MET-SER-ARG-ARG-ARG-HIS-SER-TYR-GLU-ASN-ASP-GLY-GLY-GLN-PRO-HIS-LYS-ARG-ARG-LYS-THR-SER-ASP,510,25,,Kd=2.4nM,8.619789,8.62,1,A,A,0,M,T,0,,C,B,,1,1,510,25,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,0.938048243522644,0.8810420632362366,81.14683532714844,81.0867919921875,0.4554272592067718,0.8171159625053406,0.8236659169197083,0.8245975971221924,0.8451484441757202,0.8020159006118774,GSMSRRRHSYENDGGQPHKRRKTSD,Moderate,"(8.383, 8.824]",val
3UL0,protein-peptide,Q3UYV9 P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,GSMSRRRHSDENDGGQPHKRRKTSD,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLY-SER-MET-SER-ARG-ARG-ARG-HIS-SER-ASP-GLU-ASN-ASP-GLY-GLY-GLN-PRO-HIS-LYS-ARG-ARG-LYS-THR-SER-ASP,510,25,,Kd=2.3nM,8.638272,8.64,1,A,A,0,M,T,0,,C,B,,1,1,510,25,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,0.952315092086792,0.9263238906860352,81.76091003417969,81.48954010009766,0.4372533857822418,0.7299643158912659,0.8309256434440613,0.8419292569160461,0.8635035753250122,0.8555107712745667,GSMSRRRHSDENDGGQPHKRRKTSD,Moderate,"(8.383, 8.824]",train
3UL1,protein-peptide,P05221 P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,GSAVKRPAATKKAGQAKKKKLD,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLY-SER-ALA-VAL-LYS-ARG-PRO-ALA-ALA-THR-LYS-LYS-ALA-GLY-GLN-ALA-LYS-LYS-LYS-LYS-LEU-ASP,510,22,,Kd=2.7nM,8.568636,8.57,1,A,A,0,M,T,0,,A,B,,1,1,510,22,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.952835977077484,0.8190354108810425,81.32951354980469,81.30377960205078,0.4483431875705719,0.9872868657112122,0.8280233144760132,0.8033928275108337,0.8653831481933594,0.7298088073730469,GSAVKRPAATKKAGQAKKKKLD,Moderate,"(8.383, 8.824]",train
4AOQ,protein-peptide,P84781 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,EDKCSPSGAICSGAGPPEQCCSGACVPHPILRIFVCQ,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLU-ASP-LYS-CYS-SER-PRO-SER-GLY-ALA-ILE-CYS-SER-GLY-ALA-GLY-PRO-PRO-GLU-GLN-CYS-CYS-SER-GLY-ALA-CYS-VAL-PRO-HIS-PRO-ILE-LEU-ARG-ILE-PHE-VAL-CYS-GLN,223,37,,Kd=201.8nM,6.695079,6.7,1,A,A,0,M,T,0,,D,A,,1,1,223,37,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,0.8873363733291626,0.5449276566505432,91.60086822509766,84.99893951416016,0.3557418286800384,1.3037853240966797,0.9461192488670348,0.7138553857803345,0.8726406097412109,0.5026956796646118,EDKCSPSGAICSGAGPPEQCCSGACVPHPILRIFVCQ,Low,"(6.523, 6.696]",train
4B1V,protein-peptide,Q2M3X8 P68135,CDEDETTALVCDNGSGLVKAGFAGDDAPRAVFPSIVGRPRHQGVMVGMGQKDSYVGDEAQSKRGILTLKYPIEHGIITNWDDMEKIWHHTFYNELRVAPEEHPTLLTEAPLNPKANREKMTQIMFETFNVPAMYVAIQAVLSLYASGRTTGIVLDSGDGVTHNVPIYEGYALPHAIMRLDLAGRDLTDYLMKILTERGYSFVTTAEREIVRDIKEKLCYVALDFENEMATAASSSSLEKSYELPDGQVITIGNERFRCPETLFQPSFIGMESAGIHETTYNSIMKCDIDIRKDLYANNVMSGGTTMYPGIADRMQKEITALAPSTMKIKIIAPPERKYSVWIGGSILASLSTFQQMWITKQEYDEAGPSIVHRKCF,FKHTSAALERKISMRQSREELIKRGVLKEIYD,CYS-ASP-GLU-ASP-GLU-THR-THR-ALA-LEU-VAL-CYS-ASP-ASN-GLY-SER-GLY-LEU-VAL-LYS-ALA-GLY-PHE-ALA-GLY-ASP-ASP-ALA-PRO-ARG-ALA-VAL-PHE-PRO-SER-ILE-VAL-GLY-ARG-PRO-ARG-HIS-GLN-GLY-VAL-MET-VAL-GLY-MET-GLY-GLN-LYS-ASP-SER-TYR-VAL-GLY-ASP-GLU-ALA-GLN-SER-LYS-ARG-GLY-ILE-LEU-THR-LEU-LYS-TYR-PRO-ILE-GLU-HIS-GLY-ILE-ILE-THR-ASN-TRP-ASP-ASP-MET-GLU-LYS-ILE-TRP-HIS-HIS-THR-PHE-TYR-ASN-GLU-LEU-ARG-VAL-ALA-PRO-GLU-GLU-HIS-PRO-THR-LEU-LEU-THR-GLU-ALA-PRO-LEU-ASN-PRO-LYS-ALA-ASN-ARG-GLU-LYS-MET-THR-GLN-ILE-MET-PHE-GLU-THR-PHE-ASN-VAL-PRO-ALA-MET-TYR-VAL-ALA-ILE-GLN-ALA-VAL-LEU-SER-LEU-TYR-ALA-SER-GLY-ARG-THR-THR-GLY-ILE-VAL-LEU-ASP-SER-GLY-ASP-GLY-VAL-THR-HIS-ASN-VAL-PRO-ILE-TYR-GLU-GLY-TYR-ALA-LEU-PRO-HIS-ALA-ILE-MET-ARG-LEU-ASP-LEU-ALA-GLY-ARG-ASP-LEU-THR-ASP-TYR-LEU-MET-LYS-ILE-LEU-THR-GLU-ARG-GLY-TYR-SER-PHE-VAL-THR-THR-ALA-GLU-ARG-GLU-ILE-VAL-ARG-ASP-ILE-LYS-GLU-LYS-LEU-CYS-TYR-VAL-ALA-LEU-ASP-PHE-GLU-ASN-GLU-MET-ALA-THR-ALA-ALA-SER-SER-SER-SER-LEU-GLU-LYS-SER-TYR-GLU-LEU-PRO-ASP-GLY-GLN-VAL-ILE-THR-ILE-GLY-ASN-GLU-ARG-PHE-ARG-CYS-PRO-GLU-THR-LEU-PHE-GLN-PRO-SER-PHE-ILE-GLY-MET-GLU-SER-ALA-GLY-ILE-HIS-GLU-THR-THR-TYR-ASN-SER-ILE-MET-LYS-CYS-ASP-ILE-ASP-ILE-ARG-LYS-ASP-LEU-TYR-ALA-ASN-ASN-VAL-MET-SER-GLY-GLY-THR-THR-MET-TYR-PRO-GLY-ILE-ALA-ASP-ARG-MET-GLN-LYS-GLU-ILE-THR-ALA-LEU-ALA-PRO-SER-THR-MET-LYS-ILE-LYS-ILE-ILE-ALA-PRO-PRO-GLU-ARG-LYS-TYR-SER-VAL-TRP-ILE-GLY-GLY-SER-ILE-LEU-ALA-SER-LEU-SER-THR-PHE-GLN-GLN-MET-TRP-ILE-THR-LYS-GLN-GLU-TYR-ASP-GLU-ALA-GLY-PRO-SER-ILE-VAL-HIS-ARG-LYS-CYS-PHE,PHE-LYS-HIS-THR-SER-ALA-ALA-LEU-GLU-ARG-LYS-ILE-SER-MET-ARG-GLN-SER-ARG-GLU-GLU-LEU-ILE-LYS-ARG-GLY-VAL-LEU-LYS-GLU-ILE-TYR-ASP,376,32,,Kd=0.32uM,6.49485,6.49,1,A,A,0,M,T,0,,M,A,,0,1,376,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O,0.7740903496742249,0.6369930505752563,80.1963882446289,78.74989318847656,0.4832316637039184,1.361616134643555,0.8835523128509521,0.7784514427185059,0.7038326263427734,0.6016284227371216,FKHTSAALERKISMRQSREELIKRGVLKEIYD,Low,"(6.398, 6.523]",train
4B1X,protein-peptide,Q2M3X8 P68135,CDEDETTALVCDNGSGLVKAGFAGDDAPRAVFPSIVGRPRHQGVMVGMGQKDSYVGDEAQSKRGILTLKYPIEHGIITNWDDMEKIWHHTFYNELRVAPEEHPTLLTEAPLNPKANREKMTQIMFETFNVPAMYVAIQAVLSLYASGRTTGIVLDSGDGVTHNVPIYEGYALPHAIMRLDLAGRDLTDYLMKILTERGYSFVTTAEREIVRDIKEKLCYVALDFENEMATAASSSSLEKSYELPDGQVITIGNERFRCPETLFQPSFIGMESAGIHETTYNSIMKCDIDIRKDLYANNVMSGGTTMYPGIADRMQKEITALAPSTMKIKIIAPPERKYSVWIGGSILASLSTFQQMWITKQEYDEAGPSIVHRKCF,RQQIGTKLTRRLSQRPTAEELEQRNILKPRNE,CYS-ASP-GLU-ASP-GLU-THR-THR-ALA-LEU-VAL-CYS-ASP-ASN-GLY-SER-GLY-LEU-VAL-LYS-ALA-GLY-PHE-ALA-GLY-ASP-ASP-ALA-PRO-ARG-ALA-VAL-PHE-PRO-SER-ILE-VAL-GLY-ARG-PRO-ARG-HIS-GLN-GLY-VAL-MET-VAL-GLY-MET-GLY-GLN-LYS-ASP-SER-TYR-VAL-GLY-ASP-GLU-ALA-GLN-SER-LYS-ARG-GLY-ILE-LEU-THR-LEU-LYS-TYR-PRO-ILE-GLU-HIS-GLY-ILE-ILE-THR-ASN-TRP-ASP-ASP-MET-GLU-LYS-ILE-TRP-HIS-HIS-THR-PHE-TYR-ASN-GLU-LEU-ARG-VAL-ALA-PRO-GLU-GLU-HIS-PRO-THR-LEU-LEU-THR-GLU-ALA-PRO-LEU-ASN-PRO-LYS-ALA-ASN-ARG-GLU-LYS-MET-THR-GLN-ILE-MET-PHE-GLU-THR-PHE-ASN-VAL-PRO-ALA-MET-TYR-VAL-ALA-ILE-GLN-ALA-VAL-LEU-SER-LEU-TYR-ALA-SER-GLY-ARG-THR-THR-GLY-ILE-VAL-LEU-ASP-SER-GLY-ASP-GLY-VAL-THR-HIS-ASN-VAL-PRO-ILE-TYR-GLU-GLY-TYR-ALA-LEU-PRO-HIS-ALA-ILE-MET-ARG-LEU-ASP-LEU-ALA-GLY-ARG-ASP-LEU-THR-ASP-TYR-LEU-MET-LYS-ILE-LEU-THR-GLU-ARG-GLY-TYR-SER-PHE-VAL-THR-THR-ALA-GLU-ARG-GLU-ILE-VAL-ARG-ASP-ILE-LYS-GLU-LYS-LEU-CYS-TYR-VAL-ALA-LEU-ASP-PHE-GLU-ASN-GLU-MET-ALA-THR-ALA-ALA-SER-SER-SER-SER-LEU-GLU-LYS-SER-TYR-GLU-LEU-PRO-ASP-GLY-GLN-VAL-ILE-THR-ILE-GLY-ASN-GLU-ARG-PHE-ARG-CYS-PRO-GLU-THR-LEU-PHE-GLN-PRO-SER-PHE-ILE-GLY-MET-GLU-SER-ALA-GLY-ILE-HIS-GLU-THR-THR-TYR-ASN-SER-ILE-MET-LYS-CYS-ASP-ILE-ASP-ILE-ARG-LYS-ASP-LEU-TYR-ALA-ASN-ASN-VAL-MET-SER-GLY-GLY-THR-THR-MET-TYR-PRO-GLY-ILE-ALA-ASP-ARG-MET-GLN-LYS-GLU-ILE-THR-ALA-LEU-ALA-PRO-SER-THR-MET-LYS-ILE-LYS-ILE-ILE-ALA-PRO-PRO-GLU-ARG-LYS-TYR-SER-VAL-TRP-ILE-GLY-GLY-SER-ILE-LEU-ALA-SER-LEU-SER-THR-PHE-GLN-GLN-MET-TRP-ILE-THR-LYS-GLN-GLU-TYR-ASP-GLU-ALA-GLY-PRO-SER-ILE-VAL-HIS-ARG-LYS-CYS-PHE,ARG-GLN-GLN-ILE-GLY-THR-LYS-LEU-THR-ARG-ARG-LEU-SER-GLN-ARG-PRO-THR-ALA-GLU-GLU-LEU-GLU-GLN-ARG-ASN-ILE-LEU-LYS-PRO-ARG-ASN-GLU,376,32,,Kd=4.34uM,5.36251,5.36,1,A,A,0,M,T,0,,M,B,,1,1,376,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.7210204601287842,0.6500877141952515,80.5081558227539,76.24573516845703,0.5295615196228027,1.3519444465637207,0.877091646194458,0.7819876074790955,0.6329830884933472,0.6171127557754517,RQQIGTKLTRRLSQRPTAEELEQRNILKPRNE,Low,"(5.31, 5.463]",val
4B1Y,protein-peptide,Q2M3X8 P68135,CDEDETTALVCDNGSGLVKAGFAGDDAPRAVFPSIVGRPRHQGVMVGMGQKDSYVGDEAQSKRGILTLKYPIEHGIITNWDDMEKIWHHTFYNELRVAPEEHPTLLTEAPLNPKANREKMTQIMFETFNVPAMYVAIQAVLSLYASGRTTGIVLDSGDGVTHNVPIYEGYALPHAIMRLDLAGRDLTDYLMKILTERGYSFVTTAEREIVRDIKEKLCYVALDFENEMATAASSSSLEKSYELPDGQVITIGNERFRCPETLFQPSFIGMESAGIHETTYNSIMKCDIDIRKDLYANNVMSGGTTMYPGIADRMQKEITALAPSTMKIKIIAPPERKYSVWIGGSILASLSTFQQMWITKQEYDEAGPSIVHRKCF,KREIKRRLTRKLSQRPTVEELRERKILIRFSD,CYS-ASP-GLU-ASP-GLU-THR-THR-ALA-LEU-VAL-CYS-ASP-ASN-GLY-SER-GLY-LEU-VAL-LYS-ALA-GLY-PHE-ALA-GLY-ASP-ASP-ALA-PRO-ARG-ALA-VAL-PHE-PRO-SER-ILE-VAL-GLY-ARG-PRO-ARG-HIS-GLN-GLY-VAL-MET-VAL-GLY-MET-GLY-GLN-LYS-ASP-SER-TYR-VAL-GLY-ASP-GLU-ALA-GLN-SER-LYS-ARG-GLY-ILE-LEU-THR-LEU-LYS-TYR-PRO-ILE-GLU-HIS-GLY-ILE-ILE-THR-ASN-TRP-ASP-ASP-MET-GLU-LYS-ILE-TRP-HIS-HIS-THR-PHE-TYR-ASN-GLU-LEU-ARG-VAL-ALA-PRO-GLU-GLU-HIS-PRO-THR-LEU-LEU-THR-GLU-ALA-PRO-LEU-ASN-PRO-LYS-ALA-ASN-ARG-GLU-LYS-MET-THR-GLN-ILE-MET-PHE-GLU-THR-PHE-ASN-VAL-PRO-ALA-MET-TYR-VAL-ALA-ILE-GLN-ALA-VAL-LEU-SER-LEU-TYR-ALA-SER-GLY-ARG-THR-THR-GLY-ILE-VAL-LEU-ASP-SER-GLY-ASP-GLY-VAL-THR-HIS-ASN-VAL-PRO-ILE-TYR-GLU-GLY-TYR-ALA-LEU-PRO-HIS-ALA-ILE-MET-ARG-LEU-ASP-LEU-ALA-GLY-ARG-ASP-LEU-THR-ASP-TYR-LEU-MET-LYS-ILE-LEU-THR-GLU-ARG-GLY-TYR-SER-PHE-VAL-THR-THR-ALA-GLU-ARG-GLU-ILE-VAL-ARG-ASP-ILE-LYS-GLU-LYS-LEU-CYS-TYR-VAL-ALA-LEU-ASP-PHE-GLU-ASN-GLU-MET-ALA-THR-ALA-ALA-SER-SER-SER-SER-LEU-GLU-LYS-SER-TYR-GLU-LEU-PRO-ASP-GLY-GLN-VAL-ILE-THR-ILE-GLY-ASN-GLU-ARG-PHE-ARG-CYS-PRO-GLU-THR-LEU-PHE-GLN-PRO-SER-PHE-ILE-GLY-MET-GLU-SER-ALA-GLY-ILE-HIS-GLU-THR-THR-TYR-ASN-SER-ILE-MET-LYS-CYS-ASP-ILE-ASP-ILE-ARG-LYS-ASP-LEU-TYR-ALA-ASN-ASN-VAL-MET-SER-GLY-GLY-THR-THR-MET-TYR-PRO-GLY-ILE-ALA-ASP-ARG-MET-GLN-LYS-GLU-ILE-THR-ALA-LEU-ALA-PRO-SER-THR-MET-LYS-ILE-LYS-ILE-ILE-ALA-PRO-PRO-GLU-ARG-LYS-TYR-SER-VAL-TRP-ILE-GLY-GLY-SER-ILE-LEU-ALA-SER-LEU-SER-THR-PHE-GLN-GLN-MET-TRP-ILE-THR-LYS-GLN-GLU-TYR-ASP-GLU-ALA-GLY-PRO-SER-ILE-VAL-HIS-ARG-LYS-CYS-PHE,LYS-ARG-GLU-ILE-LYS-ARG-ARG-LEU-THR-ARG-LYS-LEU-SER-GLN-ARG-PRO-THR-VAL-GLU-GLU-LEU-ARG-GLU-ARG-LYS-ILE-LEU-ILE-ARG-PHE-SER-ASP,376,32,,Kd=0.27uM,6.568636,6.57,1,A,A,0,M,T,0,,M,B,,1,1,376,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,0.6847352385520935,0.6768509149551392,80.08303833007812,76.16837310791016,0.5554118156433105,1.244032621383667,0.8701013326644897,0.7858254313468933,0.5909059047698975,0.649607241153717,KREIKRRLTRKLSQRPTVEELRERKILIRFSD,Low,"(6.523, 6.696]",train
4BRU,protein-peptide,P39998 P39517,NTFEDFYLKRELLMGIFEAGFEKPSPIQEEAIPVAITGRDILARAKNGTGKTAAFVIPTLEKVKPKLNKIQALIMVPTRELALQTSQVVRTLGKHCGISCMVTTGGTNLRDDILRLNETVHILVGTPGRVLDLASRKVADLSDCSLFIMDEADKMLSRDFKTIIEQILSFLPPTHQSLLFSATFPLTVDEFMDKHLHKPYEINLMEELTLKGITQYYAFVEERQKLHCLNTLFSKLQINQAIIFCNSTNRVELLAKKITDLGYSCYYSHARMKQQERNKVFHEFRQGKVRTLVCSDLLTRGIDIQAVNVVINFDFPKTAETYLHRIGRSGRFGHLGLAINLINWNDRFNLYKIEQELGTEIAAIPATIDKSLYVAEN,RSMQQNDYNQNRGEHIDWQDDDVSKIKQQEDFDFQRNLGMFNK,ASN-THR-PHE-GLU-ASP-PHE-TYR-LEU-LYS-ARG-GLU-LEU-LEU-MET-GLY-ILE-PHE-GLU-ALA-GLY-PHE-GLU-LYS-PRO-SER-PRO-ILE-GLN-GLU-GLU-ALA-ILE-PRO-VAL-ALA-ILE-THR-GLY-ARG-ASP-ILE-LEU-ALA-ARG-ALA-LYS-ASN-GLY-THR-GLY-LYS-THR-ALA-ALA-PHE-VAL-ILE-PRO-THR-LEU-GLU-LYS-VAL-LYS-PRO-LYS-LEU-ASN-LYS-ILE-GLN-ALA-LEU-ILE-MET-VAL-PRO-THR-ARG-GLU-LEU-ALA-LEU-GLN-THR-SER-GLN-VAL-VAL-ARG-THR-LEU-GLY-LYS-HIS-CYS-GLY-ILE-SER-CYS-MET-VAL-THR-THR-GLY-GLY-THR-ASN-LEU-ARG-ASP-ASP-ILE-LEU-ARG-LEU-ASN-GLU-THR-VAL-HIS-ILE-LEU-VAL-GLY-THR-PRO-GLY-ARG-VAL-LEU-ASP-LEU-ALA-SER-ARG-LYS-VAL-ALA-ASP-LEU-SER-ASP-CYS-SER-LEU-PHE-ILE-MET-ASP-GLU-ALA-ASP-LYS-MET-LEU-SER-ARG-ASP-PHE-LYS-THR-ILE-ILE-GLU-GLN-ILE-LEU-SER-PHE-LEU-PRO-PRO-THR-HIS-GLN-SER-LEU-LEU-PHE-SER-ALA-THR-PHE-PRO-LEU-THR-VAL-ASP-GLU-PHE-MET-ASP-LYS-HIS-LEU-HIS-LYS-PRO-TYR-GLU-ILE-ASN-LEU-MET-GLU-GLU-LEU-THR-LEU-LYS-GLY-ILE-THR-GLN-TYR-TYR-ALA-PHE-VAL-GLU-GLU-ARG-GLN-LYS-LEU-HIS-CYS-LEU-ASN-THR-LEU-PHE-SER-LYS-LEU-GLN-ILE-ASN-GLN-ALA-ILE-ILE-PHE-CYS-ASN-SER-THR-ASN-ARG-VAL-GLU-LEU-LEU-ALA-LYS-LYS-ILE-THR-ASP-LEU-GLY-TYR-SER-CYS-TYR-TYR-SER-HIS-ALA-ARG-MET-LYS-GLN-GLN-GLU-ARG-ASN-LYS-VAL-PHE-HIS-GLU-PHE-ARG-GLN-GLY-LYS-VAL-ARG-THR-LEU-VAL-CYS-SER-ASP-LEU-LEU-THR-ARG-GLY-ILE-ASP-ILE-GLN-ALA-VAL-ASN-VAL-VAL-ILE-ASN-PHE-ASP-PHE-PRO-LYS-THR-ALA-GLU-THR-TYR-LEU-HIS-ARG-ILE-GLY-ARG-SER-GLY-ARG-PHE-GLY-HIS-LEU-GLY-LEU-ALA-ILE-ASN-LEU-ILE-ASN-TRP-ASN-ASP-ARG-PHE-ASN-LEU-TYR-LYS-ILE-GLU-GLN-GLU-LEU-GLY-THR-GLU-ILE-ALA-ALA-ILE-PRO-ALA-THR-ILE-ASP-LYS-SER-LEU-TYR-VAL-ALA-GLU-ASN,ARG-SER-MET-GLN-GLN-ASN-ASP-TYR-ASN-GLN-ASN-ARG-GLY-GLU-HIS-ILE-ASP-TRP-GLN-ASP-ASP-ASP-VAL-SER-LYS-ILE-LYS-GLN-GLN-GLU-ASP-PHE-ASP-PHE-GLN-ARG-ASN-LEU-GLY-MET-PHE-ASN-LYS,377,43,,Kd=200nM,6.69897,6.7,1,A,A,0,M,T,0,,B,A,,1,1,377,43,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O,0.8077948093414307,,73.35075378417969,,0.5628836750984192,,0.7774296402931213,,0.7528860569000244,,RSMQQNDYNQNRGEHIDWQDDDVSKIKQQEDFDFQRNLGMFNK,Low,"(6.696, 6.824]",train
4DZU,protein-peptide,,SGIVQQQNNLLRAIEAQQHLLQLTVWGIKQLQARILSGGSGGWMEWDREINNYTSLIHSLIEESQNQQEKNEQELLGGSGGSGIVQQQNNLLRAIEAQQHLLQLTVWGIKQLQARILSGGSGGWMEWDREINNYTSLIHSLIEESQNQQEKNEQELLGGSGGSGIVQQQNNLLRAIEAQQHLLQLTVWGIKQLQARIL,RTWEEWDRAIAEYARRIEELIRAAQEQQRKNEEALREL,SER-GLY-ILE-VAL-GLN-GLN-GLN-ASN-ASN-LEU-LEU-ARG-ALA-ILE-GLU-ALA-GLN-GLN-HIS-LEU-LEU-GLN-LEU-THR-VAL-TRP-GLY-ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU-SER-GLY-GLY-SER-GLY-GLY-TRP-MET-GLU-TRP-ASP-ARG-GLU-ILE-ASN-ASN-TYR-THR-SER-LEU-ILE-HIS-SER-LEU-ILE-GLU-GLU-SER-GLN-ASN-GLN-GLN-GLU-LYS-ASN-GLU-GLN-GLU-LEU-LEU-GLY-GLY-SER-GLY-GLY-SER-GLY-ILE-VAL-GLN-GLN-GLN-ASN-ASN-LEU-LEU-ARG-ALA-ILE-GLU-ALA-GLN-GLN-HIS-LEU-LEU-GLN-LEU-THR-VAL-TRP-GLY-ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU-SER-GLY-GLY-SER-GLY-GLY-TRP-MET-GLU-TRP-ASP-ARG-GLU-ILE-ASN-ASN-TYR-THR-SER-LEU-ILE-HIS-SER-LEU-ILE-GLU-GLU-SER-GLN-ASN-GLN-GLN-GLU-LYS-ASN-GLU-GLN-GLU-LEU-LEU-GLY-GLY-SER-GLY-GLY-SER-GLY-ILE-VAL-GLN-GLN-GLN-ASN-ASN-LEU-LEU-ARG-ALA-ILE-GLU-ALA-GLN-GLN-HIS-LEU-LEU-GLN-LEU-THR-VAL-TRP-GLY-ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU,ARG-THR-TRP-GLU-GLU-TRP-ASP-ARG-ALA-ILE-ALA-GLU-TYR-ALA-ARG-ARG-ILE-GLU-GLU-LEU-ILE-ARG-ALA-ALA-GLN-GLU-GLN-GLN-ARG-LYS-ASN-GLU-GLU-ALA-LEU-ARG-GLU-LEU,198,38,,Ki=0.2nM,9.69897,9.7,1,A,A,0,M,T,0,,B,A,,1,1,198,38,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,0.5275554656982422,0.5317127704620361,61.08530807495117,59.45917510986328,1.3688396215438845,1.4602973461151123,0.5560716390609741,0.5951472520828247,0.5204264521598816,0.5158541798591614,RTWEEWDRAIAEYARRIEELIRAAQEQQRKNEEALREL,High,"(8.824, 12.12]",train
4EHQ,protein-peptide,Q96D31 P0DP29,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,HSMQALSWRKLYLSRAKLKA,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,HIS-SER-MET-GLN-ALA-LEU-SER-TRP-ARG-LYS-LEU-TYR-LEU-SER-ARG-ALA-LYS-LEU-LYS-ALA,148,20,,Kd=1.3uM,5.886057,5.89,1,A,A,0,M,T,0,,G,A,,1,1,148,20,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.7968990802764893,0.6610512137413025,68.55857849121094,55.45352935791016,0.4918744266033172,1.1776249408721924,0.6940807700157166,0.7029692530632019,0.7481988668441772,0.6379027366638184,HSMQALSWRKLYLSRAKLKA,Low,"(5.821, 5.959]",train
4LZX,protein-peptide,Q9H095 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,GPLGSQDLLELKSVIKLQAWWRGTMIRREIGGFKMPKDKV,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,GLY-PRO-LEU-GLY-SER-GLN-ASP-LEU-LEU-GLU-LEU-LYS-SER-VAL-ILE-LYS-LEU-GLN-ALA-TRP-TRP-ARG-GLY-THR-MET-ILE-ARG-ARG-GLU-ILE-GLY-GLY-PHE-LYS-MET-PRO-LYS-ASP-LYS-VAL,148,40,,Kd=5.07nM,8.294992,8.29,1,A,A,0,M,T,0,,B,A,,1,1,148,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)O,0.7523338198661804,,68.38164520263672,,0.5914972424507141,,0.7065612077713013,,0.6673673987388611,,GPLGSQDLLELKSVIKLQAWWRGTMIRREIGGFKMPKDKV,Moderate,"(7.921, 8.383]",train
4MI8,protein-peptide,P89884 Q14457,MASHKKSGTYWATLITAFLKTVSKVEELDCVDSAVLVDVSKIITLTQEFRRHYDSVYRADYGPALKNWKRDLSKLFTSLFVDVINSGRIVGFFDVGRYVCEEVLCPGSWTEDHELLNDCMTHFFIENNLMNHFPLEDHHHHHH,GSGTMENLSRRLKVTEALFDIMSGQT,MET-ALA-SER-HIS-LYS-LYS-SER-GLY-THR-TYR-TRP-ALA-THR-LEU-ILE-THR-ALA-PHE-LEU-LYS-THR-VAL-SER-LYS-VAL-GLU-GLU-LEU-ASP-CYS-VAL-ASP-SER-ALA-VAL-LEU-VAL-ASP-VAL-SER-LYS-ILE-ILE-THR-LEU-THR-GLN-GLU-PHE-ARG-ARG-HIS-TYR-ASP-SER-VAL-TYR-ARG-ALA-ASP-TYR-GLY-PRO-ALA-LEU-LYS-ASN-TRP-LYS-ARG-ASP-LEU-SER-LYS-LEU-PHE-THR-SER-LEU-PHE-VAL-ASP-VAL-ILE-ASN-SER-GLY-ARG-ILE-VAL-GLY-PHE-PHE-ASP-VAL-GLY-ARG-TYR-VAL-CYS-GLU-GLU-VAL-LEU-CYS-PRO-GLY-SER-TRP-THR-GLU-ASP-HIS-GLU-LEU-LEU-ASN-ASP-CYS-MET-THR-HIS-PHE-PHE-ILE-GLU-ASN-ASN-LEU-MET-ASN-HIS-PHE-PRO-LEU-GLU-ASP-HIS-HIS-HIS-HIS-HIS-HIS,GLY-SER-GLY-THR-MET-GLU-ASN-LEU-SER-ARG-ARG-LEU-LYS-VAL-THR-GLU-ALA-LEU-PHE-ASP-ILE-MET-SER-GLY-GLN-THR,143,26,,Kd=1.38uM,5.860121,5.86,1,A,A,0,M,T,0,,C,A,,1,1,143,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.7398455142974854,0.7128406167030334,79.47684478759766,78.20356750488281,0.6837349534034729,0.9938464760780334,0.7100870609283447,0.7565604448318481,0.651131272315979,0.6669455766677856,GSGTMENLSRRLKVTEALFDIMSGQT,Low,"(5.821, 5.959]",train
4MP0,protein-peptide,O55000 P62136,GHMGSLNLDSIIGRLLEVQGSRPGKNVQLTENEIRGLCLKSREIFLSQPILLELEAPLKICGDIHGQYYDLLRLFEYGGFPPESNYLFLGDYVDRGKQSLETICLLLAYKIKYPENFFLLRGNHECASINRIYGFYDECKRRYNIKLWKTFTDCFNCLPIAAIVDEKIFCCHGGLSPDLQSMEQIRRIMRPTDVPDQGLLCDLLWSDPDKDVQGWGENDRGVSFTFGAEVVAKFLHKHDLDLICRAHQVVEDGYEFFAKRQLVTLFSAPNYCGEFDNAGAMMSVDETLMCSFQILKPAD,GAMGRKRKTVTWPEEGKLREYFYFELDETERVNVNKIKDFGEAA,GLY-HIS-MET-GLY-SER-LEU-ASN-LEU-ASP-SER-ILE-ILE-GLY-ARG-LEU-LEU-GLU-VAL-GLN-GLY-SER-ARG-PRO-GLY-LYS-ASN-VAL-GLN-LEU-THR-GLU-ASN-GLU-ILE-ARG-GLY-LEU-CYS-LEU-LYS-SER-ARG-GLU-ILE-PHE-LEU-SER-GLN-PRO-ILE-LEU-LEU-GLU-LEU-GLU-ALA-PRO-LEU-LYS-ILE-CYS-GLY-ASP-ILE-HIS-GLY-GLN-TYR-TYR-ASP-LEU-LEU-ARG-LEU-PHE-GLU-TYR-GLY-GLY-PHE-PRO-PRO-GLU-SER-ASN-TYR-LEU-PHE-LEU-GLY-ASP-TYR-VAL-ASP-ARG-GLY-LYS-GLN-SER-LEU-GLU-THR-ILE-CYS-LEU-LEU-LEU-ALA-TYR-LYS-ILE-LYS-TYR-PRO-GLU-ASN-PHE-PHE-LEU-LEU-ARG-GLY-ASN-HIS-GLU-CYS-ALA-SER-ILE-ASN-ARG-ILE-TYR-GLY-PHE-TYR-ASP-GLU-CYS-LYS-ARG-ARG-TYR-ASN-ILE-LYS-LEU-TRP-LYS-THR-PHE-THR-ASP-CYS-PHE-ASN-CYS-LEU-PRO-ILE-ALA-ALA-ILE-VAL-ASP-GLU-LYS-ILE-PHE-CYS-CYS-HIS-GLY-GLY-LEU-SER-PRO-ASP-LEU-GLN-SER-MET-GLU-GLN-ILE-ARG-ARG-ILE-MET-ARG-PRO-THR-ASP-VAL-PRO-ASP-GLN-GLY-LEU-LEU-CYS-ASP-LEU-LEU-TRP-SER-ASP-PRO-ASP-LYS-ASP-VAL-GLN-GLY-TRP-GLY-GLU-ASN-ASP-ARG-GLY-VAL-SER-PHE-THR-PHE-GLY-ALA-GLU-VAL-VAL-ALA-LYS-PHE-LEU-HIS-LYS-HIS-ASP-LEU-ASP-LEU-ILE-CYS-ARG-ALA-HIS-GLN-VAL-VAL-GLU-ASP-GLY-TYR-GLU-PHE-PHE-ALA-LYS-ARG-GLN-LEU-VAL-THR-LEU-PHE-SER-ALA-PRO-ASN-TYR-CYS-GLY-GLU-PHE-ASP-ASN-ALA-GLY-ALA-MET-MET-SER-VAL-ASP-GLU-THR-LEU-MET-CYS-SER-PHE-GLN-ILE-LEU-LYS-PRO-ALA-ASP,GLY-ALA-MET-GLY-ARG-LYS-ARG-LYS-THR-VAL-THR-TRP-PRO-GLU-GLU-GLY-LYS-LEU-ARG-GLU-TYR-PHE-TYR-PHE-GLU-LEU-ASP-GLU-THR-GLU-ARG-VAL-ASN-VAL-ASN-LYS-ILE-LYS-ASP-PHE-GLY-GLU-ALA-ALA,299,44,,Kd=8.7nM,8.060481,8.06,1,A,A,0,M,T,0,,B,A,,0,1,299,44,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)C(=O)O,0.7928440570831299,0.6590712070465088,81.655029296875,86.04598999023438,0.5568140149116516,1.119438648223877,0.9050145149230956,0.7773388028144836,0.6846264600753784,0.6295043230056763,GAMGRKRKTVTWPEEGKLREYFYFELDETERVNVNKIKDFGEAA,Moderate,"(7.921, 8.383]",train
4PBZ,protein-peptide,Q09028 Q13330,MADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,KLLSSSETKRAARRPYKPIALRQSQA,MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,LYS-LEU-LEU-SER-SER-SER-GLU-THR-LYS-ARG-ALA-ALA-ARG-ARG-PRO-TYR-LYS-PRO-ILE-ALA-LEU-ARG-GLN-SER-GLN-ALA,425,26,,Kd=0.05uM,7.30103,7.3,1,A,A,0,M,T,0,,B,A,,1,1,425,26,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8705411553382874,0.5538549423217773,84.87711334228516,80.36882019042969,0.5155474543571472,1.4142539501190186,0.8769204020500183,0.7544967532157898,0.8135138750076294,0.4757533371448517,KLLSSSETKRAARRPYKPIALRQSQA,Moderate,"(7.268, 7.523]",train
4PC0,protein-peptide,Q09028 Q13330,MADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,KLLSSSETKRAARRPYKPIALRQSQALPPRPPPPAPVNDEPI,MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,LYS-LEU-LEU-SER-SER-SER-GLU-THR-LYS-ARG-ALA-ALA-ARG-ARG-PRO-TYR-LYS-PRO-ILE-ALA-LEU-ARG-GLN-SER-GLN-ALA-LEU-PRO-PRO-ARG-PRO-PRO-PRO-PRO-ALA-PRO-VAL-ASN-ASP-GLU-PRO-ILE,425,42,,Kd=0.2uM,6.69897,6.7,1,A,A,0,M,T,0,,C,A,,1,1,425,42,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O,0.8194493055343628,0.568301260471344,83.59346771240234,77.80935668945312,0.5543808937072754,1.5926505327224731,0.8678617477416992,0.723018229007721,0.7364146709442139,0.501680850982666,KLLSSSETKRAARRPYKPIALRQSQALPPRPPPPAPVNDEPI,Low,"(6.696, 6.824]",train
4Q5U,protein-peptide,Q08209 P0DP23,MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,ARKEVIRNKIRAIGKMARVFSVLR,MET-ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ALA-ARG-LYS-GLU-VAL-ILE-ARG-ASN-LYS-ILE-ARG-ALA-ILE-GLY-LYS-MET-ALA-ARG-VAL-PHE-SER-VAL-LEU-ARG,149,24,,Kd=1pM,12.0,12.0,1,A,A,0,M,T,0,,C,A,,1,1,149,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC,0.8660997152328491,0.6187185049057007,62.46949768066406,53.77767562866211,0.4670649766921997,1.1740614175796509,0.8087096214294434,0.6724050641059875,0.7937420010566711,0.6052968502044678,ARKEVIRNKIRAIGKMARVFSVLR,High,"(8.824, 12.12]",train
4TQ1,protein-peptide,Q7Z6L1 Q9H1Y0,MGSSHHHHHHSQGSMTDDKDVLRDVWFGRIPTCFTLYQDEITEREAEPYYLLLPRVSYLTLVTDKVKKHFQKVMRQEDISEIWFEYEGTPLKWHYPIGLLFDLLASSSALPWNITVHFKSFPEKDLLHCPSKDAIEAHFMSCMKEADALKHKSQVINEMQKKDHKQLWMGLQNDRFDQFWAINRKLMEYPAEENGFRYIPFRIYQTTTERPFIQKLFRPVAADGQLHTLGDLLKEVCPSAIDPEDGEKKNQVMIHGIEPMLETPLQWLSEHLSYPDNFLHISIIPQPTD,MAQTAAWRKQIFQQLTERTKRELENFRHYEQAVEQSVWV,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-GLY-SER-MET-THR-ASP-ASP-LYS-ASP-VAL-LEU-ARG-ASP-VAL-TRP-PHE-GLY-ARG-ILE-PRO-THR-CYS-PHE-THR-LEU-TYR-GLN-ASP-GLU-ILE-THR-GLU-ARG-GLU-ALA-GLU-PRO-TYR-TYR-LEU-LEU-LEU-PRO-ARG-VAL-SER-TYR-LEU-THR-LEU-VAL-THR-ASP-LYS-VAL-LYS-LYS-HIS-PHE-GLN-LYS-VAL-MET-ARG-GLN-GLU-ASP-ILE-SER-GLU-ILE-TRP-PHE-GLU-TYR-GLU-GLY-THR-PRO-LEU-LYS-TRP-HIS-TYR-PRO-ILE-GLY-LEU-LEU-PHE-ASP-LEU-LEU-ALA-SER-SER-SER-ALA-LEU-PRO-TRP-ASN-ILE-THR-VAL-HIS-PHE-LYS-SER-PHE-PRO-GLU-LYS-ASP-LEU-LEU-HIS-CYS-PRO-SER-LYS-ASP-ALA-ILE-GLU-ALA-HIS-PHE-MET-SER-CYS-MET-LYS-GLU-ALA-ASP-ALA-LEU-LYS-HIS-LYS-SER-GLN-VAL-ILE-ASN-GLU-MET-GLN-LYS-LYS-ASP-HIS-LYS-GLN-LEU-TRP-MET-GLY-LEU-GLN-ASN-ASP-ARG-PHE-ASP-GLN-PHE-TRP-ALA-ILE-ASN-ARG-LYS-LEU-MET-GLU-TYR-PRO-ALA-GLU-GLU-ASN-GLY-PHE-ARG-TYR-ILE-PRO-PHE-ARG-ILE-TYR-GLN-THR-THR-THR-GLU-ARG-PRO-PHE-ILE-GLN-LYS-LEU-PHE-ARG-PRO-VAL-ALA-ALA-ASP-GLY-GLN-LEU-HIS-THR-LEU-GLY-ASP-LEU-LEU-LYS-GLU-VAL-CYS-PRO-SER-ALA-ILE-ASP-PRO-GLU-ASP-GLY-GLU-LYS-LYS-ASN-GLN-VAL-MET-ILE-HIS-GLY-ILE-GLU-PRO-MET-LEU-GLU-THR-PRO-LEU-GLN-TRP-LEU-SER-GLU-HIS-LEU-SER-TYR-PRO-ASP-ASN-PHE-LEU-HIS-ILE-SER-ILE-ILE-PRO-GLN-PRO-THR-ASP,MET-ALA-GLN-THR-ALA-ALA-TRP-ARG-LYS-GLN-ILE-PHE-GLN-GLN-LEU-THR-GLU-ARG-THR-LYS-ARG-GLU-LEU-GLU-ASN-PHE-ARG-HIS-TYR-GLU-GLN-ALA-VAL-GLU-GLN-SER-VAL-TRP-VAL,289,39,,Kd=350uM,3.455932,3.46,1,A,A,0,M,T,0,,B,A,,1,1,289,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O,0.8270550966262817,0.4815240502357483,85.24999237060547,75.4844970703125,0.5576988458633423,1.6744245290756226,0.849916398525238,0.6220022439956665,0.7527421712875366,0.4182902872562408,MAQTAAWRKQIFQQLTERTKRELENFRHYEQAVEQSVWV,Low,"(2.044, 3.548]",val
4ZGM,protein-peptide,P43220 P01275,RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLY,HAEGTFTSDVSSYLEGQAAKEFIAWLVRGRG,ARG-PRO-GLN-GLY-ALA-THR-VAL-SER-LEU-TRP-GLU-THR-VAL-GLN-LYS-TRP-ARG-GLU-TYR-ARG-ARG-GLN-CYS-GLN-ARG-SER-LEU-THR-GLU-ASP-PRO-PRO-PRO-ALA-THR-ASP-LEU-PHE-CYS-ASN-ARG-THR-PHE-ASP-GLU-TYR-ALA-CYS-TRP-PRO-ASP-GLY-GLU-PRO-GLY-SER-PHE-VAL-ASN-VAL-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-ALA-SER-SER-VAL-PRO-GLN-GLY-HIS-VAL-TYR-ARG-PHE-CYS-THR-ALA-GLU-GLY-LEU-TRP-LEU-GLN-LYS-ASP-ASN-SER-SER-LEU-PRO-TRP-ARG-ASP-LEU-SER-GLU-CYS-GLU-GLU-SER-LYS-ARG-GLY-GLU-ARG-SER-SER-PRO-GLU-GLU-GLN-LEU-LEU-PHE-LEU-TYR,HIS-AIB-GLU-GLY-THR-PHE-THR-SER-ASP-VAL-SER-SER-TYR-LEU-GLU-GLY-GLN-ALA-ALA-LYS-GLU-PHE-ILE-ALA-TRP-LEU-VAL-ARG-GLY-ARG-GLY,122,31,,IC50=0.38nM,9.420216,9.42,1,A,A,0,M,T,0,,B,A,,1,1,122,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(C)(C)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(C)(C)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)C(C)C,0.9541894197463988,0.6025838255882263,81.54573822021484,76.58140563964844,0.4673506617546081,1.1295223236083984,0.8137556314468384,0.6825190782546997,0.8013893365859985,0.5825999975204468,HAEGTFTSDVSSYLEGQAAKEFIAWLVRGRG,High,"(8.824, 12.12]",val
5INB,protein-peptide,P36873 Q69YH5,GHMLNIDSIIQRLLEVRGSKPGKNVQLQENEIRGLCLKSREIFLSQPILLELEAPLKICGDIHGQYYDLLRLFEYGGFPPESNYLFLGDYVDRGKQSLETICLLLAYKIKYPENFFLLRGNHECASINRIYGFYDECKRRYNIKLWKTFTDCFNCLPIAAIVDEKIFCCHGGLSPDLQSMEQIRRIMRPTDVPDQGLLCDLLWSDPDKDVLGWGENDRGVSFTFGAEVVAKFLHKHDLDLICRAHQVVEDGYEFFAKRQLVTLFSAPNYCGEFDNAGAMMSVDETLMCSFQILKPAEKKKPNATR,GAMGYAFLNMRKRKRVTFGEDLSPEVFDESLPANTPLRKGGTPVCK,GLY-HIS-MET-LEU-ASN-ILE-ASP-SER-ILE-ILE-GLN-ARG-LEU-LEU-GLU-VAL-ARG-GLY-SER-LYS-PRO-GLY-LYS-ASN-VAL-GLN-LEU-GLN-GLU-ASN-GLU-ILE-ARG-GLY-LEU-CYS-LEU-LYS-SER-ARG-GLU-ILE-PHE-LEU-SER-GLN-PRO-ILE-LEU-LEU-GLU-LEU-GLU-ALA-PRO-LEU-LYS-ILE-CYS-GLY-ASP-ILE-HIS-GLY-GLN-TYR-TYR-ASP-LEU-LEU-ARG-LEU-PHE-GLU-TYR-GLY-GLY-PHE-PRO-PRO-GLU-SER-ASN-TYR-LEU-PHE-LEU-GLY-ASP-TYR-VAL-ASP-ARG-GLY-LYS-GLN-SER-LEU-GLU-THR-ILE-CYS-LEU-LEU-LEU-ALA-TYR-LYS-ILE-LYS-TYR-PRO-GLU-ASN-PHE-PHE-LEU-LEU-ARG-GLY-ASN-HIS-GLU-CYS-ALA-SER-ILE-ASN-ARG-ILE-TYR-GLY-PHE-TYR-ASP-GLU-CYS-LYS-ARG-ARG-TYR-ASN-ILE-LYS-LEU-TRP-LYS-THR-PHE-THR-ASP-CYS-PHE-ASN-CYS-LEU-PRO-ILE-ALA-ALA-ILE-VAL-ASP-GLU-LYS-ILE-PHE-CYS-CYS-HIS-GLY-GLY-LEU-SER-PRO-ASP-LEU-GLN-SER-MET-GLU-GLN-ILE-ARG-ARG-ILE-MET-ARG-PRO-THR-ASP-VAL-PRO-ASP-GLN-GLY-LEU-LEU-CYS-ASP-LEU-LEU-TRP-SER-ASP-PRO-ASP-LYS-ASP-VAL-LEU-GLY-TRP-GLY-GLU-ASN-ASP-ARG-GLY-VAL-SER-PHE-THR-PHE-GLY-ALA-GLU-VAL-VAL-ALA-LYS-PHE-LEU-HIS-LYS-HIS-ASP-LEU-ASP-LEU-ILE-CYS-ARG-ALA-HIS-GLN-VAL-VAL-GLU-ASP-GLY-TYR-GLU-PHE-PHE-ALA-LYS-ARG-GLN-LEU-VAL-THR-LEU-PHE-SER-ALA-PRO-ASN-TYR-CYS-GLY-GLU-PHE-ASP-ASN-ALA-GLY-ALA-MET-MET-SER-VAL-ASP-GLU-THR-LEU-MET-CYS-SER-PHE-GLN-ILE-LEU-LYS-PRO-ALA-GLU-LYS-LYS-LYS-PRO-ASN-ALA-THR-ARG,GLY-ALA-MET-GLY-TYR-ALA-PHE-LEU-ASN-MET-ARG-LYS-ARG-LYS-ARG-VAL-THR-PHE-GLY-GLU-ASP-LEU-SER-PRO-GLU-VAL-PHE-ASP-GLU-SER-LEU-PRO-ALA-ASN-THR-PRO-LEU-ARG-LYS-GLY-GLY-THR-PRO-VAL-CYS-LYS,305,46,,Kd=123nM,6.910095,6.91,1,A,A,0,M,T,0,,B,A,,1,1,305,46,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)O,0.7961565256118774,,84.24736785888672,,0.7091271281242371,,0.8510448336601257,,0.6791580319404602,,GAMGYAFLNMRKRKRVTFGEDLSPEVFDESLPANTPLRKGGTPVCK,Low,"(6.824, 7.049]",train
5J28,protein-peptide,P36873 P46013,GHMLNIDSIIQRLLEVRGSKPGKNVQLQENEIRGLCLKSREIFLSQPILLELEAPLKICGDIHGQYYDLLRLFEYGGFPPESNYLFLGDYVDRGKQSLETICLLLAYKIKYPENFFLLRGNHECASINRIYGFYDECKRRYNIKLWKTFTDCFNCLPIAAIVDEKIFCCHGGLSPDLQSMEQIRRIMRPTDVPDQGLLCDLLWSDPDKDVLGWGENDRGVSFTFGAEVVAKFLHKHDLDLICRAHQVVEDGYEFFAKRQLVTLFSAPNYCGEFDNAGAMMSVDETLMCSFQILKPAEKKKPNATR,GAMGYSEGIPLKRRRVSFGGHLRPELFDENLPPNMPLKRGEAPTKR,GLY-HIS-MET-LEU-ASN-ILE-ASP-SER-ILE-ILE-GLN-ARG-LEU-LEU-GLU-VAL-ARG-GLY-SER-LYS-PRO-GLY-LYS-ASN-VAL-GLN-LEU-GLN-GLU-ASN-GLU-ILE-ARG-GLY-LEU-CYS-LEU-LYS-SER-ARG-GLU-ILE-PHE-LEU-SER-GLN-PRO-ILE-LEU-LEU-GLU-LEU-GLU-ALA-PRO-LEU-LYS-ILE-CYS-GLY-ASP-ILE-HIS-GLY-GLN-TYR-TYR-ASP-LEU-LEU-ARG-LEU-PHE-GLU-TYR-GLY-GLY-PHE-PRO-PRO-GLU-SER-ASN-TYR-LEU-PHE-LEU-GLY-ASP-TYR-VAL-ASP-ARG-GLY-LYS-GLN-SER-LEU-GLU-THR-ILE-CYS-LEU-LEU-LEU-ALA-TYR-LYS-ILE-LYS-TYR-PRO-GLU-ASN-PHE-PHE-LEU-LEU-ARG-GLY-ASN-HIS-GLU-CYS-ALA-SER-ILE-ASN-ARG-ILE-TYR-GLY-PHE-TYR-ASP-GLU-CYS-LYS-ARG-ARG-TYR-ASN-ILE-LYS-LEU-TRP-LYS-THR-PHE-THR-ASP-CYS-PHE-ASN-CYS-LEU-PRO-ILE-ALA-ALA-ILE-VAL-ASP-GLU-LYS-ILE-PHE-CYS-CYS-HIS-GLY-GLY-LEU-SER-PRO-ASP-LEU-GLN-SER-MET-GLU-GLN-ILE-ARG-ARG-ILE-MET-ARG-PRO-THR-ASP-VAL-PRO-ASP-GLN-GLY-LEU-LEU-CYS-ASP-LEU-LEU-TRP-SER-ASP-PRO-ASP-LYS-ASP-VAL-LEU-GLY-TRP-GLY-GLU-ASN-ASP-ARG-GLY-VAL-SER-PHE-THR-PHE-GLY-ALA-GLU-VAL-VAL-ALA-LYS-PHE-LEU-HIS-LYS-HIS-ASP-LEU-ASP-LEU-ILE-CYS-ARG-ALA-HIS-GLN-VAL-VAL-GLU-ASP-GLY-TYR-GLU-PHE-PHE-ALA-LYS-ARG-GLN-LEU-VAL-THR-LEU-PHE-SER-ALA-PRO-ASN-TYR-CYS-GLY-GLU-PHE-ASP-ASN-ALA-GLY-ALA-MET-MET-SER-VAL-ASP-GLU-THR-LEU-MET-CYS-SER-PHE-GLN-ILE-LEU-LYS-PRO-ALA-GLU-LYS-LYS-LYS-PRO-ASN-ALA-THR-ARG,GLY-ALA-MET-GLY-TYR-SER-GLU-GLY-ILE-PRO-LEU-LYS-ARG-ARG-ARG-VAL-SER-PHE-GLY-GLY-HIS-LEU-ARG-PRO-GLU-LEU-PHE-ASP-GLU-ASN-LEU-PRO-PRO-ASN-MET-PRO-LEU-LYS-ARG-GLY-GLU-ALA-PRO-THR-LYS-ARG,305,46,,Kd=193nM,6.714443,6.71,1,A,A,0,M,T,0,,C,A,,1,1,305,46,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,0.5729424953460693,0.6985526084899902,80.85298919677734,85.44908142089844,0.8051359057426453,1.064419150352478,0.848260760307312,0.78826504945755,0.4008365571498871,0.6515342593193054,GAMGYSEGIPLKRRRVSFGGHLRPELFDENLPPNMPLKRGEAPTKR,Low,"(6.696, 6.824]",val
5J8H,protein-peptide,O00418 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,SPANSFHFKEAWKHAIQKAKHMPDPWA,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,SER-PRO-ALA-ASN-SER-PHE-HIS-PHE-LYS-GLU-ALA-TRP-LYS-HIS-ALA-ILE-GLN-LYS-ALA-LYS-HIS-MET-PRO-ASP-PRO-TRP-ALA,148,27,,Kd=153nM,6.815309,6.82,1,A,A,0,M,T,0,,B,A,,1,1,148,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.8276351690292358,0.5785504579544067,57.92594146728516,51.39380645751953,0.5646238923072815,1.3190423250198364,0.718748927116394,0.6295903921127319,0.758428156375885,0.5657904744148254,SPANSFHFKEAWKHAIQKAKHMPDPWA,Low,"(6.696, 6.824]",train
5JTP,protein-peptide,P00634 P0AG86,MSEQNNTEMTFQIQRIYTKDISFEAPNAPHVFQKDWQPEVKLDLDTASSQLADDVYEVVLRVTVTASLGEETAFLCEVQQGGIFSIAGIEGTQMAHCLGAYCPNILFPYARECITSMVSRGTFPQLNLAPVNFDALFMNYLQQQAGEGTEEHQDA,NVVGLTDQTDLFYTMKAALGLK,MET-SER-GLU-GLN-ASN-ASN-THR-GLU-MET-THR-PHE-GLN-ILE-GLN-ARG-ILE-TYR-THR-LYS-ASP-ILE-SER-PHE-GLU-ALA-PRO-ASN-ALA-PRO-HIS-VAL-PHE-GLN-LYS-ASP-TRP-GLN-PRO-GLU-VAL-LYS-LEU-ASP-LEU-ASP-THR-ALA-SER-SER-GLN-LEU-ALA-ASP-ASP-VAL-TYR-GLU-VAL-VAL-LEU-ARG-VAL-THR-VAL-THR-ALA-SER-LEU-GLY-GLU-GLU-THR-ALA-PHE-LEU-CYS-GLU-VAL-GLN-GLN-GLY-GLY-ILE-PHE-SER-ILE-ALA-GLY-ILE-GLU-GLY-THR-GLN-MET-ALA-HIS-CYS-LEU-GLY-ALA-TYR-CYS-PRO-ASN-ILE-LEU-PHE-PRO-TYR-ALA-ARG-GLU-CYS-ILE-THR-SER-MET-VAL-SER-ARG-GLY-THR-PHE-PRO-GLN-LEU-ASN-LEU-ALA-PRO-VAL-ASN-PHE-ASP-ALA-LEU-PHE-MET-ASN-TYR-LEU-GLN-GLN-GLN-ALA-GLY-GLU-GLY-THR-GLU-GLU-HIS-GLN-ASP-ALA,ASN-VAL-VAL-GLY-LEU-THR-ASP-GLN-THR-ASP-LEU-PHE-TYR-THR-MET-LYS-ALA-ALA-LEU-GLY-LEU-LYS,155,22,,Kd=40uM,4.39794,4.4,1,A,A,0,M,T,0,,E,A,,1,1,155,22,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.8827502131462097,0.7168793678283691,78.17668151855469,69.42544555664062,0.4833794236183166,0.9849754571914672,0.8381351232528687,0.7715394496917725,0.7526609897613525,0.6669240593910217,NVVGLTDQTDLFYTMKAALGLK,Low,"(4.319, 4.456]",train
5K8Q,protein-peptide,F1RAX4 P0DP23,MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,VSNAKRARAHWQLLYTLVNNPSLVGSR,MET-ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ACE-VAL-SER-ASN-ALA-LYS-ARG-ALA-ARG-ALA-HIS-TRP-GLN-LEU-LEU-TYR-THR-LEU-VAL-ASN-ASN-PRO-SER-LEU-VAL-GLY-SER-ARG-NH2,149,29,,Kd=0.9nM,9.045757,9.05,1,A,A,0,M,T,0,,B,A,,1,1,149,29,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C)[C@@H](C)O,,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C)[C@@H](C)O,0.8542783260345459,0.6586679816246033,79.58606719970703,53.841102600097656,0.5041031241416931,1.1212116479873655,0.8005489706993103,0.6986843347549438,0.7718299031257629,0.6486638188362122,VSNAKRARAHWQLLYTLVNNPSLVGSR,High,"(8.824, 12.12]",train
5KXH,protein-peptide,P70375 Q91ZW2,GAPSWDLAGYLLYCPCMGRFGNQADHFLGSLAFAKLLNRTLAVPPWIEYQHHKPPFTNLHVSYQKYFKLEPLQAYHRVVSLEDFMENLAPSHWPPEKRVAYCFEVAAQRSPDKKTCPMKEGNPFGPFWDQFHVSFNKSELFTGISFSASYKEQWTQRFPAKEHPVLALPGAPAQFPVLEEHRELQKYMVWSDEMVRTGEALISAHLVRPYVGIHLRIGSDWKNACAMLKDGTAGSHFMASPQCVGYSRSTATPLTMTMCLPDLKEIQRAVTLWVRALNARSVYIATDSESYVSEIQQLFKDKVRVVSLKPEVAQIDLYILGQADHFIGNCVSSFTAFVKRERDLHGRQSSFFGMD,DGDQCASNPCQNGGTCQDHLKSYVCFCLLDFEGRNCEKSK,GLY-ALA-PRO-SER-TRP-ASP-LEU-ALA-GLY-TYR-LEU-LEU-TYR-CYS-PRO-CYS-MET-GLY-ARG-PHE-GLY-ASN-GLN-ALA-ASP-HIS-PHE-LEU-GLY-SER-LEU-ALA-PHE-ALA-LYS-LEU-LEU-ASN-ARG-THR-LEU-ALA-VAL-PRO-PRO-TRP-ILE-GLU-TYR-GLN-HIS-HIS-LYS-PRO-PRO-PHE-THR-ASN-LEU-HIS-VAL-SER-TYR-GLN-LYS-TYR-PHE-LYS-LEU-GLU-PRO-LEU-GLN-ALA-TYR-HIS-ARG-VAL-VAL-SER-LEU-GLU-ASP-PHE-MET-GLU-ASN-LEU-ALA-PRO-SER-HIS-TRP-PRO-PRO-GLU-LYS-ARG-VAL-ALA-TYR-CYS-PHE-GLU-VAL-ALA-ALA-GLN-ARG-SER-PRO-ASP-LYS-LYS-THR-CYS-PRO-MET-LYS-GLU-GLY-ASN-PRO-PHE-GLY-PRO-PHE-TRP-ASP-GLN-PHE-HIS-VAL-SER-PHE-ASN-LYS-SER-GLU-LEU-PHE-THR-GLY-ILE-SER-PHE-SER-ALA-SER-TYR-LYS-GLU-GLN-TRP-THR-GLN-ARG-PHE-PRO-ALA-LYS-GLU-HIS-PRO-VAL-LEU-ALA-LEU-PRO-GLY-ALA-PRO-ALA-GLN-PHE-PRO-VAL-LEU-GLU-GLU-HIS-ARG-GLU-LEU-GLN-LYS-TYR-MET-VAL-TRP-SER-ASP-GLU-MET-VAL-ARG-THR-GLY-GLU-ALA-LEU-ILE-SER-ALA-HIS-LEU-VAL-ARG-PRO-TYR-VAL-GLY-ILE-HIS-LEU-ARG-ILE-GLY-SER-ASP-TRP-LYS-ASN-ALA-CYS-ALA-MET-LEU-LYS-ASP-GLY-THR-ALA-GLY-SER-HIS-PHE-MET-ALA-SER-PRO-GLN-CYS-VAL-GLY-TYR-SER-ARG-SER-THR-ALA-THR-PRO-LEU-THR-MET-THR-MET-CYS-LEU-PRO-ASP-LEU-LYS-GLU-ILE-GLN-ARG-ALA-VAL-THR-LEU-TRP-VAL-ARG-ALA-LEU-ASN-ALA-ARG-SER-VAL-TYR-ILE-ALA-THR-ASP-SER-GLU-SER-TYR-VAL-SER-GLU-ILE-GLN-GLN-LEU-PHE-LYS-ASP-LYS-VAL-ARG-VAL-VAL-SER-LEU-LYS-PRO-GLU-VAL-ALA-GLN-ILE-ASP-LEU-TYR-ILE-LEU-GLY-GLN-ALA-ASP-HIS-PHE-ILE-GLY-ASN-CYS-VAL-SER-SER-PHE-THR-ALA-PHE-VAL-LYS-ARG-GLU-ARG-ASP-LEU-HIS-GLY-ARG-GLN-SER-SER-PHE-PHE-GLY-MET-ASP,ASP-GLY-ASP-GLN-CYS-ALA-SER-ASN-PRO-CYS-GLN-ASN-GLY-GLY-THR-CYS-GLN-ASP-HIS-LEU-LYS-SER-TYR-VAL-CYS-PHE-CYS-LEU-LEU-ASP-PHE-GLU-GLY-ARG-ASN-CYS-GLU-LYS-SER-LYS,355,40,,Kd=0.49uM,6.309804,6.31,1,A,A,0,M,T,0,,B,A,,1,1,355,40,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O,0.845030665397644,0.693780779838562,85.37339782714844,84.34337615966797,0.4750136137008667,1.238272190093994,0.9219388365745544,0.8143354058265686,0.8004871606826782,0.6636421084403992,DGDQCASNPCQNGGTCQDHLKSYVCFCLLDFEGRNCEKSK,Low,"(6.26, 6.398]",train
5KY0,protein-peptide,Q01705 Q91ZW2,GAPSWDLAGYLLYCPCMGRFGNQADHFLGSLAFAKLLNRTLAVPPWIEYQHHKPPFTNLHVSYQKYFKLEPLQAYHRVVSLEDFMENLAPSHWPPEKRVAYCFEVAAQRSPDKKTCPMKEGNPFGPFWDQFHVSFNKSELFTGISFSASYKEQWTQRFPAKEHPVLALPGAPAQFPVLEEHRELQKYMVWSDEMVRTGEALISAHLVRPYVGIHLRIGSDWKNACAMLKDGTAGSHFMASPQCVGYSRSTATPLTMTMCLPDLKEIQRAVTLWVRALNARSVYIATDSESYVSEIQQLFKDKVRVVSLKPEVAQIDLYILGQADHFIGNCVSSFTAFVKRERDLHGRQSSFFGMD,DVNECISNPCQNGATCLDQIGEFQCICMPGYEGVYCEINT,GLY-ALA-PRO-SER-TRP-ASP-LEU-ALA-GLY-TYR-LEU-LEU-TYR-CYS-PRO-CYS-MET-GLY-ARG-PHE-GLY-ASN-GLN-ALA-ASP-HIS-PHE-LEU-GLY-SER-LEU-ALA-PHE-ALA-LYS-LEU-LEU-ASN-ARG-THR-LEU-ALA-VAL-PRO-PRO-TRP-ILE-GLU-TYR-GLN-HIS-HIS-LYS-PRO-PRO-PHE-THR-ASN-LEU-HIS-VAL-SER-TYR-GLN-LYS-TYR-PHE-LYS-LEU-GLU-PRO-LEU-GLN-ALA-TYR-HIS-ARG-VAL-VAL-SER-LEU-GLU-ASP-PHE-MET-GLU-ASN-LEU-ALA-PRO-SER-HIS-TRP-PRO-PRO-GLU-LYS-ARG-VAL-ALA-TYR-CYS-PHE-GLU-VAL-ALA-ALA-GLN-ARG-SER-PRO-ASP-LYS-LYS-THR-CYS-PRO-MET-LYS-GLU-GLY-ASN-PRO-PHE-GLY-PRO-PHE-TRP-ASP-GLN-PHE-HIS-VAL-SER-PHE-ASN-LYS-SER-GLU-LEU-PHE-THR-GLY-ILE-SER-PHE-SER-ALA-SER-TYR-LYS-GLU-GLN-TRP-THR-GLN-ARG-PHE-PRO-ALA-LYS-GLU-HIS-PRO-VAL-LEU-ALA-LEU-PRO-GLY-ALA-PRO-ALA-GLN-PHE-PRO-VAL-LEU-GLU-GLU-HIS-ARG-GLU-LEU-GLN-LYS-TYR-MET-VAL-TRP-SER-ASP-GLU-MET-VAL-ARG-THR-GLY-GLU-ALA-LEU-ILE-SER-ALA-HIS-LEU-VAL-ARG-PRO-TYR-VAL-GLY-ILE-HIS-LEU-ARG-ILE-GLY-SER-ASP-TRP-LYS-ASN-ALA-CYS-ALA-MET-LEU-LYS-ASP-GLY-THR-ALA-GLY-SER-HIS-PHE-MET-ALA-SER-PRO-GLN-CYS-VAL-GLY-TYR-SER-ARG-SER-THR-ALA-THR-PRO-LEU-THR-MET-THR-MET-CYS-LEU-PRO-ASP-LEU-LYS-GLU-ILE-GLN-ARG-ALA-VAL-THR-LEU-TRP-VAL-ARG-ALA-LEU-ASN-ALA-ARG-SER-VAL-TYR-ILE-ALA-THR-ASP-SER-GLU-SER-TYR-VAL-SER-GLU-ILE-GLN-GLN-LEU-PHE-LYS-ASP-LYS-VAL-ARG-VAL-VAL-SER-LEU-LYS-PRO-GLU-VAL-ALA-GLN-ILE-ASP-LEU-TYR-ILE-LEU-GLY-GLN-ALA-ASP-HIS-PHE-ILE-GLY-ASN-CYS-VAL-SER-SER-PHE-THR-ALA-PHE-VAL-LYS-ARG-GLU-ARG-ASP-LEU-HIS-GLY-ARG-GLN-SER-SER-PHE-PHE-GLY-MET-ASP,ASP-VAL-ASN-GLU-CYS-ILE-SER-ASN-PRO-CYS-GLN-ASN-GLY-ALA-THR-CYS-LEU-ASP-GLN-ILE-GLY-GLU-PHE-GLN-CYS-ILE-CYS-MET-PRO-GLY-TYR-GLU-GLY-VAL-TYR-CYS-GLU-ILE-ASN-THR,355,40,,Kd=6.5uM,5.187087,5.19,1,A,A,0,M,T,0,,B,A,,1,1,355,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.8231205940246582,0.6579382419586182,87.11614990234375,82.29607391357422,0.458943635225296,1.3302536010742188,0.9225159287452698,0.7968536615371704,0.7982717156410217,0.6232093572616577,DVNECISNPCQNGATCLDQIGEFQCICMPGYEGVYCEINT,Low,"(5.105, 5.222]",train
5KY4,protein-peptide,Q01705 Q91ZW2,GAPSWDLAGYLLYCPCMGRFGNQADHFLGSLAFAKLLNRTLAVPPWIEYQHHKPPFTNLHVSYQKYFKLEPLQAYHRVVSLEDFMENLAPSHWPPEKRVAYCFEVAAQRSPDKKTCPMKEGNPFGPFWDQFHVSFNKSELFTGISFSASYKEQWTQRFPAKEHPVLALPGAPAQFPVLEEHRELQKYMVWSDEMVRTGEALISAHLVRPYVGIHLRIGSDWKNACAMLKDGTAGSHFMASPQCVGYSRSTATPLTMTMCLPDLKEIQRAVTLWVRALNARSVYIATDSESYVSEIQQLFKDKVRVVSLKPEVAQIDLYILGQADHFIGNCVSSFTAFVKRERDLHGRQSSFFGMD,NTPDCTESSCFNGGTCVDGINSFTCLCPPGFTGSYCQYDV,GLY-ALA-PRO-SER-TRP-ASP-LEU-ALA-GLY-TYR-LEU-LEU-TYR-CYS-PRO-CYS-MET-GLY-ARG-PHE-GLY-ASN-GLN-ALA-ASP-HIS-PHE-LEU-GLY-SER-LEU-ALA-PHE-ALA-LYS-LEU-LEU-ASN-ARG-THR-LEU-ALA-VAL-PRO-PRO-TRP-ILE-GLU-TYR-GLN-HIS-HIS-LYS-PRO-PRO-PHE-THR-ASN-LEU-HIS-VAL-SER-TYR-GLN-LYS-TYR-PHE-LYS-LEU-GLU-PRO-LEU-GLN-ALA-TYR-HIS-ARG-VAL-VAL-SER-LEU-GLU-ASP-PHE-MET-GLU-ASN-LEU-ALA-PRO-SER-HIS-TRP-PRO-PRO-GLU-LYS-ARG-VAL-ALA-TYR-CYS-PHE-GLU-VAL-ALA-ALA-GLN-ARG-SER-PRO-ASP-LYS-LYS-THR-CYS-PRO-MET-LYS-GLU-GLY-ASN-PRO-PHE-GLY-PRO-PHE-TRP-ASP-GLN-PHE-HIS-VAL-SER-PHE-ASN-LYS-SER-GLU-LEU-PHE-THR-GLY-ILE-SER-PHE-SER-ALA-SER-TYR-LYS-GLU-GLN-TRP-THR-GLN-ARG-PHE-PRO-ALA-LYS-GLU-HIS-PRO-VAL-LEU-ALA-LEU-PRO-GLY-ALA-PRO-ALA-GLN-PHE-PRO-VAL-LEU-GLU-GLU-HIS-ARG-GLU-LEU-GLN-LYS-TYR-MET-VAL-TRP-SER-ASP-GLU-MET-VAL-ARG-THR-GLY-GLU-ALA-LEU-ILE-SER-ALA-HIS-LEU-VAL-ARG-PRO-TYR-VAL-GLY-ILE-HIS-LEU-ARG-ILE-GLY-SER-ASP-TRP-LYS-ASN-ALA-CYS-ALA-MET-LEU-LYS-ASP-GLY-THR-ALA-GLY-SER-HIS-PHE-MET-ALA-SER-PRO-GLN-CYS-VAL-GLY-TYR-SER-ARG-SER-THR-ALA-THR-PRO-LEU-THR-MET-THR-MET-CYS-LEU-PRO-ASP-LEU-LYS-GLU-ILE-GLN-ARG-ALA-VAL-THR-LEU-TRP-VAL-ARG-ALA-LEU-ASN-ALA-ARG-SER-VAL-TYR-ILE-ALA-THR-ASP-SER-GLU-SER-TYR-VAL-SER-GLU-ILE-GLN-GLN-LEU-PHE-LYS-ASP-LYS-VAL-ARG-VAL-VAL-SER-LEU-LYS-PRO-GLU-VAL-ALA-GLN-ILE-ASP-LEU-TYR-ILE-LEU-GLY-GLN-ALA-ASP-HIS-PHE-ILE-GLY-ASN-CYS-VAL-SER-SER-PHE-THR-ALA-PHE-VAL-LYS-ARG-GLU-ARG-ASP-LEU-HIS-GLY-ARG-GLN-SER-SER-PHE-PHE-GLY-MET-ASP,ASN-THR-PRO-ASP-CYS-THR-GLU-SER-SER-CYS-PHE-ASN-GLY-GLY-THR-CYS-VAL-ASP-GLY-ILE-ASN-SER-PHE-THR-CYS-LEU-CYS-PRO-PRO-GLY-PHE-THR-GLY-SER-TYR-CYS-GLN-TYR-ASP-VAL,355,40,,Kd=10uM,5.0,5.0,1,A,A,0,M,T,0,,B,A,,1,1,355,40,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O,0.7245633006095886,0.64513099193573,84.18126678466797,82.37290954589844,0.5873875021934509,1.4177016019821167,0.9010288715362548,0.7898821830749512,0.6804469227790833,0.6089432239532471,NTPDCTESSCFNGGTCVDGINSFTCLCPPGFTGSYCQYDV,Low,"(4.866, 5.014]",train
5KY5,protein-peptide,Q91ZW2,GAPSWDLAGYLLYCPCMGRFGNQADHFLGSLAFAKLLNRTLAVPPWIEYQHHKPPFTNLHVSYQKYFKLEPLQAYHRVVSLEDFMENLAPSHWPPEKRVAYCFEVAAQRSPDKKTCPMKEGNPFGPFWDQFHVSFNKSELFTGISFSASYKEQWTQRFPAKEHPVLALPGAPAQFPVLEEHRELQKYMVWSDEMVRTGEALISAHLVRPYVGIHLRIGSDWKNACAMLKDGTAGSHFMASPQCVGYSRSTATPLTMTMCLPDLKEIQRAVTLWVRALNARSVYIATDSESYVSEIQQLFKDKVRVVSLKPEVAQIDLYILGQADHFIGNCVSSFTAFVKRERDLHGRQSSFFGMD,DIDECASNPCQNGGTCVNTVGSYTCLCPPGFTGPNCEDDI,GLY-ALA-PRO-SER-TRP-ASP-LEU-ALA-GLY-TYR-LEU-LEU-TYR-CYS-PRO-CYS-MET-GLY-ARG-PHE-GLY-ASN-GLN-ALA-ASP-HIS-PHE-LEU-GLY-SER-LEU-ALA-PHE-ALA-LYS-LEU-LEU-ASN-ARG-THR-LEU-ALA-VAL-PRO-PRO-TRP-ILE-GLU-TYR-GLN-HIS-HIS-LYS-PRO-PRO-PHE-THR-ASN-LEU-HIS-VAL-SER-TYR-GLN-LYS-TYR-PHE-LYS-LEU-GLU-PRO-LEU-GLN-ALA-TYR-HIS-ARG-VAL-VAL-SER-LEU-GLU-ASP-PHE-MET-GLU-ASN-LEU-ALA-PRO-SER-HIS-TRP-PRO-PRO-GLU-LYS-ARG-VAL-ALA-TYR-CYS-PHE-GLU-VAL-ALA-ALA-GLN-ARG-SER-PRO-ASP-LYS-LYS-THR-CYS-PRO-MET-LYS-GLU-GLY-ASN-PRO-PHE-GLY-PRO-PHE-TRP-ASP-GLN-PHE-HIS-VAL-SER-PHE-ASN-LYS-SER-GLU-LEU-PHE-THR-GLY-ILE-SER-PHE-SER-ALA-SER-TYR-LYS-GLU-GLN-TRP-THR-GLN-ARG-PHE-PRO-ALA-LYS-GLU-HIS-PRO-VAL-LEU-ALA-LEU-PRO-GLY-ALA-PRO-ALA-GLN-PHE-PRO-VAL-LEU-GLU-GLU-HIS-ARG-GLU-LEU-GLN-LYS-TYR-MET-VAL-TRP-SER-ASP-GLU-MET-VAL-ARG-THR-GLY-GLU-ALA-LEU-ILE-SER-ALA-HIS-LEU-VAL-ARG-PRO-TYR-VAL-GLY-ILE-HIS-LEU-ARG-ILE-GLY-SER-ASP-TRP-LYS-ASN-ALA-CYS-ALA-MET-LEU-LYS-ASP-GLY-THR-ALA-GLY-SER-HIS-PHE-MET-ALA-SER-PRO-GLN-CYS-VAL-GLY-TYR-SER-ARG-SER-THR-ALA-THR-PRO-LEU-THR-MET-THR-MET-CYS-LEU-PRO-ASP-LEU-LYS-GLU-ILE-GLN-ARG-ALA-VAL-THR-LEU-TRP-VAL-ARG-ALA-LEU-ASN-ALA-ARG-SER-VAL-TYR-ILE-ALA-THR-ASP-SER-GLU-SER-TYR-VAL-SER-GLU-ILE-GLN-GLN-LEU-PHE-LYS-ASP-LYS-VAL-ARG-VAL-VAL-SER-LEU-LYS-PRO-GLU-VAL-ALA-GLN-ILE-ASP-LEU-TYR-ILE-LEU-GLY-GLN-ALA-ASP-HIS-PHE-ILE-GLY-ASN-CYS-VAL-SER-SER-PHE-THR-ALA-PHE-VAL-LYS-ARG-GLU-ARG-ASP-LEU-HIS-GLY-ARG-GLN-SER-SER-PHE-PHE-GLY-MET-ASP,ASP-ILE-ASP-GLU-CYS-ALA-SER-ASN-PRO-CYS-GLN-ASN-GLY-GLY-THR-CYS-VAL-ASN-THR-VAL-GLY-SER-TYR-THR-CYS-LEU-CYS-PRO-PRO-GLY-PHE-THR-GLY-PRO-ASN-CYS-GLU-ASP-ASP-ILE,355,40,,Kd=0.79uM,6.102373,6.1,1,A,A,0,M,T,0,,B,A,,1,1,355,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.8281925320625305,0.6216728091239929,86.10088348388672,82.7280502319336,0.4643052816390991,1.4644649028778076,0.9248613119125366,0.7790030241012573,0.8040252923965454,0.5823402404785156,DIDECASNPCQNGGTCVNTVGSYTCLCPPGFTGPNCEDDI,Low,"(6.097, 6.26]",train
5KY9,protein-peptide,Q01705 Q91ZW2,GAPSWDLAGYLLYCPCMGRFGNQADHFLGSLAFAKLLNRTLAVPPWIEYQHHKPPFTNLHVSYQKYFKLEPLQAYHRVVSLEDFMENLAPSHWPPEKRVAYCFEVAAQRSPDKKTCPMKEGNPFGPFWDQFHVSFNKSELFTGISFSASYKEQWTQRFPAKEHPVLALPGAPAQFPVLEEHRELQKYMVWSDEMVRTGEALISAHLVRPYVGIHLRIGSDWKNACAMLKDGTAGSHFMASPQCVGYSRSTATPLTMTMCLPDLKEIQRAVTLWVRALNARSVYIATDSESYVSEIQQLFKDKVRVVSLKPEVAQIDLYILGQADHFIGNCVSSFTAFVKRERDLHGRQSSFFGMD,DVNECISNPCQNGGTCLDQIGEFQCICMPGYEGVYCEINT,GLY-ALA-PRO-SER-TRP-ASP-LEU-ALA-GLY-TYR-LEU-LEU-TYR-CYS-PRO-CYS-MET-GLY-ARG-PHE-GLY-ASN-GLN-ALA-ASP-HIS-PHE-LEU-GLY-SER-LEU-ALA-PHE-ALA-LYS-LEU-LEU-ASN-ARG-THR-LEU-ALA-VAL-PRO-PRO-TRP-ILE-GLU-TYR-GLN-HIS-HIS-LYS-PRO-PRO-PHE-THR-ASN-LEU-HIS-VAL-SER-TYR-GLN-LYS-TYR-PHE-LYS-LEU-GLU-PRO-LEU-GLN-ALA-TYR-HIS-ARG-VAL-VAL-SER-LEU-GLU-ASP-PHE-MET-GLU-ASN-LEU-ALA-PRO-SER-HIS-TRP-PRO-PRO-GLU-LYS-ARG-VAL-ALA-TYR-CYS-PHE-GLU-VAL-ALA-ALA-GLN-ARG-SER-PRO-ASP-LYS-LYS-THR-CYS-PRO-MET-LYS-GLU-GLY-ASN-PRO-PHE-GLY-PRO-PHE-TRP-ASP-GLN-PHE-HIS-VAL-SER-PHE-ASN-LYS-SER-GLU-LEU-PHE-THR-GLY-ILE-SER-PHE-SER-ALA-SER-TYR-LYS-GLU-GLN-TRP-THR-GLN-ARG-PHE-PRO-ALA-LYS-GLU-HIS-PRO-VAL-LEU-ALA-LEU-PRO-GLY-ALA-PRO-ALA-GLN-PHE-PRO-VAL-LEU-GLU-GLU-HIS-ARG-GLU-LEU-GLN-LYS-TYR-MET-VAL-TRP-SER-ASP-GLU-MET-VAL-ARG-THR-GLY-GLU-ALA-LEU-ILE-SER-ALA-HIS-LEU-VAL-ARG-PRO-TYR-VAL-GLY-ILE-HIS-LEU-ARG-ILE-GLY-SER-ASP-TRP-LYS-ASN-ALA-CYS-ALA-MET-LEU-LYS-ASP-GLY-THR-ALA-GLY-SER-HIS-PHE-MET-ALA-SER-PRO-GLN-CYS-VAL-GLY-TYR-SER-ARG-SER-THR-ALA-THR-PRO-LEU-THR-MET-THR-MET-CYS-LEU-PRO-ASP-LEU-LYS-GLU-ILE-GLN-ARG-ALA-VAL-THR-LEU-TRP-VAL-ARG-ALA-LEU-ASN-ALA-ARG-SER-VAL-TYR-ILE-ALA-THR-ASP-SER-GLU-SER-TYR-VAL-SER-GLU-ILE-GLN-GLN-LEU-PHE-LYS-ASP-LYS-VAL-ARG-VAL-VAL-SER-LEU-LYS-PRO-GLU-VAL-ALA-GLN-ILE-ASP-LEU-TYR-ILE-LEU-GLY-GLN-ALA-ASP-HIS-PHE-ILE-GLY-ASN-CYS-VAL-SER-SER-PHE-THR-ALA-PHE-VAL-LYS-ARG-GLU-ARG-ASP-LEU-HIS-GLY-ARG-GLN-SER-SER-PHE-PHE-GLY-MET-ASP,ASP-VAL-ASN-GLU-CYS-ILE-SER-ASN-PRO-CYS-GLN-ASN-GLY-GLY-THR-CYS-LEU-ASP-GLN-ILE-GLY-GLU-PHE-GLN-CYS-ILE-CYS-MET-PRO-GLY-TYR-GLU-GLY-VAL-TYR-CYS-GLU-ILE-ASN-THR,355,40,,Kd=5.9uM,5.229148,5.23,1,A,A,0,M,T,0,,B,A,,1,1,355,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.7336831092834473,0.6219019293785095,85.8264389038086,81.45352935791016,0.5482280850410461,1.449796438217163,0.901567816734314,0.7753022909164429,0.6917119026184082,0.583551824092865,DVNECISNPCQNGGTCLDQIGEFQCICMPGYEGVYCEINT,Low,"(5.222, 5.31]",train
5LZ6,protein-peptide,Q9H3P7 Q8BES6,MESLPVIAAPSMWTRPQIKDFKEKIQQDADSVITVGRGEVVTVRVPTHEEGSYLFWEFATDNYDIGFGVYFEWTDSPNTAVSVHVSESSDDDEEEEENIGCEEKAKKNANKPLLDEIVPVYRRDCHEEVYAGSHQYPGRGVYLLKFDNSYSLWRSKSVYYRVYYTR,GAHSERTFETAPSEIDADEVLEILSKSKPAPTHLTLER,MET-GLU-SER-LEU-PRO-VAL-ILE-ALA-ALA-PRO-SER-MET-TRP-THR-ARG-PRO-GLN-ILE-LYS-ASP-PHE-LYS-GLU-LYS-ILE-GLN-GLN-ASP-ALA-ASP-SER-VAL-ILE-THR-VAL-GLY-ARG-GLY-GLU-VAL-VAL-THR-VAL-ARG-VAL-PRO-THR-HIS-GLU-GLU-GLY-SER-TYR-LEU-PHE-TRP-GLU-PHE-ALA-THR-ASP-ASN-TYR-ASP-ILE-GLY-PHE-GLY-VAL-TYR-PHE-GLU-TRP-THR-ASP-SER-PRO-ASN-THR-ALA-VAL-SER-VAL-HIS-VAL-SER-GLU-SER-SER-ASP-ASP-ASP-GLU-GLU-GLU-GLU-GLU-ASN-ILE-GLY-CYS-GLU-GLU-LYS-ALA-LYS-LYS-ASN-ALA-ASN-LYS-PRO-LEU-LEU-ASP-GLU-ILE-VAL-PRO-VAL-TYR-ARG-ARG-ASP-CYS-HIS-GLU-GLU-VAL-TYR-ALA-GLY-SER-HIS-GLN-TYR-PRO-GLY-ARG-GLY-VAL-TYR-LEU-LEU-LYS-PHE-ASP-ASN-SER-TYR-SER-LEU-TRP-ARG-SER-LYS-SER-VAL-TYR-TYR-ARG-VAL-TYR-TYR-THR-ARG,GLY-ALA-HIS-SER-GLU-ARG-THR-PHE-GLU-THR-ALA-PRO-SER-GLU-ILE-ASP-ALA-ASP-GLU-VAL-LEU-GLU-ILE-LEU-SER-LYS-SER-LYS-PRO-ALA-PRO-THR-HIS-LEU-THR-LEU-GLU-ARG,166,38,,Kd=8uM,5.09691,5.1,1,A,A,0,M,T,0,,B,A,,1,1,166,38,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O,0.9574078917503356,0.6779006719589233,78.2603988647461,73.4506607055664,0.5364904999732971,1.0762168169021606,0.8357558250427246,0.712432861328125,0.7917425036430359,0.6165567636489868,GAHSERTFETAPSEIDADEVLEILSKSKPAPTHLTLER,Low,"(5.014, 5.105]",train
5MK0,protein-peptide,Q7Z3T8 Q9H3S7,MEAVPRMPMIWLDLKEAGDFHFQPAVKKFVLKNYGENPEAYNEELKKLELLRQNAVRVPRDFEGCSVLRKYLGQLHYLQSRVPMGSGQEAAVPVTWTEIFSGKSVAHEDIKYEQACILYNLGALHSMLGAMDKRVSEEGMKVSCTHFQCAAGAFAYLREHFPQAYSVDMSRQILTLNVNLMLGQAQECLLEKSMLDNRKSFLVARISAQVVDYYKEACRALENPDTASLLGRIQKDWKKLVQMKIYYFAAVAHLHMGKQAEEQQKFGERVAYFQSALDKLNEAIKLAKGQPDTVQDALRFTMDVIGGKYNSAKKDNDFIYHEAVPALDTLQPVKGAPLVKPLPVNPTDPAVTGPDIFAKLV,MDSYFKAAVSDLDKLLDDFEQN,MET-GLU-ALA-VAL-PRO-ARG-MET-PRO-MET-ILE-TRP-LEU-ASP-LEU-LYS-GLU-ALA-GLY-ASP-PHE-HIS-PHE-GLN-PRO-ALA-VAL-LYS-LYS-PHE-VAL-LEU-LYS-ASN-TYR-GLY-GLU-ASN-PRO-GLU-ALA-TYR-ASN-GLU-GLU-LEU-LYS-LYS-LEU-GLU-LEU-LEU-ARG-GLN-ASN-ALA-VAL-ARG-VAL-PRO-ARG-ASP-PHE-GLU-GLY-CYS-SER-VAL-LEU-ARG-LYS-TYR-LEU-GLY-GLN-LEU-HIS-TYR-LEU-GLN-SER-ARG-VAL-PRO-MET-GLY-SER-GLY-GLN-GLU-ALA-ALA-VAL-PRO-VAL-THR-TRP-THR-GLU-ILE-PHE-SER-GLY-LYS-SER-VAL-ALA-HIS-GLU-ASP-ILE-LYS-TYR-GLU-GLN-ALA-CYS-ILE-LEU-TYR-ASN-LEU-GLY-ALA-LEU-HIS-SER-MET-LEU-GLY-ALA-MET-ASP-LYS-ARG-VAL-SER-GLU-GLU-GLY-MET-LYS-VAL-SER-CYS-THR-HIS-PHE-GLN-CYS-ALA-ALA-GLY-ALA-PHE-ALA-TYR-LEU-ARG-GLU-HIS-PHE-PRO-GLN-ALA-TYR-SER-VAL-ASP-MET-SER-ARG-GLN-ILE-LEU-THR-LEU-ASN-VAL-ASN-LEU-MET-LEU-GLY-GLN-ALA-GLN-GLU-CYS-LEU-LEU-GLU-LYS-SER-MET-LEU-ASP-ASN-ARG-LYS-SER-PHE-LEU-VAL-ALA-ARG-ILE-SER-ALA-GLN-VAL-VAL-ASP-TYR-TYR-LYS-GLU-ALA-CYS-ARG-ALA-LEU-GLU-ASN-PRO-ASP-THR-ALA-SER-LEU-LEU-GLY-ARG-ILE-GLN-LYS-ASP-TRP-LYS-LYS-LEU-VAL-GLN-MET-LYS-ILE-TYR-TYR-PHE-ALA-ALA-VAL-ALA-HIS-LEU-HIS-MET-GLY-LYS-GLN-ALA-GLU-GLU-GLN-GLN-LYS-PHE-GLY-GLU-ARG-VAL-ALA-TYR-PHE-GLN-SER-ALA-LEU-ASP-LYS-LEU-ASN-GLU-ALA-ILE-LYS-LEU-ALA-LYS-GLY-GLN-PRO-ASP-THR-VAL-GLN-ASP-ALA-LEU-ARG-PHE-THR-MET-ASP-VAL-ILE-GLY-GLY-LYS-TYR-ASN-SER-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-GLU-ALA-VAL-PRO-ALA-LEU-ASP-THR-LEU-GLN-PRO-VAL-LYS-GLY-ALA-PRO-LEU-VAL-LYS-PRO-LEU-PRO-VAL-ASN-PRO-THR-ASP-PRO-ALA-VAL-THR-GLY-PRO-ASP-ILE-PHE-ALA-LYS-LEU-VAL,MET-ASP-SER-TYR-PHE-LYS-ALA-ALA-VAL-SER-ASP-LEU-ASP-LYS-LEU-LEU-ASP-ASP-PHE-GLU-GLN-ASN,361,22,,Kd=3.1uM,5.508638,5.51,1,A,A,0,M,T,0,,B,A,dimer,1,1,361,22,0,CSCC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.964529275894165,0.7597224712371826,93.37967681884766,87.9297103881836,0.3521252274513244,0.8564284443855286,0.9384995102882384,0.8743789792060852,0.9367677569389344,0.7310583591461182,MDSYFKAAVSDLDKLLDDFEQN,Low,"(5.463, 5.6]",train
5OY9,protein-peptide,P0C2X0 P01130,KFTIVFPHNQKGNWKNVPSNYHYCPSSSDLNWHNDLIGTALQVKMPKSHKAIQADGWMCHASKWVTTCDFRWYGPKYITHSIRSFTPSVEQCKESIEQTKQGTWLNPGFPPQSCGYATVTDAEAVIVQVTPHHVLVDEYTGEWVDSQFINGKCSNYICPTVHNSTTWHSDYKVKGLCDSNLISMDITFFSEDGELSSLGKEGTGFRSNYFAYETGGKACKMQYCKHWGVRLPSGVWFEMADKDLFAAARFPECPEGSSISAPSQTSVDVSLIQDVERILDYSLCQETWSKIRAGLPISPVDLSYLAPKNPGTGPAFTIINGTLKYFETRYIRVDIAAPILSRMVGMISGTTTERELWDDWAPYEDVEIGPNGVLRTSSGYKFPLYMIGHGMLDSDLHLSSKAQVFEHPHI,TCSQDEFRCHDGKCISRQFVCDSDRDCLDGSDEASCP,LYS-PHE-THR-ILE-VAL-PHE-PRO-HIS-ASN-GLN-LYS-GLY-ASN-TRP-LYS-ASN-VAL-PRO-SER-ASN-TYR-HIS-TYR-CYS-PRO-SER-SER-SER-ASP-LEU-ASN-TRP-HIS-ASN-ASP-LEU-ILE-GLY-THR-ALA-LEU-GLN-VAL-LYS-MET-PRO-LYS-SER-HIS-MLZ-ALA-ILE-GLN-ALA-ASP-GLY-TRP-MET-CYS-HIS-ALA-SER-LYS-TRP-VAL-THR-THR-CYS-ASP-PHE-ARG-TRP-TYR-GLY-PRO-LYS-TYR-ILE-THR-HIS-SER-ILE-ARG-SER-PHE-THR-PRO-SER-VAL-GLU-GLN-CYS-LYS-GLU-SER-ILE-GLU-GLN-THR-LYS-GLN-GLY-THR-TRP-LEU-ASN-PRO-GLY-PHE-PRO-PRO-GLN-SER-CYS-GLY-TYR-ALA-THR-VAL-THR-ASP-ALA-GLU-ALA-VAL-ILE-VAL-GLN-VAL-THR-PRO-HIS-HIS-VAL-LEU-VAL-ASP-GLU-TYR-THR-GLY-GLU-TRP-VAL-ASP-SER-GLN-PHE-ILE-ASN-GLY-LYS-CYS-SER-ASN-TYR-ILE-CYS-PRO-THR-VAL-HIS-ASN-SER-THR-THR-TRP-HIS-SER-ASP-TYR-LYS-VAL-LYS-GLY-LEU-CYS-ASP-SER-ASN-LEU-ILE-SER-MET-ASP-ILE-THR-PHE-PHE-SER-GLU-ASP-GLY-GLU-LEU-SER-SER-LEU-GLY-LYS-GLU-GLY-THR-GLY-PHE-ARG-SER-ASN-TYR-PHE-ALA-TYR-GLU-THR-GLY-GLY-LYS-ALA-CYS-LYS-MET-GLN-TYR-CYS-LYS-HIS-TRP-GLY-VAL-ARG-LEU-PRO-SER-GLY-VAL-TRP-PHE-GLU-MET-ALA-ASP-LYS-ASP-LEU-PHE-ALA-ALA-ALA-ARG-PHE-PRO-GLU-CYS-PRO-GLU-GLY-SER-SER-ILE-SER-ALA-PRO-SER-GLN-THR-SER-VAL-ASP-VAL-SER-LEU-ILE-GLN-ASP-VAL-GLU-ARG-ILE-LEU-ASP-TYR-SER-LEU-CYS-GLN-GLU-THR-TRP-SER-LYS-ILE-ARG-ALA-GLY-LEU-PRO-ILE-SER-PRO-VAL-ASP-LEU-SER-TYR-LEU-ALA-PRO-LYS-ASN-PRO-GLY-THR-GLY-PRO-ALA-PHE-THR-ILE-ILE-ASN-GLY-THR-LEU-LYS-TYR-PHE-GLU-THR-ARG-TYR-ILE-ARG-VAL-ASP-ILE-ALA-ALA-PRO-ILE-LEU-SER-ARG-MET-VAL-GLY-MET-ILE-SER-GLY-THR-THR-THR-GLU-ARG-GLU-LEU-TRP-ASP-ASP-TRP-ALA-PRO-TYR-GLU-ASP-VAL-GLU-ILE-GLY-PRO-ASN-GLY-VAL-LEU-ARG-THR-SER-SER-GLY-TYR-LYS-PHE-PRO-LEU-TYR-MET-ILE-GLY-HIS-GLY-MET-LEU-ASP-SER-ASP-LEU-HIS-LEU-SER-SER-LYS-ALA-GLN-VAL-PHE-GLU-HIS-PRO-HIS-ILE,THR-CYS-SER-GLN-ASP-GLU-PHE-ARG-CYS-HIS-ASP-GLY-LYS-CYS-ILE-SER-ARG-GLN-PHE-VAL-CYS-ASP-SER-ASP-ARG-ASP-CYS-LEU-ASP-GLY-SER-ASP-GLU-ALA-SER-CYS-PRO,410,37,,Kd=3.75uM,5.425969,5.43,1,A,A,0,M,T,0,,D,A,,1,1,410,37,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,0.3696220517158508,0.5187332630157471,47.86063003540039,46.6789436340332,1.2427595853805542,1.6940300464630127,0.5016460418701172,0.5598511099815369,0.336616039276123,0.5084537863731384,TCSQDEFRCHDGKCISRQFVCDSDRDCLDGSDEASCP,Low,"(5.31, 5.463]",train
5OYL,protein-peptide,P01130 B7UCZ5,KFTIVFPHNQKGNWKNVPSNYHYCPSSSDLNWHNDLIGTALQVKMPKSHKAIQADGWMCHASKWVTTCDFRWYGPKYITHSIRSFTPSVEQCKESIEQTKQGTWLNPGFPPQSCGYATVTDAEAVIVQVTPHHVLVDEYTGEWVDSQFINGKCSNYICPTVHNSTTWHSDYKVKGLCDSNLISMDITFFSEDGELSSLGKEGTGFRSNYFAYETGGKACKMQYCKHWGVRLPSGVWFEMADKDLFAAARFPECPEGSSISAPSQTSVDVSLIQDVERILDYSLCQETWSKIRAGLPISPVDLSYLAPKNPGTGPAFTIINGTLKYFETRYIRVDIAAPILSRMVGMISGTTTERELWDDWAPYEDVEIGPNGVLRTSSGYKFPLYMIGHGMLDSDLHLSSKAQVFEHPHI,GPLGSVTCKSGDFSCGGRVNRCIPQFWRCDGQVDCDNGSDEQGCPP,LYS-PHE-THR-ILE-VAL-PHE-PRO-HIS-ASN-GLN-LYS-GLY-ASN-TRP-LYS-ASN-VAL-PRO-SER-ASN-TYR-HIS-TYR-CYS-PRO-SER-SER-SER-ASP-LEU-ASN-TRP-HIS-ASN-ASP-LEU-ILE-GLY-THR-ALA-LEU-GLN-VAL-LYS-MET-PRO-LYS-SER-HIS-MLZ-ALA-ILE-GLN-ALA-ASP-GLY-TRP-MET-CYS-HIS-ALA-SER-LYS-TRP-VAL-THR-THR-CYS-ASP-PHE-ARG-TRP-TYR-GLY-PRO-LYS-TYR-ILE-THR-HIS-SER-ILE-ARG-SER-PHE-THR-PRO-SER-VAL-GLU-GLN-CYS-LYS-GLU-SER-ILE-GLU-GLN-THR-LYS-GLN-GLY-THR-TRP-LEU-ASN-PRO-GLY-PHE-PRO-PRO-GLN-SER-CYS-GLY-TYR-ALA-THR-VAL-THR-ASP-ALA-GLU-ALA-VAL-ILE-VAL-GLN-VAL-THR-PRO-HIS-HIS-VAL-LEU-VAL-ASP-GLU-TYR-THR-GLY-GLU-TRP-VAL-ASP-SER-GLN-PHE-ILE-ASN-GLY-LYS-CYS-SER-ASN-TYR-ILE-CYS-PRO-THR-VAL-HIS-ASN-SER-THR-THR-TRP-HIS-SER-ASP-TYR-LYS-VAL-LYS-GLY-LEU-CYS-ASP-SER-ASN-LEU-ILE-SER-MET-ASP-ILE-THR-PHE-PHE-SER-GLU-ASP-GLY-GLU-LEU-SER-SER-LEU-GLY-LYS-GLU-GLY-THR-GLY-PHE-ARG-SER-ASN-TYR-PHE-ALA-TYR-GLU-THR-GLY-GLY-LYS-ALA-CYS-LYS-MET-GLN-TYR-CYS-LYS-HIS-TRP-GLY-VAL-ARG-LEU-PRO-SER-GLY-VAL-TRP-PHE-GLU-MET-ALA-ASP-LYS-ASP-LEU-PHE-ALA-ALA-ALA-ARG-PHE-PRO-GLU-CYS-PRO-GLU-GLY-SER-SER-ILE-SER-ALA-PRO-SER-GLN-THR-SER-VAL-ASP-VAL-SER-LEU-ILE-GLN-ASP-VAL-GLU-ARG-ILE-LEU-ASP-TYR-SER-LEU-CYS-GLN-GLU-THR-TRP-SER-LYS-ILE-ARG-ALA-GLY-LEU-PRO-ILE-SER-PRO-VAL-ASP-LEU-SER-TYR-LEU-ALA-PRO-LYS-ASN-PRO-GLY-THR-GLY-PRO-ALA-PHE-THR-ILE-ILE-ASN-GLY-THR-LEU-LYS-TYR-PHE-GLU-THR-ARG-TYR-ILE-ARG-VAL-ASP-ILE-ALA-ALA-PRO-ILE-LEU-SER-ARG-MET-VAL-GLY-MET-ILE-SER-GLY-THR-THR-THR-GLU-ARG-GLU-LEU-TRP-ASP-ASP-TRP-ALA-PRO-TYR-GLU-ASP-VAL-GLU-ILE-GLY-PRO-ASN-GLY-VAL-LEU-ARG-THR-SER-SER-GLY-TYR-LYS-PHE-PRO-LEU-TYR-MET-ILE-GLY-HIS-GLY-MET-LEU-ASP-SER-ASP-LEU-HIS-LEU-SER-SER-LYS-ALA-GLN-VAL-PHE-GLU-HIS-PRO-HIS-ILE,GLY-PRO-LEU-GLY-SER-VAL-THR-CYS-LYS-SER-GLY-ASP-PHE-SER-CYS-GLY-GLY-ARG-VAL-ASN-ARG-CYS-ILE-PRO-GLN-PHE-TRP-ARG-CYS-ASP-GLY-GLN-VAL-ASP-CYS-ASP-ASN-GLY-SER-ASP-GLU-GLN-GLY-CYS-PRO-PRO,410,46,,Kd=7.5uM,5.124939,5.12,1,A,A,0,M,T,0,,D,A,,1,1,410,46,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)[C@@H](C)O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O,0.3566368222236633,0.3472080826759338,45.63509368896485,46.13420867919922,1.3800143003463743,2.0722930431365967,0.5063644051551819,0.4767566621303558,0.3041281402111053,0.3148209154605865,GPLGSVTCKSGDFSCGGRVNRCIPQFWRCDGQVDCDNGSDEQGCPP,Low,"(5.105, 5.222]",train
5TZP,protein-peptide,Q9J5G4 E1C005,GPLGSMASSNMKDETYYIALNMIQNYIIEYNTNKPRKSFVIDSISYDVLKAACKSVIKTNYNEFDIIISRNIDFNVIVTQVLEDKINWGRIITIIAFCAYYSKKVKQDTSPQYYDGIISEAITDAILSKYRSWFIDQDYWNGIRIYKN,ISSAIQVGHQLALIGDEFNRAYSRK,GLY-PRO-LEU-GLY-SER-MET-ALA-SER-SER-ASN-MET-LYS-ASP-GLU-THR-TYR-TYR-ILE-ALA-LEU-ASN-MET-ILE-GLN-ASN-TYR-ILE-ILE-GLU-TYR-ASN-THR-ASN-LYS-PRO-ARG-LYS-SER-PHE-VAL-ILE-ASP-SER-ILE-SER-TYR-ASP-VAL-LEU-LYS-ALA-ALA-CYS-LYS-SER-VAL-ILE-LYS-THR-ASN-TYR-ASN-GLU-PHE-ASP-ILE-ILE-ILE-SER-ARG-ASN-ILE-ASP-PHE-ASN-VAL-ILE-VAL-THR-GLN-VAL-LEU-GLU-ASP-LYS-ILE-ASN-TRP-GLY-ARG-ILE-ILE-THR-ILE-ILE-ALA-PHE-CYS-ALA-TYR-TYR-SER-LYS-LYS-VAL-LYS-GLN-ASP-THR-SER-PRO-GLN-TYR-TYR-ASP-GLY-ILE-ILE-SER-GLU-ALA-ILE-THR-ASP-ALA-ILE-LEU-SER-LYS-TYR-ARG-SER-TRP-PHE-ILE-ASP-GLN-ASP-TYR-TRP-ASN-GLY-ILE-ARG-ILE-TYR-LYS-ASN,ILE-SER-SER-ALA-ILE-GLN-VAL-GLY-HIS-GLN-LEU-ALA-LEU-ILE-GLY-ASP-GLU-PHE-ASN-ARG-ALA-TYR-SER-ARG-LYS,148,25,,Kd=30nM,7.522879,7.52,1,A,A,0,M,T,0,,B,A,,1,1,148,25,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)O,0.9727645516395568,0.7066934704780579,93.41707611083984,80.12837982177734,0.3545477986335754,0.997636616230011,0.9231188297271729,0.7893761992454529,0.909308910369873,0.6860227584838867,ISSAIQVGHQLALIGDEFNRAYSRK,Moderate,"(7.268, 7.523]",train
5TZQ,protein-peptide,A9XRG9 Q9J5G4,GPLGSMASSNMKDETYYIALNMIQNYIIEYNTNKPRKSFVIDSISYDVLKAACKSVIKTNYNEFDIIISRNIDFNVIVTQVLEDKINWGRIITIIAFCAYYSKKVKQDTSPQYYDGIISEAITDAILSKYRSWFIDQDYWNGIRIYKN,EARTEVQIARKLQCIADQFHRLHIQR,GLY-PRO-LEU-GLY-SER-MET-ALA-SER-SER-ASN-MET-LYS-ASP-GLU-THR-TYR-TYR-ILE-ALA-LEU-ASN-MET-ILE-GLN-ASN-TYR-ILE-ILE-GLU-TYR-ASN-THR-ASN-LYS-PRO-ARG-LYS-SER-PHE-VAL-ILE-ASP-SER-ILE-SER-TYR-ASP-VAL-LEU-LYS-ALA-ALA-CYS-LYS-SER-VAL-ILE-LYS-THR-ASN-TYR-ASN-GLU-PHE-ASP-ILE-ILE-ILE-SER-ARG-ASN-ILE-ASP-PHE-ASN-VAL-ILE-VAL-THR-GLN-VAL-LEU-GLU-ASP-LYS-ILE-ASN-TRP-GLY-ARG-ILE-ILE-THR-ILE-ILE-ALA-PHE-CYS-ALA-TYR-TYR-SER-LYS-LYS-VAL-LYS-GLN-ASP-THR-SER-PRO-GLN-TYR-TYR-ASP-GLY-ILE-ILE-SER-GLU-ALA-ILE-THR-ASP-ALA-ILE-LEU-SER-LYS-TYR-ARG-SER-TRP-PHE-ILE-ASP-GLN-ASP-TYR-TRP-ASN-GLY-ILE-ARG-ILE-TYR-LYS-ASN,GLU-ALA-ARG-THR-GLU-VAL-GLN-ILE-ALA-ARG-LYS-LEU-GLN-CYS-ILE-ALA-ASP-GLN-PHE-HIS-ARG-LEU-HIS-ILE-GLN-ARG,148,26,,Kd=16nM,7.79588,7.8,1,A,A,0,M,T,0,,C,A,,0,1,148,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)CC,1.0001591444015503,0.768132209777832,92.24559020996094,81.09230041503906,0.3637720346450805,0.8270964622497559,0.9150399565696716,0.8282281160354614,0.9029043912887572,0.7531081438064575,EARTEVQIARKLQCIADQFHRLHIQR,Moderate,"(7.523, 7.921]",val
5U4K,protein-peptide,P45481 Q04206,GVRKGWHEHVTQDLRSHLVHKLVQAIFPTPDPAALKDRRMENLVAYAKKVEGDMYESANSRDEYYHLLAEKIYKIQKELEEKRRSRL,GSPGYPNGLLSGDEDFSSIADMDFSALLSQISS,GLY-VAL-ARG-LYS-GLY-TRP-HIS-GLU-HIS-VAL-THR-GLN-ASP-LEU-ARG-SER-HIS-LEU-VAL-HIS-LYS-LEU-VAL-GLN-ALA-ILE-PHE-PRO-THR-PRO-ASP-PRO-ALA-ALA-LEU-LYS-ASP-ARG-ARG-MET-GLU-ASN-LEU-VAL-ALA-TYR-ALA-LYS-LYS-VAL-GLU-GLY-ASP-MET-TYR-GLU-SER-ALA-ASN-SER-ARG-ASP-GLU-TYR-TYR-HIS-LEU-LEU-ALA-GLU-LYS-ILE-TYR-LYS-ILE-GLN-LYS-GLU-LEU-GLU-GLU-LYS-ARG-ARG-SER-ARG-LEU,GLY-SER-PRO-GLY-TYR-PRO-ASN-GLY-LEU-LEU-SER-GLY-ASP-GLU-ASP-PHE-SER-SER-ILE-ALA-ASP-MET-ASP-PHE-SER-ALA-LEU-LEU-SER-GLN-ILE-SER-SER,87,33,,Kd=15uM,4.823909,4.82,1,A,A,0,M,S,0,,B,A,,1,1,87,33,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.8845146894454956,0.6891287565231323,77.69205474853516,83.41284942626953,0.4324231743812561,0.983899474143982,0.8233139514923096,0.7421585917472839,0.7487732172012329,0.6758712530136108,GSPGYPNGLLSGDEDFSSIADMDFSALLSQISS,Low,"(4.745, 4.866]",val
5UUL,protein-peptide,Q9BXH1 Q16548,GMTDCEFGYIYRLAQDYLQCVLQIPQPGSGPSKTSRVLQNVAFSVQKEVEKNLKSCLDNVNVVSVDTARTLFNQVMEKEFEDGIINWGRIVTIFAFEGILIKKLLRQQIAPDVDTYKEISYFVAEFIMNNTGEWIRQNGGWENGFVKKFEPK,QWAREIGAQLRRMADDLNAQYER,GLY-MET-THR-ASP-CYS-GLU-PHE-GLY-TYR-ILE-TYR-ARG-LEU-ALA-GLN-ASP-TYR-LEU-GLN-CYS-VAL-LEU-GLN-ILE-PRO-GLN-PRO-GLY-SER-GLY-PRO-SER-LYS-THR-SER-ARG-VAL-LEU-GLN-ASN-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-CYS-LEU-ASP-ASN-VAL-ASN-VAL-VAL-SER-VAL-ASP-THR-ALA-ARG-THR-LEU-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLU-GLY-ILE-LEU-ILE-LYS-LYS-LEU-LEU-ARG-GLN-GLN-ILE-ALA-PRO-ASP-VAL-ASP-THR-TYR-LYS-GLU-ILE-SER-TYR-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASN-GLY-PHE-VAL-LYS-LYS-PHE-GLU-PRO-LYS,ACE-GLN-TRP-ALA-ARG-GLU-ILE-GLY-ALA-GLN-LEU-ARG-ARG-MET-ALA-ASP-ASP-LEU-ASN-ALA-GLN-TYR-GLU-ARG-NH2,152,25,,Ki=4.8nM,8.318759,8.32,1,A,A,0,M,T,0,,B,A,,1,1,152,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,1.0064201354980469,0.7076526284217834,96.1173858642578,88.82955169677734,0.3240082561969757,1.0128873586654663,0.9413698315620422,0.7963736653327942,0.9405398368835448,0.685472309589386,QWAREIGAQLRRMADDLNAQYER,Moderate,"(7.921, 8.383]",train
5VKL,protein-peptide,P23615 P04050,GIDPFTAKRTHRVINHPYYFPFNGRQAEDYLRSKERGEFVIRQSSRGDDHLVITWKLDKDLFQHIDIQELEKENPLALGKVLIVDNQKYNDLDQIIVEYLQNKVRLLNEMTSSEKFKSGTKKDVVKFIEDYSRVNPNKSVYYFSLNHDNPGWFYLMFKINANSKLYTWNVKLTNTGYFLVNYNYPSVIQLCNGFKTLLKSNSSKNRMNNYR,ESGLVNADLDVKDELMFSPLVDS,GLY-ILE-ASP-PRO-PHE-THR-ALA-LYS-ARG-THR-HIS-ARG-VAL-ILE-ASN-HIS-PRO-TYR-TYR-PHE-PRO-PHE-ASN-GLY-ARG-GLN-ALA-GLU-ASP-TYR-LEU-ARG-SER-LYS-GLU-ARG-GLY-GLU-PHE-VAL-ILE-ARG-GLN-SER-SER-ARG-GLY-ASP-ASP-HIS-LEU-VAL-ILE-THR-TRP-LYS-LEU-ASP-LYS-ASP-LEU-PHE-GLN-HIS-ILE-ASP-ILE-GLN-GLU-LEU-GLU-LYS-GLU-ASN-PRO-LEU-ALA-LEU-GLY-LYS-VAL-LEU-ILE-VAL-ASP-ASN-GLN-LYS-TYR-ASN-ASP-LEU-ASP-GLN-ILE-ILE-VAL-GLU-TYR-LEU-GLN-ASN-LYS-VAL-ARG-LEU-LEU-ASN-GLU-MET-THR-SER-SER-GLU-LYS-PHE-LYS-SER-GLY-THR-LYS-LYS-ASP-VAL-VAL-LYS-PHE-ILE-GLU-ASP-TYR-SER-ARG-VAL-ASN-PRO-ASN-LYS-SER-VAL-TYR-TYR-PHE-SER-LEU-ASN-HIS-ASP-ASN-PRO-GLY-TRP-PHE-TYR-LEU-MET-PHE-LYS-ILE-ASN-ALA-ASN-SER-LYS-LEU-TYR-THR-TRP-ASN-VAL-LYS-LEU-THR-ASN-THR-GLY-TYR-PHE-LEU-VAL-ASN-TYR-ASN-TYR-PRO-SER-VAL-ILE-GLN-LEU-CYS-ASN-GLY-PHE-LYS-THR-LEU-LEU-LYS-SER-ASN-SER-SER-LYS-ASN-ARG-MET-ASN-ASN-TYR-ARG,GLU-SER-GLY-LEU-VAL-ASN-ALA-ASP-LEU-ASP-VAL-LYS-ASP-GLU-LEU-MET-PHE-SEP-PRO-LEU-VAL-ASP-SER,211,23,,Kd=113nM,6.946922,6.95,1,A,A,0,M,T,0,,B,A,,1,1,211,23,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8307387828826904,0.7541050910949707,81.12239837646484,80.2674789428711,0.512627363204956,0.9814302325248718,0.8432023525238037,0.7995118498802185,0.7154433131217957,0.6894357800483704,ESGLVNADLDVKDELMFSPLVDS,Low,"(6.824, 7.049]",train
5VKO,protein-peptide,P23615 P04050,GIDPFTAKRTHRVINHPYYFPFNGRQAEDYLRSKERGEFVIRQSSRGDDHLVITWKLDKDLFQHIDIQELEKENPLALGKVLIVDNQKYNDLDQIIVEYLQNKVRLLNEMTSSEKFKSGTKKDVVKFIEDYSRVNPNKSVYYFSLNHDNPGWFYLMFKINANSKLYTWNVKLTNTGYFLVNYNYPSVIQLCNGFKTLLKSNSSKNRMNNYR,CGGVTPYSNESGLVNADLDVKDELMFSPLVDSGS,GLY-ILE-ASP-PRO-PHE-THR-ALA-LYS-ARG-THR-HIS-ARG-VAL-ILE-ASN-HIS-PRO-TYR-TYR-PHE-PRO-PHE-ASN-GLY-ARG-GLN-ALA-GLU-ASP-TYR-LEU-ARG-SER-LYS-GLU-ARG-GLY-GLU-PHE-VAL-ILE-ARG-GLN-SER-SER-ARG-GLY-ASP-ASP-HIS-LEU-VAL-ILE-THR-TRP-LYS-LEU-ASP-LYS-ASP-LEU-PHE-GLN-HIS-ILE-ASP-ILE-GLN-GLU-LEU-GLU-LYS-GLU-ASN-PRO-LEU-ALA-LEU-GLY-LYS-VAL-LEU-ILE-VAL-ASP-ASN-GLN-LYS-TYR-ASN-ASP-LEU-ASP-GLN-ILE-ILE-VAL-GLU-TYR-LEU-GLN-ASN-LYS-VAL-ARG-LEU-LEU-ASN-GLU-MET-THR-SER-SER-GLU-LYS-PHE-LYS-SER-GLY-THR-LYS-LYS-ASP-VAL-VAL-LYS-PHE-ILE-GLU-ASP-TYR-SER-ARG-VAL-ASN-PRO-ASN-LYS-SER-VAL-TYR-TYR-PHE-SER-LEU-ASN-HIS-ASP-ASN-PRO-GLY-TRP-PHE-TYR-LEU-MET-PHE-LYS-ILE-ASN-ALA-ASN-SER-LYS-LEU-TYR-THR-TRP-ASN-VAL-LYS-LEU-THR-ASN-THR-GLY-TYR-PHE-LEU-VAL-ASN-TYR-ASN-TYR-PRO-SER-VAL-ILE-GLN-LEU-CYS-ASN-GLY-PHE-LYS-THR-LEU-LEU-LYS-SER-ASN-SER-SER-LYS-ASN-ARG-MET-ASN-ASN-TYR-ARG,CYS-GLY-GLY-VAL-TPO-PRO-TYR-SER-ASN-GLU-SER-GLY-LEU-VAL-ASN-ALA-ASP-LEU-ASP-VAL-LYS-ASP-GLU-LEU-MET-PHE-SEP-PRO-LEU-VAL-ASP-SER-GLY-SER,211,34,,Kd=4nM,8.39794,8.4,1,A,A,0,M,T,0,,B,A,,1,1,211,34,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CS)C(C)C)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.7931191325187683,0.673505961894989,81.44709014892578,78.70022583007812,0.5803156495094299,1.2200709581375122,0.8237437009811401,0.7455113530158997,0.6553609371185303,0.6110732555389404,CGGVTPYSNESGLVNADLDVKDELMFSPLVDSGS,Moderate,"(8.383, 8.824]",train
5XIU,protein-peptide,P62983 Q8IYW5,MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GPGHMEETEINFTQKLIDLEHLLFERHKQEEQDRLLALQLQKEVDKEQM,MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-PRO-GLY-HIS-MET-GLU-GLU-THR-GLU-ILE-ASN-PHE-THR-GLN-LYS-LEU-ILE-ASP-LEU-GLU-HIS-LEU-LEU-PHE-GLU-ARG-HIS-LYS-GLN-GLU-GLU-GLN-ASP-ARG-LEU-LEU-ALA-LEU-GLN-LEU-GLN-LYS-GLU-VAL-ASP-LYS-GLU-GLN-MET,76,49,,Kd=25uM,4.60206,4.6,1,A,A,0,M,T,0,,A,B,,1,1,76,49,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC,0.8652045726776123,,81.36280822753906,,0.3959842026233673,,0.834458589553833,,0.8028910160064697,,GPGHMEETEINFTQKLIDLEHLLFERHKQEEQDRLLALQLQKEVDKEQM,Low,"(4.456, 4.606]",val
5XV8,protein-peptide,P32780 Q2YD98,GSMATSSEEVLLIVKKVRQKKQDGALYLMAERIAWAPEGKDRFTISHMYADIKCQKISPEGKAKIQLQLVLHAGDTTNFHFSNESTAVKERDAVKDLLQQLLPKFKRKAN,GSMRRRTEALGDAEEDEDDEDFVEVPEKEGYEPHIPDHLRPEYGLEAA,GLY-SER-MET-ALA-THR-SER-SER-GLU-GLU-VAL-LEU-LEU-ILE-VAL-LYS-LYS-VAL-ARG-GLN-LYS-LYS-GLN-ASP-GLY-ALA-LEU-TYR-LEU-MET-ALA-GLU-ARG-ILE-ALA-TRP-ALA-PRO-GLU-GLY-LYS-ASP-ARG-PHE-THR-ILE-SER-HIS-MET-TYR-ALA-ASP-ILE-LYS-CYS-GLN-LYS-ILE-SER-PRO-GLU-GLY-LYS-ALA-LYS-ILE-GLN-LEU-GLN-LEU-VAL-LEU-HIS-ALA-GLY-ASP-THR-THR-ASN-PHE-HIS-PHE-SER-ASN-GLU-SER-THR-ALA-VAL-LYS-GLU-ARG-ASP-ALA-VAL-LYS-ASP-LEU-LEU-GLN-GLN-LEU-LEU-PRO-LYS-PHE-LYS-ARG-LYS-ALA-ASN,GLY-SER-MET-ARG-ARG-ARG-THR-GLU-ALA-LEU-GLY-ASP-ALA-GLU-GLU-ASP-GLU-ASP-ASP-GLU-ASP-PHE-VAL-GLU-VAL-PRO-GLU-LYS-GLU-GLY-TYR-GLU-PRO-HIS-ILE-PRO-ASP-HIS-LEU-ARG-PRO-GLU-TYR-GLY-LEU-GLU-ALA-ALA,110,48,,Kd=71.4nM,7.146302,7.15,1,A,A,0,M,T,0,,A,B,,1,1,110,48,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.9430357217788696,0.7027849555015564,79.44600677490234,80.087158203125,0.4988889098167419,0.9740613698959352,0.8093262910842896,0.74806809425354,0.7826340198516846,0.6914641261100769,GSMRRRTEALGDAEEDEDDEDFVEVPEKEGYEPHIPDHLRPEYGLEAA,Moderate,"(7.049, 7.268]",train
6E3I,protein-peptide,Q16548,GMTDCEFGYIYRLAQDYLQCVLQIPQPGSGPSKTSRVLQNVAFSVQKEVEKNLKSCLDNVNVVSVDTARTLFNQVMEKEFEDGIINWGRIVTIFAFEGILIKKLLRQQIAPDVDTYKEISYFVAEFIMNNTGEWIRQNGGWENGFVKKFEPK,QRVVHIAAGLRRTGDQLEAYG,GLY-MET-THR-ASP-CYS-GLU-PHE-GLY-TYR-ILE-TYR-ARG-LEU-ALA-GLN-ASP-TYR-LEU-GLN-CYS-VAL-LEU-GLN-ILE-PRO-GLN-PRO-GLY-SER-GLY-PRO-SER-LYS-THR-SER-ARG-VAL-LEU-GLN-ASN-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-CYS-LEU-ASP-ASN-VAL-ASN-VAL-VAL-SER-VAL-ASP-THR-ALA-ARG-THR-LEU-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLU-GLY-ILE-LEU-ILE-LYS-LYS-LEU-LEU-ARG-GLN-GLN-ILE-ALA-PRO-ASP-VAL-ASP-THR-TYR-LYS-GLU-ILE-SER-TYR-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASN-GLY-PHE-VAL-LYS-LYS-PHE-GLU-PRO-LYS,ACE-GLN-ARG-VAL-VAL-HIS-ILE-ALA-ALA-GLY-LEU-ARG-ARG-THR-GLY-ASP-GLN-LEU-GLU-ALA-TYR-GLY-NH2,152,23,,Kd=3.21nM,8.493495,8.49,1,A,A,0,M,T,0,,B,A,,1,1,152,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)O,1.006125807762146,0.7329607009887695,96.73965454101562,90.5131607055664,0.3225282430648803,0.8844082951545715,0.9422734379768372,0.8223232626914978,0.9462218284606934,0.7106200456619263,QRVVHIAAGLRRTGDQLEAYG,Moderate,"(8.383, 8.824]",train
6E3J,protein-peptide,Q16548,GMTDCEFGYIYRLAQDYLQCVLQIPQPGSGPSKTSRVLQNVAFSVQKEVEKNLKSCLDNVNVVSVDTARTLFNQVMEKEFEDGIINWGRIVTIFAFEGILIKKLLRQQIAPDVDTYKEISYFVAEFIMNNTGEWIRQNGGWENGFVKKFEPK,RRVVQIAAGLRRAGDQLEKYG,GLY-MET-THR-ASP-CYS-GLU-PHE-GLY-TYR-ILE-TYR-ARG-LEU-ALA-GLN-ASP-TYR-LEU-GLN-CYS-VAL-LEU-GLN-ILE-PRO-GLN-PRO-GLY-SER-GLY-PRO-SER-LYS-THR-SER-ARG-VAL-LEU-GLN-ASN-VAL-ALA-PHE-SER-VAL-GLN-LYS-GLU-VAL-GLU-LYS-ASN-LEU-LYS-SER-CYS-LEU-ASP-ASN-VAL-ASN-VAL-VAL-SER-VAL-ASP-THR-ALA-ARG-THR-LEU-PHE-ASN-GLN-VAL-MET-GLU-LYS-GLU-PHE-GLU-ASP-GLY-ILE-ILE-ASN-TRP-GLY-ARG-ILE-VAL-THR-ILE-PHE-ALA-PHE-GLU-GLY-ILE-LEU-ILE-LYS-LYS-LEU-LEU-ARG-GLN-GLN-ILE-ALA-PRO-ASP-VAL-ASP-THR-TYR-LYS-GLU-ILE-SER-TYR-PHE-VAL-ALA-GLU-PHE-ILE-MET-ASN-ASN-THR-GLY-GLU-TRP-ILE-ARG-GLN-ASN-GLY-GLY-TRP-GLU-ASN-GLY-PHE-VAL-LYS-LYS-PHE-GLU-PRO-LYS,ACE-ARG-ARG-VAL-VAL-GLN-ILE-ALA-ALA-GLY-LEU-ARG-ARG-ALA-GLY-ASP-GLN-LEU-GLU-LYS-TYR-GLY-NH2,152,23,,Kd=13.98nM,7.854493,7.85,1,A,A,0,M,T,0,,B,A,,1,1,152,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O,1.0079467296600342,0.7519359588623047,96.61213684082033,90.44580078125,0.3219286203384399,0.8680313229560852,0.942291021347046,0.8352758884429932,0.9484935998916626,0.7311009168624878,RRVVQIAAGLRRAGDQLEKYG,Moderate,"(7.523, 7.921]",val
6J9L,protein-peptide,A0Q5Y3 A0A425B3G2,SMASKNNIFNKYPTIIHGEARGENDEFVVHTRYPRFLARKSFDDNFTGEMPAKPVNGELGQIGEPRRLAYDSRLGLWLSDFIMLDNNKPKNMEDWLGQLKAACDRIAADDLMLNEDAADLEGWDD,SKDSYTLLMNNRTARRHQRRGIDRKQLVKRLFKLIWTEQLNLEWDKD,SER-MET-ALA-SER-LYS-ASN-ASN-ILE-PHE-ASN-LYS-TYR-PRO-THR-ILE-ILE-HIS-GLY-GLU-ALA-ARG-GLY-GLU-ASN-ASP-GLU-PHE-VAL-VAL-HIS-THR-ARG-TYR-PRO-ARG-PHE-LEU-ALA-ARG-LYS-SER-PHE-ASP-ASP-ASN-PHE-THR-GLY-GLU-MET-PRO-ALA-LYS-PRO-VAL-ASN-GLY-GLU-LEU-GLY-GLN-ILE-GLY-GLU-PRO-ARG-ARG-LEU-ALA-TYR-ASP-SER-ARG-LEU-GLY-LEU-TRP-LEU-SER-ASP-PHE-ILE-MET-LEU-ASP-ASN-ASN-LYS-PRO-LYS-ASN-MET-GLU-ASP-TRP-LEU-GLY-GLN-LEU-LYS-ALA-ALA-CYS-ASP-ARG-ILE-ALA-ALA-ASP-ASP-LEU-MET-LEU-ASN-GLU-ASP-ALA-ALA-ASP-LEU-GLU-GLY-TRP-ASP-ASP,SER-LYS-ASP-SER-TYR-THR-LEU-LEU-MET-ASN-ASN-ARG-THR-ALA-ARG-ARG-HIS-GLN-ARG-ARG-GLY-ILE-ASP-ARG-LYS-GLN-LEU-VAL-LYS-ARG-LEU-PHE-LYS-LEU-ILE-TRP-THR-GLU-GLN-LEU-ASN-LEU-GLU-TRP-ASP-LYS-ASP,125,47,,Kd=2115nM,5.67469,5.67,1,A,A,0,M,T,0,,E,A,dimer,1,1,125,47,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9614497423171996,0.5025006532669067,70.7134780883789,54.83829116821289,0.4952861070632934,1.5902605056762695,0.8475158214569092,0.5567977428436279,0.8046134114265442,0.4689263701438904,SKDSYTLLMNNRTARRHQRRGIDRKQLVKRLFKLIWTEQLNLEWDKD,Low,"(5.6, 5.699]",train
6IWA,protein-peptide,P52293 Q08379,GSHMNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSV,AKKKLREYQQRNSPGVPTGAKKKKKIKN,GLY-SER-HIS-MET-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL,ALA-LYS-LYS-LYS-LEU-ARG-GLU-TYR-GLN-GLN-ARG-ASN-SEP-PRO-GLY-VAL-PRO-THR-GLY-ALA-LYS-LYS-LYS-LYS-LYS-ILE-LYS-ASN,433,28,,Kd=126nM,6.899629,6.9,1,A,A,0,M,T,0,,A,C,,1,1,433,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8187642693519592,0.7335439920425415,91.4356918334961,89.87019348144531,0.3989932537078857,0.9287837147712708,0.9137130975723268,0.8504362106323242,0.7529987692832947,0.7043208479881287,AKKKLREYQQRNSPGVPTGAKKKKKIKN,Low,"(6.824, 7.049]",train
6IUA,protein-peptide,Q12888 P52293,GTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSV,SGKRKLITSEEERDPAKRGRKS,GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL,SER-GLY-LYS-ARG-LYS-LEU-ILE-THR-SER-GLU-GLU-GLU-ARG-ASP-PRO-ALA-LYS-ARG-GLY-ARG-LYS-SER,427,22,,Kd=2.0nM,8.69897,8.7,1,A,A,0,M,T,0,,B,A,,1,1,427,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.9120803475379944,0.8400799036026001,92.61520385742188,92.23609161376952,0.3327204287052154,0.6679399609565735,0.935989260673523,0.9066804051399232,0.8754794597625732,0.8234297633171082,SGKRKLITSEEERDPAKRGRKS,Moderate,"(8.383, 8.824]",train
6IU7,protein-peptide,Q12888 P52293,GTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSV,SGKRKLITSEEERSPAKRGRKS,GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL,SER-GLY-LYS-ARG-LYS-LEU-ILE-THR-SER-GLU-GLU-GLU-ARG-SER-PRO-ALA-LYS-ARG-GLY-ARG-LYS-SER,427,22,,Kd=0.9nM,9.045757,9.05,1,A,A,0,M,T,0,,B,A,,1,1,427,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.9212340712547302,0.8016194105148315,92.47250366210938,91.38264465332033,0.3318979144096374,0.7715075016021729,0.9370126724243164,0.89333176612854,0.8866657614707947,0.778691291809082,SGKRKLITSEEERSPAKRGRKS,High,"(8.824, 12.12]",train
6F0G,protein-peptide,Q9Y294,GAMAKVQVNNVVVLDNPSPFYNPFQFEITFECIEDLSEDLEWKIIYVGSAESEEYDQVLDSVLVGPVPAGRHMFVFQADAPNPGLIPDADAVGVTVVLITCTYRGQEFIRVGYYVNNEYTETELRENPPVKPDFSKLQRNILASNPRVTRFHINWEDN,ASTERKWAELARRIRGAGGVTLNGFG,GLY-ALA-MET-ALA-LYS-VAL-GLN-VAL-ASN-ASN-VAL-VAL-VAL-LEU-ASP-ASN-PRO-SER-PRO-PHE-TYR-ASN-PRO-PHE-GLN-PHE-GLU-ILE-THR-PHE-GLU-CYS-ILE-GLU-ASP-LEU-SER-GLU-ASP-LEU-GLU-TRP-LYS-ILE-ILE-TYR-VAL-GLY-SER-ALA-GLU-SER-GLU-GLU-TYR-ASP-GLN-VAL-LEU-ASP-SER-VAL-LEU-VAL-GLY-PRO-VAL-PRO-ALA-GLY-ARG-HIS-MET-PHE-VAL-PHE-GLN-ALA-ASP-ALA-PRO-ASN-PRO-GLY-LEU-ILE-PRO-ASP-ALA-ASP-ALA-VAL-GLY-VAL-THR-VAL-VAL-LEU-ILE-THR-CYS-THR-TYR-ARG-GLY-GLN-GLU-PHE-ILE-ARG-VAL-GLY-TYR-TYR-VAL-ASN-ASN-GLU-TYR-THR-GLU-THR-GLU-LEU-ARG-GLU-ASN-PRO-PRO-VAL-LYS-PRO-ASP-PHE-SER-LYS-LEU-GLN-ARG-ASN-ILE-LEU-ALA-SER-ASN-PRO-ARG-VAL-THR-ARG-PHE-HIS-ILE-ASN-TRP-GLU-ASP-ASN,ALA-SER-THR-GLU-ARG-LYS-TRP-ALA-GLU-LEU-ALA-ARG-ARG-ILE-ARG-GLY-ALA-GLY-GLY-VAL-THR-LEU-ASN-GLY-PHE-GLY,158,26,,Kd=0.055uM,7.259637,7.26,1,A,A,0,M,T,0,,C,A,,1,1,158,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,1.0016359090805054,0.6637172698974609,94.19458770751952,87.81556701660156,0.31939297914505,1.0075207948684692,0.9413193464279176,0.7756699323654175,0.9283998012542723,0.6357291340827942,ASTERKWAELARRIRGAGGVTLNGFG,Moderate,"(7.049, 7.268]",train
6F0F,protein-peptide,Q9Y294,GAMAKVQVNNVVVLDNPSPFYNPFQFEITFECIEDLSEDLEWKIIYVGSAESEEYDQVLDSVLVGPVPAGRHMFVFQADAPNPGLIPDADAVGVTVVLITCTYRGQEFIRVGYYVNNEYTETELRENPPVKPDFSKLQRNILASNPRVTRFHINWEDN,GAMGTLTPKEAELARRIRGAGGRTLNGFG,GLY-ALA-MET-ALA-LYS-VAL-GLN-VAL-ASN-ASN-VAL-VAL-VAL-LEU-ASP-ASN-PRO-SER-PRO-PHE-TYR-ASN-PRO-PHE-GLN-PHE-GLU-ILE-THR-PHE-GLU-CYS-ILE-GLU-ASP-LEU-SER-GLU-ASP-LEU-GLU-TRP-LYS-ILE-ILE-TYR-VAL-GLY-SER-ALA-GLU-SER-GLU-GLU-TYR-ASP-GLN-VAL-LEU-ASP-SER-VAL-LEU-VAL-GLY-PRO-VAL-PRO-ALA-GLY-ARG-HIS-MET-PHE-VAL-PHE-GLN-ALA-ASP-ALA-PRO-ASN-PRO-GLY-LEU-ILE-PRO-ASP-ALA-ASP-ALA-VAL-GLY-VAL-THR-VAL-VAL-LEU-ILE-THR-CYS-THR-TYR-ARG-GLY-GLN-GLU-PHE-ILE-ARG-VAL-GLY-TYR-TYR-VAL-ASN-ASN-GLU-TYR-THR-GLU-THR-GLU-LEU-ARG-GLU-ASN-PRO-PRO-VAL-LYS-PRO-ASP-PHE-SER-LYS-LEU-GLN-ARG-ASN-ILE-LEU-ALA-SER-ASN-PRO-ARG-VAL-THR-ARG-PHE-HIS-ILE-ASN-TRP-GLU-ASP-ASN,GLY-ALA-MET-GLY-THR-LEU-THR-PRO-LYS-GLU-ALA-GLU-LEU-ALA-ARG-ARG-ILE-ARG-GLY-ALA-GLY-GLY-ARG-THR-LEU-ASN-GLY-PHE-GLY,158,29,,Kd=0.18uM,6.744727,6.74,1,A,A,0,M,T,0,,B,A,,1,1,158,29,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,0.9637393951416016,0.6143451929092407,93.0672836303711,86.08663940429688,0.3439190089702606,1.1147764921188354,0.9274663925170898,0.7391313910484314,0.8758825063705444,0.5831486582756042,GAMGTLTPKEAELARRIRGAGGRTLNGFG,Low,"(6.696, 6.824]",train
7C41,protein-peptide,P01116 P53816,MTEYKLVVVGAVGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEHHHHHH,LYDVAGSDKY,MET-THR-GLU-TYR-LYS-LEU-VAL-VAL-VAL-GLY-ALA-VAL-GLY-VAL-GLY-LYS-SER-ALA-LEU-THR-ILE-GLN-LEU-ILE-GLN-ASN-HIS-PHE-VAL-ASP-GLU-TYR-ASP-PRO-THR-ILE-GLU-ASP-SER-TYR-ARG-LYS-GLN-VAL-VAL-ILE-ASP-GLY-GLU-THR-CYS-LEU-LEU-ASP-ILE-LEU-ASP-THR-ALA-GLY-GLN-GLU-GLU-TYR-SER-ALA-MET-ARG-ASP-GLN-TYR-MET-ARG-THR-GLY-GLU-GLY-PHE-LEU-CYS-VAL-PHE-ALA-ILE-ASN-ASN-THR-LYS-SER-PHE-GLU-ASP-ILE-HIS-HIS-TYR-ARG-GLU-GLN-ILE-LYS-ARG-VAL-LYS-ASP-SER-GLU-ASP-VAL-PRO-MET-VAL-LEU-VAL-GLY-ASN-LYS-CYS-ASP-LEU-PRO-SER-ARG-THR-VAL-ASP-THR-LYS-GLN-ALA-GLN-ASP-LEU-ALA-ARG-SER-TYR-GLY-ILE-PRO-PHE-ILE-GLU-THR-SER-ALA-LYS-THR-ARG-GLN-GLY-VAL-ASP-ASP-ALA-PHE-TYR-THR-LEU-VAL-ARG-GLU-ILE-ARG-LYS-HIS-LYS-GLU-HIS-HIS-HIS-HIS-HIS-HIS,LEU-TYR-ASP-VAL-ALA-GLY-SER-ASP-LYS-TYR,174,10,,Kd=30uM,4.522879,4.522878745,1,A,A,0,M,T,0,KRAS,D,A,,1,1,174,10,0,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.901402473449707,0.7614337205886841,90.5007781982422,83.08643341064453,0.3886450231075287,0.7685160040855408,0.9260901808738708,0.8675544261932373,0.86126309633255,0.7349035143852234,LYDVAGSDKY,Low,"(4.456, 4.606]",train
2GNG,protein-peptide,P00517 P63248,GNAAAAKKGSEQESVKEFLAKAKEDFLKKWENPAQNTAHLDQFERIKTIGTGSFGRVMLVKHMETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYMPGGDMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIKVADFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFSEF,TTYADFIASGRTGRRNAIHD,GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SEP-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-ASP-PHE-LEU-LYS-LYS-TRP-GLU-ASN-PRO-ALA-GLN-ASN-THR-ALA-HIS-LEU-ASP-GLN-PHE-GLU-ARG-ILE-LYS-THR-ILE-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-MET-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-MET-PRO-GLY-GLY-ASP-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SER-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-LYS-VAL-ALA-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-SER-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-ARG-ARG-ASN-ALA-ILE-HIS-ASP,350,20,,IC50=6uM,5.221849,5.22,1,M,S,0,A,A,0,,I,A,,0,1,350,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.963882327079773,0.737093985080719,89.30492401123047,79.09368133544922,0.3786134421825409,0.9779171943664552,0.9284417033195496,0.8635342121124268,0.927134335041046,0.6894124746322632,TTYADFIASGRTGRRNAIHD,Low,"(5.105, 5.222]",val
1CLV,protein-peptide,P56634 P80403,QKDANFASGRNSIVHLFEWKWNDIADECERFLQPQGFGGVQISPPNEYLVADGRPWWERYQPVSYIINTRSGDESAFTDMTRRCNDAGVRIYVDAVINHMTGMNGVGTSGSSADHDGMNYPAVPYGSGDFHSPCEVNNYQDADNVRNCELVGLRDLNQGSDYVRGVLIDYMNHMIDLGVAGFRVDAAKHMSPGDLSVIFSGLKNLNTDYGFADGARPFIYQEVIDLGGEAISKNEYTGFGCVLEFQFGVSLGNAFQGGNQLKNLANWGPEWGLLEGLDAVVFVDNHDNQRTGGSQILTYKNPKPYKMAIAFMLAHPYGTTRIMSSFDFTDNDQGPPQDGSGNLISPGINDDNTCSNGYVCEHRWRQVYGMVGFRNAVEGTQVENWWSNDDNQIAFSRGSQGFVAFTNGGDLNQNLNTGLPAGTYCDVISGELSGGSCTGKSVTVGDNGSADISLGSAEDDGVLAIHVNAKL,CIPKWNRCGPKMDGVPCCEPYTCTSDYYGNCS,PCA-LYS-ASP-ALA-ASN-PHE-ALA-SER-GLY-ARG-ASN-SER-ILE-VAL-HIS-LEU-PHE-GLU-TRP-LYS-TRP-ASN-ASP-ILE-ALA-ASP-GLU-CYS-GLU-ARG-PHE-LEU-GLN-PRO-GLN-GLY-PHE-GLY-GLY-VAL-GLN-ILE-SER-PRO-PRO-ASN-GLU-TYR-LEU-VAL-ALA-ASP-GLY-ARG-PRO-TRP-TRP-GLU-ARG-TYR-GLN-PRO-VAL-SER-TYR-ILE-ILE-ASN-THR-ARG-SER-GLY-ASP-GLU-SER-ALA-PHE-THR-ASP-MET-THR-ARG-ARG-CYS-ASN-ASP-ALA-GLY-VAL-ARG-ILE-TYR-VAL-ASP-ALA-VAL-ILE-ASN-HIS-MET-THR-GLY-MET-ASN-GLY-VAL-GLY-THR-SER-GLY-SER-SER-ALA-ASP-HIS-ASP-GLY-MET-ASN-TYR-PRO-ALA-VAL-PRO-TYR-GLY-SER-GLY-ASP-PHE-HIS-SER-PRO-CYS-GLU-VAL-ASN-ASN-TYR-GLN-ASP-ALA-ASP-ASN-VAL-ARG-ASN-CYS-GLU-LEU-VAL-GLY-LEU-ARG-ASP-LEU-ASN-GLN-GLY-SER-ASP-TYR-VAL-ARG-GLY-VAL-LEU-ILE-ASP-TYR-MET-ASN-HIS-MET-ILE-ASP-LEU-GLY-VAL-ALA-GLY-PHE-ARG-VAL-ASP-ALA-ALA-LYS-HIS-MET-SER-PRO-GLY-ASP-LEU-SER-VAL-ILE-PHE-SER-GLY-LEU-LYS-ASN-LEU-ASN-THR-ASP-TYR-GLY-PHE-ALA-ASP-GLY-ALA-ARG-PRO-PHE-ILE-TYR-GLN-GLU-VAL-ILE-ASP-LEU-GLY-GLY-GLU-ALA-ILE-SER-LYS-ASN-GLU-TYR-THR-GLY-PHE-GLY-CYS-VAL-LEU-GLU-PHE-GLN-PHE-GLY-VAL-SER-LEU-GLY-ASN-ALA-PHE-GLN-GLY-GLY-ASN-GLN-LEU-LYS-ASN-LEU-ALA-ASN-TRP-GLY-PRO-GLU-TRP-GLY-LEU-LEU-GLU-GLY-LEU-ASP-ALA-VAL-VAL-PHE-VAL-ASP-ASN-HIS-ASP-ASN-GLN-ARG-THR-GLY-GLY-SER-GLN-ILE-LEU-THR-TYR-LYS-ASN-PRO-LYS-PRO-TYR-LYS-MET-ALA-ILE-ALA-PHE-MET-LEU-ALA-HIS-PRO-TYR-GLY-THR-THR-ARG-ILE-MET-SER-SER-PHE-ASP-PHE-THR-ASP-ASN-ASP-GLN-GLY-PRO-PRO-GLN-ASP-GLY-SER-GLY-ASN-LEU-ILE-SER-PRO-GLY-ILE-ASN-ASP-ASP-ASN-THR-CYS-SER-ASN-GLY-TYR-VAL-CYS-GLU-HIS-ARG-TRP-ARG-GLN-VAL-TYR-GLY-MET-VAL-GLY-PHE-ARG-ASN-ALA-VAL-GLU-GLY-THR-GLN-VAL-GLU-ASN-TRP-TRP-SER-ASN-ASP-ASP-ASN-GLN-ILE-ALA-PHE-SER-ARG-GLY-SER-GLN-GLY-PHE-VAL-ALA-PHE-THR-ASN-GLY-GLY-ASP-LEU-ASN-GLN-ASN-LEU-ASN-THR-GLY-LEU-PRO-ALA-GLY-THR-TYR-CYS-ASP-VAL-ILE-SER-GLY-GLU-LEU-SER-GLY-GLY-SER-CYS-THR-GLY-LYS-SER-VAL-THR-VAL-GLY-ASP-ASN-GLY-SER-ALA-ASP-ILE-SER-LEU-GLY-SER-ALA-GLU-ASP-ASP-GLY-VAL-LEU-ALA-ILE-HIS-VAL-ASN-ALA-LYS-LEU,CYS-ILE-PRO-LYS-TRP-ASN-ARG-CYS-GLY-PRO-LYS-MET-ASP-GLY-VAL-PRO-CYS-CYS-GLU-PRO-TYR-THR-CYS-THR-SER-ASP-TYR-TYR-GLY-ASN-CYS-SER,471,32,,Kd=1nM,9.0,9.0,1,A,A,0,A,A,0,,I,A,,1,1,471,32,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.7739875912666321,0.6804608106613159,88.51242065429688,90.26643371582033,0.4338246881961822,1.0482035875320437,0.935048758983612,0.8497889041900635,0.7175692319869995,0.6381287574768066,CIPKWNRCGPKMDGVPCCEPYTCTSDYYGNCS,High,"(8.824, 12.12]",train
1EES,protein-peptide,Q61036 P60953,MQTIKCVVVGDGAVGKTCLLISYTTNKFPSEYVPTVFDNYAVTVMIGGEPYTLGLFDTAGQEDYDRLRPLSYPQTDVFLVCFSVVSPSSFENVKEKWVPEITHHCPKTPFLLVGTQIDLRDDPSTIEKLAKNKQKPITPETAEKLARDLKAVKYVECSALTQKGLKNVFDEAILAALE,GSKERPEISLPSDFEHTIHVGFDAVTGEFTGIPEQWARLLQTSNIT,MET-GLN-THR-ILE-LYS-CYS-VAL-VAL-VAL-GLY-ASP-GLY-ALA-VAL-GLY-LYS-THR-CYS-LEU-LEU-ILE-SER-TYR-THR-THR-ASN-LYS-PHE-PRO-SER-GLU-TYR-VAL-PRO-THR-VAL-PHE-ASP-ASN-TYR-ALA-VAL-THR-VAL-MET-ILE-GLY-GLY-GLU-PRO-TYR-THR-LEU-GLY-LEU-PHE-ASP-THR-ALA-GLY-GLN-GLU-ASP-TYR-ASP-ARG-LEU-ARG-PRO-LEU-SER-TYR-PRO-GLN-THR-ASP-VAL-PHE-LEU-VAL-CYS-PHE-SER-VAL-VAL-SER-PRO-SER-SER-PHE-GLU-ASN-VAL-LYS-GLU-LYS-TRP-VAL-PRO-GLU-ILE-THR-HIS-HIS-CYS-PRO-LYS-THR-PRO-PHE-LEU-LEU-VAL-GLY-THR-GLN-ILE-ASP-LEU-ARG-ASP-ASP-PRO-SER-THR-ILE-GLU-LYS-LEU-ALA-LYS-ASN-LYS-GLN-LYS-PRO-ILE-THR-PRO-GLU-THR-ALA-GLU-LYS-LEU-ALA-ARG-ASP-LEU-LYS-ALA-VAL-LYS-TYR-VAL-GLU-CYS-SER-ALA-LEU-THR-GLN-LYS-GLY-LEU-LYS-ASN-VAL-PHE-ASP-GLU-ALA-ILE-LEU-ALA-ALA-LEU-GLU,GLY-SER-LYS-GLU-ARG-PRO-GLU-ILE-SER-LEU-PRO-SER-ASP-PHE-GLU-HIS-THR-ILE-HIS-VAL-GLY-PHE-ASP-ALA-VAL-THR-GLY-GLU-PHE-THR-GLY-ILE-PRO-GLU-GLN-TRP-ALA-ARG-LEU-LEU-GLN-THR-SER-ASN-ILE-THR,178,46,,Kd=20nM,7.69897,7.7,1,A,A,0,A,A,0,,B,A,,1,1,178,46,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,0.7172475457191467,0.5646844506263733,61.89435958862305,69.5204086303711,0.5887507796287537,1.3515123128890991,0.7989478707313538,0.6710270643234253,0.6745010614395142,0.5380987524986267,GSKERPEISLPSDFEHTIHVGFDAVTGEFTGIPEQWARLLQTSNIT,Moderate,"(7.523, 7.921]",val
1G0V,protein-peptide,P01094 P07267,GGHDVPLTNYLNAQYYTDITLGTPPQNFKVILDTGSSNLWVPSNECGSLACFLHSKYDHEASSSYKANGTEFAIQYGTGSLEGYISQDTLSIGDLTIPKQDFAEATSEPGLTFAFGKFDGILGLGYDTISVDKVVPPFYNAIQQDLLDEKRFAFYLGDTSKDTENGGEATFGGIDESKFKGDITWLPVRRKAYWEVKFEGIGLGDEYAELESHGAAIDTGTSLITLPSGLAEMINAEIGAKKGSTGQYTLDCNTRDNLPDLIFNFNGYNFTIGPYDYTLEVSGSCISAITPMDFPEPVGPLAIVGDAFLRKYYSIYDLGNNAVGLAKAI,MNTDQQKVSEIFQSSKEKLQGDAMVVSDAFK,GLY-GLY-HIS-ASP-VAL-PRO-LEU-THR-ASN-TYR-LEU-ASN-ALA-GLN-TYR-TYR-THR-ASP-ILE-THR-LEU-GLY-THR-PRO-PRO-GLN-ASN-PHE-LYS-VAL-ILE-LEU-ASP-THR-GLY-SER-SER-ASN-LEU-TRP-VAL-PRO-SER-ASN-GLU-CYS-GLY-SER-LEU-ALA-CYS-PHE-LEU-HIS-SER-LYS-TYR-ASP-HIS-GLU-ALA-SER-SER-SER-TYR-LYS-ALA-ASN-GLY-THR-GLU-PHE-ALA-ILE-GLN-TYR-GLY-THR-GLY-SER-LEU-GLU-GLY-TYR-ILE-SER-GLN-ASP-THR-LEU-SER-ILE-GLY-ASP-LEU-THR-ILE-PRO-LYS-GLN-ASP-PHE-ALA-GLU-ALA-THR-SER-GLU-PRO-GLY-LEU-THR-PHE-ALA-PHE-GLY-LYS-PHE-ASP-GLY-ILE-LEU-GLY-LEU-GLY-TYR-ASP-THR-ILE-SER-VAL-ASP-LYS-VAL-VAL-PRO-PRO-PHE-TYR-ASN-ALA-ILE-GLN-GLN-ASP-LEU-LEU-ASP-GLU-LYS-ARG-PHE-ALA-PHE-TYR-LEU-GLY-ASP-THR-SER-LYS-ASP-THR-GLU-ASN-GLY-GLY-GLU-ALA-THR-PHE-GLY-GLY-ILE-ASP-GLU-SER-LYS-PHE-LYS-GLY-ASP-ILE-THR-TRP-LEU-PRO-VAL-ARG-ARG-LYS-ALA-TYR-TRP-GLU-VAL-LYS-PHE-GLU-GLY-ILE-GLY-LEU-GLY-ASP-GLU-TYR-ALA-GLU-LEU-GLU-SER-HIS-GLY-ALA-ALA-ILE-ASP-THR-GLY-THR-SER-LEU-ILE-THR-LEU-PRO-SER-GLY-LEU-ALA-GLU-MET-ILE-ASN-ALA-GLU-ILE-GLY-ALA-LYS-LYS-GLY-SER-THR-GLY-GLN-TYR-THR-LEU-ASP-CYS-ASN-THR-ARG-ASP-ASN-LEU-PRO-ASP-LEU-ILE-PHE-ASN-PHE-ASN-GLY-TYR-ASN-PHE-THR-ILE-GLY-PRO-TYR-ASP-TYR-THR-LEU-GLU-VAL-SER-GLY-SER-CYS-ILE-SER-ALA-ILE-THR-PRO-MET-ASP-PHE-PRO-GLU-PRO-VAL-GLY-PRO-LEU-ALA-ILE-VAL-GLY-ASP-ALA-PHE-LEU-ARG-LYS-TYR-TYR-SER-ILE-TYR-ASP-LEU-GLY-ASN-ASN-ALA-VAL-GLY-LEU-ALA-LYS-ALA-ILE,MET-ASN-THR-ASP-GLN-GLN-LYS-VAL-SER-GLU-ILE-PHE-GLN-SER-SER-LYS-GLU-LYS-LEU-GLN-GLY-ASP-ALA-MET-VAL-VAL-SER-ASP-ALA-PHE-LYS,329,31,,Ki=0.1nM,10.0,10.0,1,A,A,0,A,A,0,,B,A,,1,1,329,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O,0.9412022233009338,0.6610122919082642,93.10686492919922,83.43550109863281,0.3644927144050598,1.2644656896591189,0.9402506351470948,0.8120096325874329,0.9188706278800964,0.6232629418373108,MNTDQQKVSEIFQSSKEKLQGDAMVVSDAFK,High,"(8.824, 12.12]",val
1G5J,protein-peptide,Q92934 Q07817,MSMAMSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQERLE,NLWAAQRYGRELRRMSDEFVDSFKK,MET-SER-MET-ALA-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG-LEU-GLU,ASN-LEU-TRP-ALA-ALA-GLN-ARG-TYR-GLY-ARG-GLU-LEU-ARG-ARG-MET-SER-ASP-GLU-PHE-VAL-ASP-SER-PHE-LYS-LYS,175,25,,Kd=0.6nM,9.221849,9.22,1,A,A,0,A,A,0,,B,A,,1,1,175,25,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.994795262813568,0.7077948451042175,85.84658813476562,75.78128814697266,0.378543347120285,1.1263363361358645,0.9222709536552428,0.7453122138977051,0.9191763401031494,0.6269869208335876,NLWAAQRYGRELRRMSDEFVDSFKK,High,"(8.824, 12.12]",train
1GNG,protein-peptide,Q92837 P49841,MHHHHHHHHHHKVSRDKDGSKVTTVVATPGQGPDRPQEVSYTDTKVIGNGSFGVVYQAKLCDSGELVAIKKVLQDKRFKNRELQIMRKLDHCNIVRLRYFFYSSGEKKDEVYLNLVLDYVPETVYRVARHYSRAKQTLPVIYVKLYMYQLFRSLAYIHSFGICHRDIKPQNLLLDPDTAVLKLCDFGSAKQLVRGEPNVSYICSRYYRAPELIFGATDYTSSIDVWSAGCVLAELLLGQPIFPGDSGVDQLVEIIKVLGTPTREQIREMNPNYTEFKFPQIKAHPWTKVFRPRTPPEAIALCSRLLEYTPTARLTPLEACAHSFFDELRDPNVKLPNGRDTPALFNFTTQELSSNPPLATILIPPHARIQAAASTPTN,SQPETRTGDDDPHRLLQQLVLSGNLIKEAVRRLHSRRLQ,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LYS-VAL-SER-ARG-ASP-LYS-ASP-GLY-SER-LYS-VAL-THR-THR-VAL-VAL-ALA-THR-PRO-GLY-GLN-GLY-PRO-ASP-ARG-PRO-GLN-GLU-VAL-SER-TYR-THR-ASP-THR-LYS-VAL-ILE-GLY-ASN-GLY-SER-PHE-GLY-VAL-VAL-TYR-GLN-ALA-LYS-LEU-CYS-ASP-SER-GLY-GLU-LEU-VAL-ALA-ILE-LYS-LYS-VAL-LEU-GLN-ASP-LYS-ARG-PHE-LYS-ASN-ARG-GLU-LEU-GLN-ILE-MET-ARG-LYS-LEU-ASP-HIS-CYS-ASN-ILE-VAL-ARG-LEU-ARG-TYR-PHE-PHE-TYR-SER-SER-GLY-GLU-LYS-LYS-ASP-GLU-VAL-TYR-LEU-ASN-LEU-VAL-LEU-ASP-TYR-VAL-PRO-GLU-THR-VAL-TYR-ARG-VAL-ALA-ARG-HIS-TYR-SER-ARG-ALA-LYS-GLN-THR-LEU-PRO-VAL-ILE-TYR-VAL-LYS-LEU-TYR-MET-TYR-GLN-LEU-PHE-ARG-SER-LEU-ALA-TYR-ILE-HIS-SER-PHE-GLY-ILE-CYS-HIS-ARG-ASP-ILE-LYS-PRO-GLN-ASN-LEU-LEU-LEU-ASP-PRO-ASP-THR-ALA-VAL-LEU-LYS-LEU-CYS-ASP-PHE-GLY-SER-ALA-LYS-GLN-LEU-VAL-ARG-GLY-GLU-PRO-ASN-VAL-SER-PTR-ILE-CYS-SER-ARG-TYR-TYR-ARG-ALA-PRO-GLU-LEU-ILE-PHE-GLY-ALA-THR-ASP-TYR-THR-SER-SER-ILE-ASP-VAL-TRP-SER-ALA-GLY-CYS-VAL-LEU-ALA-GLU-LEU-LEU-LEU-GLY-GLN-PRO-ILE-PHE-PRO-GLY-ASP-SER-GLY-VAL-ASP-GLN-LEU-VAL-GLU-ILE-ILE-LYS-VAL-LEU-GLY-THR-PRO-THR-ARG-GLU-GLN-ILE-ARG-GLU-MET-ASN-PRO-ASN-TYR-THR-GLU-PHE-LYS-PHE-PRO-GLN-ILE-LYS-ALA-HIS-PRO-TRP-THR-LYS-VAL-PHE-ARG-PRO-ARG-THR-PRO-PRO-GLU-ALA-ILE-ALA-LEU-CYS-SER-ARG-LEU-LEU-GLU-TYR-THR-PRO-THR-ALA-ARG-LEU-THR-PRO-LEU-GLU-ALA-CYS-ALA-HIS-SER-PHE-PHE-ASP-GLU-LEU-ARG-ASP-PRO-ASN-VAL-LYS-LEU-PRO-ASN-GLY-ARG-ASP-THR-PRO-ALA-LEU-PHE-ASN-PHE-THR-THR-GLN-GLU-LEU-SER-SER-ASN-PRO-PRO-LEU-ALA-THR-ILE-LEU-ILE-PRO-PRO-HIS-ALA-ARG-ILE-GLN-ALA-ALA-ALA-SER-THR-PRO-THR-ASN,SER-GLN-PRO-GLU-THR-ARG-THR-GLY-ASP-ASP-ASP-PRO-HIS-ARG-LEU-LEU-GLN-GLN-LEU-VAL-LEU-SER-GLY-ASN-LEU-ILE-LYS-GLU-ALA-VAL-ARG-ARG-LEU-HIS-SER-ARG-ARG-LEU-GLN,378,39,,Kd=39nM,7.408935,7.41,1,A,A,0,A,A,0,,X,A,,1,1,378,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,0.7314799427986145,0.635129988193512,79.44102478027344,78.68305969238281,0.7137863039970398,1.4602925777435305,0.8527458310127258,0.757745623588562,0.6292210221290588,0.5714072585105896,SQPETRTGDDDPHRLLQQLVLSGNLIKEAVRRLHSRRLQ,Moderate,"(7.268, 7.523]",val
1J2J,protein-peptide,Q8BSL7 Q9UJY5,GSMRILMVGLDAAGKTTILYKLKLGEIVTTIPTIGFNVETVEYKNISFTVWDVGGLDKIRPLWRHYFQNTQGLIFVVDSNDRERVNEAREELMRMLAEDELRDAVLLVFANKQDLPNAMNAAEITDKLGLHSLRHRNWYIQATCATSGDGLYEGLDWLSNQLRNQK,NVIFEDEEKSKMLARLLKSSHPEDLRAANKLIKEMVQEDQKRMEK,GLY-SER-MET-ARG-ILE-LEU-MET-VAL-GLY-LEU-ASP-ALA-ALA-GLY-LYS-THR-THR-ILE-LEU-TYR-LYS-LEU-LYS-LEU-GLY-GLU-ILE-VAL-THR-THR-ILE-PRO-THR-ILE-GLY-PHE-ASN-VAL-GLU-THR-VAL-GLU-TYR-LYS-ASN-ILE-SER-PHE-THR-VAL-TRP-ASP-VAL-GLY-GLY-LEU-ASP-LYS-ILE-ARG-PRO-LEU-TRP-ARG-HIS-TYR-PHE-GLN-ASN-THR-GLN-GLY-LEU-ILE-PHE-VAL-VAL-ASP-SER-ASN-ASP-ARG-GLU-ARG-VAL-ASN-GLU-ALA-ARG-GLU-GLU-LEU-MET-ARG-MET-LEU-ALA-GLU-ASP-GLU-LEU-ARG-ASP-ALA-VAL-LEU-LEU-VAL-PHE-ALA-ASN-LYS-GLN-ASP-LEU-PRO-ASN-ALA-MET-ASN-ALA-ALA-GLU-ILE-THR-ASP-LYS-LEU-GLY-LEU-HIS-SER-LEU-ARG-HIS-ARG-ASN-TRP-TYR-ILE-GLN-ALA-THR-CYS-ALA-THR-SER-GLY-ASP-GLY-LEU-TYR-GLU-GLY-LEU-ASP-TRP-LEU-SER-ASN-GLN-LEU-ARG-ASN-GLN-LYS,ASN-VAL-ILE-PHE-GLU-ASP-GLU-GLU-LYS-SER-LYS-MET-LEU-ALA-ARG-LEU-LEU-LYS-SER-SER-HIS-PRO-GLU-ASP-LEU-ARG-ALA-ALA-ASN-LYS-LEU-ILE-LYS-GLU-MET-VAL-GLN-GLU-ASP-GLN-LYS-ARG-MET-GLU-LYS,166,45,,Kd=1.4uM,5.853872,5.85,1,A,A,0,A,A,0,,B,A,,1,1,166,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,0.8213036060333252,,83.90277862548828,,0.3973692953586578,,0.9038493633270264,,0.8006671667098999,,NVIFEDEEKSKMLARLLKSSHPEDLRAANKLIKEMVQEDQKRMEK,Low,"(5.821, 5.959]",train
1JSP,protein-peptide,Q92793 P04637,GSHMRKKIFKPEELRQALMPTLEALYRQDPESLPFRQPVDPQLLGIPDYFDIVKNPMDLSTIKRKLDTGQYQEPWQYVDDVWLMFNNAWLYNRKTSRVYKFCSKLAEVFEQEIDPVMQSLG,SHLKSKKGQSTSRHKKLMFK,GLY-SER-HIS-MET-ARG-LYS-LYS-ILE-PHE-LYS-PRO-GLU-GLU-LEU-ARG-GLN-ALA-LEU-MET-PRO-THR-LEU-GLU-ALA-LEU-TYR-ARG-GLN-ASP-PRO-GLU-SER-LEU-PRO-PHE-ARG-GLN-PRO-VAL-ASP-PRO-GLN-LEU-LEU-GLY-ILE-PRO-ASP-TYR-PHE-ASP-ILE-VAL-LYS-ASN-PRO-MET-ASP-LEU-SER-THR-ILE-LYS-ARG-LYS-LEU-ASP-THR-GLY-GLN-TYR-GLN-GLU-PRO-TRP-GLN-TYR-VAL-ASP-ASP-VAL-TRP-LEU-MET-PHE-ASN-ASN-ALA-TRP-LEU-TYR-ASN-ARG-LYS-THR-SER-ARG-VAL-TYR-LYS-PHE-CYS-SER-LYS-LEU-ALA-GLU-VAL-PHE-GLU-GLN-GLU-ILE-ASP-PRO-VAL-MET-GLN-SER-LEU-GLY,SER-HIS-LEU-LYS-SER-LYS-LYS-GLY-GLN-SER-THR-SER-ARG-HIS-LYS-ALY-LEU-MET-PHE-LYS,121,20,,Kd=50uM,4.30103,4.3,1,A,A,0,A,A,0,,A,B,,1,1,121,20,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.859032154083252,0.5479798316955566,73.87078094482422,78.70724487304688,0.3584924638271332,1.184897780418396,0.9016863107681274,0.6909568309783936,0.7375530004501343,0.5122355222702026,SHLKSKKGQSTSRHKKLMFK,Low,"(4.155, 4.319]",train
1LJ2,protein-peptide,Q04637 P03536,MHSLQNVIPQQQAHIAELQVYNNKLERDLQNKIGSLTSSIEWYLRSMELDPEIKADIEQQINSIDAINPLHAFDDLESVIRNLISDYDKLFLMFKGLIQRSNYQYSFGSE,APKRERKTIRIRDPNQGGKDITEEIMSG,MET-HIS-SER-LEU-GLN-ASN-VAL-ILE-PRO-GLN-GLN-GLN-ALA-HIS-ILE-ALA-GLU-LEU-GLN-VAL-TYR-ASN-ASN-LYS-LEU-GLU-ARG-ASP-LEU-GLN-ASN-LYS-ILE-GLY-SER-LEU-THR-SER-SER-ILE-GLU-TRP-TYR-LEU-ARG-SER-MET-GLU-LEU-ASP-PRO-GLU-ILE-LYS-ALA-ASP-ILE-GLU-GLN-GLN-ILE-ASN-SER-ILE-ASP-ALA-ILE-ASN-PRO-LEU-HIS-ALA-PHE-ASP-ASP-LEU-GLU-SER-VAL-ILE-ARG-ASN-LEU-ILE-SER-ASP-TYR-ASP-LYS-LEU-PHE-LEU-MET-PHE-LYS-GLY-LEU-ILE-GLN-ARG-SER-ASN-TYR-GLN-TYR-SER-PHE-GLY-SER-GLU,ALA-PRO-LYS-ARG-GLU-ARG-LYS-THR-ILE-ARG-ILE-ARG-ASP-PRO-ASN-GLN-GLY-GLY-LYS-ASP-ILE-THR-GLU-GLU-ILE-MET-SER-GLY,110,28,,Kd=27uM,4.568636,4.57,1,A,A,0,A,A,0,,C,A,dimer,1,1,110,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.8057816028594971,0.4457307457923889,70.7662582397461,67.89327239990234,0.6062149405479431,1.5887349843978882,0.6733425259590149,0.4774955213069916,0.6577318906784058,0.3696077167987823,APKRERKTIRIRDPNQGGKDITEEIMSG,Low,"(4.456, 4.606]",train
1M5N,protein-peptide,Q14974 P12272,MELITILEKTVSPDRLELEAAQKFLERAAVENLPTFLVELSRVLANPGNSQVARVAAGLQIKNSLTSKDPDIKAQYQQRWLAIDANARREVKNYVLQTLGTETYRPSSASQCVAGIACAEIPVNQWPELIPQLVANVTNPNSTEHMKESTLEAIGYICQDIDPEQLQDKSNEILTAIIQGMRKEEPSNNVKLAATNALLNSLEFTKANFDKESERHFIMQVVCEATQCPDTRVRVAALQNLVKIMSLYYQYMETYMGPALFAITIEAMKSDIDEVALQGIEFWSNVCDEEMDLAIEASEAAEQGRPPEHTSKFYAKGALQYLVPILTQTLTKQDENDDDDDWNPCKAAGVCLMLLATCCEDDIVPHVLPFIKEHIKNPDWRYRDAAVMAFGCILEGPEPSQLKPLVIQAMPTLIELMKDPSVVVRDTAAWTVGRICELLPEAAINDVYLAPLLQCLIEGLSAEPRVASNVCWAFSSLAEAAYEAA,YLTQETNKVETYKEQPLKTPGKKKKGKP,MET-GLU-LEU-ILE-THR-ILE-LEU-GLU-LYS-THR-VAL-SER-PRO-ASP-ARG-LEU-GLU-LEU-GLU-ALA-ALA-GLN-LYS-PHE-LEU-GLU-ARG-ALA-ALA-VAL-GLU-ASN-LEU-PRO-THR-PHE-LEU-VAL-GLU-LEU-SER-ARG-VAL-LEU-ALA-ASN-PRO-GLY-ASN-SER-GLN-VAL-ALA-ARG-VAL-ALA-ALA-GLY-LEU-GLN-ILE-LYS-ASN-SER-LEU-THR-SER-LYS-ASP-PRO-ASP-ILE-LYS-ALA-GLN-TYR-GLN-GLN-ARG-TRP-LEU-ALA-ILE-ASP-ALA-ASN-ALA-ARG-ARG-GLU-VAL-LYS-ASN-TYR-VAL-LEU-GLN-THR-LEU-GLY-THR-GLU-THR-TYR-ARG-PRO-SER-SER-ALA-SER-GLN-CYS-VAL-ALA-GLY-ILE-ALA-CYS-ALA-GLU-ILE-PRO-VAL-ASN-GLN-TRP-PRO-GLU-LEU-ILE-PRO-GLN-LEU-VAL-ALA-ASN-VAL-THR-ASN-PRO-ASN-SER-THR-GLU-HIS-MET-LYS-GLU-SER-THR-LEU-GLU-ALA-ILE-GLY-TYR-ILE-CYS-GLN-ASP-ILE-ASP-PRO-GLU-GLN-LEU-GLN-ASP-LYS-SER-ASN-GLU-ILE-LEU-THR-ALA-ILE-ILE-GLN-GLY-MET-ARG-LYS-GLU-GLU-PRO-SER-ASN-ASN-VAL-LYS-LEU-ALA-ALA-THR-ASN-ALA-LEU-LEU-ASN-SER-LEU-GLU-PHE-THR-LYS-ALA-ASN-PHE-ASP-LYS-GLU-SER-GLU-ARG-HIS-PHE-ILE-MET-GLN-VAL-VAL-CYS-GLU-ALA-THR-GLN-CYS-PRO-ASP-THR-ARG-VAL-ARG-VAL-ALA-ALA-LEU-GLN-ASN-LEU-VAL-LYS-ILE-MET-SER-LEU-TYR-TYR-GLN-TYR-MET-GLU-THR-TYR-MET-GLY-PRO-ALA-LEU-PHE-ALA-ILE-THR-ILE-GLU-ALA-MET-LYS-SER-ASP-ILE-ASP-GLU-VAL-ALA-LEU-GLN-GLY-ILE-GLU-PHE-TRP-SER-ASN-VAL-CYS-ASP-GLU-GLU-MET-ASP-LEU-ALA-ILE-GLU-ALA-SER-GLU-ALA-ALA-GLU-GLN-GLY-ARG-PRO-PRO-GLU-HIS-THR-SER-LYS-PHE-TYR-ALA-LYS-GLY-ALA-LEU-GLN-TYR-LEU-VAL-PRO-ILE-LEU-THR-GLN-THR-LEU-THR-LYS-GLN-ASP-GLU-ASN-ASP-ASP-ASP-ASP-ASP-TRP-ASN-PRO-CYS-LYS-ALA-ALA-GLY-VAL-CYS-LEU-MET-LEU-LEU-ALA-THR-CYS-CYS-GLU-ASP-ASP-ILE-VAL-PRO-HIS-VAL-LEU-PRO-PHE-ILE-LYS-GLU-HIS-ILE-LYS-ASN-PRO-ASP-TRP-ARG-TYR-ARG-ASP-ALA-ALA-VAL-MET-ALA-PHE-GLY-CYS-ILE-LEU-GLU-GLY-PRO-GLU-PRO-SER-GLN-LEU-LYS-PRO-LEU-VAL-ILE-GLN-ALA-MET-PRO-THR-LEU-ILE-GLU-LEU-MET-LYS-ASP-PRO-SER-VAL-VAL-VAL-ARG-ASP-THR-ALA-ALA-TRP-THR-VAL-GLY-ARG-ILE-CYS-GLU-LEU-LEU-PRO-GLU-ALA-ALA-ILE-ASN-ASP-VAL-TYR-LEU-ALA-PRO-LEU-LEU-GLN-CYS-LEU-ILE-GLU-GLY-LEU-SER-ALA-GLU-PRO-ARG-VAL-ALA-SER-ASN-VAL-CYS-TRP-ALA-PHE-SER-SER-LEU-ALA-GLU-ALA-ALA-TYR-GLU-ALA-ALA,TYR-LEU-THR-GLN-GLU-THR-ASN-LYS-VAL-GLU-THR-TYR-LYS-GLU-GLN-PRO-LEU-LYS-THR-PRO-GLY-LYS-LYS-LYS-LYS-GLY-LYS-PRO,485,28,,Kd=2.1nM,8.677781,8.68,1,A,A,0,A,A,0,,Q,S,,1,1,485,28,0,CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.7005742192268372,0.6149787306785583,84.07860565185547,75.87598419189453,0.4923759400844574,1.326608419418335,0.8803902268409729,0.794460117816925,0.6215071082115173,0.5701083540916443,YLTQETNKVETYKEQPLKTPGKKKKGKP,Moderate,"(8.383, 8.824]",train
1MCV,protein-peptide,P00772,VVGGTEAQRNSWPSQISLQYRSGSSWAHTCGGTLIRQNWVMTAAHCVDRELTFRVVVGEHNLNQNDGTEQYVGVQKIVVHPYWNTDDVAAGYDIALLRLAQSVTLNSYVQLGVLPRAGTILANNSPCYITGWGLTRTNGQLAQTLQQAYLPTVDYAICSSSSYWGSTVKNSMVCAGGDGVRSGCQGDSGGPLHCLVNGQYAVHGVTSFVSRLGCNVTRKPTVFTRVSAYISWINNVIASN,PCTLEYMRCKQDSDCLAGCVCGPNGFCG,VAL-VAL-GLY-GLY-THR-GLU-ALA-GLN-ARG-ASN-SER-TRP-PRO-SER-GLN-ILE-SER-LEU-GLN-TYR-ARG-SER-GLY-SER-SER-TRP-ALA-HIS-THR-CYS-GLY-GLY-THR-LEU-ILE-ARG-GLN-ASN-TRP-VAL-MET-THR-ALA-ALA-HIS-CYS-VAL-ASP-ARG-GLU-LEU-THR-PHE-ARG-VAL-VAL-VAL-GLY-GLU-HIS-ASN-LEU-ASN-GLN-ASN-ASP-GLY-THR-GLU-GLN-TYR-VAL-GLY-VAL-GLN-LYS-ILE-VAL-VAL-HIS-PRO-TYR-TRP-ASN-THR-ASP-ASP-VAL-ALA-ALA-GLY-TYR-ASP-ILE-ALA-LEU-LEU-ARG-LEU-ALA-GLN-SER-VAL-THR-LEU-ASN-SER-TYR-VAL-GLN-LEU-GLY-VAL-LEU-PRO-ARG-ALA-GLY-THR-ILE-LEU-ALA-ASN-ASN-SER-PRO-CYS-TYR-ILE-THR-GLY-TRP-GLY-LEU-THR-ARG-THR-ASN-GLY-GLN-LEU-ALA-GLN-THR-LEU-GLN-GLN-ALA-TYR-LEU-PRO-THR-VAL-ASP-TYR-ALA-ILE-CYS-SER-SER-SER-SER-TYR-TRP-GLY-SER-THR-VAL-LYS-ASN-SER-MET-VAL-CYS-ALA-GLY-GLY-ASP-GLY-VAL-ARG-SER-GLY-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-HIS-CYS-LEU-VAL-ASN-GLY-GLN-TYR-ALA-VAL-HIS-GLY-VAL-THR-SER-PHE-VAL-SER-ARG-LEU-GLY-CYS-ASN-VAL-THR-ARG-LYS-PRO-THR-VAL-PHE-THR-ARG-VAL-SER-ALA-TYR-ILE-SER-TRP-ILE-ASN-ASN-VAL-ILE-ALA-SER-ASN,PRO-CYS-THR-LEU-GLU-TYR-MET-ARG-CYS-LYS-GLN-ASP-SER-ASP-CYS-LEU-ALA-GLY-CYS-VAL-CYS-GLY-PRO-ASN-GLY-PHE-CYS-GLY,240,28,,Ki=98nM,7.008774,7.01,1,A,A,0,A,A,0,,I,A,,1,1,240,28,0,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O,0.7757982015609741,0.6525619626045227,87.82960510253906,89.54145812988281,0.4627130031585693,1.067477822303772,0.9275513291358948,0.8016321659088135,0.7215352654457092,0.6152943968772888,PCTLEYMRCKQDSDCLAGCVCGPNGFCG,Moderate,"(6.824, 7.049]",train
1MXE,protein-peptide,P62152 Q63450,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGFISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVTMMTSK,IKKNFAKSKWKQAFNATAVVRHMRK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-PHE-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-THR-MET-MET-THR-SER-LYS,ILE-LYS-LYS-ASN-PHE-ALA-LYS-SER-LYS-TRP-LYS-GLN-ALA-PHE-ASN-ALA-THR-ALA-VAL-VAL-ARG-HIS-MET-ARG-LYS,148,25,,Kd=1pM,12.0,12.0,1,A,A,0,A,A,0,,E,A,,1,1,148,25,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)O)C(=O)O,0.9332124590873718,0.6204880475997925,77.3629379272461,54.55242538452149,0.4000907242298126,1.331744909286499,0.8668534159660339,0.6732663512229919,0.8594843149185181,0.5946245789527893,IKKNFAKSKWKQAFNATAVVRHMRK,High,"(8.824, 12.12]",train
1MZW,protein-peptide,O43172 O43447,MAVANSSPVNPVVFFDVSIGGQEVGRMKIELFADVVPKTAENFRQFCTGEFRKDGVPIGYKGSTFHRVIKDFMIQGGDFVNGDGTGVASIYRGPFADENFKLRHSAPGLLSMANSGPSTNGCQFFITCSKCDWLDGKHVVFGKIIDGLLVMRKIENVPTGPNNKPKLPVVISQCGEM,EVKASLRALGEPITLFGEGPAERRERLRNIL,MET-ALA-VAL-ALA-ASN-SER-SER-PRO-VAL-ASN-PRO-VAL-VAL-PHE-PHE-ASP-VAL-SER-ILE-GLY-GLY-GLN-GLU-VAL-GLY-ARG-MET-LYS-ILE-GLU-LEU-PHE-ALA-ASP-VAL-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-GLN-PHE-CYS-THR-GLY-GLU-PHE-ARG-LYS-ASP-GLY-VAL-PRO-ILE-GLY-TYR-LYS-GLY-SER-THR-PHE-HIS-ARG-VAL-ILE-LYS-ASP-PHE-MET-ILE-GLN-GLY-GLY-ASP-PHE-VAL-ASN-GLY-ASP-GLY-THR-GLY-VAL-ALA-SER-ILE-TYR-ARG-GLY-PRO-PHE-ALA-ASP-GLU-ASN-PHE-LYS-LEU-ARG-HIS-SER-ALA-PRO-GLY-LEU-LEU-SER-MET-ALA-ASN-SER-GLY-PRO-SER-THR-ASN-GLY-CYS-GLN-PHE-PHE-ILE-THR-CYS-SER-LYS-CYS-ASP-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-ILE-ILE-ASP-GLY-LEU-LEU-VAL-MET-ARG-LYS-ILE-GLU-ASN-VAL-PRO-THR-GLY-PRO-ASN-ASN-LYS-PRO-LYS-LEU-PRO-VAL-VAL-ILE-SER-GLN-CYS-GLY-GLU-MET,GLU-VAL-LYS-ALA-SER-LEU-ARG-ALA-LEU-GLY-GLU-PRO-ILE-THR-LEU-PHE-GLY-GLU-GLY-PRO-ALA-GLU-ARG-ARG-GLU-ARG-LEU-ARG-ASN-ILE-LEU,177,31,,Kd=1.97uM,5.705534,5.71,1,A,A,0,A,A,0,,B,A,,1,1,177,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,0.8777844309806824,0.6254346370697021,90.03313446044922,82.97928619384766,0.3622661828994751,1.0586555004119873,0.9259130954742432,0.7309430241584778,0.8597425818443298,0.5814021825790405,EVKASLRALGEPITLFGEGPAERRERLRNIL,Low,"(5.699, 5.821]",train
1O9A,protein-peptide,Q53971 P02751,SKPGCYDNGKHYQINQQWERTYLGNALVCTCYGGSRGFNCESKPEAEETCFDKYTGNTYRVGDTYERPKDSMIWDCTCIGAGRGRISCTIANR,EESLPTEQGQSGSTTEVEDSKPKLSIHFDNEWPKED,SER-LYS-PRO-GLY-CYS-TYR-ASP-ASN-GLY-LYS-HIS-TYR-GLN-ILE-ASN-GLN-GLN-TRP-GLU-ARG-THR-TYR-LEU-GLY-ASN-ALA-LEU-VAL-CYS-THR-CYS-TYR-GLY-GLY-SER-ARG-GLY-PHE-ASN-CYS-GLU-SER-LYS-PRO-GLU-ALA-GLU-GLU-THR-CYS-PHE-ASP-LYS-TYR-THR-GLY-ASN-THR-TYR-ARG-VAL-GLY-ASP-THR-TYR-GLU-ARG-PRO-LYS-ASP-SER-MET-ILE-TRP-ASP-CYS-THR-CYS-ILE-GLY-ALA-GLY-ARG-GLY-ARG-ILE-SER-CYS-THR-ILE-ALA-ASN-ARG,GLU-GLU-SER-LEU-PRO-THR-GLU-GLN-GLY-GLN-SER-GLY-SER-THR-THR-GLU-VAL-GLU-ASP-SER-LYS-PRO-LYS-LEU-SER-ILE-HIS-PHE-ASP-ASN-GLU-TRP-PRO-LYS-GLU-ASP,93,36,,Kd=1uM,6.0,6.0,1,A,A,0,A,A,0,,B,A,,1,1,93,36,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.7660843133926392,0.4966492652893066,75.0577392578125,57.45736312866211,0.5758379101753235,1.321338415145874,0.657778263092041,0.5516759157180786,0.6187422275543213,0.4828926026821136,EESLPTEQGQSGSTTEVEDSKPKLSIHFDNEWPKED,Low,"(5.959, 6.097]",val
1OZS,protein-peptide,P19429 P63316,MKGKSEEELSDLFRMFDKNADGYIDLEELKIMLQATGETITEDDIEELMKDGDKNNDGRIDYDEFLEFMKGVE,TQKIFDLRGKFKRPTLRRVR,MET-LYS-GLY-LYS-SER-GLU-GLU-GLU-LEU-SER-ASP-LEU-PHE-ARG-MET-PHE-ASP-LYS-ASN-ALA-ASP-GLY-TYR-ILE-ASP-LEU-GLU-GLU-LEU-LYS-ILE-MET-LEU-GLN-ALA-THR-GLY-GLU-THR-ILE-THR-GLU-ASP-ASP-ILE-GLU-GLU-LEU-MET-LYS-ASP-GLY-ASP-LYS-ASN-ASN-ASP-GLY-ARG-ILE-ASP-TYR-ASP-GLU-PHE-LEU-GLU-PHE-MET-LYS-GLY-VAL-GLU,THR-GLN-LYS-ILE-PHE-ASP-LEU-ARG-GLY-LYS-PHE-LYS-ARG-PRO-THR-LEU-ARG-ARG-VAL-ARG,73,20,,Kd=31uM,4.508638,4.51,1,A,A,0,A,A,0,,B,A,,1,1,73,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.8770300149917603,0.6373258233070374,87.49942779541016,74.60195922851562,0.4068953990936279,0.9419330954551696,0.8269556760787964,0.7014271020889282,0.755139946937561,0.6213005185127258,TQKIFDLRGKFKRPTLRRVR,Low,"(4.456, 4.606]",val
1P9D,protein-peptide,P54725 P55036,MAVTITLKTLQQQTFKIRMEPDETVKVLKEKIEAEKGRDAFPVAGQKLIYAGKILSDDVPIRDYRIDEKNFVVVMVTK,MTISQQEFGRTGLPDLSSMTEEEQIAYAMQMSLQGAEFGQAESAD,MET-ALA-VAL-THR-ILE-THR-LEU-LYS-THR-LEU-GLN-GLN-GLN-THR-PHE-LYS-ILE-ARG-MET-GLU-PRO-ASP-GLU-THR-VAL-LYS-VAL-LEU-LYS-GLU-LYS-ILE-GLU-ALA-GLU-LYS-GLY-ARG-ASP-ALA-PHE-PRO-VAL-ALA-GLY-GLN-LYS-LEU-ILE-TYR-ALA-GLY-LYS-ILE-LEU-SER-ASP-ASP-VAL-PRO-ILE-ARG-ASP-TYR-ARG-ILE-ASP-GLU-LYS-ASN-PHE-VAL-VAL-VAL-MET-VAL-THR-LYS,MET-THR-ILE-SER-GLN-GLN-GLU-PHE-GLY-ARG-THR-GLY-LEU-PRO-ASP-LEU-SER-SER-MET-THR-GLU-GLU-GLU-GLN-ILE-ALA-TYR-ALA-MET-GLN-MET-SER-LEU-GLN-GLY-ALA-GLU-PHE-GLY-GLN-ALA-GLU-SER-ALA-ASP,78,45,,Kd=12.9uM,4.88941,4.89,1,A,A,0,A,A,0,,S,U,,1,1,78,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCSC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9259672164916992,0.5073263049125671,78.1968002319336,69.75408935546875,0.4106578826904297,1.5432279109954834,0.8527745008468628,0.5761070847511292,0.8121514916419983,0.4901311099529266,MTISQQEFGRTGLPDLSSMTEEEQIAYAMQMSLQGAEFGQAESAD,Low,"(4.866, 5.014]",train
1PD7,protein-peptide,Q05195 Q62141,ESDSVEFNNAISYVNKIKTRFLDHPEIYRSFLEILHTYQKEQLHTKGRPFRGMSEEEVFTEVANLFRGQEDLLSEFGQFLPEAKR,VRMNIQMLLEAADYLERREREAEH,GLU-SER-ASP-SER-VAL-GLU-PHE-ASN-ASN-ALA-ILE-SER-TYR-VAL-ASN-LYS-ILE-LYS-THR-ARG-PHE-LEU-ASP-HIS-PRO-GLU-ILE-TYR-ARG-SER-PHE-LEU-GLU-ILE-LEU-HIS-THR-TYR-GLN-LYS-GLU-GLN-LEU-HIS-THR-LYS-GLY-ARG-PRO-PHE-ARG-GLY-MET-SER-GLU-GLU-GLU-VAL-PHE-THR-GLU-VAL-ALA-ASN-LEU-PHE-ARG-GLY-GLN-GLU-ASP-LEU-LEU-SER-GLU-PHE-GLY-GLN-PHE-LEU-PRO-GLU-ALA-LYS-ARG,VAL-ARG-MET-ASN-ILE-GLN-MET-LEU-LEU-GLU-ALA-ALA-ASP-TYR-LEU-GLU-ARG-ARG-GLU-ARG-GLU-ALA-GLU-HIS,85,24,,Kd=0.3uM,6.522879,6.52,1,A,A,0,A,A,0,,B,A,,1,1,85,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,0.9881937503814696,0.6985002756118774,93.64095306396484,80.32874298095703,0.3661929965019226,0.9088812470436096,0.8730244636535645,0.7514833211898804,0.8793714046478271,0.6852544546127319,VRMNIQMLLEAADYLERREREAEH,Low,"(6.398, 6.523]",val
1PSB,protein-peptide,P02638 Q15208,SELEKAVVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDSDGDGECDFQEFMAFVAMITTACHEFFEHE,KRLRRSAHARKETEFLRLKRTRLGLE,SER-GLU-LEU-GLU-LYS-ALA-VAL-VAL-ALA-LEU-ILE-ASP-VAL-PHE-HIS-GLN-TYR-SER-GLY-ARG-GLU-GLY-ASP-LYS-HIS-LYS-LEU-LYS-LYS-SER-GLU-LEU-LYS-GLU-LEU-ILE-ASN-ASN-GLU-LEU-SER-HIS-PHE-LEU-GLU-GLU-ILE-LYS-GLU-GLN-GLU-VAL-VAL-ASP-LYS-VAL-MET-GLU-THR-LEU-ASP-SER-ASP-GLY-ASP-GLY-GLU-CYS-ASP-PHE-GLN-GLU-PHE-MET-ALA-PHE-VAL-ALA-MET-ILE-THR-THR-ALA-CYS-HIS-GLU-PHE-PHE-GLU-HIS-GLU,LYS-ARG-LEU-ARG-ARG-SER-ALA-HIS-ALA-ARG-LYS-GLU-THR-GLU-PHE-LEU-ARG-LEU-LYS-ARG-THR-ARG-LEU-GLY-LEU-GLU,91,26,,Kd=20uM,4.69897,4.7,1,A,A,0,A,A,0,,C,A,,1,1,91,26,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.8951535224914551,0.6687358617782593,79.16404724121094,71.84314727783203,0.3781862556934356,0.9368441104888916,0.868990957736969,0.733361005783081,0.7628052234649658,0.6525796055793762,KRLRRSAHARKETEFLRLKRTRLGLE,Low,"(4.606, 4.745]",train
1SYQ,protein-peptide,P18206 Q9Y490,HHHHHHMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,PLLQAAKGLAGAVSELLRSAQPASA,HIS-HIS-HIS-HIS-HIS-HIS-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,PRO-LEU-LEU-GLN-ALA-ALA-LYS-GLY-LEU-ALA-GLY-ALA-VAL-SER-GLU-LEU-LEU-ARG-SER-ALA-GLN-PRO-ALA-SER-ALA,264,25,,Kd=14.7nM,7.832683,7.83,1,A,A,0,A,A,0,,B,A,,1,1,264,25,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9425581693649292,0.6172860860824585,85.4634017944336,79.00047302246094,0.4203736782073974,1.2737537622451782,0.8657468557357788,0.7407926917076111,0.907695174217224,0.5864094495773315,PLLQAAKGLAGAVSELLRSAQPASA,Moderate,"(7.523, 7.921]",train
1T01,protein-peptide,P12003 P26039,AMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVSAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVRAAQMLQADPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNTKSQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWD,GRPLLQAAKGLAGAVSELLRSAQP,ALA-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-SER-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-ARG-ALA-ALA-GLN-MET-LEU-GLN-ALA-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-THR-LYS-SER-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP,GLY-ARG-PRO-LEU-LEU-GLN-ALA-ALA-LYS-GLY-LEU-ALA-GLY-ALA-VAL-SER-GLU-LEU-LEU-ARG-SER-ALA-GLN-PRO,255,24,,Kd=39nM,7.408935,7.41,1,A,A,0,A,A,0,,B,A,,1,1,255,24,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9826093316078186,0.6510021686553955,93.14321899414062,81.80784606933594,0.3512664139270782,1.2174158096313477,0.9013267159461976,0.777108907699585,0.949166476726532,0.6194754838943481,GRPLLQAAKGLAGAVSELLRSAQP,Moderate,"(7.268, 7.523]",val
1UEL,protein-peptide,P54727 P55036,MQVTLKTLQQQTFKIDIDPEETVKALKEKIESEKGKDAFPVAGQKLIYAGKILNDDTALKEYKIDEKNFVVVMVTKPKAVSTPAPATLEHHHHHH,GSHMTISQQEFGRTGLPDLSSMTEEEQIAYAMQMSLQGAEFGQAESAD,MET-GLN-VAL-THR-LEU-LYS-THR-LEU-GLN-GLN-GLN-THR-PHE-LYS-ILE-ASP-ILE-ASP-PRO-GLU-GLU-THR-VAL-LYS-ALA-LEU-LYS-GLU-LYS-ILE-GLU-SER-GLU-LYS-GLY-LYS-ASP-ALA-PHE-PRO-VAL-ALA-GLY-GLN-LYS-LEU-ILE-TYR-ALA-GLY-LYS-ILE-LEU-ASN-ASP-ASP-THR-ALA-LEU-LYS-GLU-TYR-LYS-ILE-ASP-GLU-LYS-ASN-PHE-VAL-VAL-VAL-MET-VAL-THR-LYS-PRO-LYS-ALA-VAL-SER-THR-PRO-ALA-PRO-ALA-THR-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-SER-HIS-MET-THR-ILE-SER-GLN-GLN-GLU-PHE-GLY-ARG-THR-GLY-LEU-PRO-ASP-LEU-SER-SER-MET-THR-GLU-GLU-GLU-GLN-ILE-ALA-TYR-ALA-MET-GLN-MET-SER-LEU-GLN-GLY-ALA-GLU-PHE-GLY-GLN-ALA-GLU-SER-ALA-ASP,95,48,,Kd=3.4uM,5.468521,5.47,1,A,A,0,A,A,0,,B,A,,1,1,95,48,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)CC)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9466644525527954,0.49176025390625,69.19772338867188,57.72040939331055,0.4949593544006347,2.049458742141724,0.7616167664527893,0.4692587256431579,0.7700242400169373,0.3723856210708618,GSHMTISQQEFGRTGLPDLSSMTEEEQIAYAMQMSLQGAEFGQAESAD,Low,"(5.463, 5.6]",train
1VRK,protein-peptide,P11799,ADQLTDEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLNLMARKMKDTDSEEKLKEAFRVFDKDGNGFISAAELRHVMTNLGEKLTDEEVDEMIREADVDGDGQVNYEEFVQVMMAK,RRKWQKTGHAVRAIGRLSSS,ALA-ASP-GLN-LEU-THR-ASP-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-ASN-LEU-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-LYS-LEU-LYS-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-PHE-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-VAL-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-VAL-MET-MET-ALA-LYS,ARG-ARG-LYS-TRF-GLN-LYS-THR-GLY-HIS-ALA-VAL-ARG-ALA-ILE-GLY-ARG-LEU-SER-SER-SER-NH2,148,21,,Kd=6.8nM,8.167491,8.17,1,A,A,0,A,A,0,,B,A,,1,1,148,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(Cc1cn(C=O)c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,0.8679288029670715,0.6363977193832397,76.09581756591797,50.00405502319336,0.4428043663501739,1.043799638748169,0.8184086084365845,0.6893789768218994,0.8059040307998657,0.6231524348258972,RRKWQKTGHAVRAIGRLSSS,Moderate,"(7.921, 8.383]",train
1VYT,protein-peptide,P22002 P54287,GSADSYTSRPSLDSDVSLEEDRESARREVESQAQQQLERAKHKPVAFAVRTNVSYCGVLDEECPVQGSGVNFEAKDFLHIKEKYSNDWWIGRLVKEGGDIAFIPSPQRLESIRLKQEQKARRSGNPSSLSDIGNRRSPPPSLAKQKQKQAEHVPPYDVVPSMRPVVLVGPSLKGYEVTDMMQKALFDFLKHRFDGRISITRVTADLSLAKRSVLNNPGKRTIIERSSARSSIAEVQSEIERIFELAKSLQLVVLDADTINHPAQLAKTSLAPIIVFVKVSSPKVLQRLIRSRGKSQMKHLTVQMMAYDKLVQCPPESFDVILDENQLDDACEHLAEYLEVYWRATHHPAPG,QKLREKQQLEEDLKGYLDWITQAED,GLY-SER-ALA-ASP-SER-TYR-THR-SER-ARG-PRO-SER-LEU-ASP-SER-ASP-VAL-SER-LEU-GLU-GLU-ASP-ARG-GLU-SER-ALA-ARG-ARG-GLU-VAL-GLU-SER-GLN-ALA-GLN-GLN-GLN-LEU-GLU-ARG-ALA-LYS-HIS-LYS-PRO-VAL-ALA-PHE-ALA-VAL-ARG-THR-ASN-VAL-SER-TYR-CYS-GLY-VAL-LEU-ASP-GLU-GLU-CYS-PRO-VAL-GLN-GLY-SER-GLY-VAL-ASN-PHE-GLU-ALA-LYS-ASP-PHE-LEU-HIS-ILE-LYS-GLU-LYS-TYR-SER-ASN-ASP-TRP-TRP-ILE-GLY-ARG-LEU-VAL-LYS-GLU-GLY-GLY-ASP-ILE-ALA-PHE-ILE-PRO-SER-PRO-GLN-ARG-LEU-GLU-SER-ILE-ARG-LEU-LYS-GLN-GLU-GLN-LYS-ALA-ARG-ARG-SER-GLY-ASN-PRO-SER-SER-LEU-SER-ASP-ILE-GLY-ASN-ARG-ARG-SER-PRO-PRO-PRO-SER-LEU-ALA-LYS-GLN-LYS-GLN-LYS-GLN-ALA-GLU-HIS-VAL-PRO-PRO-TYR-ASP-VAL-VAL-PRO-SER-MET-ARG-PRO-VAL-VAL-LEU-VAL-GLY-PRO-SER-LEU-LYS-GLY-TYR-GLU-VAL-THR-ASP-MET-MET-GLN-LYS-ALA-LEU-PHE-ASP-PHE-LEU-LYS-HIS-ARG-PHE-ASP-GLY-ARG-ILE-SER-ILE-THR-ARG-VAL-THR-ALA-ASP-LEU-SER-LEU-ALA-LYS-ARG-SER-VAL-LEU-ASN-ASN-PRO-GLY-LYS-ARG-THR-ILE-ILE-GLU-ARG-SER-SER-ALA-ARG-SER-SER-ILE-ALA-GLU-VAL-GLN-SER-GLU-ILE-GLU-ARG-ILE-PHE-GLU-LEU-ALA-LYS-SER-LEU-GLN-LEU-VAL-VAL-LEU-ASP-ALA-ASP-THR-ILE-ASN-HIS-PRO-ALA-GLN-LEU-ALA-LYS-THR-SER-LEU-ALA-PRO-ILE-ILE-VAL-PHE-VAL-LYS-VAL-SER-SER-PRO-LYS-VAL-LEU-GLN-ARG-LEU-ILE-ARG-SER-ARG-GLY-LYS-SER-GLN-MET-LYS-HIS-LEU-THR-VAL-GLN-MET-MET-ALA-TYR-ASP-LYS-LEU-VAL-GLN-CYS-PRO-PRO-GLU-SER-PHE-ASP-VAL-ILE-LEU-ASP-GLU-ASN-GLN-LEU-ASP-ASP-ALA-CYS-GLU-HIS-LEU-ALA-GLU-TYR-LEU-GLU-VAL-TYR-TRP-ARG-ALA-THR-HIS-HIS-PRO-ALA-PRO-GLY,GLN-LYS-LEU-ARG-GLU-LYS-GLN-GLN-LEU-GLU-GLU-ASP-LEU-LYS-GLY-TYR-LEU-ASP-TRP-ILE-THR-GLN-ALA-GLU-ASP,351,25,,Kd=20nM,7.69897,7.7,1,A,A,0,A,A,0,,E,A,,1,1,351,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8950657844543457,0.7603999972343445,72.57403564453125,68.63837432861328,0.5963658094406128,1.1675186157226562,0.772361159324646,0.763774037361145,0.7994121313095093,0.6723057627677917,QKLREKQQLEEDLKGYLDWITQAED,Moderate,"(7.523, 7.921]",train
1WA7,protein-peptide,P07948 P22575,GSPEEQGDIVVALYPYDGIHPDDLSFKKGEKMKVLEEHGEWWKAKSLLTKKEGFIPSNYVAKLNT,WDPGMPTPPLPPRPANLGERQA,GLY-SER-PRO-GLU-GLU-GLN-GLY-ASP-ILE-VAL-VAL-ALA-LEU-TYR-PRO-TYR-ASP-GLY-ILE-HIS-PRO-ASP-ASP-LEU-SER-PHE-LYS-LYS-GLY-GLU-LYS-MET-LYS-VAL-LEU-GLU-GLU-HIS-GLY-GLU-TRP-TRP-LYS-ALA-LYS-SER-LEU-LEU-THR-LYS-LYS-GLU-GLY-PHE-ILE-PRO-SER-ASN-TYR-VAL-ALA-LYS-LEU-ASN-THR,TRP-ASP-PRO-GLY-MET-PRO-THR-PRO-PRO-LEU-PRO-PRO-ARG-PRO-ALA-ASN-LEU-GLY-GLU-ARG-GLN-ALA,65,22,,Kd=9.58uM,5.018634,5.02,1,A,A,0,A,A,0,,B,A,,1,1,65,22,0,CSCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9636217951774596,0.6200454235076904,94.13594818115234,86.57456970214844,0.3425516486167907,0.8289585709571838,0.874437689781189,0.693324863910675,0.8206878900527954,0.6017255783081055,WDPGMPTPPLPPRPANLGERQA,Low,"(5.014, 5.105]",train
1WLP,protein-peptide,P13498 P14598,GSDITGPIILQTYRAIADYEKTSGSEMALSTGDVVEVVEKSESGWWFCQMKAKRGWIPASFLEPLDSPDETEDPEPNYAGEPYVAIKAYTAVEGDEVSLLEGEAVEVIHKLLDGWWVIRKDDVTGYFPSMYLQKSGQD,GPLGSKQPPSNPPPRPPAEARKKPS,GLY-SER-ASP-ILE-THR-GLY-PRO-ILE-ILE-LEU-GLN-THR-TYR-ARG-ALA-ILE-ALA-ASP-TYR-GLU-LYS-THR-SER-GLY-SER-GLU-MET-ALA-LEU-SER-THR-GLY-ASP-VAL-VAL-GLU-VAL-VAL-GLU-LYS-SER-GLU-SER-GLY-TRP-TRP-PHE-CYS-GLN-MET-LYS-ALA-LYS-ARG-GLY-TRP-ILE-PRO-ALA-SER-PHE-LEU-GLU-PRO-LEU-ASP-SER-PRO-ASP-GLU-THR-GLU-ASP-PRO-GLU-PRO-ASN-TYR-ALA-GLY-GLU-PRO-TYR-VAL-ALA-ILE-LYS-ALA-TYR-THR-ALA-VAL-GLU-GLY-ASP-GLU-VAL-SER-LEU-LEU-GLU-GLY-GLU-ALA-VAL-GLU-VAL-ILE-HIS-LYS-LEU-LEU-ASP-GLY-TRP-TRP-VAL-ILE-ARG-LYS-ASP-ASP-VAL-THR-GLY-TYR-PHE-PRO-SER-MET-TYR-LEU-GLN-LYS-SER-GLY-GLN-ASP,GLY-PRO-LEU-GLY-SER-LYS-GLN-PRO-PRO-SER-ASN-PRO-PRO-PRO-ARG-PRO-PRO-ALA-GLU-ALA-ARG-LYS-LYS-PRO-SER,138,25,,Kd=0.64uM,6.19382,6.19,1,A,A,0,A,A,0,,A,B,,1,1,138,25,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,0.9710239171981812,0.7231752276420593,88.61063385009766,69.57030487060547,0.3873536884784698,0.8889895081520081,0.8692184090614319,0.7384853363037109,0.854604184627533,0.6604708433151245,GPLGSKQPPSNPPPRPPAEARKKPS,Low,"(6.097, 6.26]",val
1XJ7,protein-peptide,P10275,HIEGYECQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,HKKLLQLLT,HIS-ILE-GLU-GLY-TYR-GLU-CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,HIS-LYS-LYS-LEU-LEU-GLN-LEU-LEU-THR,257,9,,Kd=39uM,4.408935,4.41,1,A,A,0,A,A,0,,B,A,,1,1,257,9,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.957972526550293,0.8608511686325073,93.48192596435548,94.4470443725586,0.3298707008361816,0.5885963439941406,0.9456639289855956,0.9166575074195862,0.9399030208587646,0.8371719717979431,HKKLLQLLT,Low,"(4.319, 4.456]",train
1XQH,protein-peptide,Q8WTS6 P04637,GPLGSGQYKDNIRHGVCWIYYPDGGSLVGEVNEDGEMTGEKIAYVYPDERTALYGKFIDGEMIEGKLATLMSTEEGRPHFELMPGNSVYHFDKSTSSCISTNALLPDPYESERVYVAESLISSAGEGLFSKVAVGPNTVMSFYNGVRITHQEVDSRDWALNGNTLSLDEETVIDVPEPYNHVSKYCASLGHKANHSFTPNCIYDMFVHPRFGPIKCIRTLRAVEADEELTVAYGYDHSPPGKSGPEAPEWYQVELKAFQATQQK,LKSKKGQSTY,GLY-PRO-LEU-GLY-SER-GLY-GLN-TYR-LYS-ASP-ASN-ILE-ARG-HIS-GLY-VAL-CYS-TRP-ILE-TYR-TYR-PRO-ASP-GLY-GLY-SER-LEU-VAL-GLY-GLU-VAL-ASN-GLU-ASP-GLY-GLU-MET-THR-GLY-GLU-LYS-ILE-ALA-TYR-VAL-TYR-PRO-ASP-GLU-ARG-THR-ALA-LEU-TYR-GLY-LYS-PHE-ILE-ASP-GLY-GLU-MET-ILE-GLU-GLY-LYS-LEU-ALA-THR-LEU-MET-SER-THR-GLU-GLU-GLY-ARG-PRO-HIS-PHE-GLU-LEU-MET-PRO-GLY-ASN-SER-VAL-TYR-HIS-PHE-ASP-LYS-SER-THR-SER-SER-CYS-ILE-SER-THR-ASN-ALA-LEU-LEU-PRO-ASP-PRO-TYR-GLU-SER-GLU-ARG-VAL-TYR-VAL-ALA-GLU-SER-LEU-ILE-SER-SER-ALA-GLY-GLU-GLY-LEU-PHE-SER-LYS-VAL-ALA-VAL-GLY-PRO-ASN-THR-VAL-MET-SER-PHE-TYR-ASN-GLY-VAL-ARG-ILE-THR-HIS-GLN-GLU-VAL-ASP-SER-ARG-ASP-TRP-ALA-LEU-ASN-GLY-ASN-THR-LEU-SER-LEU-ASP-GLU-GLU-THR-VAL-ILE-ASP-VAL-PRO-GLU-PRO-TYR-ASN-HIS-VAL-SER-LYS-TYR-CYS-ALA-SER-LEU-GLY-HIS-LYS-ALA-ASN-HIS-SER-PHE-THR-PRO-ASN-CYS-ILE-TYR-ASP-MET-PHE-VAL-HIS-PRO-ARG-PHE-GLY-PRO-ILE-LYS-CYS-ILE-ARG-THR-LEU-ARG-ALA-VAL-GLU-ALA-ASP-GLU-GLU-LEU-THR-VAL-ALA-TYR-GLY-TYR-ASP-HIS-SER-PRO-PRO-GLY-LYS-SER-GLY-PRO-GLU-ALA-PRO-GLU-TRP-TYR-GLN-VAL-GLU-LEU-LYS-ALA-PHE-GLN-ALA-THR-GLN-GLN-LYS,LEU-LYS-SER-MLZ-LYS-GLY-GLN-SER-THR-TYR,264,10,,Kd=0.2uM,6.69897,6.7,1,A,A,0,A,A,0,,B,A,,1,1,264,10,0,CC(C)C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O,CNCCCCC(NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9398713707923888,0.880476713180542,90.7485122680664,88.38871002197266,0.4507420063018799,0.6345970630645752,0.9130635261535645,0.907930076122284,0.894109845161438,0.8475717306137085,LKSKKGQSTY,Low,"(6.696, 6.824]",train
1XR0,protein-peptide,P11362 Q8WU20,MGSDTVPDNHRNKFKVINVDDDGNELGSGIMELTDTELILYTRKRDSVKWHYLCLRRYGYDSNLFSFESGRRCQTGQGIFAFKCARAEELFNMLQEIMQNNSINVVEEPVVERNNHQTELEVPRTPRTP,HSQMAVHKLAKSIPLRRQVTVS,MET-GLY-SER-ASP-THR-VAL-PRO-ASP-ASN-HIS-ARG-ASN-LYS-PHE-LYS-VAL-ILE-ASN-VAL-ASP-ASP-ASP-GLY-ASN-GLU-LEU-GLY-SER-GLY-ILE-MET-GLU-LEU-THR-ASP-THR-GLU-LEU-ILE-LEU-TYR-THR-ARG-LYS-ARG-ASP-SER-VAL-LYS-TRP-HIS-TYR-LEU-CYS-LEU-ARG-ARG-TYR-GLY-TYR-ASP-SER-ASN-LEU-PHE-SER-PHE-GLU-SER-GLY-ARG-ARG-CYS-GLN-THR-GLY-GLN-GLY-ILE-PHE-ALA-PHE-LYS-CYS-ALA-ARG-ALA-GLU-GLU-LEU-PHE-ASN-MET-LEU-GLN-GLU-ILE-MET-GLN-ASN-ASN-SER-ILE-ASN-VAL-VAL-GLU-GLU-PRO-VAL-VAL-GLU-ARG-ASN-ASN-HIS-GLN-THR-GLU-LEU-GLU-VAL-PRO-ARG-THR-PRO-ARG-THR-PRO,HIS-SER-GLN-MET-ALA-VAL-HIS-LYS-LEU-ALA-LYS-SER-ILE-PRO-LEU-ARG-ARG-GLN-VAL-THR-VAL-SER,129,22,,Kd=10uM,5.0,5.0,1,A,A,0,A,A,0,,A,B,,1,1,129,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(C)C,0.9944927096366882,0.9197706580162048,77.9375228881836,77.56071472167969,0.4737005233764648,0.7512091398239136,0.7975661158561707,0.8114526867866516,0.8243534564971924,0.7918113470077515,HSQMAVHKLAKSIPLRRQVTVS,Low,"(4.866, 5.014]",train
1YDI,protein-peptide,O43707 P18206,HHHHHMPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,VGWEQLLTTIARTINEVENQILTR,HIS-HIS-HIS-HIS-HIS-MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,VAL-GLY-TRP-GLU-GLN-LEU-LEU-THR-THR-ILE-ALA-ARG-THR-ILE-ASN-GLU-VAL-GLU-ASN-GLN-ILE-LEU-THR-ARG,263,24,,Kd=1.78nM,8.74958,8.75,1,A,A,0,A,A,0,,B,A,,1,1,263,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9648609161376952,0.6084735989570618,85.83220672607422,78.87672424316406,0.406508207321167,1.291469693183899,0.8680118918418884,0.7383121848106384,0.9368083477020264,0.5760139226913452,VGWEQLLTTIARTINEVENQILTR,Moderate,"(8.383, 8.824]",train
1YK0,protein-peptide,P01160 P17342,MPSLLVLTFSPCVLLGWALLAGGTGGGGVGGGGGGAGIGGGRQEREALPPQKIEVLVLLPQDDSYLFSLTRVRPAIEYALRSVEGNGTGRRLLPPGTRFQVAYEDSDCGNRALFSLVDRVAAARGAKPDLILGPVCEYAAAPVARLASHWDLPMLSAGALAAGFQHKDSEYSHLTRVAPAYAKMGEMMLALFRHHHWSRAALVYSDDKLERNCYFTLEGVHEVFQEEGLHTSIYSFDETKDLDLEDIVRNIQASERVVIMCASSDTIRSIMLVAHRHGMTSGDYAFFNIELFNSSSYGDGSWKRGDKHDFEAKQAYSSLQTVTLLRTVKPEFEKFSMEVKSSVEKQGLNMEDYVNMFVEGFHDAILLYVLALHEVLRAGYSKKDGGKIIQQTWNRTFEGIAGQVSIDANGDRYGDFSVIAMTDVEAGTQEVIGDYFGKEGRFEMRPNVKYPWGPLKLRIDENRIVEHTNSSPCKSSGGLE,SCFGGRMDRIGAQSGLGCNSF,MET-PRO-SER-LEU-LEU-VAL-LEU-THR-PHE-SER-PRO-CYS-VAL-LEU-LEU-GLY-TRP-ALA-LEU-LEU-ALA-GLY-GLY-THR-GLY-GLY-GLY-GLY-VAL-GLY-GLY-GLY-GLY-GLY-GLY-ALA-GLY-ILE-GLY-GLY-GLY-ARG-GLN-GLU-ARG-GLU-ALA-LEU-PRO-PRO-GLN-LYS-ILE-GLU-VAL-LEU-VAL-LEU-LEU-PRO-GLN-ASP-ASP-SER-TYR-LEU-PHE-SER-LEU-THR-ARG-VAL-ARG-PRO-ALA-ILE-GLU-TYR-ALA-LEU-ARG-SER-VAL-GLU-GLY-ASN-GLY-THR-GLY-ARG-ARG-LEU-LEU-PRO-PRO-GLY-THR-ARG-PHE-GLN-VAL-ALA-TYR-GLU-ASP-SER-ASP-CYS-GLY-ASN-ARG-ALA-LEU-PHE-SER-LEU-VAL-ASP-ARG-VAL-ALA-ALA-ALA-ARG-GLY-ALA-LYS-PRO-ASP-LEU-ILE-LEU-GLY-PRO-VAL-CYS-GLU-TYR-ALA-ALA-ALA-PRO-VAL-ALA-ARG-LEU-ALA-SER-HIS-TRP-ASP-LEU-PRO-MET-LEU-SER-ALA-GLY-ALA-LEU-ALA-ALA-GLY-PHE-GLN-HIS-LYS-ASP-SER-GLU-TYR-SER-HIS-LEU-THR-ARG-VAL-ALA-PRO-ALA-TYR-ALA-LYS-MET-GLY-GLU-MET-MET-LEU-ALA-LEU-PHE-ARG-HIS-HIS-HIS-TRP-SER-ARG-ALA-ALA-LEU-VAL-TYR-SER-ASP-ASP-LYS-LEU-GLU-ARG-ASN-CYS-TYR-PHE-THR-LEU-GLU-GLY-VAL-HIS-GLU-VAL-PHE-GLN-GLU-GLU-GLY-LEU-HIS-THR-SER-ILE-TYR-SER-PHE-ASP-GLU-THR-LYS-ASP-LEU-ASP-LEU-GLU-ASP-ILE-VAL-ARG-ASN-ILE-GLN-ALA-SER-GLU-ARG-VAL-VAL-ILE-MET-CYS-ALA-SER-SER-ASP-THR-ILE-ARG-SER-ILE-MET-LEU-VAL-ALA-HIS-ARG-HIS-GLY-MET-THR-SER-GLY-ASP-TYR-ALA-PHE-PHE-ASN-ILE-GLU-LEU-PHE-ASN-SER-SER-SER-TYR-GLY-ASP-GLY-SER-TRP-LYS-ARG-GLY-ASP-LYS-HIS-ASP-PHE-GLU-ALA-LYS-GLN-ALA-TYR-SER-SER-LEU-GLN-THR-VAL-THR-LEU-LEU-ARG-THR-VAL-LYS-PRO-GLU-PHE-GLU-LYS-PHE-SER-MET-GLU-VAL-LYS-SER-SER-VAL-GLU-LYS-GLN-GLY-LEU-ASN-MET-GLU-ASP-TYR-VAL-ASN-MET-PHE-VAL-GLU-GLY-PHE-HIS-ASP-ALA-ILE-LEU-LEU-TYR-VAL-LEU-ALA-LEU-HIS-GLU-VAL-LEU-ARG-ALA-GLY-TYR-SER-LYS-LYS-ASP-GLY-GLY-LYS-ILE-ILE-GLN-GLN-THR-TRP-ASN-ARG-THR-PHE-GLU-GLY-ILE-ALA-GLY-GLN-VAL-SER-ILE-ASP-ALA-ASN-GLY-ASP-ARG-TYR-GLY-ASP-PHE-SER-VAL-ILE-ALA-MET-THR-ASP-VAL-GLU-ALA-GLY-THR-GLN-GLU-VAL-ILE-GLY-ASP-TYR-PHE-GLY-LYS-GLU-GLY-ARG-PHE-GLU-MET-ARG-PRO-ASN-VAL-LYS-TYR-PRO-TRP-GLY-PRO-LEU-LYS-LEU-ARG-ILE-ASP-GLU-ASN-ARG-ILE-VAL-GLU-HIS-THR-ASN-SER-SER-PRO-CYS-LYS-SER-SER-GLY-GLY-LEU-GLU,SER-CYS-PHE-GLY-GLY-ARG-MET-ASP-ARG-ILE-GLY-ALA-GLN-SER-GLY-LEU-GLY-CYS-ASN-SER-PHE,480,21,,Kd=0.96nM,9.017729,9.02,1,A,A,0,A,A,0,,E,A,dimer,1,1,480,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.8367900848388672,0.723071813583374,72.91695404052734,69.49744415283203,0.650425910949707,1.1376782655715942,0.7830677628517151,0.7556630969047546,0.7379451394081116,0.6302885413169861,SCFGGRMDRIGAQSGLGCNSF,High,"(8.824, 12.12]",train
1YK1,protein-peptide,P16860 P17342,PSLLVLTFSPCVLLGWALLAGGTGGGGVGGGGGGAGIGGGRQEREALPPQKIEVLVLLPQDDSYLFSLTRVRPAIEYALRSVEGNGTGRRLLPPGTRFQVAYEDSDCGNRALFSLVDRVAAARGAKPDLILGPVCEYAAAPVARLASHWDLPMLSAGALAAGFQHKDSEYSHLTRVAPAYAKMGEMMLALFRHHHWSRAALVYSDDKLERNCYFTLEGVHEVFQEEGLHTSIYSFDETKDLDLEDIVRNIQASERVVIMCASSDTIRSIMLVAHRHGMTSGDYAFFNIELFNSSSYGDGSWKRGDKHDFEAKQAYSSLQTVTLLRTVKPEFEKFSMEVKSSVEKQGLNMEDYVNMFVEGFHDAILLYVLALHEVLRAGYSKKDGGKIIQQTWNRTFEGIAGQVSIDANGDRYGDFSVIAMTDVEAGTQEVIGDYFGKEGRFEMRPNVKYPWGPLKLRIDENRIVEHTNSSPCKSSGGLE,GCFGRKMDRISSSSGLGCKVL,PRO-SER-LEU-LEU-VAL-LEU-THR-PHE-SER-PRO-CYS-VAL-LEU-LEU-GLY-TRP-ALA-LEU-LEU-ALA-GLY-GLY-THR-GLY-GLY-GLY-GLY-VAL-GLY-GLY-GLY-GLY-GLY-GLY-ALA-GLY-ILE-GLY-GLY-GLY-ARG-GLN-GLU-ARG-GLU-ALA-LEU-PRO-PRO-GLN-LYS-ILE-GLU-VAL-LEU-VAL-LEU-LEU-PRO-GLN-ASP-ASP-SER-TYR-LEU-PHE-SER-LEU-THR-ARG-VAL-ARG-PRO-ALA-ILE-GLU-TYR-ALA-LEU-ARG-SER-VAL-GLU-GLY-ASN-GLY-THR-GLY-ARG-ARG-LEU-LEU-PRO-PRO-GLY-THR-ARG-PHE-GLN-VAL-ALA-TYR-GLU-ASP-SER-ASP-CYS-GLY-ASN-ARG-ALA-LEU-PHE-SER-LEU-VAL-ASP-ARG-VAL-ALA-ALA-ALA-ARG-GLY-ALA-LYS-PRO-ASP-LEU-ILE-LEU-GLY-PRO-VAL-CYS-GLU-TYR-ALA-ALA-ALA-PRO-VAL-ALA-ARG-LEU-ALA-SER-HIS-TRP-ASP-LEU-PRO-MET-LEU-SER-ALA-GLY-ALA-LEU-ALA-ALA-GLY-PHE-GLN-HIS-LYS-ASP-SER-GLU-TYR-SER-HIS-LEU-THR-ARG-VAL-ALA-PRO-ALA-TYR-ALA-LYS-MET-GLY-GLU-MET-MET-LEU-ALA-LEU-PHE-ARG-HIS-HIS-HIS-TRP-SER-ARG-ALA-ALA-LEU-VAL-TYR-SER-ASP-ASP-LYS-LEU-GLU-ARG-ASN-CYS-TYR-PHE-THR-LEU-GLU-GLY-VAL-HIS-GLU-VAL-PHE-GLN-GLU-GLU-GLY-LEU-HIS-THR-SER-ILE-TYR-SER-PHE-ASP-GLU-THR-LYS-ASP-LEU-ASP-LEU-GLU-ASP-ILE-VAL-ARG-ASN-ILE-GLN-ALA-SER-GLU-ARG-VAL-VAL-ILE-MET-CYS-ALA-SER-SER-ASP-THR-ILE-ARG-SER-ILE-MET-LEU-VAL-ALA-HIS-ARG-HIS-GLY-MET-THR-SER-GLY-ASP-TYR-ALA-PHE-PHE-ASN-ILE-GLU-LEU-PHE-ASN-SER-SER-SER-TYR-GLY-ASP-GLY-SER-TRP-LYS-ARG-GLY-ASP-LYS-HIS-ASP-PHE-GLU-ALA-LYS-GLN-ALA-TYR-SER-SER-LEU-GLN-THR-VAL-THR-LEU-LEU-ARG-THR-VAL-LYS-PRO-GLU-PHE-GLU-LYS-PHE-SER-MET-GLU-VAL-LYS-SER-SER-VAL-GLU-LYS-GLN-GLY-LEU-ASN-MET-GLU-ASP-TYR-VAL-ASN-MET-PHE-VAL-GLU-GLY-PHE-HIS-ASP-ALA-ILE-LEU-LEU-TYR-VAL-LEU-ALA-LEU-HIS-GLU-VAL-LEU-ARG-ALA-GLY-TYR-SER-LYS-LYS-ASP-GLY-GLY-LYS-ILE-ILE-GLN-GLN-THR-TRP-ASN-ARG-THR-PHE-GLU-GLY-ILE-ALA-GLY-GLN-VAL-SER-ILE-ASP-ALA-ASN-GLY-ASP-ARG-TYR-GLY-ASP-PHE-SER-VAL-ILE-ALA-MET-THR-ASP-VAL-GLU-ALA-GLY-THR-GLN-GLU-VAL-ILE-GLY-ASP-TYR-PHE-GLY-LYS-GLU-GLY-ARG-PHE-GLU-MET-ARG-PRO-ASN-VAL-LYS-TYR-PRO-TRP-GLY-PRO-LEU-LYS-LEU-ARG-ILE-ASP-GLU-ASN-ARG-ILE-VAL-GLU-HIS-THR-ASN-SER-SER-PRO-CYS-LYS-SER-SER-GLY-GLY-LEU-GLU,GLY-CYS-PHE-GLY-ARG-LYS-MET-ASP-ARG-ILE-SER-SER-SER-SER-GLY-LEU-GLY-CYS-LYS-VAL-LEU,479,21,,Kd=45.7nM,7.340084,7.34,1,A,A,0,A,A,0,,E,A,dimer,1,1,479,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O,0.8022451996803284,0.722465455532074,74.12236022949219,69.61216735839844,0.6326674818992615,1.1383126974105835,0.7932314276695251,0.7542603611946106,0.6982486248016357,0.6283997297286987,GCFGRKMDRISSSSGLGCKVL,Moderate,"(7.268, 7.523]",train
1ZSG,protein-peptide,Q13153 Q14155,MTDNSNNQLVVRAKFNFQQTNEDELSFSKGDVIHVTRVEEGGWWEGTLNGRTGWFPSNYVREVKA,DATPPPVIAPRPEHTKSVYTRS,MET-THR-ASP-ASN-SER-ASN-ASN-GLN-LEU-VAL-VAL-ARG-ALA-LYS-PHE-ASN-PHE-GLN-GLN-THR-ASN-GLU-ASP-GLU-LEU-SER-PHE-SER-LYS-GLY-ASP-VAL-ILE-HIS-VAL-THR-ARG-VAL-GLU-GLU-GLY-GLY-TRP-TRP-GLU-GLY-THR-LEU-ASN-GLY-ARG-THR-GLY-TRP-PHE-PRO-SER-ASN-TYR-VAL-ARG-GLU-VAL-LYS-ALA,ASP-ALA-THR-PRO-PRO-PRO-VAL-ILE-ALA-PRO-ARG-PRO-GLU-HIS-THR-LYS-SER-VAL-TYR-THR-ARG-SER,65,22,,Kd=7.5uM,5.124939,5.12,1,A,A,0,A,A,0,,B,A,,1,1,65,22,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.8807355165481567,0.6904274225234985,86.47450256347656,76.87484741210938,0.4153249859809875,0.7989124655723572,0.8132508397102356,0.7395680546760559,0.7180089950561523,0.668526828289032,DATPPPVIAPRPEHTKSVYTRS,Low,"(5.105, 5.222]",train
2A7U,protein-peptide,P0ABA4 Q0SYU2,SEFITVARPYAKAAFDFAVEHQSVERWQDMLAFAAEVTKNEQMAELLSGALAPETLAESFIAVCGEQLDENGQNLIRVMAENGRLNALPDVLEQFIHLRAVSEATAEVDVISAAALSEQQLAKISAAMEKRLSR,MQLNSTEISELIKQRIAQFNVV,SER-GLU-PHE-ILE-THR-VAL-ALA-ARG-PRO-TYR-ALA-LYS-ALA-ALA-PHE-ASP-PHE-ALA-VAL-GLU-HIS-GLN-SER-VAL-GLU-ARG-TRP-GLN-ASP-MET-LEU-ALA-PHE-ALA-ALA-GLU-VAL-THR-LYS-ASN-GLU-GLN-MET-ALA-GLU-LEU-LEU-SER-GLY-ALA-LEU-ALA-PRO-GLU-THR-LEU-ALA-GLU-SER-PHE-ILE-ALA-VAL-CYS-GLY-GLU-GLN-LEU-ASP-GLU-ASN-GLY-GLN-ASN-LEU-ILE-ARG-VAL-MET-ALA-GLU-ASN-GLY-ARG-LEU-ASN-ALA-LEU-PRO-ASP-VAL-LEU-GLU-GLN-PHE-ILE-HIS-LEU-ARG-ALA-VAL-SER-GLU-ALA-THR-ALA-GLU-VAL-ASP-VAL-ILE-SER-ALA-ALA-ALA-LEU-SER-GLU-GLN-GLN-LEU-ALA-LYS-ILE-SER-ALA-ALA-MET-GLU-LYS-ARG-LEU-SER-ARG,MET-GLN-LEU-ASN-SER-THR-GLU-ILE-SER-GLU-LEU-ILE-LYS-GLN-ARG-ILE-ALA-GLN-PHE-ASN-VAL-VAL,134,22,,Kd=120nM,6.920819,6.92,1,A,A,0,A,A,0,,A,B,,1,1,134,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCSC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)CC,0.958741009235382,0.6861756443977356,77.10440063476562,72.87401580810547,0.4087233245372772,1.0652329921722412,0.8412594795227051,0.723970353603363,0.871925413608551,0.6160926222801208,MQLNSTEISELIKQRIAQFNVV,Low,"(6.824, 7.049]",train
2A9H,protein-peptide,P0A334 P13487,MSGSHHHHHHSSGIEGRGRLIKHMPPMLSGLLARLVKLLLGRHGSALHWRAAGAATVLLVIVLLAGSYLAVLAERGAPGAALISYPDALWWSVETATTVGYGDLYPVTLWGRCVAVVVMVAGITSYGLVFAAVATWFVGREQERRGHFVRHSEKA,QFTNVSCTTSKECWSVCQRLHNTSRGKCMNKKCRCYS,MET-SER-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ILE-GLU-GLY-ARG-GLY-ARG-LEU-ILE-LYS-HIS-MET-PRO-PRO-MET-LEU-SER-GLY-LEU-LEU-ALA-ARG-LEU-VAL-LYS-LEU-LEU-LEU-GLY-ARG-HIS-GLY-SER-ALA-LEU-HIS-TRP-ARG-ALA-ALA-GLY-ALA-ALA-THR-VAL-LEU-LEU-VAL-ILE-VAL-LEU-LEU-ALA-GLY-SER-TYR-LEU-ALA-VAL-LEU-ALA-GLU-ARG-GLY-ALA-PRO-GLY-ALA-ALA-LEU-ILE-SER-TYR-PRO-ASP-ALA-LEU-TRP-TRP-SER-VAL-GLU-THR-ALA-THR-THR-VAL-GLY-TYR-GLY-ASP-LEU-TYR-PRO-VAL-THR-LEU-TRP-GLY-ARG-CYS-VAL-ALA-VAL-VAL-VAL-MET-VAL-ALA-GLY-ILE-THR-SER-TYR-GLY-LEU-VAL-PHE-ALA-ALA-VAL-ALA-THR-TRP-PHE-VAL-GLY-ARG-GLU-GLN-GLU-ARG-ARG-GLY-HIS-PHE-VAL-ARG-HIS-SER-GLU-LYS-ALA,PCA-PHE-THR-ASN-VAL-SER-CYS-THR-THR-SER-LYS-GLU-CYS-TRP-SER-VAL-CYS-GLN-ARG-LEU-HIS-ASN-THR-SER-ARG-GLY-LYS-CYS-MET-ASN-LYS-LYS-CYS-ARG-CYS-TYR-SER,155,37,,Kd=900nM,6.045757,6.05,1,A,A,0,A,A,0,,E,A,4mer,1,1,155,37,0,CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCC(=O)N1)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCC(=O)N1)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,0.6835659742355347,0.6918113827705383,52.45166397094727,48.13961410522461,0.7475057244300842,1.235454559326172,0.576788067817688,0.6090973019599915,0.5247135758399963,0.5592641234397888,QFTNVSCTTSKECWSVCQRLHNTSRGKCMNKKCRCYS,Low,"(5.959, 6.097]",train
2BE6,protein-peptide,Q13936 P0DP23,MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAKL,GHMDEVTVGKFYATFLIQEYFRKFKKRKEQGLVGKPS,MET-ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS-LEU,GLY-HIS-MET-ASP-GLU-VAL-THR-VAL-GLY-LYS-PHE-TYR-ALA-THR-PHE-LEU-ILE-GLN-GLU-TYR-PHE-ARG-LYS-PHE-LYS-LYS-ARG-LYS-GLU-GLN-GLY-LEU-VAL-GLY-LYS-PRO-SER,150,37,,Kd=2.63nM,8.580044,8.58,1,A,A,0,A,A,0,,D,A,,1,1,150,37,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O,0.8519912958145142,0.5534484386444092,74.92279052734375,49.80836868286133,0.5257742404937744,1.4597541093826294,0.7760892510414124,0.6017062664031982,0.7573304176330566,0.5413839817047119,GHMDEVTVGKFYATFLIQEYFRKFKKRKEQGLVGKPS,Moderate,"(8.383, 8.824]",train
2BQZ,protein-peptide,Q9NQR1 P62805,RKSKAELQSEERKRIDELIESGKEEGMKIDLIDGKGRGVIATKQFSRGDFVVEYHGDLIEITDAKKREALYAQDPSTGCYMYYFQYLSKTYCVDATRETNRLGRLINHSKCGNCQTKLHDIDGVPHLILIASRDIAAGEELLYDYGDRSKASIEAHPWLKH,RHRKVLRDNY,ARG-LYS-SER-LYS-ALA-GLU-LEU-GLN-SER-GLU-GLU-ARG-LYS-ARG-ILE-ASP-GLU-LEU-ILE-GLU-SER-GLY-LYS-GLU-GLU-GLY-MET-LYS-ILE-ASP-LEU-ILE-ASP-GLY-LYS-GLY-ARG-GLY-VAL-ILE-ALA-THR-LYS-GLN-PHE-SER-ARG-GLY-ASP-PHE-VAL-VAL-GLU-TYR-HIS-GLY-ASP-LEU-ILE-GLU-ILE-THR-ASP-ALA-LYS-LYS-ARG-GLU-ALA-LEU-TYR-ALA-GLN-ASP-PRO-SER-THR-GLY-CYS-TYR-MET-TYR-TYR-PHE-GLN-TYR-LEU-SER-LYS-THR-TYR-CYS-VAL-ASP-ALA-THR-ARG-GLU-THR-ASN-ARG-LEU-GLY-ARG-LEU-ILE-ASN-HIS-SER-LYS-CYS-GLY-ASN-CYS-GLN-THR-LYS-LEU-HIS-ASP-ILE-ASP-GLY-VAL-PRO-HIS-LEU-ILE-LEU-ILE-ALA-SER-ARG-ASP-ILE-ALA-ALA-GLY-GLU-GLU-LEU-LEU-TYR-ASP-TYR-GLY-ASP-ARG-SER-LYS-ALA-SER-ILE-GLU-ALA-HIS-PRO-TRP-LEU-LYS-HIS,ARG-HIS-ARG-MLZ-VAL-LEU-ARG-ASP-ASN-TYR,161,10,,Kd=20uM,4.69897,4.7,1,A,A,0,A,A,0,,B,A,,1,1,161,10,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CNCCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CNCCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8952229619026184,0.8510854244232178,91.52735137939452,87.95945739746094,0.3624526262283325,0.6172109246253967,0.9144640564918518,0.8989852070808411,0.8538629412651062,0.8391104340553284,RHRKVLRDNY,Low,"(4.606, 4.745]",val
2C1M,protein-peptide,Q9JIH2 P52293,NWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSV,MAKRVAEKELTDRNWDEEDEVEEMGTFSVASEEVMKNRAVKKAKRR,ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL,MET-ALA-LYS-ARG-VAL-ALA-GLU-LYS-GLU-LEU-THR-ASP-ARG-ASN-TRP-ASP-GLU-GLU-ASP-GLU-VAL-GLU-GLU-MET-GLY-THR-PHE-SER-VAL-ALA-SER-GLU-GLU-VAL-MET-LYS-ASN-ARG-ALA-VAL-LYS-LYS-ALA-LYS-ARG-ARG,424,46,,Kd=1.1nM,8.958607,8.96,1,A,A,0,A,A,0,,B,A,,1,1,424,46,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCSC)C(C)C)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.7634642124176025,0.6345440745353699,86.29146575927734,86.08782196044922,0.4929521381855011,1.4243868589401243,0.9027485847473145,0.7753567099571228,0.6674728393554688,0.5993409156799316,MAKRVAEKELTDRNWDEEDEVEEMGTFSVASEEVMKNRAVKKAKRR,Moderate,"(8.824, 12.12]",val
2F31,protein-peptide,Q3US76 O08808,SAMMYIQELRSGLRDMHLLSCLESLRVSLNNNPVSWVQTFGAEGLASLLDILKRLHDEKEETSGNYDSRNQHEIIRCLKAFMNNKFGIKTMLETEEGILLLVRAMDPAVPNMMIDAAKLLSALCILPQPEDMNERVLEAMTERAEMDEVERFQPLLDGLKSGTSIALKVGCLQLINALITPAEELDFRVHIRSELMRLGLHQVLQELREIENEDMKVQLCVFDEQGDEDFFDL,DETGVMDSLLEALQSGAAFR,SER-ALA-MET-MET-TYR-ILE-GLN-GLU-LEU-ARG-SER-GLY-LEU-ARG-ASP-MET-HIS-LEU-LEU-SER-CYS-LEU-GLU-SER-LEU-ARG-VAL-SER-LEU-ASN-ASN-ASN-PRO-VAL-SER-TRP-VAL-GLN-THR-PHE-GLY-ALA-GLU-GLY-LEU-ALA-SER-LEU-LEU-ASP-ILE-LEU-LYS-ARG-LEU-HIS-ASP-GLU-LYS-GLU-GLU-THR-SER-GLY-ASN-TYR-ASP-SER-ARG-ASN-GLN-HIS-GLU-ILE-ILE-ARG-CYS-LEU-LYS-ALA-PHE-MET-ASN-ASN-LYS-PHE-GLY-ILE-LYS-THR-MET-LEU-GLU-THR-GLU-GLU-GLY-ILE-LEU-LEU-LEU-VAL-ARG-ALA-MET-ASP-PRO-ALA-VAL-PRO-ASN-MET-MET-ILE-ASP-ALA-ALA-LYS-LEU-LEU-SER-ALA-LEU-CYS-ILE-LEU-PRO-GLN-PRO-GLU-ASP-MET-ASN-GLU-ARG-VAL-LEU-GLU-ALA-MET-THR-GLU-ARG-ALA-GLU-MET-ASP-GLU-VAL-GLU-ARG-PHE-GLN-PRO-LEU-LEU-ASP-GLY-LEU-LYS-SER-GLY-THR-SER-ILE-ALA-LEU-LYS-VAL-GLY-CYS-LEU-GLN-LEU-ILE-ASN-ALA-LEU-ILE-THR-PRO-ALA-GLU-GLU-LEU-ASP-PHE-ARG-VAL-HIS-ILE-ARG-SER-GLU-LEU-MET-ARG-LEU-GLY-LEU-HIS-GLN-VAL-LEU-GLN-GLU-LEU-ARG-GLU-ILE-GLU-ASN-GLU-ASP-MET-LYS-VAL-GLN-LEU-CYS-VAL-PHE-ASP-GLU-GLN-GLY-ASP-GLU-ASP-PHE-PHE-ASP-LEU,ASP-GLU-THR-GLY-VAL-MET-ASP-SER-LEU-LEU-GLU-ALA-LEU-GLN-SER-GLY-ALA-ALA-PHE-ARG,233,20,,Kd=102nM,6.9914,6.99,1,A,A,0,A,A,0,,B,A,,1,1,233,20,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,0.9708115458488464,0.7391567230224609,95.4344482421875,89.41710662841797,0.3430486619472503,0.8860065937042236,0.9409717321395874,0.8465721011161804,0.9436864852905272,0.7123028039932251,DETGVMDSLLEALQSGAAFR,Low,"(6.824, 7.049]",train
2H4M,protein-peptide,Q92973 P09651,MEYEWKPDEQGLQQILQLLKESQSPDTTIQRTVQQKLEQLNQYPDFNNYLIFVLTKLKSEDEPTRSLSGLILKNNVKAHFQNFPNGVTDFIKSECLNNIGDSSPLIRATVGILITTIASKGELQNWPDLLPKLCSLLDSEDYNTCEGAFGALQKICEDSAEILDSDVLDRPLNIMIPKFLQFFKHSSPKIRSHAVACVNQFIISRTQALMLHIDSFIENLFALAGDEEPEVRKNVCRALVMLLEVRMDRLLPHMHNIVEYMLQRTQDQDENVALEACEFWLTLAEQPICKDVLVRHLPKLIPVLVNGMKYSDIDIILLKGDVEEDETIPDSEQDIGGSGGSGDTISDWNLRKCSAAALDVLANVYRDELLPHILPLLKELLFHHEWVVKESGILVLGAIAEGCMQGMIPYLPELIPHLIQCLSDKKALVRSITCWTLSRYAHWVVSQPPDTYLKPLMTELLKRILDSNKRVQEAACSAFATLEEEACTELVPYLAYILDTLVFAFSKYQHKNLLILYDAIGTLADSVGHHLNKPEYIQMLMPPLIQKWNMLKDEDKDLFPLLECLSSVATALQSGFLPYCEPVYQRCVNLVQKTLAQAMLNNAQPDQYEAPDKDFMIVALDLLSGLAEGLGGNIEQLVARSNILTLMYQCMQDKMPEVRQSSFALLGDLTKACFQHVKPCIADFMPILGTNLNPEFISVCNNATWAIGEISIQMGIEMQPYIPMVLHQLVEIINRPNTPKTLLENTAITIGRLGYVCPQEVAPMLQQFIRPWCTSLRNIRDNEEKDSAFRGICTMISVNPSGVIQDFIFFCDAVASWINPKDDLRDMFCKILHGFKNQVGDENWRRFSDQFPLPLKERLAAFYGV,GGSYNDFGNYNNQSSNFGPMKGGNFGGRSSGPYGGGGQYFAKPRNQGGY,MET-GLU-TYR-GLU-TRP-LYS-PRO-ASP-GLU-GLN-GLY-LEU-GLN-GLN-ILE-LEU-GLN-LEU-LEU-LYS-GLU-SER-GLN-SER-PRO-ASP-THR-THR-ILE-GLN-ARG-THR-VAL-GLN-GLN-LYS-LEU-GLU-GLN-LEU-ASN-GLN-TYR-PRO-ASP-PHE-ASN-ASN-TYR-LEU-ILE-PHE-VAL-LEU-THR-LYS-LEU-LYS-SER-GLU-ASP-GLU-PRO-THR-ARG-SER-LEU-SER-GLY-LEU-ILE-LEU-LYS-ASN-ASN-VAL-LYS-ALA-HIS-PHE-GLN-ASN-PHE-PRO-ASN-GLY-VAL-THR-ASP-PHE-ILE-LYS-SER-GLU-CYS-LEU-ASN-ASN-ILE-GLY-ASP-SER-SER-PRO-LEU-ILE-ARG-ALA-THR-VAL-GLY-ILE-LEU-ILE-THR-THR-ILE-ALA-SER-LYS-GLY-GLU-LEU-GLN-ASN-TRP-PRO-ASP-LEU-LEU-PRO-LYS-LEU-CYS-SER-LEU-LEU-ASP-SER-GLU-ASP-TYR-ASN-THR-CYS-GLU-GLY-ALA-PHE-GLY-ALA-LEU-GLN-LYS-ILE-CYS-GLU-ASP-SER-ALA-GLU-ILE-LEU-ASP-SER-ASP-VAL-LEU-ASP-ARG-PRO-LEU-ASN-ILE-MET-ILE-PRO-LYS-PHE-LEU-GLN-PHE-PHE-LYS-HIS-SER-SER-PRO-LYS-ILE-ARG-SER-HIS-ALA-VAL-ALA-CYS-VAL-ASN-GLN-PHE-ILE-ILE-SER-ARG-THR-GLN-ALA-LEU-MET-LEU-HIS-ILE-ASP-SER-PHE-ILE-GLU-ASN-LEU-PHE-ALA-LEU-ALA-GLY-ASP-GLU-GLU-PRO-GLU-VAL-ARG-LYS-ASN-VAL-CYS-ARG-ALA-LEU-VAL-MET-LEU-LEU-GLU-VAL-ARG-MET-ASP-ARG-LEU-LEU-PRO-HIS-MET-HIS-ASN-ILE-VAL-GLU-TYR-MET-LEU-GLN-ARG-THR-GLN-ASP-GLN-ASP-GLU-ASN-VAL-ALA-LEU-GLU-ALA-CYS-GLU-PHE-TRP-LEU-THR-LEU-ALA-GLU-GLN-PRO-ILE-CYS-LYS-ASP-VAL-LEU-VAL-ARG-HIS-LEU-PRO-LYS-LEU-ILE-PRO-VAL-LEU-VAL-ASN-GLY-MET-LYS-TYR-SER-ASP-ILE-ASP-ILE-ILE-LEU-LEU-LYS-GLY-ASP-VAL-GLU-GLU-ASP-GLU-THR-ILE-PRO-ASP-SER-GLU-GLN-ASP-ILE-GLY-GLY-SER-GLY-GLY-SER-GLY-ASP-THR-ILE-SER-ASP-TRP-ASN-LEU-ARG-LYS-CYS-SER-ALA-ALA-ALA-LEU-ASP-VAL-LEU-ALA-ASN-VAL-TYR-ARG-ASP-GLU-LEU-LEU-PRO-HIS-ILE-LEU-PRO-LEU-LEU-LYS-GLU-LEU-LEU-PHE-HIS-HIS-GLU-TRP-VAL-VAL-LYS-GLU-SER-GLY-ILE-LEU-VAL-LEU-GLY-ALA-ILE-ALA-GLU-GLY-CYS-MET-GLN-GLY-MET-ILE-PRO-TYR-LEU-PRO-GLU-LEU-ILE-PRO-HIS-LEU-ILE-GLN-CYS-LEU-SER-ASP-LYS-LYS-ALA-LEU-VAL-ARG-SER-ILE-THR-CYS-TRP-THR-LEU-SER-ARG-TYR-ALA-HIS-TRP-VAL-VAL-SER-GLN-PRO-PRO-ASP-THR-TYR-LEU-LYS-PRO-LEU-MET-THR-GLU-LEU-LEU-LYS-ARG-ILE-LEU-ASP-SER-ASN-LYS-ARG-VAL-GLN-GLU-ALA-ALA-CYS-SER-ALA-PHE-ALA-THR-LEU-GLU-GLU-GLU-ALA-CYS-THR-GLU-LEU-VAL-PRO-TYR-LEU-ALA-TYR-ILE-LEU-ASP-THR-LEU-VAL-PHE-ALA-PHE-SER-LYS-TYR-GLN-HIS-LYS-ASN-LEU-LEU-ILE-LEU-TYR-ASP-ALA-ILE-GLY-THR-LEU-ALA-ASP-SER-VAL-GLY-HIS-HIS-LEU-ASN-LYS-PRO-GLU-TYR-ILE-GLN-MET-LEU-MET-PRO-PRO-LEU-ILE-GLN-LYS-TRP-ASN-MET-LEU-LYS-ASP-GLU-ASP-LYS-ASP-LEU-PHE-PRO-LEU-LEU-GLU-CYS-LEU-SER-SER-VAL-ALA-THR-ALA-LEU-GLN-SER-GLY-PHE-LEU-PRO-TYR-CYS-GLU-PRO-VAL-TYR-GLN-ARG-CYS-VAL-ASN-LEU-VAL-GLN-LYS-THR-LEU-ALA-GLN-ALA-MET-LEU-ASN-ASN-ALA-GLN-PRO-ASP-GLN-TYR-GLU-ALA-PRO-ASP-LYS-ASP-PHE-MET-ILE-VAL-ALA-LEU-ASP-LEU-LEU-SER-GLY-LEU-ALA-GLU-GLY-LEU-GLY-GLY-ASN-ILE-GLU-GLN-LEU-VAL-ALA-ARG-SER-ASN-ILE-LEU-THR-LEU-MET-TYR-GLN-CYS-MET-GLN-ASP-LYS-MET-PRO-GLU-VAL-ARG-GLN-SER-SER-PHE-ALA-LEU-LEU-GLY-ASP-LEU-THR-LYS-ALA-CYS-PHE-GLN-HIS-VAL-LYS-PRO-CYS-ILE-ALA-ASP-PHE-MET-PRO-ILE-LEU-GLY-THR-ASN-LEU-ASN-PRO-GLU-PHE-ILE-SER-VAL-CYS-ASN-ASN-ALA-THR-TRP-ALA-ILE-GLY-GLU-ILE-SER-ILE-GLN-MET-GLY-ILE-GLU-MET-GLN-PRO-TYR-ILE-PRO-MET-VAL-LEU-HIS-GLN-LEU-VAL-GLU-ILE-ILE-ASN-ARG-PRO-ASN-THR-PRO-LYS-THR-LEU-LEU-GLU-ASN-THR-ALA-ILE-THR-ILE-GLY-ARG-LEU-GLY-TYR-VAL-CYS-PRO-GLN-GLU-VAL-ALA-PRO-MET-LEU-GLN-GLN-PHE-ILE-ARG-PRO-TRP-CYS-THR-SER-LEU-ARG-ASN-ILE-ARG-ASP-ASN-GLU-GLU-LYS-ASP-SER-ALA-PHE-ARG-GLY-ILE-CYS-THR-MET-ILE-SER-VAL-ASN-PRO-SER-GLY-VAL-ILE-GLN-ASP-PHE-ILE-PHE-PHE-CYS-ASP-ALA-VAL-ALA-SER-TRP-ILE-ASN-PRO-LYS-ASP-ASP-LEU-ARG-ASP-MET-PHE-CYS-LYS-ILE-LEU-HIS-GLY-PHE-LYS-ASN-GLN-VAL-GLY-ASP-GLU-ASN-TRP-ARG-ARG-PHE-SER-ASP-GLN-PHE-PRO-LEU-PRO-LEU-LYS-GLU-ARG-LEU-ALA-ALA-PHE-TYR-GLY-VAL,GLY-GLY-SER-TYR-ASN-ASP-PHE-GLY-ASN-TYR-ASN-ASN-GLN-SER-SER-ASN-PHE-GLY-PRO-MET-LYS-GLY-GLY-ASN-PHE-GLY-GLY-ARG-SER-SER-GLY-PRO-TYR-GLY-GLY-GLY-GLY-GLN-TYR-PHE-ALA-LYS-PRO-ARG-ASN-GLN-GLY-GLY-TYR,865,49,,Kd=42nM,7.376751,7.38,1,A,A,0,A,A,0,,C,A,,1,1,865,49,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O,0.701831579208374,0.5092922449111938,60.63333511352539,58.46277618408203,0.5773501396179199,1.9287214279174805,0.775233268737793,0.7031660079956055,0.6540774703025818,0.4543209373950958,GGSYNDFGNYNNQSSNFGPMKGGNFGGRSSGPYGGGGQYFAKPRNQGGY,Moderate,"(7.268, 7.523]",train
2IHS,protein-peptide,A1Z6E0 P09052,GHMRELQADFVKPARIDILLDMPPASRDLQLKHSWNSEDRSLNIFVKEDDKLTFHRHPVAQSTDCIRGKVGLTKGLHIWEIYWPTRQRGTHAVVGVCTADAPLHSVGYQSLVGSTEQSWGWDLGRNKLYHDSKNCAGVTYPAILKNDEAFLVPDKFLVALDMDEGTLSFIVDQQYLGIAFRGLRGKKLYPIVSAVWGHCEITMRYIGGLVDELN,DINNNNNIVEDVERKREFYI,GLY-HIS-MET-ARG-GLU-LEU-GLN-ALA-ASP-PHE-VAL-LYS-PRO-ALA-ARG-ILE-ASP-ILE-LEU-LEU-ASP-MET-PRO-PRO-ALA-SER-ARG-ASP-LEU-GLN-LEU-LYS-HIS-SER-TRP-ASN-SER-GLU-ASP-ARG-SER-LEU-ASN-ILE-PHE-VAL-LYS-GLU-ASP-ASP-LYS-LEU-THR-PHE-HIS-ARG-HIS-PRO-VAL-ALA-GLN-SER-THR-ASP-CYS-ILE-ARG-GLY-LYS-VAL-GLY-LEU-THR-LYS-GLY-LEU-HIS-ILE-TRP-GLU-ILE-TYR-TRP-PRO-THR-ARG-GLN-ARG-GLY-THR-HIS-ALA-VAL-VAL-GLY-VAL-CYS-THR-ALA-ASP-ALA-PRO-LEU-HIS-SER-VAL-GLY-TYR-GLN-SER-LEU-VAL-GLY-SER-THR-GLU-GLN-SER-TRP-GLY-TRP-ASP-LEU-GLY-ARG-ASN-LYS-LEU-TYR-HIS-ASP-SER-LYS-ASN-CYS-ALA-GLY-VAL-THR-TYR-PRO-ALA-ILE-LEU-LYS-ASN-ASP-GLU-ALA-PHE-LEU-VAL-PRO-ASP-LYS-PHE-LEU-VAL-ALA-LEU-ASP-MET-ASP-GLU-GLY-THR-LEU-SER-PHE-ILE-VAL-ASP-GLN-GLN-TYR-LEU-GLY-ILE-ALA-PHE-ARG-GLY-LEU-ARG-GLY-LYS-LYS-LEU-TYR-PRO-ILE-VAL-SER-ALA-VAL-TRP-GLY-HIS-CYS-GLU-ILE-THR-MET-ARG-TYR-ILE-GLY-GLY-LEU-VAL-ASP-GLU-LEU-ASN,ASP-ILE-ASN-ASN-ASN-ASN-ASN-ILE-VAL-GLU-ASP-VAL-GLU-ARG-LYS-ARG-GLU-PHE-TYR-ILE,214,20,,Kd=40nM,7.39794,7.4,1,A,A,0,A,A,0,,C,A,,1,1,214,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.9214373230934144,0.7385591268539429,92.22712707519533,88.94983673095703,0.3653112053871155,0.8976712822914124,0.924270749092102,0.824599027633667,0.8352588415145874,0.684922993183136,DINNNNNIVEDVERKREFYI,Moderate,"(7.268, 7.523]",val
2JBY,protein-peptide,Q85295 Q16611,MGSHHHHHHSQDPMMSRLKTAVYDYLNDVDITECTEMDLLCQLSNCCDFINETYAKNYDTLYDIMERDILSYNIVNIKNTLTFALRDASPSVKLATLTLLASVIKKLNKIQHTDAAMFSEVIDGIVAEEQQVIGFIQKKCKYNTT,PSSTMGQVGRQLAIIGDDINRRYDSE,MET-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-MET-MET-SER-ARG-LEU-LYS-THR-ALA-VAL-TYR-ASP-TYR-LEU-ASN-ASP-VAL-ASP-ILE-THR-GLU-CYS-THR-GLU-MET-ASP-LEU-LEU-CYS-GLN-LEU-SER-ASN-CYS-CYS-ASP-PHE-ILE-ASN-GLU-THR-TYR-ALA-LYS-ASN-TYR-ASP-THR-LEU-TYR-ASP-ILE-MET-GLU-ARG-ASP-ILE-LEU-SER-TYR-ASN-ILE-VAL-ASN-ILE-LYS-ASN-THR-LEU-THR-PHE-ALA-LEU-ARG-ASP-ALA-SER-PRO-SER-VAL-LYS-LEU-ALA-THR-LEU-THR-LEU-LEU-ALA-SER-VAL-ILE-LYS-LYS-LEU-ASN-LYS-ILE-GLN-HIS-THR-ASP-ALA-ALA-MET-PHE-SER-GLU-VAL-ILE-ASP-GLY-ILE-VAL-ALA-GLU-GLU-GLN-GLN-VAL-ILE-GLY-PHE-ILE-GLN-LYS-LYS-CYS-LYS-TYR-ASN-THR-THR,PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU,145,26,,IC50=50nM,7.30103,7.3,1,A,A,0,A,A,0,,B,A,,1,1,145,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.6216652393341064,0.539337694644928,63.70955657958984,62.39391708374024,1.1356408596038818,1.291764497756958,0.5501672625541687,0.6155989766120911,0.5189257264137268,0.4771689176559448,PSSTMGQVGRQLAIIGDDINRRYDSE,Moderate,"(7.268, 7.523]",train
2JOD,protein-peptide,P18509 P41586,MGSMAHSDGIFKKEQAMCLEKIQRANELMGFNDSSPGCPGMWDNITCWKPAHVGEMVLVSCPELFRIFNPDQDMGVVSRNCTEDGWSEPFPHYFDACGFDEYESET,FTDSYSRYRKQMAVKKYLAAVLGKRYKQRVKNK,MET-GLY-SER-MET-ALA-HIS-SER-ASP-GLY-ILE-PHE-LYS-LYS-GLU-GLN-ALA-MET-CYS-LEU-GLU-LYS-ILE-GLN-ARG-ALA-ASN-GLU-LEU-MET-GLY-PHE-ASN-ASP-SER-SER-PRO-GLY-CYS-PRO-GLY-MET-TRP-ASP-ASN-ILE-THR-CYS-TRP-LYS-PRO-ALA-HIS-VAL-GLY-GLU-MET-VAL-LEU-VAL-SER-CYS-PRO-GLU-LEU-PHE-ARG-ILE-PHE-ASN-PRO-ASP-GLN-ASP-MET-GLY-VAL-VAL-SER-ARG-ASN-CYS-THR-GLU-ASP-GLY-TRP-SER-GLU-PRO-PHE-PRO-HIS-TYR-PHE-ASP-ALA-CYS-GLY-PHE-ASP-GLU-TYR-GLU-SER-GLU-THR,PHE-THR-ASP-SER-TYR-SER-ARG-TYR-ARG-LYS-GLN-MET-ALA-VAL-LYS-LYS-TYR-LEU-ALA-ALA-VAL-LEU-GLY-LYS-ARG-TYR-LYS-GLN-ARG-VAL-LYS-ASN-LYS,106,33,,Ki=350nM,6.455932,6.46,1,A,A,0,A,A,0,,B,A,,1,1,106,33,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)O,0.8501479029655457,0.6525435447692871,72.86238098144531,65.00098419189453,0.4873449504375458,1.2133052349090576,0.7846235036849976,0.6607947945594788,0.7361332774162292,0.5974147319793701,FTDSYSRYRKQMAVKKYLAAVLGKRYKQRVKNK,Low,"(6.398, 6.523]",val
2JTT,protein-peptide,P30801 Q9CXW3,MASPLDQAIGLLIGIFHKYSGKEGDKHTLSKKELKELIQKELTIGSKLQDAEIVKLMDDLDRNKDQEVNFQEYITFLGALAMIYNEALKG,GPGSSEGLMNVLKKIYEDGDDDMKRTINKAWVESR,MET-ALA-SER-PRO-LEU-ASP-GLN-ALA-ILE-GLY-LEU-LEU-ILE-GLY-ILE-PHE-HIS-LYS-TYR-SER-GLY-LYS-GLU-GLY-ASP-LYS-HIS-THR-LEU-SER-LYS-LYS-GLU-LEU-LYS-GLU-LEU-ILE-GLN-LYS-GLU-LEU-THR-ILE-GLY-SER-LYS-LEU-GLN-ASP-ALA-GLU-ILE-VAL-LYS-LEU-MET-ASP-ASP-LEU-ASP-ARG-ASN-LYS-ASP-GLN-GLU-VAL-ASN-PHE-GLN-GLU-TYR-ILE-THR-PHE-LEU-GLY-ALA-LEU-ALA-MET-ILE-TYR-ASN-GLU-ALA-LEU-LYS-GLY,GLY-PRO-GLY-SER-SER-GLU-GLY-LEU-MET-ASN-VAL-LEU-LYS-LYS-ILE-TYR-GLU-ASP-GLY-ASP-ASP-ASP-MET-LYS-ARG-THR-ILE-ASN-LYS-ALA-TRP-VAL-GLU-SER-ARG,90,35,,Kd=4.9uM,5.309804,5.31,1,A,A,0,A,A,0,,C,A,dimer,1,1,90,35,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.8711540699005127,0.5891404151916504,81.76570129394531,67.86376190185547,0.5037609338760376,1.137101173400879,0.787005603313446,0.6519961357116699,0.7071911096572876,0.5734264850616455,GPGSSEGLMNVLKKIYEDGDDDMKRTINKAWVESR,Low,"(5.222, 5.31]",train
2K05,protein-peptide,P48061 P61073,GMKPVSLSYRCPCRFFESHVARANVKHLKILNTPNCACQIVARLKNNNRQVCIDPKLKWIQEYLEKCLNK,GSMEGISIYTSDNYTEEMGSGDYDSMKEPAFREENANFNK,GLY-MET-LYS-PRO-VAL-SER-LEU-SER-TYR-ARG-CYS-PRO-CYS-ARG-PHE-PHE-GLU-SER-HIS-VAL-ALA-ARG-ALA-ASN-VAL-LYS-HIS-LEU-LYS-ILE-LEU-ASN-THR-PRO-ASN-CYS-ALA-CYS-GLN-ILE-VAL-ALA-ARG-LEU-LYS-ASN-ASN-ASN-ARG-GLN-VAL-CYS-ILE-ASP-PRO-LYS-LEU-LYS-TRP-ILE-GLN-GLU-TYR-LEU-GLU-LYS-CYS-LEU-ASN-LYS,GLY-SER-MET-GLU-GLY-ILE-SER-ILE-TYS-THR-SER-ASP-ASN-TYS-THR-GLU-GLU-MET-GLY-SER-GLY-ASP-TYS-ASP-SER-MET-LYS-GLU-PRO-ALA-PHE-ARG-GLU-GLU-ASN-ALA-ASN-PHE-ASN-LYS,70,40,,Kd=0.2uM,6.69897,6.7,1,A,A,0,A,A,0,,B,A,dimer,0,1,70,40,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)C[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)C[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)CC,1.008519411087036,0.7264748811721802,65.87480163574219,71.28478240966797,0.5014874339103699,1.167127251625061,0.7877525091171265,0.6833169460296631,0.7398474812507629,0.6390500664710999,GSMEGISIYTSDNYTEEMGSGDYDSMKEPAFREENANFNK,Low,"(6.696, 6.824]",train
2K2U,protein-peptide,P04486 P32776,PSHSGAAIFEKVSGIIAINEDVSPAELTWRSTDGDKVHTVVLSTIDKLQATPASSEKMMLRLIGKVDESKKRKDNEGNEVVPKPQRHMFSFNNRTVMDNIKMTLQQIISRYKDAD,GFTPHDSAPYGALDMADFEFEQMFTDALGIDEYGG,PRO-SER-HIS-SER-GLY-ALA-ALA-ILE-PHE-GLU-LYS-VAL-SER-GLY-ILE-ILE-ALA-ILE-ASN-GLU-ASP-VAL-SER-PRO-ALA-GLU-LEU-THR-TRP-ARG-SER-THR-ASP-GLY-ASP-LYS-VAL-HIS-THR-VAL-VAL-LEU-SER-THR-ILE-ASP-LYS-LEU-GLN-ALA-THR-PRO-ALA-SER-SER-GLU-LYS-MET-MET-LEU-ARG-LEU-ILE-GLY-LYS-VAL-ASP-GLU-SER-LYS-LYS-ARG-LYS-ASP-ASN-GLU-GLY-ASN-GLU-VAL-VAL-PRO-LYS-PRO-GLN-ARG-HIS-MET-PHE-SER-PHE-ASN-ASN-ARG-THR-VAL-MET-ASP-ASN-ILE-LYS-MET-THR-LEU-GLN-GLN-ILE-ILE-SER-ARG-TYR-LYS-ASP-ALA-ASP,GLY-PHE-THR-PRO-HIS-ASP-SER-ALA-PRO-TYR-GLY-ALA-LEU-ASP-MET-ALA-ASP-PHE-GLU-PHE-GLU-GLN-MET-PHE-THR-ASP-ALA-LEU-GLY-ILE-ASP-GLU-TYR-GLY-GLY,115,35,,Kd=360nM,6.443697,6.44,1,A,A,0,A,A,0,,B,A,,1,1,115,35,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9207770228385924,0.6382855772972107,78.455810546875,70.85851287841797,0.4235761761665344,1.086352825164795,0.8632471561431885,0.6782895922660828,0.7893261313438416,0.6011106371879578,GFTPHDSAPYGALDMADFEFEQMFTDALGIDEYGG,Low,"(6.398, 6.523]",train
2K3U,protein-peptide,A6QIG7,NSGLPTTLGKLDERLRNYLKKGTKNSAQFEKMVILTENKGYYTVYLNTPLAEDRKNVELLGKMYKTYFFKKGESKSSYVINGPGKTNEYAY,TTPDYGHYDDKDTLDLNTPVDK,ASN-SER-GLY-LEU-PRO-THR-THR-LEU-GLY-LYS-LEU-ASP-GLU-ARG-LEU-ARG-ASN-TYR-LEU-LYS-LYS-GLY-THR-LYS-ASN-SER-ALA-GLN-PHE-GLU-LYS-MET-VAL-ILE-LEU-THR-GLU-ASN-LYS-GLY-TYR-TYR-THR-VAL-TYR-LEU-ASN-THR-PRO-LEU-ALA-GLU-ASP-ARG-LYS-ASN-VAL-GLU-LEU-LEU-GLY-LYS-MET-TYR-LYS-THR-TYR-PHE-PHE-LYS-LYS-GLY-GLU-SER-LYS-SER-SER-TYR-VAL-ILE-ASN-GLY-PRO-GLY-LYS-THR-ASN-GLU-TYR-ALA-TYR,ACE-THR-THR-PRO-ASP-TYS-GLY-HIS-TYS-ASP-ASP-LYS-ASP-THR-LEU-ASP-LEU-ASN-THR-PRO-VAL-ASP-LYS-NH2,91,24,,Kd=8.4nM,8.075721,8.08,1,A,A,0,A,A,0,,B,A,,1,1,91,24,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O,0.6969856023788452,0.524030327796936,71.38825225830078,56.46365737915039,0.7205100059509277,1.2248203754425049,0.6775727272033691,0.5906490683555603,0.580157458782196,0.5073756575584412,TTPDYGHYDDKDTLDLNTPVDK,Moderate,"(7.921, 8.383]",train
2K42,protein-peptide,P42768 P0DJ89,GHMSGFKHVSHVGWDPQNGFDVNNLDPDLRSLFSRAGISEAQLTDAETSKLIYDFIEDQGGLEAVRQEMRRQ,GHMLPDVAQRLMQHLAEHGIQPARNMAEHIPPAPNW,GLY-HIS-MET-SER-GLY-PHE-LYS-HIS-VAL-SER-HIS-VAL-GLY-TRP-ASP-PRO-GLN-ASN-GLY-PHE-ASP-VAL-ASN-ASN-LEU-ASP-PRO-ASP-LEU-ARG-SER-LEU-PHE-SER-ARG-ALA-GLY-ILE-SER-GLU-ALA-GLN-LEU-THR-ASP-ALA-GLU-THR-SER-LYS-LEU-ILE-TYR-ASP-PHE-ILE-GLU-ASP-GLN-GLY-GLY-LEU-GLU-ALA-VAL-ARG-GLN-GLU-MET-ARG-ARG-GLN,GLY-HIS-MET-LEU-PRO-ASP-VAL-ALA-GLN-ARG-LEU-MET-GLN-HIS-LEU-ALA-GLU-HIS-GLY-ILE-GLN-PRO-ALA-ARG-ASN-MET-ALA-GLU-HIS-ILE-PRO-PRO-ALA-PRO-ASN-TRP,72,36,,Kd=35nM,7.455932,7.46,1,A,A,0,A,A,0,,B,A,,1,1,72,36,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,1.054025173187256,0.6419947743415833,95.52274322509766,66.79056549072266,0.3956471085548401,1.0906776189804075,0.8515825867652893,0.6664867401123047,0.855793297290802,0.6098300814628601,GHMLPDVAQRLMQHLAEHGIQPARNMAEHIPPAPNW,Moderate,"(7.268, 7.523]",train
2KA6,protein-peptide,P42224 P45481,SPQESRRLSIQRCIQSLVHACQCRNANCSLPSCQKMKRVVQHTKGCKRKTNGGCPVCKQLIALCCYHAKHCQENKCPVPFCLNIKHKLRQQQ,GSHMSEVHPSRLQTTDNLLPMSPEEFDEVSRIVGSVEFDSMMNTV,SER-PRO-GLN-GLU-SER-ARG-ARG-LEU-SER-ILE-GLN-ARG-CYS-ILE-GLN-SER-LEU-VAL-HIS-ALA-CYS-GLN-CYS-ARG-ASN-ALA-ASN-CYS-SER-LEU-PRO-SER-CYS-GLN-LYS-MET-LYS-ARG-VAL-VAL-GLN-HIS-THR-LYS-GLY-CYS-LYS-ARG-LYS-THR-ASN-GLY-GLY-CYS-PRO-VAL-CYS-LYS-GLN-LEU-ILE-ALA-LEU-CYS-CYS-TYR-HIS-ALA-LYS-HIS-CYS-GLN-GLU-ASN-LYS-CYS-PRO-VAL-PRO-PHE-CYS-LEU-ASN-ILE-LYS-HIS-LYS-LEU-ARG-GLN-GLN-GLN,GLY-SER-HIS-MET-SER-GLU-VAL-HIS-PRO-SER-ARG-LEU-GLN-THR-THR-ASP-ASN-LEU-LEU-PRO-MET-SER-PRO-GLU-GLU-PHE-ASP-GLU-VAL-SER-ARG-ILE-VAL-GLY-SER-VAL-GLU-PHE-ASP-SER-MET-MET-ASN-THR-VAL,92,45,,Kd=52nM,7.283997,7.28,1,A,A,0,A,A,0,,B,A,,1,1,92,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C,0.9836050271987916,0.5825589299201965,85.73577117919922,72.74034118652344,0.3606375753879547,1.3244879245758057,0.8858886361122131,0.6427333354949951,0.8711727261543274,0.5675153136253357,GSHMSEVHPSRLQTTDNLLPMSPEEFDEVSRIVGSVEFDSMMNTV,Moderate,"(7.268, 7.523]",val
2KBW,protein-peptide,P55957 Q07820,TPPPAEEEEDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEG,GPLGSESQEDIIRNIARHLAQVGDSMDRSIPPGLV,THR-PRO-PRO-PRO-ALA-GLU-GLU-GLU-GLU-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY,GLY-PRO-LEU-GLY-SER-GLU-SER-GLN-GLU-ASP-ILE-ILE-ARG-ASN-ILE-ALA-ARG-HIS-LEU-ALA-GLN-VAL-GLY-ASP-SER-MET-ASP-ARG-SER-ILE-PRO-PRO-GLY-LEU-VAL,164,35,,Kd=0.32uM,6.49485,6.49,1,A,A,0,A,A,0,,B,A,,1,1,164,35,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9581506252288818,0.6230645179748535,81.1706314086914,79.57174682617188,0.4175495207309723,1.1395864486694336,0.8751242756843567,0.7127276062965393,0.8564196825027466,0.5892158150672913,GPLGSESQEDIIRNIARHLAQVGDSMDRSIPPGLV,Low,"(6.398, 6.523]",val
2KC8,protein-peptide,P0C077 P0C079,GSHMAYFLDFDERALKEWRKLGSTVREQLKKKLVEVLESPRIEANKLRGMPDCYKIKLRSSGYRLVYQVIDEKVVVFVISVGKAEASEVYSEAVKRIL,GSHKQTLLSDEDAELVEIVKERLRNPKPVRVTLDEL,GLY-SER-HIS-MET-ALA-TYR-PHE-LEU-ASP-PHE-ASP-GLU-ARG-ALA-LEU-LYS-GLU-TRP-ARG-LYS-LEU-GLY-SER-THR-VAL-ARG-GLU-GLN-LEU-LYS-LYS-LYS-LEU-VAL-GLU-VAL-LEU-GLU-SER-PRO-ARG-ILE-GLU-ALA-ASN-LYS-LEU-ARG-GLY-MET-PRO-ASP-CYS-TYR-LYS-ILE-LYS-LEU-ARG-SER-SER-GLY-TYR-ARG-LEU-VAL-TYR-GLN-VAL-ILE-ASP-GLU-LYS-VAL-VAL-VAL-PHE-VAL-ILE-SER-VAL-GLY-LYS-ALA-GLU-ALA-SER-GLU-VAL-TYR-SER-GLU-ALA-VAL-LYS-ARG-ILE-LEU,GLY-SER-HIS-LYS-GLN-THR-LEU-LEU-SER-ASP-GLU-ASP-ALA-GLU-LEU-VAL-GLU-ILE-VAL-LYS-GLU-ARG-LEU-ARG-ASN-PRO-LYS-PRO-VAL-ARG-VAL-THR-LEU-ASP-GLU-LEU,98,36,,Kd=200nM,6.69897,6.7,1,A,A,0,A,A,0,,B,A,,1,1,98,36,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,1.0018538236618042,0.6420650482177734,88.73453521728516,80.38301849365234,0.4517064094543457,1.0373495817184448,0.8356750011444092,0.7042884230613708,0.8241820931434631,0.6265091896057129,GSHKQTLLSDEDAELVEIVKERLRNPKPVRVTLDEL,Low,"(6.696, 6.824]",train
2KHS,protein-peptide,P00644 Q1WCB7,ATSTKKLHKEPATLIKAIDGDTVKLMYKGQPMTFRLLLVDTPETKHPKKGVEKYGPEASAFTKKMVENAKKIEVEFDKGQRTDKYGRGLAYIYADGKMVNEALVRQGLAKVAYVYKPNNTH,GSVAYVYKPNNTHEQLLRKSEAQAKKEKLNIWSED,ALA-THR-SER-THR-LYS-LYS-LEU-HIS-LYS-GLU-PRO-ALA-THR-LEU-ILE-LYS-ALA-ILE-ASP-GLY-ASP-THR-VAL-LYS-LEU-MET-TYR-LYS-GLY-GLN-PRO-MET-THR-PHE-ARG-LEU-LEU-LEU-VAL-ASP-THR-PRO-GLU-THR-LYS-HIS-PRO-LYS-LYS-GLY-VAL-GLU-LYS-TYR-GLY-PRO-GLU-ALA-SER-ALA-PHE-THR-LYS-LYS-MET-VAL-GLU-ASN-ALA-LYS-LYS-ILE-GLU-VAL-GLU-PHE-ASP-LYS-GLY-GLN-ARG-THR-ASP-LYS-TYR-GLY-ARG-GLY-LEU-ALA-TYR-ILE-TYR-ALA-ASP-GLY-LYS-MET-VAL-ASN-GLU-ALA-LEU-VAL-ARG-GLN-GLY-LEU-ALA-LYS-VAL-ALA-TYR-VAL-TYR-LYS-PRO-ASN-ASN-THR-HIS,GLY-SER-VAL-ALA-TYR-VAL-TYR-LYS-PRO-ASN-ASN-THR-HIS-GLU-GLN-LEU-LEU-ARG-LYS-SER-GLU-ALA-GLN-ALA-LYS-LYS-GLU-LYS-LEU-ASN-ILE-TRP-SER-GLU-ASP,121,35,,Kd=0.36uM,6.443697,6.44,1,A,A,0,A,A,0,,B,A,,1,1,121,35,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CN)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9073985815048218,0.5766177177429199,75.68590545654297,76.21498107910156,0.5061046481132507,1.2613416910171509,0.8293031454086304,0.6448742747306824,0.7466338872909546,0.5285618305206299,GSVAYVYKPNNTHEQLLRKSEAQAKKEKLNIWSED,Low,"(6.398, 6.523]",train
2KQS,protein-peptide,Q9UER7 P63165,GSMSDQEAKPSTEDLGDKKEGEYIKLKVIGQDSSEIHFKVKMTTHLKKLKESYCQRQGVPMNSLRFLFEGQRIADNHTPKELGMEEEDVIEVYQEQTGG,GSKTSVATQCDPEEIIVLSDSD,GLY-SER-MET-SER-ASP-GLN-GLU-ALA-LYS-PRO-SER-THR-GLU-ASP-LEU-GLY-ASP-LYS-LYS-GLU-GLY-GLU-TYR-ILE-LYS-LEU-LYS-VAL-ILE-GLY-GLN-ASP-SER-SER-GLU-ILE-HIS-PHE-LYS-VAL-LYS-MET-THR-THR-HIS-LEU-LYS-LYS-LEU-LYS-GLU-SER-TYR-CYS-GLN-ARG-GLN-GLY-VAL-PRO-MET-ASN-SER-LEU-ARG-PHE-LEU-PHE-GLU-GLY-GLN-ARG-ILE-ALA-ASP-ASN-HIS-THR-PRO-LYS-GLU-LEU-GLY-MET-GLU-GLU-GLU-ASP-VAL-ILE-GLU-VAL-TYR-GLN-GLU-GLN-THR-GLY-GLY,GLY-SER-LYS-THR-SER-VAL-ALA-THR-GLN-CYS-ASP-PRO-GLU-GLU-ILE-ILE-VAL-LEU-SER-ASP-SER-ASP,99,22,,Kd=55.3uM,4.257275,4.26,1,A,A,0,A,A,0,,B,A,,1,1,99,22,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9348156452178956,0.7738721966743469,86.96697998046875,78.16934204101562,0.3936258852481842,0.8337095975875854,0.8316351771354675,0.7533466219902039,0.7849908471107483,0.6969329118728638,GSKTSVATQCDPEEIIVLSDSD,Low,"(4.155, 4.319]",val
2KRI,protein-peptide,P02749 P01130,GSCKLPVKKATVVYQGERVKIQEKFKNGMLHGDKVSFFCKNKEKKCSYTEDAQCIDGTIEVPKCFKEHSSLAFWKTDASDVKPCA,TCGPASFQCNSSTCIPQLWACDNDPDCEDGSDEWPQRCRG,GLY-SER-CYS-LYS-LEU-PRO-VAL-LYS-LYS-ALA-THR-VAL-VAL-TYR-GLN-GLY-GLU-ARG-VAL-LYS-ILE-GLN-GLU-LYS-PHE-LYS-ASN-GLY-MET-LEU-HIS-GLY-ASP-LYS-VAL-SER-PHE-PHE-CYS-LYS-ASN-LYS-GLU-LYS-LYS-CYS-SER-TYR-THR-GLU-ASP-ALA-GLN-CYS-ILE-ASP-GLY-THR-ILE-GLU-VAL-PRO-LYS-CYS-PHE-LYS-GLU-HIS-SER-SER-LEU-ALA-PHE-TRP-LYS-THR-ASP-ALA-SER-ASP-VAL-LYS-PRO-CYS-ALA,THR-CYS-GLY-PRO-ALA-SER-PHE-GLN-CYS-ASN-SER-SER-THR-CYS-ILE-PRO-GLN-LEU-TRP-ALA-CYS-ASP-ASN-ASP-PRO-ASP-CYS-GLU-ASP-GLY-SER-ASP-GLU-TRP-PRO-GLN-ARG-CYS-ARG-GLY,85,40,,Kd=46uM,4.337242,4.34,1,A,A,0,A,A,0,,B,A,,1,1,85,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.89716637134552,0.6131258010864258,67.33672332763672,60.53590774536133,0.5208505988121033,1.2429238557815552,0.8395084142684937,0.6697732210159302,0.7465807795524597,0.5989639163017273,TCGPASFQCNSSTCIPQLWACDNDPDCEDGSDEWPQRCRG,Low,"(4.319, 4.456]",train
2KT5,protein-peptide,P10238 Q9JJW6 Q9J0X9,MASMTGGQQMGRDPDKWQHDLFDSGCGGGEGVETGAKLLVSNLDFGVSDADIQELFAEFGTLKKAAVDYDRSGRSLGTADVHFERRADALKAMKQYKGVPLDGRPMDIQLVASQIDLEHHHHHH,GPLGSVWSRLGARRPSCSPERHGGKVARLQPPPTKAQPAR,MET-ALA-SER-MET-THR-GLY-GLY-GLN-GLN-MET-GLY-ARG-ASP-PRO-ASP-LYS-TRP-GLN-HIS-ASP-LEU-PHE-ASP-SER-GLY-CYS-GLY-GLY-GLY-GLU-GLY-VAL-GLU-THR-GLY-ALA-LYS-LEU-LEU-VAL-SER-ASN-LEU-ASP-PHE-GLY-VAL-SER-ASP-ALA-ASP-ILE-GLN-GLU-LEU-PHE-ALA-GLU-PHE-GLY-THR-LEU-LYS-LYS-ALA-ALA-VAL-ASP-TYR-ASP-ARG-SER-GLY-ARG-SER-LEU-GLY-THR-ALA-ASP-VAL-HIS-PHE-GLU-ARG-ARG-ALA-ASP-ALA-LEU-LYS-ALA-MET-LYS-GLN-TYR-LYS-GLY-VAL-PRO-LEU-ASP-GLY-ARG-PRO-MET-ASP-ILE-GLN-LEU-VAL-ALA-SER-GLN-ILE-ASP-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-PRO-LEU-GLY-SER-VAL-TRP-SER-ARG-LEU-GLY-ALA-ARG-ARG-PRO-SER-CYS-SER-PRO-GLU-ARG-HIS-GLY-GLY-LYS-VAL-ALA-ARG-LEU-GLN-PRO-PRO-PRO-THR-LYS-ALA-GLN-PRO-ALA-ARG,124,40,,Kd=28uM,4.552842,4.55,1,A,A,0,A,A,0,,B,A,,1,1,124,40,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(C)C,0.7239760756492615,0.6328544020652771,59.445045471191406,52.03164291381836,0.7472071051597595,1.487027883529663,0.6007988452911377,0.4987532198429107,0.4346484243869781,0.4597264528274536,GPLGSVWSRLGARRPSCSPERHGGKVARLQPPPTKAQPAR,Low,"(4.456, 4.606]",train
2KXH,protein-peptide,Q96AE4 Q9UHX1,GAMAQRQRALAIMCRVYVGSIYYELGEDTIRQAFAPFGPIKSIDMSWDSVTMKHKGFAFVEYEVPEAAQLALEQMNSVMLGGRNIKVGRPSNIGQAQPIIDQLAEEARAFNRIYVASVHQDLSDDDIKSVFEAFGKIKSCTLARDPTTGKHKGYGFIEYEKAQSSQDAVSSMNLFDLGGQYLRVGKAVTPPMPLLTPAT,GAMGYVNDAFKDALQRARQIAAKIGGDAGTS,GLY-ALA-MET-ALA-GLN-ARG-GLN-ARG-ALA-LEU-ALA-ILE-MET-CYS-ARG-VAL-TYR-VAL-GLY-SER-ILE-TYR-TYR-GLU-LEU-GLY-GLU-ASP-THR-ILE-ARG-GLN-ALA-PHE-ALA-PRO-PHE-GLY-PRO-ILE-LYS-SER-ILE-ASP-MET-SER-TRP-ASP-SER-VAL-THR-MET-LYS-HIS-LYS-GLY-PHE-ALA-PHE-VAL-GLU-TYR-GLU-VAL-PRO-GLU-ALA-ALA-GLN-LEU-ALA-LEU-GLU-GLN-MET-ASN-SER-VAL-MET-LEU-GLY-GLY-ARG-ASN-ILE-LYS-VAL-GLY-ARG-PRO-SER-ASN-ILE-GLY-GLN-ALA-GLN-PRO-ILE-ILE-ASP-GLN-LEU-ALA-GLU-GLU-ALA-ARG-ALA-PHE-ASN-ARG-ILE-TYR-VAL-ALA-SER-VAL-HIS-GLN-ASP-LEU-SER-ASP-ASP-ASP-ILE-LYS-SER-VAL-PHE-GLU-ALA-PHE-GLY-LYS-ILE-LYS-SER-CYS-THR-LEU-ALA-ARG-ASP-PRO-THR-THR-GLY-LYS-HIS-LYS-GLY-TYR-GLY-PHE-ILE-GLU-TYR-GLU-LYS-ALA-GLN-SER-SER-GLN-ASP-ALA-VAL-SER-SER-MET-ASN-LEU-PHE-ASP-LEU-GLY-GLY-GLN-TYR-LEU-ARG-VAL-GLY-LYS-ALA-VAL-THR-PRO-PRO-MET-PRO-LEU-LEU-THR-PRO-ALA-THR,GLY-ALA-MET-GLY-TYR-VAL-ASN-ASP-ALA-PHE-LYS-ASP-ALA-LEU-GLN-ARG-ALA-ARG-GLN-ILE-ALA-ALA-LYS-ILE-GLY-GLY-ASP-ALA-GLY-THR-SER,199,31,,Kd=14uM,4.853872,4.85,1,A,A,0,A,A,0,,B,A,,1,1,199,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,0.8996257185935974,0.6397713422775269,86.43948364257812,84.73048400878906,0.4934006333351135,0.9894105195999146,0.8376806378364563,0.7594192028045654,0.8335902094841003,0.6098594069480896,GAMGYVNDAFKDALQRARQIAAKIGGDAGTS,Low,"(4.745, 4.866]",train
2KXW,protein-peptide,P04775 P07463,MKEQDSEEELIEAFKVFDRDGNGLISAAELRHVMTNLGEKLTDDEVDEMIREADIDGDGHINYEEFVRMMVSK,KRKQEEVSAIVIQRAYRRYLLKQKVKK,MET-LYS-GLU-GLN-ASP-SER-GLU-GLU-GLU-LEU-ILE-GLU-ALA-PHE-LYS-VAL-PHE-ASP-ARG-ASP-GLY-ASN-GLY-LEU-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-ASP-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-HIS-ILE-ASN-TYR-GLU-GLU-PHE-VAL-ARG-MET-MET-VAL-SER-LYS,LYS-ARG-LYS-GLN-GLU-GLU-VAL-SER-ALA-ILE-VAL-ILE-GLN-ARG-ALA-TYR-ARG-ARG-TYR-LEU-LEU-LYS-GLN-LYS-VAL-LYS-LYS,73,27,,Kd=10nM,8.0,8.0,1,A,A,0,A,A,0,,B,A,,1,1,73,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,0.8856931328773499,0.584800660610199,79.18710327148438,57.91266632080078,0.4771722555160522,1.1521339416503906,0.7661633491516113,0.6349449157714844,0.7405755519866943,0.5722646117210388,KRKQEEVSAIVIQRAYRRYLLKQKVKK,Moderate,"(7.921, 8.383]",train
2L1L,protein-peptide,O14980 P61925,ISGAMHEEDEKRFLVTVIKDLLGLCEQKRGKDNKAIIASNIMYIVGQYPRFLRAHWKFLKTVVNKLFEFMHETHDGVQDMACDTFIKIAQKCRRHFVQVQVGEVMPFIDEILNNINTIICDLQPQQV,GSASGNLNELALKLAGLDINKTEGEEC,ILE-SER-GLY-ALA-MET-HIS-GLU-GLU-ASP-GLU-LYS-ARG-PHE-LEU-VAL-THR-VAL-ILE-LYS-ASP-LEU-LEU-GLY-LEU-CYS-GLU-GLN-LYS-ARG-GLY-LYS-ASP-ASN-LYS-ALA-ILE-ILE-ALA-SER-ASN-ILE-MET-TYR-ILE-VAL-GLY-GLN-TYR-PRO-ARG-PHE-LEU-ARG-ALA-HIS-TRP-LYS-PHE-LEU-LYS-THR-VAL-VAL-ASN-LYS-LEU-PHE-GLU-PHE-MET-HIS-GLU-THR-HIS-ASP-GLY-VAL-GLN-ASP-MET-ALA-CYS-ASP-THR-PHE-ILE-LYS-ILE-ALA-GLN-LYS-CYS-ARG-ARG-HIS-PHE-VAL-GLN-VAL-GLN-VAL-GLY-GLU-VAL-MET-PRO-PHE-ILE-ASP-GLU-ILE-LEU-ASN-ASN-ILE-ASN-THR-ILE-ILE-CYS-ASP-LEU-GLN-PRO-GLN-GLN-VAL,GLY-SER-ALA-SER-GLY-ASN-LEU-ASN-GLU-LEU-ALA-LEU-LYS-LEU-ALA-GLY-LEU-ASP-ILE-ASN-LYS-THR-GLU-GLY-GLU-GLU-CYS,127,27,,Kd=7nM,8.154902,8.15,1,A,A,0,A,A,0,,A,B,,1,1,127,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)CS)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)CS)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O,0.932112455368042,0.774185836315155,94.19587707519533,84.20198822021484,0.3827131390571594,0.7813879251480103,0.894658088684082,0.8316808938980103,0.8318980932235718,0.75981205701828,GSASGNLNELALKLAGLDINKTEGEEC,Moderate,"(7.921, 8.383]",val
2L9S,protein-peptide,Q96QT6 Q60520,SNASLQNNQPVEFNHAINYVNKIKNRFQGQPDIYKAFLEILHTYQKEQRNAKEAGGNYTPALTEQEVYAQVARLFKNQEDLLSEFGQFLPDANS,SNADYVQPQLRRPFELLIAAAMERNPTQFQLPNELTCTTALPGSS,SER-ASN-ALA-SER-LEU-GLN-ASN-ASN-GLN-PRO-VAL-GLU-PHE-ASN-HIS-ALA-ILE-ASN-TYR-VAL-ASN-LYS-ILE-LYS-ASN-ARG-PHE-GLN-GLY-GLN-PRO-ASP-ILE-TYR-LYS-ALA-PHE-LEU-GLU-ILE-LEU-HIS-THR-TYR-GLN-LYS-GLU-GLN-ARG-ASN-ALA-LYS-GLU-ALA-GLY-GLY-ASN-TYR-THR-PRO-ALA-LEU-THR-GLU-GLN-GLU-VAL-TYR-ALA-GLN-VAL-ALA-ARG-LEU-PHE-LYS-ASN-GLN-GLU-ASP-LEU-LEU-SER-GLU-PHE-GLY-GLN-PHE-LEU-PRO-ASP-ALA-ASN-SER,SER-ASN-ALA-ASP-TYR-VAL-GLN-PRO-GLN-LEU-ARG-ARG-PRO-PHE-GLU-LEU-LEU-ILE-ALA-ALA-ALA-MET-GLU-ARG-ASN-PRO-THR-GLN-PHE-GLN-LEU-PRO-ASN-GLU-LEU-THR-CYS-THR-THR-ALA-LEU-PRO-GLY-SER-SER,94,45,,Kd=2.2uM,5.657577,5.66,1,A,A,0,A,A,0,,A,B,,1,1,94,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,1.0638800859451294,0.5930343866348267,81.41262817382812,67.85441589355469,0.3935332894325256,1.2528444528579712,0.8572357892990112,0.5255785584449768,0.8817281723022461,0.5367600321769714,SNADYVQPQLRRPFELLIAAAMERNPTQFQLPNELTCTTALPGSS,Low,"(5.6, 5.699]",train
2LEH,protein-peptide,O14893 Q16637,GYSPTLQWQQQQVAQFSTVRQNVNKHRSHWKSQQLDSNVTMPKSEDEEGWKKFCLGEKLCADGAVGPATNESPGIDYVQIGFPPLLSIVSRMNQATVTSVLEYLSNWFGERDFTPELGRWLYALLACLEKPLLPEAHSLIRQLARRCSEVRLLVDSKDDERVPALNLLICLVSRYFDQRDLADEPSLEY,GQSDDSDIWDDTALIKAYDKAVASFK,GLY-TYR-SER-PRO-THR-LEU-GLN-TRP-GLN-GLN-GLN-GLN-VAL-ALA-GLN-PHE-SER-THR-VAL-ARG-GLN-ASN-VAL-ASN-LYS-HIS-ARG-SER-HIS-TRP-LYS-SER-GLN-GLN-LEU-ASP-SER-ASN-VAL-THR-MET-PRO-LYS-SER-GLU-ASP-GLU-GLU-GLY-TRP-LYS-LYS-PHE-CYS-LEU-GLY-GLU-LYS-LEU-CYS-ALA-ASP-GLY-ALA-VAL-GLY-PRO-ALA-THR-ASN-GLU-SER-PRO-GLY-ILE-ASP-TYR-VAL-GLN-ILE-GLY-PHE-PRO-PRO-LEU-LEU-SER-ILE-VAL-SER-ARG-MET-ASN-GLN-ALA-THR-VAL-THR-SER-VAL-LEU-GLU-TYR-LEU-SER-ASN-TRP-PHE-GLY-GLU-ARG-ASP-PHE-THR-PRO-GLU-LEU-GLY-ARG-TRP-LEU-TYR-ALA-LEU-LEU-ALA-CYS-LEU-GLU-LYS-PRO-LEU-LEU-PRO-GLU-ALA-HIS-SER-LEU-ILE-ARG-GLN-LEU-ALA-ARG-ARG-CYS-SER-GLU-VAL-ARG-LEU-LEU-VAL-ASP-SER-LYS-ASP-ASP-GLU-ARG-VAL-PRO-ALA-LEU-ASN-LEU-LEU-ILE-CYS-LEU-VAL-SER-ARG-TYR-PHE-ASP-GLN-ARG-ASP-LEU-ALA-ASP-GLU-PRO-SER-LEU-GLU-TYR,GLY-GLN-SER-ASP-ASP-SER-ASP-ILE-TRP-ASP-ASP-THR-ALA-LEU-ILE-LYS-ALA-TYR-ASP-LYS-ALA-VAL-ALA-SER-PHE-LYS,189,26,,Kd=3.3nM,8.481486,8.48,1,A,A,0,A,A,0,,B,A,,1,1,189,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.7461094856262207,0.729362428188324,72.60102081298828,75.28799438476562,0.6874887943267822,0.9445865750312804,0.7255849242210388,0.8026480674743652,0.6727522611618042,0.7110409736633301,GQSDDSDIWDDTALIKAYDKAVASFK,Moderate,"(8.383, 8.824]",train
2LKM,protein-peptide,Q96QT6 Q9UBU8,SNAEVKVKIPEELKPWLVDDWDLITRQKQLFYLPAKKNVDSILEDYANYRKSRGNTDNKEYAVNEVVAGIKEYFNVMLGTQLLYKFERPQYAEILADHPDAPMSQVYGAPHLLRLFVRIGAMLAYTPLDEKSLALLLNYLHDFLKYLAKNSATLFSASDYEVAPPEYHRKAV,DYVQPQLRRPFELLIAAAMERNPTQFQLPNELTCTTALPGSS,SER-ASN-ALA-GLU-VAL-LYS-VAL-LYS-ILE-PRO-GLU-GLU-LEU-LYS-PRO-TRP-LEU-VAL-ASP-ASP-TRP-ASP-LEU-ILE-THR-ARG-GLN-LYS-GLN-LEU-PHE-TYR-LEU-PRO-ALA-LYS-LYS-ASN-VAL-ASP-SER-ILE-LEU-GLU-ASP-TYR-ALA-ASN-TYR-ARG-LYS-SER-ARG-GLY-ASN-THR-ASP-ASN-LYS-GLU-TYR-ALA-VAL-ASN-GLU-VAL-VAL-ALA-GLY-ILE-LYS-GLU-TYR-PHE-ASN-VAL-MET-LEU-GLY-THR-GLN-LEU-LEU-TYR-LYS-PHE-GLU-ARG-PRO-GLN-TYR-ALA-GLU-ILE-LEU-ALA-ASP-HIS-PRO-ASP-ALA-PRO-MET-SER-GLN-VAL-TYR-GLY-ALA-PRO-HIS-LEU-LEU-ARG-LEU-PHE-VAL-ARG-ILE-GLY-ALA-MET-LEU-ALA-TYR-THR-PRO-LEU-ASP-GLU-LYS-SER-LEU-ALA-LEU-LEU-LEU-ASN-TYR-LEU-HIS-ASP-PHE-LEU-LYS-TYR-LEU-ALA-LYS-ASN-SER-ALA-THR-LEU-PHE-SER-ALA-SER-ASP-TYR-GLU-VAL-ALA-PRO-PRO-GLU-TYR-HIS-ARG-LYS-ALA-VAL,ASP-TYR-VAL-GLN-PRO-GLN-LEU-ARG-ARG-PRO-PHE-GLU-LEU-LEU-ILE-ALA-ALA-ALA-MET-GLU-ARG-ASN-PRO-THR-GLN-PHE-GLN-LEU-PRO-ASN-GLU-LEU-THR-CYS-THR-THR-ALA-LEU-PRO-GLY-SER-SER,172,42,,Kd=12nM,7.920819,7.92,1,A,A,0,A,A,0,,A,B,,1,1,172,42,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9692878723144532,0.6561672687530518,91.97736358642578,74.90583801269531,0.409510999917984,1.116872787475586,0.8909388780593872,0.737591028213501,0.8662115931510925,0.6358112692832947,DYVQPQLRRPFELLIAAAMERNPTQFQLPNELTCTTALPGSS,Moderate,"(7.523, 7.921]",train
2LNK,protein-peptide,P35579 P26447,MRGSHHHHHHGSMACPLEKALDVMVSTFHKYSGKEGDKFKLNKSELKELLTRELPSFLGKRTDEAAFQKLMSNLDSNRDNEVDFQEYCVFLSCIAMMCNEFFEGFPDKQPRKK,QRELEDATETADAMNREVSSLKNKLRRGDLPFVVPRRMA,MET-ARG-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-SER-MET-ALA-CYS-PRO-LEU-GLU-LYS-ALA-LEU-ASP-VAL-MET-VAL-SER-THR-PHE-HIS-LYS-TYR-SER-GLY-LYS-GLU-GLY-ASP-LYS-PHE-LYS-LEU-ASN-LYS-SER-GLU-LEU-LYS-GLU-LEU-LEU-THR-ARG-GLU-LEU-PRO-SER-PHE-LEU-GLY-LYS-ARG-THR-ASP-GLU-ALA-ALA-PHE-GLN-LYS-LEU-MET-SER-ASN-LEU-ASP-SER-ASN-ARG-ASP-ASN-GLU-VAL-ASP-PHE-GLN-GLU-TYR-CYS-VAL-PHE-LEU-SER-CYS-ILE-ALA-MET-MET-CYS-ASN-GLU-PHE-PHE-GLU-GLY-PHE-PRO-ASP-LYS-GLN-PRO-ARG-LYS-LYS,GLN-ARG-GLU-LEU-GLU-ASP-ALA-THR-GLU-THR-ALA-ASP-ALA-MET-ASN-ARG-GLU-VAL-SER-SER-LEU-LYS-ASN-LYS-LEU-ARG-ARG-GLY-ASP-LEU-PRO-PHE-VAL-VAL-PRO-ARG-ARG-MET-ALA,113,39,,Kd=4nM,8.39794,8.4,1,A,A,0,A,A,0,,C,A,dimer,1,1,113,39,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.9743269681930542,0.6179504990577698,72.81607055664062,54.029109954833984,0.4530882239341736,1.1959528923034668,0.802082359790802,0.623272716999054,0.7747893929481506,0.5391862988471985,QRELEDATETADAMNREVSSLKNKLRRGDLPFVVPRRMA,Moderate,"(8.383, 8.824]",train
2LP0,protein-peptide,O75496 P31274,TRKKRCPYTKYQTLELEKEFLFNMYLTRDRRYEVARVLNLTERQVKIWFQNRRMKMKKMN,NQEFDSEEETVEDSLVEDSE,THR-ARG-LYS-LYS-ARG-CYS-PRO-TYR-THR-LYS-TYR-GLN-THR-LEU-GLU-LEU-GLU-LYS-GLU-PHE-LEU-PHE-ASN-MET-TYR-LEU-THR-ARG-ASP-ARG-ARG-TYR-GLU-VAL-ALA-ARG-VAL-LEU-ASN-LEU-THR-GLU-ARG-GLN-VAL-LYS-ILE-TRP-PHE-GLN-ASN-ARG-ARG-MET-LYS-MET-LYS-LYS-MET-ASN,ASN-GLN-GLU-PHE-ASP-SER-GLU-GLU-GLU-THR-VAL-GLU-ASP-SER-LEU-VAL-GLU-ASP-SER-GLU,60,20,,Kd=22.2uM,4.653647,4.65,1,A,A,0,A,A,0,,B,A,,1,1,60,20,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O,0.9086689949035645,0.6965087056159973,91.5944595336914,87.45685577392578,0.374885618686676,0.8857001662254333,0.8465701937675476,0.7467918992042542,0.7366936802864075,0.6839378476142883,NQEFDSEEETVEDSLVEDSE,Low,"(4.606, 4.745]",train
2LPB,protein-peptide,P03069 P19659,QRRQLTPQQQQLVNQMKVAPIPKQLLQRIPNIPPNINTWQQVTALAQQKLLTPQDMEAAKEVYKIHQQLLFKARLQQQQAQ,STDSTPMFEYENLEDNSKEWTSLFDNDIPVTTDD,GLN-ARG-ARG-GLN-LEU-THR-PRO-GLN-GLN-GLN-GLN-LEU-VAL-ASN-GLN-MET-LYS-VAL-ALA-PRO-ILE-PRO-LYS-GLN-LEU-LEU-GLN-ARG-ILE-PRO-ASN-ILE-PRO-PRO-ASN-ILE-ASN-THR-TRP-GLN-GLN-VAL-THR-ALA-LEU-ALA-GLN-GLN-LYS-LEU-LEU-THR-PRO-GLN-ASP-MET-GLU-ALA-ALA-LYS-GLU-VAL-TYR-LYS-ILE-HIS-GLN-GLN-LEU-LEU-PHE-LYS-ALA-ARG-LEU-GLN-GLN-GLN-GLN-ALA-GLN,SER-THR-ASP-SER-THR-PRO-MET-PHE-GLU-TYR-GLU-ASN-LEU-GLU-ASP-ASN-SER-LYS-GLU-TRP-THR-SER-LEU-PHE-ASP-ASN-ASP-ILE-PRO-VAL-THR-THR-ASP-ASP,81,34,,Kd=10.1uM,4.995679,5.0,1,A,A,0,A,A,0,,B,A,,1,1,81,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O,0.946366548538208,0.6567094326019287,81.621337890625,70.6533432006836,0.4454770386219024,1.0237042903900146,0.8182404637336731,0.7074359059333801,0.750137209892273,0.6440277695655823,STDSTPMFEYENLEDNSKEWTSLFDNDIPVTTDD,Low,"(4.866, 5.014]",train
2LQC,protein-peptide,Q13936 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMK,GTGAALSWQAAIDAARQAKLMGSA,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS,GLY-THR-GLY-ALA-ALA-LEU-SER-TRP-GLN-ALA-ALA-ILE-ASP-ALA-ALA-ARG-GLN-ALA-LYS-LEU-MET-GLY-SER-ALA,77,24,,Kd=2.9uM,5.537602,5.54,1,A,A,0,A,A,0,,B,A,,1,1,77,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.8621500730514526,0.7172989845275879,80.64166259765625,60.42772674560547,0.4364047050476074,0.8441506624221802,0.8127205967903137,0.7742217779159546,0.7259925007820129,0.7030682563781738,GTGAALSWQAAIDAARQAKLMGSA,Low,"(5.463, 5.6]",train
2M04,protein-peptide,Q9BXH1 Q07817,MSAMSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQERLEHHHHHH,EEQWAREIGAQLRRMADDLNAQYER,MET-SER-ALA-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLU-GLU-GLN-TRP-ALA-ARG-GLU-ILE-GLY-ALA-GLN-LEU-ARG-ARG-MET-ALA-ASP-ASP-LEU-ASN-ALA-GLN-TYR-GLU-ARG,180,25,,Kd=10nM,8.0,8.0,1,A,A,0,A,A,0,,B,A,,1,1,180,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.926343560218811,0.775356650352478,75.06737518310547,72.58216094970703,0.5126016736030579,0.9827595949172974,0.8485517501831055,0.7921625971794128,0.906157374382019,0.7017106413841248,EEQWAREIGAQLRRMADDLNAQYER,Moderate,"(7.921, 8.383]",train
2M5B,protein-peptide,P55957 Q16611,ALPSASEEQVAQDTEEVFRSYVFYRHQQEQEAEGVAAPADPEMVTLPLQPSSTMGQVGRQLAIIGDDINRRYDSEFQTMLQHLQPTAENAYEYFTKIATSLFESGINWGRVVALLGFGYRLALHVYQHGLTGFLGQVTRFVVDFMLHHCIARWIAQRGGWVAALNLGNG,EDIIRNIARHLALVGDLLDRSI,ALA-LEU-PRO-SER-ALA-SER-GLU-GLU-GLN-VAL-ALA-GLN-ASP-THR-GLU-GLU-VAL-PHE-ARG-SER-TYR-VAL-PHE-TYR-ARG-HIS-GLN-GLN-GLU-GLN-GLU-ALA-GLU-GLY-VAL-ALA-ALA-PRO-ALA-ASP-PRO-GLU-MET-VAL-THR-LEU-PRO-LEU-GLN-PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU-PHE-GLN-THR-MET-LEU-GLN-HIS-LEU-GLN-PRO-THR-ALA-GLU-ASN-ALA-TYR-GLU-TYR-PHE-THR-LYS-ILE-ALA-THR-SER-LEU-PHE-GLU-SER-GLY-ILE-ASN-TRP-GLY-ARG-VAL-VAL-ALA-LEU-LEU-GLY-PHE-GLY-TYR-ARG-LEU-ALA-LEU-HIS-VAL-TYR-GLN-HIS-GLY-LEU-THR-GLY-PHE-LEU-GLY-GLN-VAL-THR-ARG-PHE-VAL-VAL-ASP-PHE-MET-LEU-HIS-HIS-CYS-ILE-ALA-ARG-TRP-ILE-ALA-GLN-ARG-GLY-GLY-TRP-VAL-ALA-ALA-LEU-ASN-LEU-GLY-ASN-GLY,GLU-ASP-ILE-ILE-ARG-ASN-ILE-ALA-ARG-HIS-LEU-ALA-MK8-VAL-GLY-ASP-MK8-NLE-ASP-ARG-SER-ILE-NH2,169,23,,Kd=10uM,5.0,5.0,1,A,A,0,A,A,0,,B,A,,1,1,169,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O,CCCCC(NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C(C)(N)CCCC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,CCCCC(NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C(C)(N)CCCC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,0.9722591638565063,0.6935200095176697,79.63213348388672,76.7278060913086,0.4278554320335388,0.9628309011459352,0.8924943208694458,0.7988842129707336,0.9202108383178712,0.6671789288520813,EDIIRNIARHLALVGDLLDRSI,Low,"(4.866, 5.014]",train
2MAK,protein-peptide,Q13586 Q96D31,GSHMASSRQKYAEEELEQVREALRKAEKELESHSSWYAPEALQKWLQLTHEVEVQYYNIKKQNAEKQLLVAKEGAEKIKKKR,GSELNELAEFARLQDQLDHRGDH,GLY-SER-HIS-MET-ALA-SER-SER-ARG-GLN-LYS-TYR-ALA-GLU-GLU-GLU-LEU-GLU-GLN-VAL-ARG-GLU-ALA-LEU-ARG-LYS-ALA-GLU-LYS-GLU-LEU-GLU-SER-HIS-SER-SER-TRP-TYR-ALA-PRO-GLU-ALA-LEU-GLN-LYS-TRP-LEU-GLN-LEU-THR-HIS-GLU-VAL-GLU-VAL-GLN-TYR-TYR-ASN-ILE-LYS-LYS-GLN-ASN-ALA-GLU-LYS-GLN-LEU-LEU-VAL-ALA-LYS-GLU-GLY-ALA-GLU-LYS-ILE-LYS-LYS-LYS-ARG,GLY-SER-GLU-LEU-ASN-GLU-LEU-ALA-GLU-PHE-ALA-ARG-LEU-GLN-ASP-GLN-LEU-ASP-HIS-ARG-GLY-ASP-HIS,82,23,,Kd=310uM,3.508638,3.51,1,A,A,0,A,A,0,,B,A,dimer,1,1,82,23,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8250138759613037,0.7006592154502869,77.70805358886719,72.27812194824219,0.4514437615871429,1.068405032157898,0.7214096784591675,0.6348738670349121,0.7318673133850098,0.572288453578949,GSELNELAEFARLQDQLDHRGDH,Low,"(2.044, 3.548]",train
2MFQ,protein-peptide,Q16620 Q8WU20,SHMDTVPDNHRNKFKVINVDDDGNELGSGIMELTDTELILYTRKRDSVKWHYLCLRRYGYDSNLFSFESGRRCQTGQGIFAFKCARAEELFNMLQEIMQNNSINVVEEPVVERNN,GPDAVIIGMTKIPVIENPQYFGI,SER-HIS-MET-ASP-THR-VAL-PRO-ASP-ASN-HIS-ARG-ASN-LYS-PHE-LYS-VAL-ILE-ASN-VAL-ASP-ASP-ASP-GLY-ASN-GLU-LEU-GLY-SER-GLY-ILE-MET-GLU-LEU-THR-ASP-THR-GLU-LEU-ILE-LEU-TYR-THR-ARG-LYS-ARG-ASP-SER-VAL-LYS-TRP-HIS-TYR-LEU-CYS-LEU-ARG-ARG-TYR-GLY-TYR-ASP-SER-ASN-LEU-PHE-SER-PHE-GLU-SER-GLY-ARG-ARG-CYS-GLN-THR-GLY-GLN-GLY-ILE-PHE-ALA-PHE-LYS-CYS-ALA-ARG-ALA-GLU-GLU-LEU-PHE-ASN-MET-LEU-GLN-GLU-ILE-MET-GLN-ASN-ASN-SER-ILE-ASN-VAL-VAL-GLU-GLU-PRO-VAL-VAL-GLU-ARG-ASN-ASN,GLY-PRO-ASP-ALA-VAL-ILE-ILE-GLY-MET-THR-LYS-ILE-PRO-VAL-ILE-GLU-ASN-PRO-GLN-PTR-PHE-GLY-ILE,115,23,,Kd=5.2uM,5.283997,5.28,1,A,A,0,A,A,0,,B,A,,1,1,115,23,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O,0.9925239086151124,0.8477214574813843,88.7259292602539,84.71861267089844,0.4292447566986084,0.7319685816764832,0.8699397444725037,0.83028244972229,0.8329525589942932,0.7814290523529053,GPDAVIIGMTKIPVIENPQYFGI,Low,"(5.222, 5.31]",train
2MNU,protein-peptide,P02751,GSEVPQLTDLSFVDITDSSIGLRWTPLNSSTIIGYRITVVAAGEGIPIFEDFVDSSVGYYTVTGLEPGIDYDISVITLINGGESAPTTLTQQT,SSSPIQGSWTWENGKWTWKGIIRLEQ,GLY-SER-GLU-VAL-PRO-GLN-LEU-THR-ASP-LEU-SER-PHE-VAL-ASP-ILE-THR-ASP-SER-SER-ILE-GLY-LEU-ARG-TRP-THR-PRO-LEU-ASN-SER-SER-THR-ILE-ILE-GLY-TYR-ARG-ILE-THR-VAL-VAL-ALA-ALA-GLY-GLU-GLY-ILE-PRO-ILE-PHE-GLU-ASP-PHE-VAL-ASP-SER-SER-VAL-GLY-TYR-TYR-THR-VAL-THR-GLY-LEU-GLU-PRO-GLY-ILE-ASP-TYR-ASP-ILE-SER-VAL-ILE-THR-LEU-ILE-ASN-GLY-GLY-GLU-SER-ALA-PRO-THR-THR-LEU-THR-GLN-GLN-THR,SER-SER-SER-PRO-ILE-GLN-GLY-SER-TRP-THR-TRP-GLU-ASN-GLY-LYS-TRP-THR-TRP-LYS-GLY-ILE-ILE-ARG-LEU-GLU-GLN,93,26,,Kd=230nM,6.638272,6.64,1,A,A,0,A,A,0,,B,A,,1,1,93,26,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9973846077919006,0.7169125080108643,84.64469146728516,69.4066162109375,0.5596675872802734,1.061192274093628,0.786168098449707,0.6328853368759155,0.7718273997306824,0.5497472286224365,SSSPIQGSWTWENGKWTWKGIIRLEQ,Low,"(6.523, 6.696]",train
2MRE,protein-peptide,Q9NS91 P0CG48,GSHMQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,GSRQVTKVDCPVCGVNIPESHINKHLDSCLSRE,GLY-SER-HIS-MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,GLY-SER-ARG-GLN-VAL-THR-LYS-VAL-ASP-CYS-PRO-VAL-CYS-GLY-VAL-ASN-ILE-PRO-GLU-SER-HIS-ILE-ASN-LYS-HIS-LEU-ASP-SER-CYS-LEU-SER-ARG-GLU,79,33,,Kd=19uM,4.721246,4.72,1,A,A,0,A,A,0,,B,A,,1,1,79,33,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)O)C(C)C)C(C)C)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O)C(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O)C(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8483999371528625,0.5658779740333557,80.79402923583984,73.67756652832031,0.3605246245861053,1.18131422996521,0.8861995935440063,0.6416455507278442,0.8166285157203674,0.54693603515625,GSRQVTKVDCPVCGVNIPESHINKHLDSCLSRE,Low,"(4.606, 4.745]",train
2MUR,protein-peptide,Q6NZ36 P62987,SHMQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQLEDGRTLSDYNIQKESTLHLVLRLRGG,SHMGAAALRSCPMCQKEFAPRLTQLDVDSHLAQCLAESTEDVTW,SER-HIS-MET-GLN-ILE-PHE-VAL-LYS-THR-LEU-THR-GLY-LYS-THR-ILE-THR-LEU-GLU-VAL-GLU-PRO-SER-ASP-THR-ILE-GLU-ASN-VAL-LYS-ALA-LYS-ILE-GLN-ASP-LYS-GLU-GLY-ILE-PRO-PRO-ASP-GLN-GLN-ARG-LEU-ILE-PHE-ALA-GLY-LYS-GLN-LEU-GLU-ASP-GLY-ARG-THR-LEU-SER-ASP-TYR-ASN-ILE-GLN-LYS-GLU-SER-THR-LEU-HIS-LEU-VAL-LEU-ARG-LEU-ARG-GLY-GLY,SER-HIS-MET-GLY-ALA-ALA-ALA-LEU-ARG-SER-CYS-PRO-MET-CYS-GLN-LYS-GLU-PHE-ALA-PRO-ARG-LEU-THR-GLN-LEU-ASP-VAL-ASP-SER-HIS-LEU-ALA-GLN-CYS-LEU-ALA-GLU-SER-THR-GLU-ASP-VAL-THR-TRP,78,44,,Kd=9.26uM,5.033389,5.03,1,A,A,0,A,A,0,,A,B,,1,1,78,44,0,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,0.865608811378479,0.4529745578765869,72.4325942993164,66.79298400878906,0.3589367270469665,1.600190281867981,0.8891358971595764,0.5299367308616638,0.8238663077354431,0.4337339997291565,SHMGAAALRSCPMCQKEFAPRLTQLDVDSHLAQCLAESTEDVTW,Low,"(5.014, 5.105]",train
2MV7,protein-peptide,P42568 Q8TEK3,DKAYLDELVELHRRLMTLRERHILQQIVNLIEETGHFHITNTTFDFDLCSLDKTTVRKLQSYLETSGTS,TNKLPVSIPLASVVLPSRAERARST,ASP-LYS-ALA-TYR-LEU-ASP-GLU-LEU-VAL-GLU-LEU-HIS-ARG-ARG-LEU-MET-THR-LEU-ARG-GLU-ARG-HIS-ILE-LEU-GLN-GLN-ILE-VAL-ASN-LEU-ILE-GLU-GLU-THR-GLY-HIS-PHE-HIS-ILE-THR-ASN-THR-THR-PHE-ASP-PHE-ASP-LEU-CYS-SER-LEU-ASP-LYS-THR-THR-VAL-ARG-LYS-LEU-GLN-SER-TYR-LEU-GLU-THR-SER-GLY-THR-SER,THR-ASN-LYS-LEU-PRO-VAL-SER-ILE-PRO-LEU-ALA-SER-VAL-VAL-LEU-PRO-SER-ARG-ALA-GLU-ARG-ALA-ARG-SER-THR,69,25,,Kd=1.56nM,8.806875,8.81,1,A,A,0,A,A,0,,B,A,,1,1,69,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(C)C,0.991188108921051,0.7144838571548462,94.72832489013672,82.01081848144531,0.3612056076526642,0.6811445355415344,0.8632985949516296,0.7656408548355103,0.8569369912147522,0.7016946077346802,TNKLPVSIPLASVVLPSRAERARST,Moderate,"(8.383, 8.824]",val
2N2H,protein-peptide,Q60520 Q8BR65,SNAEHIYRCEDERFELDVVLETNLATIRVLEAIQKKLSRLSAEEQAKFRLDNTLGGTSEVIHRKALQRIYADKAADIIDGLRKNPSIAVPIVLKRLKMKEEEWREAQRGFNKVWREQNEKYYLKS,SNAAQLNYLLTDEQIMEDLRTLNKLKS,SER-ASN-ALA-GLU-HIS-ILE-TYR-ARG-CYS-GLU-ASP-GLU-ARG-PHE-GLU-LEU-ASP-VAL-VAL-LEU-GLU-THR-ASN-LEU-ALA-THR-ILE-ARG-VAL-LEU-GLU-ALA-ILE-GLN-LYS-LYS-LEU-SER-ARG-LEU-SER-ALA-GLU-GLU-GLN-ALA-LYS-PHE-ARG-LEU-ASP-ASN-THR-LEU-GLY-GLY-THR-SER-GLU-VAL-ILE-HIS-ARG-LYS-ALA-LEU-GLN-ARG-ILE-TYR-ALA-ASP-LYS-ALA-ALA-ASP-ILE-ILE-ASP-GLY-LEU-ARG-LYS-ASN-PRO-SER-ILE-ALA-VAL-PRO-ILE-VAL-LEU-LYS-ARG-LEU-LYS-MET-LYS-GLU-GLU-GLU-TRP-ARG-GLU-ALA-GLN-ARG-GLY-PHE-ASN-LYS-VAL-TRP-ARG-GLU-GLN-ASN-GLU-LYS-TYR-TYR-LEU-LYS-SER,SER-ASN-ALA-ALA-GLN-LEU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLN-ILE-MET-GLU-ASP-LEU-ARG-THR-LEU-ASN-LYS-LEU-LYS-SER,125,27,,Kd=0.93uM,6.031517,6.03,1,A,A,0,A,A,0,,A,B,,1,1,125,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,1.030092477798462,0.6791691184043884,93.46542358398438,80.55695343017578,0.3461484909057617,1.0145121812820437,0.9004936218261719,0.7505077719688416,0.9062422513961792,0.6613344550132751,SNAAQLNYLLTDEQIMEDLRTLNKLKS,Low,"(5.959, 6.097]",train
2ODG,protein-peptide,O75531 P50402,MTTSQKHRDFVAEPMGEKPVGSLAGIGEVLGKKLEERGFDKAYVVLGQFLVLKKDEDLFREWLKDTCGANAKQSRDCFGCLREWCDAFL,HDNYADLSDTELTTLLRRYNIPHGPVVGSTRRLYEKKIFEYETQRRR,MET-THR-THR-SER-GLN-LYS-HIS-ARG-ASP-PHE-VAL-ALA-GLU-PRO-MET-GLY-GLU-LYS-PRO-VAL-GLY-SER-LEU-ALA-GLY-ILE-GLY-GLU-VAL-LEU-GLY-LYS-LYS-LEU-GLU-GLU-ARG-GLY-PHE-ASP-LYS-ALA-TYR-VAL-VAL-LEU-GLY-GLN-PHE-LEU-VAL-LEU-LYS-LYS-ASP-GLU-ASP-LEU-PHE-ARG-GLU-TRP-LEU-LYS-ASP-THR-CYS-GLY-ALA-ASN-ALA-LYS-GLN-SER-ARG-ASP-CYS-PHE-GLY-CYS-LEU-ARG-GLU-TRP-CYS-ASP-ALA-PHE-LEU,HIS-ASP-ASN-TYR-ALA-ASP-LEU-SER-ASP-THR-GLU-LEU-THR-THR-LEU-LEU-ARG-ARG-TYR-ASN-ILE-PRO-HIS-GLY-PRO-VAL-VAL-GLY-SER-THR-ARG-ARG-LEU-TYR-GLU-LYS-LYS-ILE-PHE-GLU-TYR-GLU-THR-GLN-ARG-ARG-ARG,89,47,,Kd=0.59uM,6.229148,6.23,1,A,A,0,A,A,0,,C,A,dimer,1,1,89,47,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8065385818481445,,75.93778228759766,,0.3554162383079529,,0.88187575340271,,0.7877042889595032,,HDNYADLSDTELTTLLRRYNIPHGPVVGSTRRLYEKKIFEYETQRRR,Low,"(6.097, 6.26]",train
2OT8,protein-peptide,P52272 Q92973,MEYEWKPDEQGLQQILQLLKESQSPDTTIQRTVQQKLEQLNQYPDFNNYLIFVLTKLKSEDEPTRSLSGLILKNNVKAHFQNFPNGVTDFIKSECLNNIGDSSPLIRATVGILITTIASKGELQNWPDLLPKLCSLLDSEDYNTCEGAFGALQKICEDSAEILDSDVLDRPLNIMIPKFLQFFKHSSPKIRSHAVACVNQFIISRTQALMLHIDSFIENLFALAGDEEPEVRKNVCRALVMLLEVRMDRLLPHMHNIVEYMLQRTQDQDENVALEACEFWLTLAEQPICKDVLVRHLPKLIPVLVNGMKYSDIDIILLKGDVEGGSGGDDTISDWNLRKCSAAALDVLANVYRDELLPHILPLLKELLFHHEWVVKESGILVLGAIAEGCMQGMIPYLPELIPHLIQCLSDKKALVRSITCWTLSRYAHWVVSQPPDTYLKPLMTELLKRILDSNKRVQEAACSAFATLEEEACTELVPYLAYILDTLVFAFSKYQHKNLLILYDAIGTLADSVGHHLNKPEYIQMLMPPLIQKWNMLKDEDKDLFPLLECLSSVATALQSGFLPYCEPVYQRCVNLVQKTLAQAMLNNAQPDQYEAPDKDFMIVALDLLSGLAEGLGGNIEQLVARSNILTLMYQCMQDKMPEVRQSSFALLGDLTKACFQHVKPCIADFMPILGTNLNPEFISVCNNATWAIGEISIQMGIEMQPYIPMVLHQLVEIINRPNTPKTLLENTAITIGRLGYVCPQEVAPMLQQFIRPWCTSLRNIRDNEEKDSAFRGICTMISVNPSGVIQDFIFFCDAVASWINPKDDLRDMFCKILHGFKNQVGDENWRRFSDQFPLPLKERLAAFYGV,ERPAQNEKRKEKNIKRGGNRFEPYANPTKR,MET-GLU-TYR-GLU-TRP-LYS-PRO-ASP-GLU-GLN-GLY-LEU-GLN-GLN-ILE-LEU-GLN-LEU-LEU-LYS-GLU-SER-GLN-SER-PRO-ASP-THR-THR-ILE-GLN-ARG-THR-VAL-GLN-GLN-LYS-LEU-GLU-GLN-LEU-ASN-GLN-TYR-PRO-ASP-PHE-ASN-ASN-TYR-LEU-ILE-PHE-VAL-LEU-THR-LYS-LEU-LYS-SER-GLU-ASP-GLU-PRO-THR-ARG-SER-LEU-SER-GLY-LEU-ILE-LEU-LYS-ASN-ASN-VAL-LYS-ALA-HIS-PHE-GLN-ASN-PHE-PRO-ASN-GLY-VAL-THR-ASP-PHE-ILE-LYS-SER-GLU-CYS-LEU-ASN-ASN-ILE-GLY-ASP-SER-SER-PRO-LEU-ILE-ARG-ALA-THR-VAL-GLY-ILE-LEU-ILE-THR-THR-ILE-ALA-SER-LYS-GLY-GLU-LEU-GLN-ASN-TRP-PRO-ASP-LEU-LEU-PRO-LYS-LEU-CYS-SER-LEU-LEU-ASP-SER-GLU-ASP-TYR-ASN-THR-CYS-GLU-GLY-ALA-PHE-GLY-ALA-LEU-GLN-LYS-ILE-CYS-GLU-ASP-SER-ALA-GLU-ILE-LEU-ASP-SER-ASP-VAL-LEU-ASP-ARG-PRO-LEU-ASN-ILE-MET-ILE-PRO-LYS-PHE-LEU-GLN-PHE-PHE-LYS-HIS-SER-SER-PRO-LYS-ILE-ARG-SER-HIS-ALA-VAL-ALA-CYS-VAL-ASN-GLN-PHE-ILE-ILE-SER-ARG-THR-GLN-ALA-LEU-MET-LEU-HIS-ILE-ASP-SER-PHE-ILE-GLU-ASN-LEU-PHE-ALA-LEU-ALA-GLY-ASP-GLU-GLU-PRO-GLU-VAL-ARG-LYS-ASN-VAL-CYS-ARG-ALA-LEU-VAL-MET-LEU-LEU-GLU-VAL-ARG-MET-ASP-ARG-LEU-LEU-PRO-HIS-MET-HIS-ASN-ILE-VAL-GLU-TYR-MET-LEU-GLN-ARG-THR-GLN-ASP-GLN-ASP-GLU-ASN-VAL-ALA-LEU-GLU-ALA-CYS-GLU-PHE-TRP-LEU-THR-LEU-ALA-GLU-GLN-PRO-ILE-CYS-LYS-ASP-VAL-LEU-VAL-ARG-HIS-LEU-PRO-LYS-LEU-ILE-PRO-VAL-LEU-VAL-ASN-GLY-MET-LYS-TYR-SER-ASP-ILE-ASP-ILE-ILE-LEU-LEU-LYS-GLY-ASP-VAL-GLU-GLY-GLY-SER-GLY-GLY-ASP-ASP-THR-ILE-SER-ASP-TRP-ASN-LEU-ARG-LYS-CYS-SER-ALA-ALA-ALA-LEU-ASP-VAL-LEU-ALA-ASN-VAL-TYR-ARG-ASP-GLU-LEU-LEU-PRO-HIS-ILE-LEU-PRO-LEU-LEU-LYS-GLU-LEU-LEU-PHE-HIS-HIS-GLU-TRP-VAL-VAL-LYS-GLU-SER-GLY-ILE-LEU-VAL-LEU-GLY-ALA-ILE-ALA-GLU-GLY-CYS-MET-GLN-GLY-MET-ILE-PRO-TYR-LEU-PRO-GLU-LEU-ILE-PRO-HIS-LEU-ILE-GLN-CYS-LEU-SER-ASP-LYS-LYS-ALA-LEU-VAL-ARG-SER-ILE-THR-CYS-TRP-THR-LEU-SER-ARG-TYR-ALA-HIS-TRP-VAL-VAL-SER-GLN-PRO-PRO-ASP-THR-TYR-LEU-LYS-PRO-LEU-MET-THR-GLU-LEU-LEU-LYS-ARG-ILE-LEU-ASP-SER-ASN-LYS-ARG-VAL-GLN-GLU-ALA-ALA-CYS-SER-ALA-PHE-ALA-THR-LEU-GLU-GLU-GLU-ALA-CYS-THR-GLU-LEU-VAL-PRO-TYR-LEU-ALA-TYR-ILE-LEU-ASP-THR-LEU-VAL-PHE-ALA-PHE-SER-LYS-TYR-GLN-HIS-LYS-ASN-LEU-LEU-ILE-LEU-TYR-ASP-ALA-ILE-GLY-THR-LEU-ALA-ASP-SER-VAL-GLY-HIS-HIS-LEU-ASN-LYS-PRO-GLU-TYR-ILE-GLN-MET-LEU-MET-PRO-PRO-LEU-ILE-GLN-LYS-TRP-ASN-MET-LEU-LYS-ASP-GLU-ASP-LYS-ASP-LEU-PHE-PRO-LEU-LEU-GLU-CYS-LEU-SER-SER-VAL-ALA-THR-ALA-LEU-GLN-SER-GLY-PHE-LEU-PRO-TYR-CYS-GLU-PRO-VAL-TYR-GLN-ARG-CYS-VAL-ASN-LEU-VAL-GLN-LYS-THR-LEU-ALA-GLN-ALA-MET-LEU-ASN-ASN-ALA-GLN-PRO-ASP-GLN-TYR-GLU-ALA-PRO-ASP-LYS-ASP-PHE-MET-ILE-VAL-ALA-LEU-ASP-LEU-LEU-SER-GLY-LEU-ALA-GLU-GLY-LEU-GLY-GLY-ASN-ILE-GLU-GLN-LEU-VAL-ALA-ARG-SER-ASN-ILE-LEU-THR-LEU-MET-TYR-GLN-CYS-MET-GLN-ASP-LYS-MET-PRO-GLU-VAL-ARG-GLN-SER-SER-PHE-ALA-LEU-LEU-GLY-ASP-LEU-THR-LYS-ALA-CYS-PHE-GLN-HIS-VAL-LYS-PRO-CYS-ILE-ALA-ASP-PHE-MET-PRO-ILE-LEU-GLY-THR-ASN-LEU-ASN-PRO-GLU-PHE-ILE-SER-VAL-CYS-ASN-ASN-ALA-THR-TRP-ALA-ILE-GLY-GLU-ILE-SER-ILE-GLN-MET-GLY-ILE-GLU-MET-GLN-PRO-TYR-ILE-PRO-MET-VAL-LEU-HIS-GLN-LEU-VAL-GLU-ILE-ILE-ASN-ARG-PRO-ASN-THR-PRO-LYS-THR-LEU-LEU-GLU-ASN-THR-ALA-ILE-THR-ILE-GLY-ARG-LEU-GLY-TYR-VAL-CYS-PRO-GLN-GLU-VAL-ALA-PRO-MET-LEU-GLN-GLN-PHE-ILE-ARG-PRO-TRP-CYS-THR-SER-LEU-ARG-ASN-ILE-ARG-ASP-ASN-GLU-GLU-LYS-ASP-SER-ALA-PHE-ARG-GLY-ILE-CYS-THR-MET-ILE-SER-VAL-ASN-PRO-SER-GLY-VAL-ILE-GLN-ASP-PHE-ILE-PHE-PHE-CYS-ASP-ALA-VAL-ALA-SER-TRP-ILE-ASN-PRO-LYS-ASP-ASP-LEU-ARG-ASP-MET-PHE-CYS-LYS-ILE-LEU-HIS-GLY-PHE-LYS-ASN-GLN-VAL-GLY-ASP-GLU-ASN-TRP-ARG-ARG-PHE-SER-ASP-GLN-PHE-PRO-LEU-PRO-LEU-LYS-GLU-ARG-LEU-ALA-ALA-PHE-TYR-GLY-VAL,GLU-ARG-PRO-ALA-GLN-ASN-GLU-LYS-ARG-LYS-GLU-LYS-ASN-ILE-LYS-ARG-GLY-GLY-ASN-ARG-PHE-GLU-PRO-TYR-ALA-ASN-PRO-THR-LYS-ARG,852,30,,Kd=20nM,7.69897,7.7,1,A,A,0,A,A,0,,C,A,,1,1,852,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7630730271339417,0.6929707527160645,61.76099395751953,60.771949768066406,0.4905911087989807,1.1376454830169678,0.7897574305534363,0.7873013615608215,0.7351434230804443,0.6693881154060364,ERPAQNEKRKEKNIKRGGNRFEPYANPTKR,Moderate,"(7.523, 7.921]",train
2OTK,protein-peptide,P05067,GSSHHHHHHLQVDNKFNKEMASAGGEIVYLPNLNPDQLCAFIHSLHDDPSQSANLLAEAKKLNDAQAPKVD,DAEFRHDSGYEVHHQKLVFFAEDVGSNKGAIIGLMVGGVV,GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLN-VAL-ASP-ASN-LYS-PHE-ASN-LYS-GLU-MET-ALA-SER-ALA-GLY-GLY-GLU-ILE-VAL-TYR-LEU-PRO-ASN-LEU-ASN-PRO-ASP-GLN-LEU-CYS-ALA-PHE-ILE-HIS-SER-LEU-HIS-ASP-ASP-PRO-SER-GLN-SER-ALA-ASN-LEU-LEU-ALA-GLU-ALA-LYS-LYS-LEU-ASN-ASP-ALA-GLN-ALA-PRO-LYS-VAL-ASP,ASP-ALA-GLU-PHE-ARG-HIS-ASP-SER-GLY-TYR-GLU-VAL-HIS-HIS-GLN-LYS-LEU-VAL-PHE-PHE-ALA-GLU-ASP-VAL-GLY-SER-ASN-LYS-GLY-ALA-ILE-ILE-GLY-LEU-MET-VAL-GLY-GLY-VAL-VAL,71,40,,Kd=17nM,7.769551,7.77,1,A,A,0,A,A,0,,C,E,dimer,1,1,71,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(C)C)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,1.056689739227295,0.5678014755249023,66.60507202148438,55.20718383789063,0.4716043174266815,1.3778992891311646,0.7415077090263367,0.5379656553268433,0.7526022791862488,0.469626635313034,DAEFRHDSGYEVHHQKLVFFAEDVGSNKGAIIGLMVGGVV,Moderate,"(7.523, 7.921]",train
2P1L,protein-peptide,Q07817 Q14457,MSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,GSGTMENLSRRLKVTGDLFDIMSGQTDVDHP,MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,GLY-SER-GLY-THR-MET-GLU-ASN-LEU-SER-ARG-ARG-LEU-LYS-VAL-THR-GLY-ASP-LEU-PHE-ASP-ILE-MET-SER-GLY-GLN-THR-ASP-VAL-ASP-HIS-PRO,153,31,,Kd=2.3uM,5.638272,5.64,1,A,A,0,A,A,0,,B,A,,1,1,153,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.9014202952384948,0.5781320333480835,80.45100402832031,69.36932373046875,0.5688544511795044,1.3085143566131592,0.8163748979568481,0.6698792576789856,0.8173826932907104,0.5511102080345154,GSGTMENLSRRLKVTGDLFDIMSGQTDVDHP,Low,"(5.6, 5.699]",train
2PHE,protein-peptide,P06492 P53999,AMFQIGKMRYVSVRDFKGKVLIDIREYWMDPEGEMKPGRKGISLNPEQWSQLKEQISDIDDAVRKL,YGALDMADFEFEQMFTDALGIDEYGG,ALA-MET-PHE-GLN-ILE-GLY-LYS-MET-ARG-TYR-VAL-SER-VAL-ARG-ASP-PHE-LYS-GLY-LYS-VAL-LEU-ILE-ASP-ILE-ARG-GLU-TYR-TRP-MET-ASP-PRO-GLU-GLY-GLU-MET-LYS-PRO-GLY-ARG-LYS-GLY-ILE-SER-LEU-ASN-PRO-GLU-GLN-TRP-SER-GLN-LEU-LYS-GLU-GLN-ILE-SER-ASP-ILE-ASP-ASP-ALA-VAL-ARG-LYS-LEU,TYR-GLY-ALA-LEU-ASP-MET-ALA-ASP-PHE-GLU-PHE-GLU-GLN-MET-PHE-THR-ASP-ALA-LEU-GLY-ILE-ASP-GLU-TYR-GLY-GLY,66,26,,Kd=15uM,4.823909,4.82,1,A,A,0,A,A,0,,C,A,dimer,1,1,66,26,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CN)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CN)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.765121579170227,0.5476852655410767,79.60193634033203,78.10697174072266,0.5290940999984741,1.0819542407989502,0.7278574109077454,0.6263217329978943,0.5978071689605713,0.5280261039733887,YGALDMADFEFEQMFTDALGIDEYGG,Low,"(4.745, 4.866]",train
2PON,protein-peptide,Q07817 Q14457,MSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYG,GGTMENLSRRLKVTGDLFDIMSG,MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY,GLY-GLY-THR-MET-GLU-ASN-LEU-SER-ARG-ARG-LEU-LYS-VAL-THR-GLY-ASP-LEU-PHE-ASP-ILE-MET-SER-GLY,156,23,,Kd=1.4uM,5.853872,5.85,1,A,A,0,A,A,0,,A,B,,1,1,156,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.9460279941558838,0.7199490666389465,86.07940673828125,83.57112121582031,0.4918447434902191,0.8982208371162415,0.8787863850593567,0.8089828491210938,0.8825311064720154,0.6976906061172485,GGTMENLSRRLKVTGDLFDIMSG,Low,"(5.821, 5.959]",val
2QUR,protein-peptide,P63248 P05132,GNAAAAKKGSEQESVKEFLAKAKEDFLKKWETPSQNTAQLDQFDRIKTLGTGSFGRVMLVKHKESGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVAGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLPNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNADDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGRRNAIHD,GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SER-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-ASP-PHE-LEU-LYS-LYS-TRP-GLU-THR-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-GLN-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-SER-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-ALA-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SER-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-PRO-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-ALA-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-ARG-ARG-ASN-ALA-ILE-HIS-ASP,350,20,,IC50=500nM,6.30103,6.3,1,A,A,0,A,A,0,,B,A,,1,1,350,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9522467851638794,0.7246288061141968,88.25244140625,80.54246520996094,0.4017218947410583,0.9863312840461732,0.9232001900672911,0.858022153377533,0.9206570386886596,0.6823518872261047,TTYADFIASGRTGRRNAIHD,Low,"(6.26, 6.398]",train
2QXV,protein-peptide,Q61188 Q921E6,SFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,KTMFSSNRQKILERTETLNQEWKQRRIQPV,SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,LYS-THR-MET-PHE-SER-SER-ASN-ARG-GLN-LYS-ILE-LEU-GLU-ARG-THR-GLU-THR-LEU-ASN-GLN-GLU-TRP-LYS-GLN-ARG-ARG-ILE-GLN-PRO-VAL,361,30,,Kd=0.38uM,6.420216,6.42,1,A,A,0,A,A,0,,B,A,,1,1,361,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9352097511291504,0.7920324802398682,94.63082122802734,92.67122650146484,0.3480235040187835,0.8210541009902954,0.9479233026504515,0.8789421319961548,0.9128497242927552,0.7703050971031189,KTMFSSNRQKILERTETLNQEWKQRRIQPV,Low,"(6.398, 6.523]",train
2ROZ,protein-peptide,Q9DBR4 P12023,GSSGSSGPTPKTELVQKFRVQYLGMLPVDRPVGMDTLNSAIENLMTSSSKEDWPSVNMNVADATVTVISEKNEEEVLVECRVRFLSFMGVGKDVHTFAFIMDTGNQRFECHVFWCEPNAANVSEAVQAACSGPSSG,DAAVTPEERHLSKMQQNGYENPTYKFFEQMQN,GLY-SER-SER-GLY-SER-SER-GLY-PRO-THR-PRO-LYS-THR-GLU-LEU-VAL-GLN-LYS-PHE-ARG-VAL-GLN-TYR-LEU-GLY-MET-LEU-PRO-VAL-ASP-ARG-PRO-VAL-GLY-MET-ASP-THR-LEU-ASN-SER-ALA-ILE-GLU-ASN-LEU-MET-THR-SER-SER-SER-LYS-GLU-ASP-TRP-PRO-SER-VAL-ASN-MET-ASN-VAL-ALA-ASP-ALA-THR-VAL-THR-VAL-ILE-SER-GLU-LYS-ASN-GLU-GLU-GLU-VAL-LEU-VAL-GLU-CYS-ARG-VAL-ARG-PHE-LEU-SER-PHE-MET-GLY-VAL-GLY-LYS-ASP-VAL-HIS-THR-PHE-ALA-PHE-ILE-MET-ASP-THR-GLY-ASN-GLN-ARG-PHE-GLU-CYS-HIS-VAL-PHE-TRP-CYS-GLU-PRO-ASN-ALA-ALA-ASN-VAL-SER-GLU-ALA-VAL-GLN-ALA-ALA-CYS-SER-GLY-PRO-SER-SER-GLY,ASP-ALA-ALA-VAL-THR-PRO-GLU-GLU-ARG-HIS-LEU-SER-LYS-MET-GLN-GLN-ASN-GLY-TYR-GLU-ASN-PRO-THR-TYR-LYS-PHE-PHE-GLU-GLN-MET-GLN-ASN,136,32,,Kd=0.32uM,6.49485,6.49,1,A,A,0,A,A,0,,A,B,,1,1,136,32,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9690060019493104,0.6453101634979248,80.95648956298828,74.0392074584961,0.4053117632865906,1.0665223598480225,0.8717193603515625,0.6634533405303955,0.8184764385223389,0.5718405246734619,DAAVTPEERHLSKMQQNGYENPTYKFFEQMQN,Low,"(6.398, 6.523]",train
2RR3,protein-peptide,P22059 Q9P0L0,PLGSDHEQILVLDPPTDLKFKGPFTDVVTTNLKLRNPSDRKVCFKVKTTAPRRYCVRPNSGIIDPGSTVTVSVMLQPFDYDPNEKSKHKFMVQTIFAPPNTSDMEAVWKEAKPDELMDSKLRCVFEMPNE,PLGSDHWGKGDMSDEDDENEFFDAPEIITMPENLGHKRTGSHHHHHH,PRO-LEU-GLY-SER-ASP-HIS-GLU-GLN-ILE-LEU-VAL-LEU-ASP-PRO-PRO-THR-ASP-LEU-LYS-PHE-LYS-GLY-PRO-PHE-THR-ASP-VAL-VAL-THR-THR-ASN-LEU-LYS-LEU-ARG-ASN-PRO-SER-ASP-ARG-LYS-VAL-CYS-PHE-LYS-VAL-LYS-THR-THR-ALA-PRO-ARG-ARG-TYR-CYS-VAL-ARG-PRO-ASN-SER-GLY-ILE-ILE-ASP-PRO-GLY-SER-THR-VAL-THR-VAL-SER-VAL-MET-LEU-GLN-PRO-PHE-ASP-TYR-ASP-PRO-ASN-GLU-LYS-SER-LYS-HIS-LYS-PHE-MET-VAL-GLN-THR-ILE-PHE-ALA-PRO-PRO-ASN-THR-SER-ASP-MET-GLU-ALA-VAL-TRP-LYS-GLU-ALA-LYS-PRO-ASP-GLU-LEU-MET-ASP-SER-LYS-LEU-ARG-CYS-VAL-PHE-GLU-MET-PRO-ASN-GLU,PRO-LEU-GLY-SER-ASP-HIS-TRP-GLY-LYS-GLY-ASP-MET-SER-ASP-GLU-ASP-ASP-GLU-ASN-GLU-PHE-PHE-ASP-ALA-PRO-GLU-ILE-ILE-THR-MET-PRO-GLU-ASN-LEU-GLY-HIS-LYS-ARG-THR-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS,130,47,,Kd=2.1uM,5.677781,5.68,1,A,A,0,A,A,0,,B,A,,1,1,130,47,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9495853781700134,0.5468742847442627,83.63407135009766,79.12102508544922,0.4544970691204071,1.6024582386016846,0.825550377368927,0.6284815669059753,0.8111025094985962,0.5264724493026733,PLGSDHWGKGDMSDEDDENEFFDAPEIITMPENLGHKRTGSHHHHHH,Low,"(5.6, 5.699]",train
2VAY,protein-peptide,Q13698 P0DP23,QLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,KFYATFLIQEHFRKFMKRQEE,GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,LYS-PHE-TYR-ALA-THR-PHE-LEU-ILE-GLN-GLU-HIS-PHE-ARG-LYS-PHE-MET-LYS-ARG-GLN-GLU-GLU,146,21,,Kd=7.9nM,8.102373,8.1,1,A,A,0,A,A,0,,B,A,,1,1,146,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.8361029028892517,0.6236903071403503,77.2802963256836,57.896514892578125,0.4715076386928558,1.272171974182129,0.8099442720413208,0.6765996217727661,0.779019832611084,0.6104629635810852,KFYATFLIQEHFRKFMKRQEE,Moderate,"(7.921, 8.383]",val
2VDA,protein-peptide,P10408 Q8CVI4,VFGSRNDRTLRRMRKVVNIINAMEPEMEKLSDEELKGKTAEFRARLEKGEVLENLIPEAFAVVREASKRVFGMRHFDVQLLGGMVLNERCIAEMRTGEGKTLTATLPAYLNALTGKGVHVVTVNDYLAQRDAENNRPLFEFLGLTVGINLPGMPAPAKREAYAADITYGTNNEYGFDYLRDNMAFSPEERVQRKLHYALVDEVDSILIDEARTPLIISGPAEDSSEMYKRVNKIIPHLIRQEKEDSETFQGEGHFSVDEKSRQVNLTERGLVLIEELLVKEGIMDEGESLYSPANIMLMHHVTAALRAHALFTRDVDYIVKDGEVIIVDEHTGRTMQGRRWSDGLHQAVEAKEGVQIQNENQTLASITFQNYFRLYEKLAGMTGTADTEAFEFSSIYKLDTVVVPTNRPMIRKDLPDLVYMTEAEKIQAIIEDIKERTAKGQPVLVGTISIEKSELVSNELTKAGIKHNVLNAKFHANEAAIVAQAGYPAAVTIATNMAGRGTDIVLGGSWQAEVAALENPTAEQIEKIKADWQVRHDAVLEAGGLHIIGTERHESRRIDNQLRGRSGRQGDAGSSRFYLSMEDALMRIFASDRVSGMMRKLGMKPGEAIEHPWVTKAIANAQRKVESRNFDIRKQLLEYDDVANDQRRAIYSQRNELLDVSDVSETINSIREDVFKATIDAYIPPQSLEEMWDIPGLQERLKNDFDLDLPIAEWLDKEPELHEETLRERILAQSIEVYQRKEEVVGAEMMRHFEKGVMLQTLDSLWKEHLAAMDYLRQGIHLRGYAQKDPKQEYKRESFSMFAAMLESLKYEVISTLSKVQVRMPEE,MMITLRKRRKLPLAVAVAAGVMSAQAMA,VAL-PHE-GLY-SER-ARG-ASN-ASP-ARG-THR-LEU-ARG-ARG-MET-ARG-LYS-VAL-VAL-ASN-ILE-ILE-ASN-ALA-MET-GLU-PRO-GLU-MET-GLU-LYS-LEU-SER-ASP-GLU-GLU-LEU-LYS-GLY-LYS-THR-ALA-GLU-PHE-ARG-ALA-ARG-LEU-GLU-LYS-GLY-GLU-VAL-LEU-GLU-ASN-LEU-ILE-PRO-GLU-ALA-PHE-ALA-VAL-VAL-ARG-GLU-ALA-SER-LYS-ARG-VAL-PHE-GLY-MET-ARG-HIS-PHE-ASP-VAL-GLN-LEU-LEU-GLY-GLY-MET-VAL-LEU-ASN-GLU-ARG-CYS-ILE-ALA-GLU-MET-ARG-THR-GLY-GLU-GLY-LYS-THR-LEU-THR-ALA-THR-LEU-PRO-ALA-TYR-LEU-ASN-ALA-LEU-THR-GLY-LYS-GLY-VAL-HIS-VAL-VAL-THR-VAL-ASN-ASP-TYR-LEU-ALA-GLN-ARG-ASP-ALA-GLU-ASN-ASN-ARG-PRO-LEU-PHE-GLU-PHE-LEU-GLY-LEU-THR-VAL-GLY-ILE-ASN-LEU-PRO-GLY-MET-PRO-ALA-PRO-ALA-LYS-ARG-GLU-ALA-TYR-ALA-ALA-ASP-ILE-THR-TYR-GLY-THR-ASN-ASN-GLU-TYR-GLY-PHE-ASP-TYR-LEU-ARG-ASP-ASN-MET-ALA-PHE-SER-PRO-GLU-GLU-ARG-VAL-GLN-ARG-LYS-LEU-HIS-TYR-ALA-LEU-VAL-ASP-GLU-VAL-ASP-SER-ILE-LEU-ILE-ASP-GLU-ALA-ARG-THR-PRO-LEU-ILE-ILE-SER-GLY-PRO-ALA-GLU-ASP-SER-SER-GLU-MET-TYR-LYS-ARG-VAL-ASN-LYS-ILE-ILE-PRO-HIS-LEU-ILE-ARG-GLN-GLU-LYS-GLU-ASP-SER-GLU-THR-PHE-GLN-GLY-GLU-GLY-HIS-PHE-SER-VAL-ASP-GLU-LYS-SER-ARG-GLN-VAL-ASN-LEU-THR-GLU-ARG-GLY-LEU-VAL-LEU-ILE-GLU-GLU-LEU-LEU-VAL-LYS-GLU-GLY-ILE-MET-ASP-GLU-GLY-GLU-SER-LEU-TYR-SER-PRO-ALA-ASN-ILE-MET-LEU-MET-HIS-HIS-VAL-THR-ALA-ALA-LEU-ARG-ALA-HIS-ALA-LEU-PHE-THR-ARG-ASP-VAL-ASP-TYR-ILE-VAL-LYS-ASP-GLY-GLU-VAL-ILE-ILE-VAL-ASP-GLU-HIS-THR-GLY-ARG-THR-MET-GLN-GLY-ARG-ARG-TRP-SER-ASP-GLY-LEU-HIS-GLN-ALA-VAL-GLU-ALA-LYS-GLU-GLY-VAL-GLN-ILE-GLN-ASN-GLU-ASN-GLN-THR-LEU-ALA-SER-ILE-THR-PHE-GLN-ASN-TYR-PHE-ARG-LEU-TYR-GLU-LYS-LEU-ALA-GLY-MET-THR-GLY-THR-ALA-ASP-THR-GLU-ALA-PHE-GLU-PHE-SER-SER-ILE-TYR-LYS-LEU-ASP-THR-VAL-VAL-VAL-PRO-THR-ASN-ARG-PRO-MET-ILE-ARG-LYS-ASP-LEU-PRO-ASP-LEU-VAL-TYR-MET-THR-GLU-ALA-GLU-LYS-ILE-GLN-ALA-ILE-ILE-GLU-ASP-ILE-LYS-GLU-ARG-THR-ALA-LYS-GLY-GLN-PRO-VAL-LEU-VAL-GLY-THR-ILE-SER-ILE-GLU-LYS-SER-GLU-LEU-VAL-SER-ASN-GLU-LEU-THR-LYS-ALA-GLY-ILE-LYS-HIS-ASN-VAL-LEU-ASN-ALA-LYS-PHE-HIS-ALA-ASN-GLU-ALA-ALA-ILE-VAL-ALA-GLN-ALA-GLY-TYR-PRO-ALA-ALA-VAL-THR-ILE-ALA-THR-ASN-MET-ALA-GLY-ARG-GLY-THR-ASP-ILE-VAL-LEU-GLY-GLY-SER-TRP-GLN-ALA-GLU-VAL-ALA-ALA-LEU-GLU-ASN-PRO-THR-ALA-GLU-GLN-ILE-GLU-LYS-ILE-LYS-ALA-ASP-TRP-GLN-VAL-ARG-HIS-ASP-ALA-VAL-LEU-GLU-ALA-GLY-GLY-LEU-HIS-ILE-ILE-GLY-THR-GLU-ARG-HIS-GLU-SER-ARG-ARG-ILE-ASP-ASN-GLN-LEU-ARG-GLY-ARG-SER-GLY-ARG-GLN-GLY-ASP-ALA-GLY-SER-SER-ARG-PHE-TYR-LEU-SER-MET-GLU-ASP-ALA-LEU-MET-ARG-ILE-PHE-ALA-SER-ASP-ARG-VAL-SER-GLY-MET-MET-ARG-LYS-LEU-GLY-MET-LYS-PRO-GLY-GLU-ALA-ILE-GLU-HIS-PRO-TRP-VAL-THR-LYS-ALA-ILE-ALA-ASN-ALA-GLN-ARG-LYS-VAL-GLU-SER-ARG-ASN-PHE-ASP-ILE-ARG-LYS-GLN-LEU-LEU-GLU-TYR-ASP-ASP-VAL-ALA-ASN-ASP-GLN-ARG-ARG-ALA-ILE-TYR-SER-GLN-ARG-ASN-GLU-LEU-LEU-ASP-VAL-SER-ASP-VAL-SER-GLU-THR-ILE-ASN-SER-ILE-ARG-GLU-ASP-VAL-PHE-LYS-ALA-THR-ILE-ASP-ALA-TYR-ILE-PRO-PRO-GLN-SER-LEU-GLU-GLU-MET-TRP-ASP-ILE-PRO-GLY-LEU-GLN-GLU-ARG-LEU-LYS-ASN-ASP-PHE-ASP-LEU-ASP-LEU-PRO-ILE-ALA-GLU-TRP-LEU-ASP-LYS-GLU-PRO-GLU-LEU-HIS-GLU-GLU-THR-LEU-ARG-GLU-ARG-ILE-LEU-ALA-GLN-SER-ILE-GLU-VAL-TYR-GLN-ARG-LYS-GLU-GLU-VAL-VAL-GLY-ALA-GLU-MET-MET-ARG-HIS-PHE-GLU-LYS-GLY-VAL-MET-LEU-GLN-THR-LEU-ASP-SER-LEU-TRP-LYS-GLU-HIS-LEU-ALA-ALA-MET-ASP-TYR-LEU-ARG-GLN-GLY-ILE-HIS-LEU-ARG-GLY-TYR-ALA-GLN-LYS-ASP-PRO-LYS-GLN-GLU-TYR-LYS-ARG-GLU-SER-PHE-SER-MET-PHE-ALA-ALA-MET-LEU-GLU-SER-LEU-LYS-TYR-GLU-VAL-ILE-SER-THR-LEU-SER-LYS-VAL-GLN-VAL-ARG-MET-PRO-GLU-GLU,MET-MET-ILE-THR-LEU-ARG-LYS-ARG-ARG-LYS-LEU-PRO-LEU-ALA-VAL-ALA-VAL-ALA-ALA-GLY-VAL-MET-SER-ALA-GLN-ALA-MET-ALA,828,28,,Kd=3uM,5.522879,5.52,1,A,A,0,A,A,0,,B,A,,1,1,828,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCSC)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(C)C,0.5721578001976013,0.6235447525978088,52.51423263549805,56.180809020996094,0.7808432579040527,1.2868456840515137,0.7777537703514099,0.7799593210220337,0.5003148317337036,0.5844411253929138,MMITLRKRRKLPLAVAVAAGVMSAQAMA,Low,"(5.463, 5.6]",train
2W84,protein-peptide,O75381 P50542,GAMATPGSENVLPREPLIATAVKFLQNSRVRQSPLATRRAFLKKKGLTDEEIDMAFQQSGTAADEPSSLW,GVADLALSENWAQEFLAAGD,GLY-ALA-MET-ALA-THR-PRO-GLY-SER-GLU-ASN-VAL-LEU-PRO-ARG-GLU-PRO-LEU-ILE-ALA-THR-ALA-VAL-LYS-PHE-LEU-GLN-ASN-SER-ARG-VAL-ARG-GLN-SER-PRO-LEU-ALA-THR-ARG-ARG-ALA-PHE-LEU-LYS-LYS-LYS-GLY-LEU-THR-ASP-GLU-GLU-ILE-ASP-MET-ALA-PHE-GLN-GLN-SER-GLY-THR-ALA-ALA-ASP-GLU-PRO-SER-SER-LEU-TRP,GLY-VAL-ALA-ASP-LEU-ALA-LEU-SER-GLU-ASN-TRP-ALA-GLN-GLU-PHE-LEU-ALA-ALA-GLY-ASP,70,20,,Kd=0.07uM,7.154902,7.15,1,A,A,0,A,A,0,,B,A,,1,1,70,20,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)O,1.050533890724182,0.8119063377380371,88.13665008544922,80.41646575927734,0.3656143248081207,0.8740699291229248,0.8404402136802673,0.7630260586738586,0.8530572652816772,0.7080549597740173,GVADLALSENWAQEFLAAGD,Moderate,"(7.049, 7.268]",train
2XNS,protein-peptide,O43566 P63096,SNAAREVKLLLLGAGESGKSTIVKQMKIIHEAGYSEEECKQYKAVVYSNTIQSIIAIIRAMGRLKIDFGDSARADDARQLFVLAGAAEEGFMTAELAGVIKRLWKDSGVQACFNRSREYQLNDSAAYYLNDLDRIAQPNYIPTQQDVLRTRVKTTGIVETHFTFKDLHFKMFDVGGQRSERKKWIHCFEGVTAIIFCVALSDYDLVLAEDEEMNRMHESMKLFDSICNNKWFTDTSIILFLNKKDLFEEKIKKSPLTICYPEYAGSNTYEEAAAYIQCQFEDLNKRKDTKEIYTHFTCATDTKNVQFVFDAVTDVIIKNNLKDCGLF,DIEGLVELLNRVQSSGAHDQRGLLSNEEVFRALRDFDRWF,SER-ASN-ALA-ALA-ARG-GLU-VAL-LYS-LEU-LEU-LEU-LEU-GLY-ALA-GLY-GLU-SER-GLY-LYS-SER-THR-ILE-VAL-LYS-GLN-MET-LYS-ILE-ILE-HIS-GLU-ALA-GLY-TYR-SER-GLU-GLU-GLU-CYS-LYS-GLN-TYR-LYS-ALA-VAL-VAL-TYR-SER-ASN-THR-ILE-GLN-SER-ILE-ILE-ALA-ILE-ILE-ARG-ALA-MET-GLY-ARG-LEU-LYS-ILE-ASP-PHE-GLY-ASP-SER-ALA-ARG-ALA-ASP-ASP-ALA-ARG-GLN-LEU-PHE-VAL-LEU-ALA-GLY-ALA-ALA-GLU-GLU-GLY-PHE-MET-THR-ALA-GLU-LEU-ALA-GLY-VAL-ILE-LYS-ARG-LEU-TRP-LYS-ASP-SER-GLY-VAL-GLN-ALA-CYS-PHE-ASN-ARG-SER-ARG-GLU-TYR-GLN-LEU-ASN-ASP-SER-ALA-ALA-TYR-TYR-LEU-ASN-ASP-LEU-ASP-ARG-ILE-ALA-GLN-PRO-ASN-TYR-ILE-PRO-THR-GLN-GLN-ASP-VAL-LEU-ARG-THR-ARG-VAL-LYS-THR-THR-GLY-ILE-VAL-GLU-THR-HIS-PHE-THR-PHE-LYS-ASP-LEU-HIS-PHE-LYS-MET-PHE-ASP-VAL-GLY-GLY-GLN-ARG-SER-GLU-ARG-LYS-LYS-TRP-ILE-HIS-CYS-PHE-GLU-GLY-VAL-THR-ALA-ILE-ILE-PHE-CYS-VAL-ALA-LEU-SER-ASP-TYR-ASP-LEU-VAL-LEU-ALA-GLU-ASP-GLU-GLU-MET-ASN-ARG-MET-HIS-GLU-SER-MET-LYS-LEU-PHE-ASP-SER-ILE-CYS-ASN-ASN-LYS-TRP-PHE-THR-ASP-THR-SER-ILE-ILE-LEU-PHE-LEU-ASN-LYS-LYS-ASP-LEU-PHE-GLU-GLU-LYS-ILE-LYS-LYS-SER-PRO-LEU-THR-ILE-CYS-TYR-PRO-GLU-TYR-ALA-GLY-SER-ASN-THR-TYR-GLU-GLU-ALA-ALA-ALA-TYR-ILE-GLN-CYS-GLN-PHE-GLU-ASP-LEU-ASN-LYS-ARG-LYS-ASP-THR-LYS-GLU-ILE-TYR-THR-HIS-PHE-THR-CYS-ALA-THR-ASP-THR-LYS-ASN-VAL-GLN-PHE-VAL-PHE-ASP-ALA-VAL-THR-ASP-VAL-ILE-ILE-LYS-ASN-ASN-LEU-LYS-ASP-CYS-GLY-LEU-PHE,ASP-ILE-GLU-GLY-LEU-VAL-GLU-LEU-LEU-ASN-ARG-VAL-GLN-SER-SER-GLY-ALA-HIS-ASP-GLN-ARG-GLY-LEU-LEU-SER-ASN-GLU-GLU-VAL-PHE-ARG-ALA-LEU-ARG-ASP-PHE-ASP-ARG-TRP-PHE,327,40,,Kd=810nM,6.091515,6.09,1,A,A,0,A,A,0,,C,A,,1,1,327,40,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.6430716514587402,0.6543539762496948,72.66057586669922,66.81622314453125,0.7358909845352173,1.259663701057434,0.8138653039932251,0.7656736969947815,0.6003732085227966,0.6265239715576172,DIEGLVELLNRVQSSGAHDQRGLLSNEEVFRALRDFDRWF,Low,"(5.959, 6.097]",train
2XZE,protein-peptide,O95630 Q9Y3E7,MSDHGDVSLPPEDRVRALSQLGSAVEVNEDIPPRRYFRSGVEIIRMASIYSEEGNIEHAFILYNKYITLFIEKLPKHRDYKSAVIPEKKDTVKKLKEIAFPKAEELKAELLKRYTKEYTEYNEEKKKEAEELARNMAIQQELEKEK,KVTDALPEPEPPGAMAASEDEEEEEEALEAMQSRLATLRS,MET-SER-ASP-HIS-GLY-ASP-VAL-SER-LEU-PRO-PRO-GLU-ASP-ARG-VAL-ARG-ALA-LEU-SER-GLN-LEU-GLY-SER-ALA-VAL-GLU-VAL-ASN-GLU-ASP-ILE-PRO-PRO-ARG-ARG-TYR-PHE-ARG-SER-GLY-VAL-GLU-ILE-ILE-ARG-MET-ALA-SER-ILE-TYR-SER-GLU-GLU-GLY-ASN-ILE-GLU-HIS-ALA-PHE-ILE-LEU-TYR-ASN-LYS-TYR-ILE-THR-LEU-PHE-ILE-GLU-LYS-LEU-PRO-LYS-HIS-ARG-ASP-TYR-LYS-SER-ALA-VAL-ILE-PRO-GLU-LYS-LYS-ASP-THR-VAL-LYS-LYS-LEU-LYS-GLU-ILE-ALA-PHE-PRO-LYS-ALA-GLU-GLU-LEU-LYS-ALA-GLU-LEU-LEU-LYS-ARG-TYR-THR-LYS-GLU-TYR-THR-GLU-TYR-ASN-GLU-GLU-LYS-LYS-LYS-GLU-ALA-GLU-GLU-LEU-ALA-ARG-ASN-MET-ALA-ILE-GLN-GLN-GLU-LEU-GLU-LYS-GLU-LYS,LYS-VAL-THR-ASP-ALA-LEU-PRO-GLU-PRO-GLU-PRO-PRO-GLY-ALA-MET-ALA-ALA-SER-GLU-ASP-GLU-GLU-GLU-GLU-GLU-GLU-ALA-LEU-GLU-ALA-MET-GLN-SER-ARG-LEU-ALA-THR-LEU-ARG-SER,146,40,,Kd=113nM,6.946922,6.95,1,A,A,0,A,A,0,,Q,A,dimer,1,1,146,40,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.9525365829467772,0.6999166011810303,88.01969146728516,77.84432983398438,0.4016945958137512,1.076685905456543,0.8616675138473511,0.7330090999603271,0.8072430491447449,0.6445544958114624,KVTDALPEPEPPGAMAASEDEEEEEEALEAMQSRLATLRS,Low,"(6.824, 7.049]",train
2Y8S,protein-peptide,B6KAM0 B6KV60,GSAMGSASTSGNPFQANVEMKTFMERFNLTHHHQSGIYVDLGQDKEVDGTLYREPAGLCPIWGKHIELQQPDRPPYRNNFLEDVPTEKEYKQSGNPLPGGFNLNFVTPSGQRISPFPMELLEKNSNIKASTDLGRCAEFAFKTVAMDKNNKATKYRYPFVYDSKKRLCHILAVSMQLMEGKKYCSVKGEPPDLTWYCFKPRKSVTENHHLIYGSAYVGENPDAFISKCPNQALRGYRFGVWKKGRCLDYTELTDTVIERVESKAQCWVKTFENDGVASDQPHTYPLTSQASWNDWWPLHQSDQPHSGGVGRNYGFYYVDTTGEGKCALSDQVPDCLVSDSAAVSYTAAGSLSEETPNFIIPSNPSVTPPTPETALQCTADKFPDSFGACDVQACKRQKTSCVGGQIQSTSVDCTADEQNECGSNTAAALVPR,DIVQHMEDIGGAPPVSCVTNEILGVTCAPQAIAKATT,GLY-SER-ALA-MET-GLY-SER-ALA-SER-THR-SER-GLY-ASN-PRO-PHE-GLN-ALA-ASN-VAL-GLU-MET-LYS-THR-PHE-MET-GLU-ARG-PHE-ASN-LEU-THR-HIS-HIS-HIS-GLN-SER-GLY-ILE-TYR-VAL-ASP-LEU-GLY-GLN-ASP-LYS-GLU-VAL-ASP-GLY-THR-LEU-TYR-ARG-GLU-PRO-ALA-GLY-LEU-CYS-PRO-ILE-TRP-GLY-LYS-HIS-ILE-GLU-LEU-GLN-GLN-PRO-ASP-ARG-PRO-PRO-TYR-ARG-ASN-ASN-PHE-LEU-GLU-ASP-VAL-PRO-THR-GLU-LYS-GLU-TYR-LYS-GLN-SER-GLY-ASN-PRO-LEU-PRO-GLY-GLY-PHE-ASN-LEU-ASN-PHE-VAL-THR-PRO-SER-GLY-GLN-ARG-ILE-SER-PRO-PHE-PRO-MET-GLU-LEU-LEU-GLU-LYS-ASN-SER-ASN-ILE-LYS-ALA-SER-THR-ASP-LEU-GLY-ARG-CYS-ALA-GLU-PHE-ALA-PHE-LYS-THR-VAL-ALA-MET-ASP-LYS-ASN-ASN-LYS-ALA-THR-LYS-TYR-ARG-TYR-PRO-PHE-VAL-TYR-ASP-SER-LYS-LYS-ARG-LEU-CYS-HIS-ILE-LEU-ALA-VAL-SER-MET-GLN-LEU-MET-GLU-GLY-LYS-LYS-TYR-CYS-SER-VAL-LYS-GLY-GLU-PRO-PRO-ASP-LEU-THR-TRP-TYR-CYS-PHE-LYS-PRO-ARG-LYS-SER-VAL-THR-GLU-ASN-HIS-HIS-LEU-ILE-TYR-GLY-SER-ALA-TYR-VAL-GLY-GLU-ASN-PRO-ASP-ALA-PHE-ILE-SER-LYS-CYS-PRO-ASN-GLN-ALA-LEU-ARG-GLY-TYR-ARG-PHE-GLY-VAL-TRP-LYS-LYS-GLY-ARG-CYS-LEU-ASP-TYR-THR-GLU-LEU-THR-ASP-THR-VAL-ILE-GLU-ARG-VAL-GLU-SER-LYS-ALA-GLN-CYS-TRP-VAL-LYS-THR-PHE-GLU-ASN-ASP-GLY-VAL-ALA-SER-ASP-GLN-PRO-HIS-THR-TYR-PRO-LEU-THR-SER-GLN-ALA-SER-TRP-ASN-ASP-TRP-TRP-PRO-LEU-HIS-GLN-SER-ASP-GLN-PRO-HIS-SER-GLY-GLY-VAL-GLY-ARG-ASN-TYR-GLY-PHE-TYR-TYR-VAL-ASP-THR-THR-GLY-GLU-GLY-LYS-CYS-ALA-LEU-SER-ASP-GLN-VAL-PRO-ASP-CYS-LEU-VAL-SER-ASP-SER-ALA-ALA-VAL-SER-TYR-THR-ALA-ALA-GLY-SER-LEU-SER-GLU-GLU-THR-PRO-ASN-PHE-ILE-ILE-PRO-SER-ASN-PRO-SER-VAL-THR-PRO-PRO-THR-PRO-GLU-THR-ALA-LEU-GLN-CYS-THR-ALA-ASP-LYS-PHE-PRO-ASP-SER-PHE-GLY-ALA-CYS-ASP-VAL-GLN-ALA-CYS-LYS-ARG-GLN-LYS-THR-SER-CYS-VAL-GLY-GLY-GLN-ILE-GLN-SER-THR-SER-VAL-ASP-CYS-THR-ALA-ASP-GLU-GLN-ASN-GLU-CYS-GLY-SER-ASN-THR-ALA-ALA-ALA-LEU-VAL-PRO-ARG,ASP-ILE-VAL-GLN-HIS-MET-GLU-ASP-ILE-GLY-GLY-ALA-PRO-PRO-VAL-SER-CYS-VAL-THR-ASN-GLU-ILE-LEU-GLY-VAL-THR-CYS-ALA-PRO-GLN-ALA-ILE-ALA-LYS-ALA-THR-THR,432,37,,Kd=0.989nM,9.004804,9.0,1,A,A,0,A,A,0,,B,A,,1,1,432,37,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(C)C)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(C)C)C(C)C)C(=O)O,0.8631843328475952,0.767314076423645,65.74609375,67.49928283691406,0.7556219100952148,1.0478482246398926,0.7971206903457642,0.7960443496704102,0.8037407398223877,0.7311963438987732,DIVQHMEDIGGAPPVSCVTNEILGVTCAPQAIAKATT,High,"(8.824, 12.12]",train
3AJB,protein-peptide,P40855 P56589,GPLGSIAQARRQYHFESNQRTCNMTVLSMLPTLREALMQQLNSESLTALLKNRPSNKLEIWEDLKIISFTRSTVAVYSTCMLVVLLRVQLNIIGGYIYLDNAAVGKNGTTILAPPDVQQQYLSSIQHLLGDGLTELITVIKQAVQKVLGSVSLKHSLSLLDLEQKLKEIRNLVEQHKSSSWINKDGSKPLLCHYMMPDEETPLAVQACGLSPRDITTIKLLNETRDMLESPDFSTVLNTCLNRGFSRLLDNMAEFFRPTEQDLQHGNSMNSLSSVSLPLAKIIPIVNGQIHSVCSETPSHFVQDLLTMEQVKDFAANVYEAFSTPQQLEK,GPLGSMAAAEEGASVGAEADRELEELLESALDDFDKAKPSPAPPSTTTA,GLY-PRO-LEU-GLY-SER-ILE-ALA-GLN-ALA-ARG-ARG-GLN-TYR-HIS-PHE-GLU-SER-ASN-GLN-ARG-THR-CYS-ASN-MET-THR-VAL-LEU-SER-MET-LEU-PRO-THR-LEU-ARG-GLU-ALA-LEU-MET-GLN-GLN-LEU-ASN-SER-GLU-SER-LEU-THR-ALA-LEU-LEU-LYS-ASN-ARG-PRO-SER-ASN-LYS-LEU-GLU-ILE-TRP-GLU-ASP-LEU-LYS-ILE-ILE-SER-PHE-THR-ARG-SER-THR-VAL-ALA-VAL-TYR-SER-THR-CYS-MET-LEU-VAL-VAL-LEU-LEU-ARG-VAL-GLN-LEU-ASN-ILE-ILE-GLY-GLY-TYR-ILE-TYR-LEU-ASP-ASN-ALA-ALA-VAL-GLY-LYS-ASN-GLY-THR-THR-ILE-LEU-ALA-PRO-PRO-ASP-VAL-GLN-GLN-GLN-TYR-LEU-SER-SER-ILE-GLN-HIS-LEU-LEU-GLY-ASP-GLY-LEU-THR-GLU-LEU-ILE-THR-VAL-ILE-LYS-GLN-ALA-VAL-GLN-LYS-VAL-LEU-GLY-SER-VAL-SER-LEU-LYS-HIS-SER-LEU-SER-LEU-LEU-ASP-LEU-GLU-GLN-LYS-LEU-LYS-GLU-ILE-ARG-ASN-LEU-VAL-GLU-GLN-HIS-LYS-SER-SER-SER-TRP-ILE-ASN-LYS-ASP-GLY-SER-LYS-PRO-LEU-LEU-CYS-HIS-TYR-MET-MET-PRO-ASP-GLU-GLU-THR-PRO-LEU-ALA-VAL-GLN-ALA-CYS-GLY-LEU-SER-PRO-ARG-ASP-ILE-THR-THR-ILE-LYS-LEU-LEU-ASN-GLU-THR-ARG-ASP-MET-LEU-GLU-SER-PRO-ASP-PHE-SER-THR-VAL-LEU-ASN-THR-CYS-LEU-ASN-ARG-GLY-PHE-SER-ARG-LEU-LEU-ASP-ASN-MET-ALA-GLU-PHE-PHE-ARG-PRO-THR-GLU-GLN-ASP-LEU-GLN-HIS-GLY-ASN-SER-MET-ASN-SER-LEU-SER-SER-VAL-SER-LEU-PRO-LEU-ALA-LYS-ILE-ILE-PRO-ILE-VAL-ASN-GLY-GLN-ILE-HIS-SER-VAL-CYS-SER-GLU-THR-PRO-SER-HIS-PHE-VAL-GLN-ASP-LEU-LEU-THR-MET-GLU-GLN-VAL-LYS-ASP-PHE-ALA-ALA-ASN-VAL-TYR-GLU-ALA-PHE-SER-THR-PRO-GLN-GLN-LEU-GLU-LYS,GLY-PRO-LEU-GLY-SER-MET-ALA-ALA-ALA-GLU-GLU-GLY-ALA-SER-VAL-GLY-ALA-GLU-ALA-ASP-ARG-GLU-LEU-GLU-GLU-LEU-LEU-GLU-SER-ALA-LEU-ASP-ASP-PHE-ASP-LYS-ALA-LYS-PRO-SER-PRO-ALA-PRO-PRO-SER-THR-THR-THR-ALA,330,49,,Kd=40.8nM,7.38934,7.39,1,A,A,0,A,A,0,,B,A,,1,1,330,49,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,0.7761502861976624,0.6136660575866699,80.04875183105469,73.80996704101562,0.6159234046936035,1.315840482711792,0.8276835680007935,0.7252550721168518,0.6890585422515869,0.5800870060920715,GPLGSMAAAEEGASVGAEADRELEELLESALDDFDKAKPSPAPPSTTTA,Moderate,"(7.268, 7.523]",train
3BRT,protein-peptide,O15111 O14920 Q9Y6K9,EWGAPETLQRCLEENQELRDAIRQSNQILRERCEELLHFQASQREEKEFLMCKFQEARKLVERLGLEK,AMAPAKKSEELVAEAHNLCTLLENAIQDTVREQGNSMMNLDWSWLTE,GLU-TRP-GLY-ALA-PRO-GLU-THR-LEU-GLN-ARG-CYS-LEU-GLU-GLU-ASN-GLN-GLU-LEU-ARG-ASP-ALA-ILE-ARG-GLN-SER-ASN-GLN-ILE-LEU-ARG-GLU-ARG-CYS-GLU-GLU-LEU-LEU-HIS-PHE-GLN-ALA-SER-GLN-ARG-GLU-GLU-LYS-GLU-PHE-LEU-MET-CYS-LYS-PHE-GLN-GLU-ALA-ARG-LYS-LEU-VAL-GLU-ARG-LEU-GLY-LEU-GLU-LYS,ALA-MET-ALA-PRO-ALA-LYS-LYS-SER-GLU-GLU-LEU-VAL-ALA-GLU-ALA-HIS-ASN-LEU-CYS-THR-LEU-LEU-GLU-ASN-ALA-ILE-GLN-ASP-THR-VAL-ARG-GLU-GLN-GLY-ASN-SER-MET-MET-ASN-LEU-ASP-TRP-SER-TRP-LEU-THR-GLU,68,47,,IC50=36nM,7.443697,7.44,1,A,A,0,A,A,0,,A,B,dimer,1,1,68,47,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,1.0392417907714844,0.4453737735748291,80.82534790039062,57.427764892578125,0.389770358800888,2.1879849433898926,0.7870578765869141,0.3326624631881714,0.770766019821167,0.2529633939266205,AMAPAKKSEELVAEAHNLCTLLENAIQDTVREQGNSMMNLDWSWLTE,Moderate,"(7.268, 7.523]",train
3C66,protein-peptide,P29468 P45976,MSSQKVFGITGPVSTVGATAAENKLNDSLIQELKKEGSFETEQETANRVQVLKILQELAQRFVYEVSKKKNMSDGMARDAGGKIFTYGSYRLGVHGPGSDIDTLVVVPKHVTREDFFTVFDSLLRERKELDEIAPVPDAFVPIIKIKFSGISIDLICARLDQPQVPLSLTLSDKNLLRNLDEKDLRALNGTRVTDEILELVPKPNVFRIALRAIKLWAQRRAVYANIFGFPGGVAWAMLVARICQLYPNACSAVILNRFFIILSEWNWPQPVILKPIEDGPLQVRVWNPKIYAQDRSHRMPVITPAYPSMCATHNITESTKKVILQEFVRGVQITNDIFSNKKSWANLFEKNDFFFRYKFYLEITAYTRGSDEQHLKWSGLVESKVRLLVMKLEVLAGIKIAHPFTKPFESSYCCPTEDDYEMIQDKYGSHKTETALNALKLVTDENKEEESIKDAPKAYLSTMYIGLDFNIENKKEKVDIHIPCTEFVNLCRSFNEDYGDHKVFNLALRFVKGYDLPDEVFDENEKRPSKKSKRKN,DLEVIISLGPDPTRLDAKLLDSYSTA,MET-SER-SER-GLN-LYS-VAL-PHE-GLY-ILE-THR-GLY-PRO-VAL-SER-THR-VAL-GLY-ALA-THR-ALA-ALA-GLU-ASN-LYS-LEU-ASN-ASP-SER-LEU-ILE-GLN-GLU-LEU-LYS-LYS-GLU-GLY-SER-PHE-GLU-THR-GLU-GLN-GLU-THR-ALA-ASN-ARG-VAL-GLN-VAL-LEU-LYS-ILE-LEU-GLN-GLU-LEU-ALA-GLN-ARG-PHE-VAL-TYR-GLU-VAL-SER-LYS-LYS-LYS-ASN-MET-SER-ASP-GLY-MET-ALA-ARG-ASP-ALA-GLY-GLY-LYS-ILE-PHE-THR-TYR-GLY-SER-TYR-ARG-LEU-GLY-VAL-HIS-GLY-PRO-GLY-SER-ASP-ILE-ASP-THR-LEU-VAL-VAL-VAL-PRO-LYS-HIS-VAL-THR-ARG-GLU-ASP-PHE-PHE-THR-VAL-PHE-ASP-SER-LEU-LEU-ARG-GLU-ARG-LYS-GLU-LEU-ASP-GLU-ILE-ALA-PRO-VAL-PRO-ASP-ALA-PHE-VAL-PRO-ILE-ILE-LYS-ILE-LYS-PHE-SER-GLY-ILE-SER-ILE-ASP-LEU-ILE-CYS-ALA-ARG-LEU-ASP-GLN-PRO-GLN-VAL-PRO-LEU-SER-LEU-THR-LEU-SER-ASP-LYS-ASN-LEU-LEU-ARG-ASN-LEU-ASP-GLU-LYS-ASP-LEU-ARG-ALA-LEU-ASN-GLY-THR-ARG-VAL-THR-ASP-GLU-ILE-LEU-GLU-LEU-VAL-PRO-LYS-PRO-ASN-VAL-PHE-ARG-ILE-ALA-LEU-ARG-ALA-ILE-LYS-LEU-TRP-ALA-GLN-ARG-ARG-ALA-VAL-TYR-ALA-ASN-ILE-PHE-GLY-PHE-PRO-GLY-GLY-VAL-ALA-TRP-ALA-MET-LEU-VAL-ALA-ARG-ILE-CYS-GLN-LEU-TYR-PRO-ASN-ALA-CYS-SER-ALA-VAL-ILE-LEU-ASN-ARG-PHE-PHE-ILE-ILE-LEU-SER-GLU-TRP-ASN-TRP-PRO-GLN-PRO-VAL-ILE-LEU-LYS-PRO-ILE-GLU-ASP-GLY-PRO-LEU-GLN-VAL-ARG-VAL-TRP-ASN-PRO-LYS-ILE-TYR-ALA-GLN-ASP-ARG-SER-HIS-ARG-MET-PRO-VAL-ILE-THR-PRO-ALA-TYR-PRO-SER-MET-CYS-ALA-THR-HIS-ASN-ILE-THR-GLU-SER-THR-LYS-LYS-VAL-ILE-LEU-GLN-GLU-PHE-VAL-ARG-GLY-VAL-GLN-ILE-THR-ASN-ASP-ILE-PHE-SER-ASN-LYS-LYS-SER-TRP-ALA-ASN-LEU-PHE-GLU-LYS-ASN-ASP-PHE-PHE-PHE-ARG-TYR-LYS-PHE-TYR-LEU-GLU-ILE-THR-ALA-TYR-THR-ARG-GLY-SER-ASP-GLU-GLN-HIS-LEU-LYS-TRP-SER-GLY-LEU-VAL-GLU-SER-LYS-VAL-ARG-LEU-LEU-VAL-MET-LYS-LEU-GLU-VAL-LEU-ALA-GLY-ILE-LYS-ILE-ALA-HIS-PRO-PHE-THR-LYS-PRO-PHE-GLU-SER-SER-TYR-CYS-CYS-PRO-THR-GLU-ASP-ASP-TYR-GLU-MET-ILE-GLN-ASP-LYS-TYR-GLY-SER-HIS-LYS-THR-GLU-THR-ALA-LEU-ASN-ALA-LEU-LYS-LEU-VAL-THR-ASP-GLU-ASN-LYS-GLU-GLU-GLU-SER-ILE-LYS-ASP-ALA-PRO-LYS-ALA-TYR-LEU-SER-THR-MET-TYR-ILE-GLY-LEU-ASP-PHE-ASN-ILE-GLU-ASN-LYS-LYS-GLU-LYS-VAL-ASP-ILE-HIS-ILE-PRO-CYS-THR-GLU-PHE-VAL-ASN-LEU-CYS-ARG-SER-PHE-ASN-GLU-ASP-TYR-GLY-ASP-HIS-LYS-VAL-PHE-ASN-LEU-ALA-LEU-ARG-PHE-VAL-LYS-GLY-TYR-ASP-LEU-PRO-ASP-GLU-VAL-PHE-ASP-GLU-ASN-GLU-LYS-ARG-PRO-SER-LYS-LYS-SER-LYS-ARG-LYS-ASN,ASP-LEU-GLU-VAL-ILE-ILE-SER-LEU-GLY-PRO-ASP-PRO-THR-ARG-LEU-ASP-ALA-LYS-LEU-LEU-ASP-SER-TYR-SER-THR-ALA,537,26,,Kd=3uM,5.522879,5.52,1,A,A,0,A,A,0,,C,A,,1,1,537,26,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,0.6628557443618774,0.6908889412879944,77.3240966796875,75.95260620117188,0.6768538951873779,1.1746286153793335,0.8544080853462219,0.8195059299468994,0.5616816878318787,0.6319655179977417,DLEVIISLGPDPTRLDAKLLDSYSTA,Low,"(5.463, 5.6]",train
3ECH,protein-peptide,P52003 Q9HXS2,MNYPVNPDLMPALMAVFQHVRTRIQSELDCQRLDLTPPDVHVLKLIDEQRGLNLQDLGRQMCRDKALITRKIRELEGRNLVRRERNPSDQRSFQLFLTDEGLAIHLHAELIMSRVHDELFAPLTPVEQATLVHLLDQCLAAQ,RRDYTEQLRRAARRNAWDLYGEHFY,MET-ASN-TYR-PRO-VAL-ASN-PRO-ASP-LEU-MET-PRO-ALA-LEU-MET-ALA-VAL-PHE-GLN-HIS-VAL-ARG-THR-ARG-ILE-GLN-SER-GLU-LEU-ASP-CYS-GLN-ARG-LEU-ASP-LEU-THR-PRO-PRO-ASP-VAL-HIS-VAL-LEU-LYS-LEU-ILE-ASP-GLU-GLN-ARG-GLY-LEU-ASN-LEU-GLN-ASP-LEU-GLY-ARG-GLN-MET-CYS-ARG-ASP-LYS-ALA-LEU-ILE-THR-ARG-LYS-ILE-ARG-GLU-LEU-GLU-GLY-ARG-ASN-LEU-VAL-ARG-ARG-GLU-ARG-ASN-PRO-SER-ASP-GLN-ARG-SER-PHE-GLN-LEU-PHE-LEU-THR-ASP-GLU-GLY-LEU-ALA-ILE-HIS-LEU-HIS-ALA-GLU-LEU-ILE-MET-SER-ARG-VAL-HIS-ASP-GLU-LEU-PHE-ALA-PRO-LEU-THR-PRO-VAL-GLU-GLN-ALA-THR-LEU-VAL-HIS-LEU-LEU-ASP-GLN-CYS-LEU-ALA-ALA-GLN,ARG-ARG-ASP-TYR-THR-GLU-GLN-LEU-ARG-ARG-ALA-ALA-ARG-ARG-ASN-ALA-TRP-ASP-LEU-TYR-GLY-GLU-HIS-PHE-TYR,142,25,,Kd=300nM,6.522879,6.52,1,A,A,0,A,A,0,,C,A,dimer,1,1,142,25,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.7622289657592773,0.6738501787185669,82.05692291259766,74.1498031616211,0.4906820356845855,1.168777585029602,0.7725687623023987,0.7188593745231628,0.6361410021781921,0.6185837984085083,RRDYTEQLRRAARRNAWDLYGEHFY,Low,"(6.398, 6.523]",val
3EHU,protein-peptide,P06850 P34998 P0AEX9,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENEQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFSLQDQHCESLSLASNISGLQCNASVDLIGTCWPRSPAGQLVVRPCPAFFYGVRYNTTNNGYRECLANGSWAARVNYSECQEILNEEKKSKVHYHVAHHHHHH,ARAEQLAQQAHSNRKLMEII,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-GLU-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-SER-LEU-GLN-ASP-GLN-HIS-CYS-GLU-SER-LEU-SER-LEU-ALA-SER-ASN-ILE-SER-GLY-LEU-GLN-CYS-ASN-ALA-SER-VAL-ASP-LEU-ILE-GLY-THR-CYS-TRP-PRO-ARG-SER-PRO-ALA-GLY-GLN-LEU-VAL-VAL-ARG-PRO-CYS-PRO-ALA-PHE-PHE-TYR-GLY-VAL-ARG-TYR-ASN-THR-THR-ASN-ASN-GLY-TYR-ARG-GLU-CYS-LEU-ALA-ASN-GLY-SER-TRP-ALA-ALA-ARG-VAL-ASN-TYR-SER-GLU-CYS-GLN-GLU-ILE-LEU-ASN-GLU-GLU-LYS-LYS-SER-LYS-VAL-HIS-TYR-HIS-VAL-ALA-HIS-HIS-HIS-HIS-HIS-HIS,ALA-ARG-ALA-GLU-GLN-LEU-ALA-GLN-GLN-ALA-HIS-SER-ASN-ARG-LYS-LEU-MET-GLU-ILE-ILE-NH2,476,21,,IC50=6.6uM,5.180456,5.18,1,A,A,0,A,A,0,,C,A,,1,1,476,21,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,0.5790364742279053,0.5861295461654663,61.51775741577149,67.46013641357422,0.755058228969574,1.4338752031326294,0.7486568689346313,0.7476556897163391,0.4849680364131927,0.5260525941848755,ARAEQLAQQAHSNRKLMEII,Low,"(5.105, 5.222]",train
3FSH,protein-peptide,P60605 Q9UKV5,GSHMAGTALKRLMAEYKQLTLNPPEGIVAGPMNEENFFEWEALIMGPEDTCFEFGVFPAILSFPLDYPLSPPKMRFTCEMFHPNIYPDGRVCISILHAPGDDPMGYESSAERWSPVQSVEKILLSVVSMLAEPNDESGANVDASKMWRDDREQFYKIAKQIVQKSLGL,SADERQRMLVQRKDELLQQARKRFLNKS,GLY-SER-HIS-MET-ALA-GLY-THR-ALA-LEU-LYS-ARG-LEU-MET-ALA-GLU-TYR-LYS-GLN-LEU-THR-LEU-ASN-PRO-PRO-GLU-GLY-ILE-VAL-ALA-GLY-PRO-MET-ASN-GLU-GLU-ASN-PHE-PHE-GLU-TRP-GLU-ALA-LEU-ILE-MET-GLY-PRO-GLU-ASP-THR-CYS-PHE-GLU-PHE-GLY-VAL-PHE-PRO-ALA-ILE-LEU-SER-PHE-PRO-LEU-ASP-TYR-PRO-LEU-SER-PRO-PRO-LYS-MET-ARG-PHE-THR-CYS-GLU-MET-PHE-HIS-PRO-ASN-ILE-TYR-PRO-ASP-GLY-ARG-VAL-CYS-ILE-SER-ILE-LEU-HIS-ALA-PRO-GLY-ASP-ASP-PRO-MET-GLY-TYR-GLU-SER-SER-ALA-GLU-ARG-TRP-SER-PRO-VAL-GLN-SER-VAL-GLU-LYS-ILE-LEU-LEU-SER-VAL-VAL-SER-MET-LEU-ALA-GLU-PRO-ASN-ASP-GLU-SER-GLY-ALA-ASN-VAL-ASP-ALA-SER-LYS-MET-TRP-ARG-ASP-ASP-ARG-GLU-GLN-PHE-TYR-LYS-ILE-ALA-LYS-GLN-ILE-VAL-GLN-LYS-SER-LEU-GLY-LEU,SER-ALA-ASP-GLU-ARG-GLN-ARG-MET-LEU-VAL-GLN-ARG-LYS-ASP-GLU-LEU-LEU-GLN-GLN-ALA-ARG-LYS-ARG-PHE-LEU-ASN-LYS-SER,168,28,,Kd=5nM,8.30103,8.3,1,A,A,0,A,A,0,,C,A,,0,1,168,28,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,0.9267504811286926,0.7473071813583374,93.79600524902344,87.66425323486328,0.3827287852764129,0.8719574213027954,0.9090507626533508,0.818759024143219,0.8705887198448181,0.7294442057609558,SADERQRMLVQRKDELLQQARKRFLNKS,Moderate,"(7.921, 8.383]",train
3GJ3,protein-peptide,P49791 P62826,GPHMASAAQGEPQVQFKLVLVGDGGTGKTTFVKRHLTGEFEKKYVATLGVEVHPLVFHTNRGPIKFNVWDTAGQEKFGGLRDGYYIQAQCAIIMFDVTSRVTYKNVPNWHRDLVRVCENIPIVLCGNKVDIKDRKVKAKSIVFHRKKNLQYYDISAKSNYNFEKPFLWLARKLIGDPNLEFVAMPALAPPEVVMDPALAAQYEHDLEVAQTTALPDEDDDL,GPLGSGTWDCDTCLVQNKPEAVKCVACETPKPG,GLY-PRO-HIS-MET-ALA-SER-ALA-ALA-GLN-GLY-GLU-PRO-GLN-VAL-GLN-PHE-LYS-LEU-VAL-LEU-VAL-GLY-ASP-GLY-GLY-THR-GLY-LYS-THR-THR-PHE-VAL-LYS-ARG-HIS-LEU-THR-GLY-GLU-PHE-GLU-LYS-LYS-TYR-VAL-ALA-THR-LEU-GLY-VAL-GLU-VAL-HIS-PRO-LEU-VAL-PHE-HIS-THR-ASN-ARG-GLY-PRO-ILE-LYS-PHE-ASN-VAL-TRP-ASP-THR-ALA-GLY-GLN-GLU-LYS-PHE-GLY-GLY-LEU-ARG-ASP-GLY-TYR-TYR-ILE-GLN-ALA-GLN-CYS-ALA-ILE-ILE-MET-PHE-ASP-VAL-THR-SER-ARG-VAL-THR-TYR-LYS-ASN-VAL-PRO-ASN-TRP-HIS-ARG-ASP-LEU-VAL-ARG-VAL-CYS-GLU-ASN-ILE-PRO-ILE-VAL-LEU-CYS-GLY-ASN-LYS-VAL-ASP-ILE-LYS-ASP-ARG-LYS-VAL-LYS-ALA-LYS-SER-ILE-VAL-PHE-HIS-ARG-LYS-LYS-ASN-LEU-GLN-TYR-TYR-ASP-ILE-SER-ALA-LYS-SER-ASN-TYR-ASN-PHE-GLU-LYS-PRO-PHE-LEU-TRP-LEU-ALA-ARG-LYS-LEU-ILE-GLY-ASP-PRO-ASN-LEU-GLU-PHE-VAL-ALA-MET-PRO-ALA-LEU-ALA-PRO-PRO-GLU-VAL-VAL-MET-ASP-PRO-ALA-LEU-ALA-ALA-GLN-TYR-GLU-HIS-ASP-LEU-GLU-VAL-ALA-GLN-THR-THR-ALA-LEU-PRO-ASP-GLU-ASP-ASP-ASP-LEU,GLY-PRO-LEU-GLY-SER-GLY-THR-TRP-ASP-CYS-ASP-THR-CYS-LEU-VAL-GLN-ASN-LYS-PRO-GLU-ALA-VAL-LYS-CYS-VAL-ALA-CYS-GLU-THR-PRO-LYS-PRO-GLY,221,33,,Kd=49uM,4.309804,4.31,1,A,A,0,A,A,0,,B,A,,1,1,221,33,0,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,0.6051279306411743,0.6932947635650635,65.4496841430664,68.76049041748047,0.9325910210609436,1.2160173654556274,0.7029510736465454,0.66814786195755,0.3912036418914795,0.5666629076004028,GPLGSGTWDCDTCLVQNKPEAVKCVACETPKPG,Low,"(4.155, 4.319]",train
3H8K,protein-peptide,P60604 Q9UKV5,AGTALKRLMAEYKQLTLNPPEGIVAGPMNEENFFEWEALIMGPEDTCFEFGVFPAILSFPLDYPLSPPKMRFTCEMFHPNIYPDGRVCISILHAPGDDPMGYESSAERWSPVQSVEKILLSVVSMLAEPNDESGANVDASKMWRDDREQFYKIAKQIVQKSLGL,WSADERQRMLVQRKDELLQQARKRFLNK,ALA-GLY-THR-ALA-LEU-LYS-ARG-LEU-MET-ALA-GLU-TYR-LYS-GLN-LEU-THR-LEU-ASN-PRO-PRO-GLU-GLY-ILE-VAL-ALA-GLY-PRO-MET-ASN-GLU-GLU-ASN-PHE-PHE-GLU-TRP-GLU-ALA-LEU-ILE-MET-GLY-PRO-GLU-ASP-THR-CYS-PHE-GLU-PHE-GLY-VAL-PHE-PRO-ALA-ILE-LEU-SER-PHE-PRO-LEU-ASP-TYR-PRO-LEU-SER-PRO-PRO-LYS-MET-ARG-PHE-THR-CYS-GLU-MET-PHE-HIS-PRO-ASN-ILE-TYR-PRO-ASP-GLY-ARG-VAL-CYS-ILE-SER-ILE-LEU-HIS-ALA-PRO-GLY-ASP-ASP-PRO-MET-GLY-TYR-GLU-SER-SER-ALA-GLU-ARG-TRP-SER-PRO-VAL-GLN-SER-VAL-GLU-LYS-ILE-LEU-LEU-SER-VAL-VAL-SER-MET-LEU-ALA-GLU-PRO-ASN-ASP-GLU-SER-GLY-ALA-ASN-VAL-ASP-ALA-SER-LYS-MET-TRP-ARG-ASP-ASP-ARG-GLU-GLN-PHE-TYR-LYS-ILE-ALA-LYS-GLN-ILE-VAL-GLN-LYS-SER-LEU-GLY-LEU,TRP-SER-ALA-ASP-GLU-ARG-GLN-ARG-MET-LEU-VAL-GLN-ARG-LYS-ASP-GLU-LEU-LEU-GLN-GLN-ALA-ARG-LYS-ARG-PHE-LEU-ASN-LYS,164,28,,Kd=21nM,7.677781,7.68,1,A,A,0,A,A,0,,B,A,,1,1,164,28,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O,0.8994253873825073,0.7510769963264465,93.27265167236328,85.9765396118164,0.3862650692462921,0.8817294239997864,0.9056806564331056,0.8201800584793091,0.8555437922477722,0.7338011860847473,WSADERQRMLVQRKDELLQQARKRFLNK,Moderate,"(7.523, 7.921]",train
3IOL,protein-peptide,P43220 P01275,GSHMRPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEEQLLFLY,HAEGTFTSDVSSYLEGQAAKEFIAWLVKGRG,GLY-SER-HIS-MET-ARG-PRO-GLN-GLY-ALA-THR-VAL-SER-LEU-TRP-GLU-THR-VAL-GLN-LYS-TRP-ARG-GLU-TYR-ARG-ARG-GLN-CYS-GLN-ARG-SER-LEU-THR-GLU-ASP-PRO-PRO-PRO-ALA-THR-ASP-LEU-PHE-CYS-ASN-ARG-THR-PHE-ASP-GLU-TYR-ALA-CYS-TRP-PRO-ASP-GLY-GLU-PRO-GLY-SER-PHE-VAL-ASN-VAL-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-ALA-SER-SER-VAL-PRO-GLN-GLY-HIS-VAL-TYR-ARG-PHE-CYS-THR-ALA-GLU-GLY-LEU-TRP-LEU-GLN-LYS-ASP-ASN-SER-SER-LEU-PRO-TRP-ARG-ASP-LEU-SER-GLU-CYS-GLU-GLU-SER-LYS-ARG-GLY-GLU-ARG-SER-SER-PRO-GLU-GLU-GLN-LEU-LEU-PHE-LEU-TYR,HIS-ALA-GLU-GLY-THR-PHE-THR-SER-ASP-VAL-SER-SER-TYR-LEU-GLU-GLY-GLN-ALA-ALA-LYS-GLU-PHE-ILE-ALA-TRP-LEU-VAL-LYS-GLY-ARG-GLY,126,31,,IC50=500nM,6.30103,6.3,1,A,A,0,A,A,0,,B,A,,1,1,126,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.934502124786377,0.7150546908378601,80.22167205810547,75.343505859375,0.4943662285804748,1.093264102935791,0.7955901622772217,0.7020416259765625,0.778147280216217,0.6191016435623169,HAEGTFTSDVSSYLEGQAAKEFIAWLVKGRG,Low,"(6.26, 6.398]",val
3KV4,protein-peptide,Q9UPP1 Q6NXT2,MASVPVYCLCRLPYDVTRFMIECDMCQDWFHGSCVGVEEEKAADIDLYHCPNCEVLHGPSIMKKRRGSSKGHDTHKGKPVKTGSPTFVRELRSRTFDSSDEVILKPTGNQLTVEFLEENSFSVPILVLKKDGLGMTLPSPSFTVRDVEHYVGSDKEIDVIDVTRQADCKMKLGDFVKYYYSGKREKVLNVISLEFSDTRLSNLVETPKIVRKLSWVENLWPEECVFERPNVQKYCLMSVRDSYTDFHIDFGGTSVWYHVLKGEKIFYLIRPTNANLTLFECWSSSSNQNEMFFGDQVDKCYKCSVKQGQTLFIPTGWIHAVLTPVDCLAFGGNFLHSLNIEMQLKAYEIEKRLSTADLFRFPNFETICWYVGKHILDIFRGLRENRRHPASYLVHGGKALNLAFRAWTRKEALPDHEDEIPETVRTVQLIKDLAREIRLVEDIFQQN,ARTKQTARKSTGGKAPRKQLATKA,MET-ALA-SER-VAL-PRO-VAL-TYR-CYS-LEU-CYS-ARG-LEU-PRO-TYR-ASP-VAL-THR-ARG-PHE-MET-ILE-GLU-CYS-ASP-MET-CYS-GLN-ASP-TRP-PHE-HIS-GLY-SER-CYS-VAL-GLY-VAL-GLU-GLU-GLU-LYS-ALA-ALA-ASP-ILE-ASP-LEU-TYR-HIS-CYS-PRO-ASN-CYS-GLU-VAL-LEU-HIS-GLY-PRO-SER-ILE-MET-LYS-LYS-ARG-ARG-GLY-SER-SER-LYS-GLY-HIS-ASP-THR-HIS-LYS-GLY-LYS-PRO-VAL-LYS-THR-GLY-SER-PRO-THR-PHE-VAL-ARG-GLU-LEU-ARG-SER-ARG-THR-PHE-ASP-SER-SER-ASP-GLU-VAL-ILE-LEU-LYS-PRO-THR-GLY-ASN-GLN-LEU-THR-VAL-GLU-PHE-LEU-GLU-GLU-ASN-SER-PHE-SER-VAL-PRO-ILE-LEU-VAL-LEU-LYS-LYS-ASP-GLY-LEU-GLY-MET-THR-LEU-PRO-SER-PRO-SER-PHE-THR-VAL-ARG-ASP-VAL-GLU-HIS-TYR-VAL-GLY-SER-ASP-LYS-GLU-ILE-ASP-VAL-ILE-ASP-VAL-THR-ARG-GLN-ALA-ASP-CYS-LYS-MET-LYS-LEU-GLY-ASP-PHE-VAL-LYS-TYR-TYR-TYR-SER-GLY-LYS-ARG-GLU-LYS-VAL-LEU-ASN-VAL-ILE-SER-LEU-GLU-PHE-SER-ASP-THR-ARG-LEU-SER-ASN-LEU-VAL-GLU-THR-PRO-LYS-ILE-VAL-ARG-LYS-LEU-SER-TRP-VAL-GLU-ASN-LEU-TRP-PRO-GLU-GLU-CYS-VAL-PHE-GLU-ARG-PRO-ASN-VAL-GLN-LYS-TYR-CYS-LEU-MET-SER-VAL-ARG-ASP-SER-TYR-THR-ASP-PHE-HIS-ILE-ASP-PHE-GLY-GLY-THR-SER-VAL-TRP-TYR-HIS-VAL-LEU-LYS-GLY-GLU-LYS-ILE-PHE-TYR-LEU-ILE-ARG-PRO-THR-ASN-ALA-ASN-LEU-THR-LEU-PHE-GLU-CYS-TRP-SER-SER-SER-SER-ASN-GLN-ASN-GLU-MET-PHE-PHE-GLY-ASP-GLN-VAL-ASP-LYS-CYS-TYR-LYS-CYS-SER-VAL-LYS-GLN-GLY-GLN-THR-LEU-PHE-ILE-PRO-THR-GLY-TRP-ILE-HIS-ALA-VAL-LEU-THR-PRO-VAL-ASP-CYS-LEU-ALA-PHE-GLY-GLY-ASN-PHE-LEU-HIS-SER-LEU-ASN-ILE-GLU-MET-GLN-LEU-LYS-ALA-TYR-GLU-ILE-GLU-LYS-ARG-LEU-SER-THR-ALA-ASP-LEU-PHE-ARG-PHE-PRO-ASN-PHE-GLU-THR-ILE-CYS-TRP-TYR-VAL-GLY-LYS-HIS-ILE-LEU-ASP-ILE-PHE-ARG-GLY-LEU-ARG-GLU-ASN-ARG-ARG-HIS-PRO-ALA-SER-TYR-LEU-VAL-HIS-GLY-GLY-LYS-ALA-LEU-ASN-LEU-ALA-PHE-ARG-ALA-TRP-THR-ARG-LYS-GLU-ALA-LEU-PRO-ASP-HIS-GLU-ASP-GLU-ILE-PRO-GLU-THR-VAL-ARG-THR-VAL-GLN-LEU-ILE-LYS-ASP-LEU-ALA-ARG-GLU-ILE-ARG-LEU-VAL-GLU-ASP-ILE-PHE-GLN-GLN-ASN,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA,447,24,,Kd=1uM,6.0,6.0,1,A,A,0,A,A,0,,B,A,,1,1,447,24,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.6629650592803955,0.6638736128807068,76.23950958251953,73.70983123779297,0.5933544635772705,1.177556395530701,0.8000397682189941,0.774218738079071,0.5663290023803711,0.6139160394668579,ARTKQTARKSTGGKAPRKQLATKA,Low,"(5.959, 6.097]",train
3MHP,protein-peptide,P10933 Q8SKU2,SKKQDENIVVNKFKPKEPYVGRCLLNTKITGDDAPGETWHMVFSTEGEVPYREGQSIGIVPDGIDKNGKPHKLRLYSIASSAIGDFGDSKTVSLCVKRLVYTNDAGEVVKGVCSNFLCDLKPGSEVKITGPVGKEMLMPKDPNATVIMLGTGTGIAPFRSFLWKMFFEKHEDYQFNGLAWLFLGVPTSSSLLYKEEFEKMKEKAPENFRLDFAVSREQVNDKGEKMYIQTRMAQYAEELWELLKKDNTFVYMCGLKGMEKGIDDIMVSLAAKDGIDWIEYKRTLKKAEQWNVEVYL,KTEQPLSPYTAYDDLKPPSSPSPTKP,SER-LYS-LYS-GLN-ASP-GLU-ASN-ILE-VAL-VAL-ASN-LYS-PHE-LYS-PRO-LYS-GLU-PRO-TYR-VAL-GLY-ARG-CYS-LEU-LEU-ASN-THR-LYS-ILE-THR-GLY-ASP-ASP-ALA-PRO-GLY-GLU-THR-TRP-HIS-MET-VAL-PHE-SER-THR-GLU-GLY-GLU-VAL-PRO-TYR-ARG-GLU-GLY-GLN-SER-ILE-GLY-ILE-VAL-PRO-ASP-GLY-ILE-ASP-LYS-ASN-GLY-LYS-PRO-HIS-LYS-LEU-ARG-LEU-TYR-SER-ILE-ALA-SER-SER-ALA-ILE-GLY-ASP-PHE-GLY-ASP-SER-LYS-THR-VAL-SER-LEU-CYS-VAL-LYS-ARG-LEU-VAL-TYR-THR-ASN-ASP-ALA-GLY-GLU-VAL-VAL-LYS-GLY-VAL-CYS-SER-ASN-PHE-LEU-CYS-ASP-LEU-LYS-PRO-GLY-SER-GLU-VAL-LYS-ILE-THR-GLY-PRO-VAL-GLY-LYS-GLU-MET-LEU-MET-PRO-LYS-ASP-PRO-ASN-ALA-THR-VAL-ILE-MET-LEU-GLY-THR-GLY-THR-GLY-ILE-ALA-PRO-PHE-ARG-SER-PHE-LEU-TRP-LYS-MET-PHE-PHE-GLU-LYS-HIS-GLU-ASP-TYR-GLN-PHE-ASN-GLY-LEU-ALA-TRP-LEU-PHE-LEU-GLY-VAL-PRO-THR-SER-SER-SER-LEU-LEU-TYR-LYS-GLU-GLU-PHE-GLU-LYS-MET-LYS-GLU-LYS-ALA-PRO-GLU-ASN-PHE-ARG-LEU-ASP-PHE-ALA-VAL-SER-ARG-GLU-GLN-VAL-ASN-ASP-LYS-GLY-GLU-LYS-MET-TYR-ILE-GLN-THR-ARG-MET-ALA-GLN-TYR-ALA-GLU-GLU-LEU-TRP-GLU-LEU-LEU-LYS-LYS-ASP-ASN-THR-PHE-VAL-TYR-MET-CYS-GLY-LEU-LYS-GLY-MET-GLU-LYS-GLY-ILE-ASP-ASP-ILE-MET-VAL-SER-LEU-ALA-ALA-LYS-ASP-GLY-ILE-ASP-TRP-ILE-GLU-TYR-LYS-ARG-THR-LEU-LYS-LYS-ALA-GLU-GLN-TRP-ASN-VAL-GLU-VAL-TYR-LEU,LYS-THR-GLU-GLN-PRO-LEU-SER-PRO-TYR-THR-ALA-TYR-ASP-ASP-LEU-LYS-PRO-PRO-SER-SER-PRO-SER-PRO-THR-LYS-PRO,296,26,,Kd=2.75uM,5.560667,5.56,1,A,A,0,A,A,0,,C,A,dimer,1,1,296,26,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,0.762851357460022,0.6995881795883179,86.29325866699219,83.61518859863281,0.5241270661354065,0.9862027168273926,0.8991733193397522,0.8193851709365845,0.6783050298690796,0.6696388721466064,KTEQPLSPYTAYDDLKPPSSPSPTKP,Low,"(5.463, 5.6]",train
3MJH,protein-peptide,P20339 Q15075,NKICQFKLVLLGESAVGKSSLVLRFVKGQFHEFQESTIGAAFLTQTVCLDDTTVKFEIWDTAGLERYHSLAPMYYRGAQAAIVVYDITNEESFARAKNWVKELQRQASPNIVIALSGNKADLANKRAVDFQEAQSYADDNSLLFMETSAKTSMNVNEIFMAIAKKLPK,SSSEGFICPQCMKSLGSADELFKHYEAVHDAGND,ASN-LYS-ILE-CYS-GLN-PHE-LYS-LEU-VAL-LEU-LEU-GLY-GLU-SER-ALA-VAL-GLY-LYS-SER-SER-LEU-VAL-LEU-ARG-PHE-VAL-LYS-GLY-GLN-PHE-HIS-GLU-PHE-GLN-GLU-SER-THR-ILE-GLY-ALA-ALA-PHE-LEU-THR-GLN-THR-VAL-CYS-LEU-ASP-ASP-THR-THR-VAL-LYS-PHE-GLU-ILE-TRP-ASP-THR-ALA-GLY-LEU-GLU-ARG-TYR-HIS-SER-LEU-ALA-PRO-MET-TYR-TYR-ARG-GLY-ALA-GLN-ALA-ALA-ILE-VAL-VAL-TYR-ASP-ILE-THR-ASN-GLU-GLU-SER-PHE-ALA-ARG-ALA-LYS-ASN-TRP-VAL-LYS-GLU-LEU-GLN-ARG-GLN-ALA-SER-PRO-ASN-ILE-VAL-ILE-ALA-LEU-SER-GLY-ASN-LYS-ALA-ASP-LEU-ALA-ASN-LYS-ARG-ALA-VAL-ASP-PHE-GLN-GLU-ALA-GLN-SER-TYR-ALA-ASP-ASP-ASN-SER-LEU-LEU-PHE-MET-GLU-THR-SER-ALA-LYS-THR-SER-MET-ASN-VAL-ASN-GLU-ILE-PHE-MET-ALA-ILE-ALA-LYS-LYS-LEU-PRO-LYS,SER-SER-SER-GLU-GLY-PHE-ILE-CYS-PRO-GLN-CYS-MET-LYS-SER-LEU-GLY-SER-ALA-ASP-GLU-LEU-PHE-LYS-HIS-TYR-GLU-ALA-VAL-HIS-ASP-ALA-GLY-ASN-ASP,168,34,,Kd=2.4uM,5.619789,5.62,1,A,A,0,A,A,0,,B,A,dimer,1,1,168,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7165824174880981,0.6405834555625916,79.95375061035156,86.45819091796875,0.4953950047492981,1.084376096725464,0.8796518445014954,0.7411847114562988,0.6758150458335876,0.6154330968856812,SSSEGFICPQCMKSLGSADELFKHYEAVHDAGND,Low,"(5.6, 5.699]",train
3N00,protein-peptide,O75376 P20393,MKKHHHHHHGPEPTVEDVISQVARAHREIFTYAHDKLGSSPGNFNANHASGSPYPHGRSGRTVQEIWEDFSMSFTPAVREVVEFAKHIPGFRDLSQHDQVTLLKAGTFEVLMVRFASLFNVKDQTVMFLSRTTYSLQELGAMGMGDLLSAMFDFSEKLNSLALTEEELGLFTAVVLVSADRSGMENSASVEQLQETLLRALRALVLKNRPLETSRFTKLLLKLPDLRTLNNMHSEKLLSFRVDAQ,THRLITLADHICQIITQDFAR,MET-LYS-LYS-HIS-HIS-HIS-HIS-HIS-HIS-GLY-PRO-GLU-PRO-THR-VAL-GLU-ASP-VAL-ILE-SER-GLN-VAL-ALA-ARG-ALA-HIS-ARG-GLU-ILE-PHE-THR-TYR-ALA-HIS-ASP-LYS-LEU-GLY-SER-SER-PRO-GLY-ASN-PHE-ASN-ALA-ASN-HIS-ALA-SER-GLY-SER-PRO-TYR-PRO-HIS-GLY-ARG-SER-GLY-ARG-THR-VAL-GLN-GLU-ILE-TRP-GLU-ASP-PHE-SER-MET-SER-PHE-THR-PRO-ALA-VAL-ARG-GLU-VAL-VAL-GLU-PHE-ALA-LYS-HIS-ILE-PRO-GLY-PHE-ARG-ASP-LEU-SER-GLN-HIS-ASP-GLN-VAL-THR-LEU-LEU-LYS-ALA-GLY-THR-PHE-GLU-VAL-LEU-MET-VAL-ARG-PHE-ALA-SER-LEU-PHE-ASN-VAL-LYS-ASP-GLN-THR-VAL-MET-PHE-LEU-SER-ARG-THR-THR-TYR-SER-LEU-GLN-GLU-LEU-GLY-ALA-MET-GLY-MET-GLY-ASP-LEU-LEU-SER-ALA-MET-PHE-ASP-PHE-SER-GLU-LYS-LEU-ASN-SER-LEU-ALA-LEU-THR-GLU-GLU-GLU-LEU-GLY-LEU-PHE-THR-ALA-VAL-VAL-LEU-VAL-SER-ALA-ASP-ARG-SER-GLY-MET-GLU-ASN-SER-ALA-SER-VAL-GLU-GLN-LEU-GLN-GLU-THR-LEU-LEU-ARG-ALA-LEU-ARG-ALA-LEU-VAL-LEU-LYS-ASN-ARG-PRO-LEU-GLU-THR-SER-ARG-PHE-THR-LYS-LEU-LEU-LEU-LYS-LEU-PRO-ASP-LEU-ARG-THR-LEU-ASN-ASN-MET-HIS-SER-GLU-LYS-LEU-LEU-SER-PHE-ARG-VAL-ASP-ALA-GLN,THR-HIS-ARG-LEU-ILE-THR-LEU-ALA-ASP-HIS-ILE-CYS-GLN-ILE-ILE-THR-GLN-ASP-PHE-ALA-ARG,245,21,,IC50=0.22uM,6.657577,6.66,1,A,A,0,A,A,0,,B,A,,1,1,245,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,0.7846711874008179,0.7895064353942871,75.81956481933594,71.39656066894531,0.6879368424415588,1.07196843624115,0.7632318735122681,0.7782313823699951,0.6608016490936279,0.7081415057182312,THRLITLADHICQIITQDFAR,Low,"(6.523, 6.696]",train
3O34,protein-peptide,O15164 P68431,SPNEDWCAVCQNGGELLCCEKCPKVFHLSCHVPTLTNFPSGEWICTFCRDLSKPEVEYDCDAPSHNSEKKKTEGLVKLTPIDKRKCERLLLFLYCHEMSLAFQDPVPLTVPDYYKIIKNPMDLSTIKKRLQEDYSMYSKPEDFVADFRLIFQNCAEFNEPDSEVANAGIKLENYFEELLKNLYP,GKAPRKQLATKAARKSAPATYK,SER-PRO-ASN-GLU-ASP-TRP-CYS-ALA-VAL-CYS-GLN-ASN-GLY-GLY-GLU-LEU-LEU-CYS-CYS-GLU-LYS-CYS-PRO-LYS-VAL-PHE-HIS-LEU-SER-CYS-HIS-VAL-PRO-THR-LEU-THR-ASN-PHE-PRO-SER-GLY-GLU-TRP-ILE-CYS-THR-PHE-CYS-ARG-ASP-LEU-SER-LYS-PRO-GLU-VAL-GLU-TYR-ASP-CYS-ASP-ALA-PRO-SER-HIS-ASN-SER-GLU-LYS-LYS-LYS-THR-GLU-GLY-LEU-VAL-LYS-LEU-THR-PRO-ILE-ASP-LYS-ARG-LYS-CYS-GLU-ARG-LEU-LEU-LEU-PHE-LEU-TYR-CYS-HIS-GLU-MET-SER-LEU-ALA-PHE-GLN-ASP-PRO-VAL-PRO-LEU-THR-VAL-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-ASN-PRO-MET-ASP-LEU-SER-THR-ILE-LYS-LYS-ARG-LEU-GLN-GLU-ASP-TYR-SER-MET-TYR-SER-LYS-PRO-GLU-ASP-PHE-VAL-ALA-ASP-PHE-ARG-LEU-ILE-PHE-GLN-ASN-CYS-ALA-GLU-PHE-ASN-GLU-PRO-ASP-SER-GLU-VAL-ALA-ASN-ALA-GLY-ILE-LYS-LEU-GLU-ASN-TYR-PHE-GLU-GLU-LEU-LEU-LYS-ASN-LEU-TYR-PRO,GLY-LYS-ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-ALY-ALA-ALA-ARG-LYS-SER-ALA-PRO-ALA-THR-TYR-LYS,184,22,,Kd=8.8uM,5.055517,5.06,1,A,A,0,A,A,0,,B,A,,1,1,184,22,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.6905814409255981,0.7373984456062317,80.15434265136719,88.31388854980469,0.5989981889724731,0.8391450047492981,0.8546575307846069,0.8181648254394531,0.5464071035385132,0.6934295892715454,GKAPRKQLATKAARKSAPATYK,Low,"(5.014, 5.105]",train
3OAK,protein-peptide,Q06505 P23615,GIDPFTDDLEQYLDEKILRLKDEMNIAAQLDIDTLNKRIETGDTSLIAMQKVKLLPKVVSVLSKANLADTILDNNLLQSVRIWLEPLPDGSLPSFEIQKSLFAALNDLPVKTEHLKESGLGRVVIFYTKSKRVEAQLARLAEKLIAEWTRP,DPFTHMSDKIDEMYDIFGDGHDYDWALEIEN,GLY-ILE-ASP-PRO-PHE-THR-ASP-ASP-LEU-GLU-GLN-TYR-LEU-ASP-GLU-LYS-ILE-LEU-ARG-LEU-LYS-ASP-GLU-MET-ASN-ILE-ALA-ALA-GLN-LEU-ASP-ILE-ASP-THR-LEU-ASN-LYS-ARG-ILE-GLU-THR-GLY-ASP-THR-SER-LEU-ILE-ALA-MET-GLN-LYS-VAL-LYS-LEU-LEU-PRO-LYS-VAL-VAL-SER-VAL-LEU-SER-LYS-ALA-ASN-LEU-ALA-ASP-THR-ILE-LEU-ASP-ASN-ASN-LEU-LEU-GLN-SER-VAL-ARG-ILE-TRP-LEU-GLU-PRO-LEU-PRO-ASP-GLY-SER-LEU-PRO-SER-PHE-GLU-ILE-GLN-LYS-SER-LEU-PHE-ALA-ALA-LEU-ASN-ASP-LEU-PRO-VAL-LYS-THR-GLU-HIS-LEU-LYS-GLU-SER-GLY-LEU-GLY-ARG-VAL-VAL-ILE-PHE-TYR-THR-LYS-SER-LYS-ARG-VAL-GLU-ALA-GLN-LEU-ALA-ARG-LEU-ALA-GLU-LYS-LEU-ILE-ALA-GLU-TRP-THR-ARG-PRO,ASP-PRO-PHE-THR-HIS-MET-SER-ASP-LYS-ILE-ASP-GLU-MET-TYR-ASP-ILE-PHE-GLY-ASP-GLY-HIS-ASP-TYR-ASP-TRP-ALA-LEU-GLU-ILE-GLU-ASN,151,31,,Kd=170nM,6.769551,6.77,1,A,A,0,A,A,0,,C,A,,0,1,151,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O,0.8527897000312805,0.6432557702064514,89.44322967529297,86.96318817138672,0.4083459675312042,1.1404136419296265,0.8964127898216248,0.7337923049926758,0.7594663500785828,0.6206216216087341,DPFTHMSDKIDEMYDIFGDGHDYDWALEIEN,Low,"(6.696, 6.824]",train
3OIQ,protein-peptide,P13382 P32797,AHKNRIFVSSSKDFEGYPSKAIVPVQFVALLTSIHLTETKCLLGFSNFERRGDQSQEDQYLIKLKFKDRGSERLARITISLLCQYFDIELPDLDSDSGASPTVILRDIHLERLCFSSCKALYVSKHGNYTLFLEDIKPLDLVSVISTISTKSTNSSKHSSSELISECDLNNSLVDIFNNLIEMNRDEKNRFKFVKLIHYDIELKKFVQDQQKVLSQKSKAAAINPFFVPNRLG,SPLKLQSRKLRYANDVQDLLDDVENSPVVATKRQNV,ALA-HIS-LYS-ASN-ARG-ILE-PHE-VAL-SER-SER-SER-LYS-ASP-PHE-GLU-GLY-TYR-PRO-SER-LYS-ALA-ILE-VAL-PRO-VAL-GLN-PHE-VAL-ALA-LEU-LEU-THR-SER-ILE-HIS-LEU-THR-GLU-THR-LYS-CYS-LEU-LEU-GLY-PHE-SER-ASN-PHE-GLU-ARG-ARG-GLY-ASP-GLN-SER-GLN-GLU-ASP-GLN-TYR-LEU-ILE-LYS-LEU-LYS-PHE-LYS-ASP-ARG-GLY-SER-GLU-ARG-LEU-ALA-ARG-ILE-THR-ILE-SER-LEU-LEU-CYS-GLN-TYR-PHE-ASP-ILE-GLU-LEU-PRO-ASP-LEU-ASP-SER-ASP-SER-GLY-ALA-SER-PRO-THR-VAL-ILE-LEU-ARG-ASP-ILE-HIS-LEU-GLU-ARG-LEU-CYS-PHE-SER-SER-CYS-LYS-ALA-LEU-TYR-VAL-SER-LYS-HIS-GLY-ASN-TYR-THR-LEU-PHE-LEU-GLU-ASP-ILE-LYS-PRO-LEU-ASP-LEU-VAL-SER-VAL-ILE-SER-THR-ILE-SER-THR-LYS-SER-THR-ASN-SER-SER-LYS-HIS-SER-SER-SER-GLU-LEU-ILE-SER-GLU-CYS-ASP-LEU-ASN-ASN-SER-LEU-VAL-ASP-ILE-PHE-ASN-ASN-LEU-ILE-GLU-MET-ASN-ARG-ASP-GLU-LYS-ASN-ARG-PHE-LYS-PHE-VAL-LYS-LEU-ILE-HIS-TYR-ASP-ILE-GLU-LEU-LYS-LYS-PHE-VAL-GLN-ASP-GLN-GLN-LYS-VAL-LEU-SER-GLN-LYS-SER-LYS-ALA-ALA-ALA-ILE-ASN-PRO-PHE-PHE-VAL-PRO-ASN-ARG-LEU-GLY,SER-PRO-LEU-LYS-LEU-GLN-SER-ARG-LYS-LEU-ARG-TYR-ALA-ASN-ASP-VAL-GLN-ASP-LEU-LEU-ASP-ASP-VAL-GLU-ASN-SER-PRO-VAL-VAL-ALA-THR-LYS-ARG-GLN-ASN-VAL,233,36,,Kd=3.8uM,5.420216,5.42,1,A,A,0,A,A,0,,B,A,,1,1,233,36,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(C)C)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)O,0.7598040103912354,0.6753111481666565,70.06198120117188,66.61278533935547,0.6475778222084045,1.2027337551116943,0.7904651165008545,0.7188292145729065,0.6382911205291748,0.6241955757141113,SPLKLQSRKLRYANDVQDLLDDVENSPVVATKRQNV,Low,"(5.31, 5.463]",train
3ONW,protein-peptide,O43566 P63096,SNAGAREVKLLLLGAGESGKSTIVKQMKIIHEAGYSEEECKQYKAVVYSNTIQSIIAIIRAMGRLKIDFGDSARADDARQLFVLAGAAEEGFMTAELAGVIKRLWKDSGVQACFNRSREYLLNDSAAYYLNDLDRIAQPNYIPTQQDVLRTRVKTTGIVETHFTFKDLHFKMFDVGGQRSERKKWIHCFEGVTAIIFCVALSDYDLVLAEDEEMNRMHESMKLFDSICNNKWFTDTSIILFLNKKDLFEEKIKKSPLTICYPEYAGSNTYEEAAAYIQCQFEDLNKRKDTKEIYTHFTCATDTKNVQFVFDAVTDVIIKNNLKDCGLF,DIEGLVELLNRVQSSGAHDQRGLLRKEDLVLPEFLQ,SER-ASN-ALA-GLY-ALA-ARG-GLU-VAL-LYS-LEU-LEU-LEU-LEU-GLY-ALA-GLY-GLU-SER-GLY-LYS-SER-THR-ILE-VAL-LYS-GLN-MET-LYS-ILE-ILE-HIS-GLU-ALA-GLY-TYR-SER-GLU-GLU-GLU-CYS-LYS-GLN-TYR-LYS-ALA-VAL-VAL-TYR-SER-ASN-THR-ILE-GLN-SER-ILE-ILE-ALA-ILE-ILE-ARG-ALA-MET-GLY-ARG-LEU-LYS-ILE-ASP-PHE-GLY-ASP-SER-ALA-ARG-ALA-ASP-ASP-ALA-ARG-GLN-LEU-PHE-VAL-LEU-ALA-GLY-ALA-ALA-GLU-GLU-GLY-PHE-MET-THR-ALA-GLU-LEU-ALA-GLY-VAL-ILE-LYS-ARG-LEU-TRP-LYS-ASP-SER-GLY-VAL-GLN-ALA-CYS-PHE-ASN-ARG-SER-ARG-GLU-TYR-LEU-LEU-ASN-ASP-SER-ALA-ALA-TYR-TYR-LEU-ASN-ASP-LEU-ASP-ARG-ILE-ALA-GLN-PRO-ASN-TYR-ILE-PRO-THR-GLN-GLN-ASP-VAL-LEU-ARG-THR-ARG-VAL-LYS-THR-THR-GLY-ILE-VAL-GLU-THR-HIS-PHE-THR-PHE-LYS-ASP-LEU-HIS-PHE-LYS-MET-PHE-ASP-VAL-GLY-GLY-GLN-ARG-SER-GLU-ARG-LYS-LYS-TRP-ILE-HIS-CYS-PHE-GLU-GLY-VAL-THR-ALA-ILE-ILE-PHE-CYS-VAL-ALA-LEU-SER-ASP-TYR-ASP-LEU-VAL-LEU-ALA-GLU-ASP-GLU-GLU-MET-ASN-ARG-MET-HIS-GLU-SER-MET-LYS-LEU-PHE-ASP-SER-ILE-CYS-ASN-ASN-LYS-TRP-PHE-THR-ASP-THR-SER-ILE-ILE-LEU-PHE-LEU-ASN-LYS-LYS-ASP-LEU-PHE-GLU-GLU-LYS-ILE-LYS-LYS-SER-PRO-LEU-THR-ILE-CYS-TYR-PRO-GLU-TYR-ALA-GLY-SER-ASN-THR-TYR-GLU-GLU-ALA-ALA-ALA-TYR-ILE-GLN-CYS-GLN-PHE-GLU-ASP-LEU-ASN-LYS-ARG-LYS-ASP-THR-LYS-GLU-ILE-TYR-THR-HIS-PHE-THR-CYS-ALA-THR-ASP-THR-LYS-ASN-VAL-GLN-PHE-VAL-PHE-ASP-ALA-VAL-THR-ASP-VAL-ILE-ILE-LYS-ASN-ASN-LEU-LYS-ASP-CYS-GLY-LEU-PHE,ASP-ILE-GLU-GLY-LEU-VAL-GLU-LEU-LEU-ASN-ARG-VAL-GLN-SER-SER-GLY-ALA-HIS-ASP-GLN-ARG-GLY-LEU-LEU-ARG-LYS-GLU-ASP-LEU-VAL-LEU-PRO-GLU-PHE-LEU-GLN,328,36,,Kd=2.3nM,8.638272,8.64,1,A,A,0,A,A,0,,C,A,,1,1,328,36,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7964028716087341,0.6025080680847168,78.38470458984375,62.74429702758789,0.5536904335021973,1.493302345275879,0.8365510106086731,0.729117751121521,0.7245526313781738,0.5708556175231934,DIEGLVELLNRVQSSGAHDQRGLLRKEDLVLPEFLQ,Moderate,"(8.383, 8.824]",train
3OWT,protein-peptide,P11938 P06701,SAIRSDFSNEDIYDNIDPDTISFPPKIATTDLFLPLFFHFGSTRQFMDKLHEVISGDYEPSQAEKLVQDLCDETGIRKNFSTSILTCLSGDLMVFPRYFLNMFKDNVNPPPNVPGIWTHDDDESLKSNDQEQIRKLVKKHGTGRMEMRKRFFEKDLL,SEKGNAKMIDFATLSKLKKKYQIILDR,SER-ALA-ILE-ARG-SER-ASP-PHE-SER-ASN-GLU-ASP-ILE-TYR-ASP-ASN-ILE-ASP-PRO-ASP-THR-ILE-SER-PHE-PRO-PRO-LYS-ILE-ALA-THR-THR-ASP-LEU-PHE-LEU-PRO-LEU-PHE-PHE-HIS-PHE-GLY-SER-THR-ARG-GLN-PHE-MET-ASP-LYS-LEU-HIS-GLU-VAL-ILE-SER-GLY-ASP-TYR-GLU-PRO-SER-GLN-ALA-GLU-LYS-LEU-VAL-GLN-ASP-LEU-CYS-ASP-GLU-THR-GLY-ILE-ARG-LYS-ASN-PHE-SER-THR-SER-ILE-LEU-THR-CYS-LEU-SER-GLY-ASP-LEU-MET-VAL-PHE-PRO-ARG-TYR-PHE-LEU-ASN-MET-PHE-LYS-ASP-ASN-VAL-ASN-PRO-PRO-PRO-ASN-VAL-PRO-GLY-ILE-TRP-THR-HIS-ASP-ASP-ASP-GLU-SER-LEU-LYS-SER-ASN-ASP-GLN-GLU-GLN-ILE-ARG-LYS-LEU-VAL-LYS-LYS-HIS-GLY-THR-GLY-ARG-MET-GLU-MET-ARG-LYS-ARG-PHE-PHE-GLU-LYS-ASP-LEU-LEU,SER-GLU-LYS-GLY-ASN-ALA-LYS-MET-ILE-ASP-PHE-ALA-THR-LEU-SER-LYS-LEU-LYS-LYS-LYS-TYR-GLN-ILE-ILE-LEU-ASP-ARG,157,27,,Kd=2.49uM,5.603801,5.6,1,A,A,0,A,A,0,,C,A,dimer,1,1,157,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9163790941238404,0.7452332973480225,90.53487396240234,79.81111145019531,0.4167528748512268,0.9096219539642334,0.8995643258094788,0.8102650046348572,0.8288708329200745,0.7289753556251526,SEKGNAKMIDFATLSKLKKKYQIILDR,Low,"(5.6, 5.699]",train
3QBR,protein-peptide,Q5BWX6 Q16611,HHHHHHSQDPMSNTADFRLQTSTLCHSFLLASANKQDTDYLTDLLDNTNIDLTCVPNGQEIIHSLLQLVGDFNQRFSQTHEIEPVAQSLGIDSDKPVDKTALEIFYLEILNGLFEKLNWGRIVAMFAFLRILVLRLSKHGHSDAIQMLIKTTSQYSDEKLKNWINLHDGWSGLIEFSGR,LPLQPSSTMGQVGRQLAIIGDDINRRYDSEFQTM,HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-MET-SER-ASN-THR-ALA-ASP-PHE-ARG-LEU-GLN-THR-SER-THR-LEU-CYS-HIS-SER-PHE-LEU-LEU-ALA-SER-ALA-ASN-LYS-GLN-ASP-THR-ASP-TYR-LEU-THR-ASP-LEU-LEU-ASP-ASN-THR-ASN-ILE-ASP-LEU-THR-CYS-VAL-PRO-ASN-GLY-GLN-GLU-ILE-ILE-HIS-SER-LEU-LEU-GLN-LEU-VAL-GLY-ASP-PHE-ASN-GLN-ARG-PHE-SER-GLN-THR-HIS-GLU-ILE-GLU-PRO-VAL-ALA-GLN-SER-LEU-GLY-ILE-ASP-SER-ASP-LYS-PRO-VAL-ASP-LYS-THR-ALA-LEU-GLU-ILE-PHE-TYR-LEU-GLU-ILE-LEU-ASN-GLY-LEU-PHE-GLU-LYS-LEU-ASN-TRP-GLY-ARG-ILE-VAL-ALA-MET-PHE-ALA-PHE-LEU-ARG-ILE-LEU-VAL-LEU-ARG-LEU-SER-LYS-HIS-GLY-HIS-SER-ASP-ALA-ILE-GLN-MET-LEU-ILE-LYS-THR-THR-SER-GLN-TYR-SER-ASP-GLU-LYS-LEU-LYS-ASN-TRP-ILE-ASN-LEU-HIS-ASP-GLY-TRP-SER-GLY-LEU-ILE-GLU-PHE-SER-GLY-ARG,LEU-PRO-LEU-GLN-PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU-PHE-GLN-THR-MET,179,34,,IC50=68nM,7.167491,7.17,1,A,A,0,A,A,0,,B,A,,1,1,179,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8949499726295471,0.7370384335517883,85.29498291015625,75.54631042480469,0.5536576509475708,0.941635251045227,0.84051913022995,0.7720769643783569,0.7999895811080933,0.6863793134689331,LPLQPSSTMGQVGRQLAIIGDDINRRYDSEFQTM,Moderate,"(7.049, 7.268]",train
3R85,protein-peptide,Q9Y5Z4 Q07817,GSHMSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,SAQKNQEQLLTLASILREDGKVFDEK,GLY-SER-HIS-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,SER-ALA-GLN-LYS-ASN-GLN-GLU-GLN-LEU-LEU-THR-LEU-ALA-SER-ILE-LEU-ARG-GLU-ASP-GLY-LYS-VAL-PHE-ASP-GLU-LYS,156,26,,Kd=41.3uM,4.38405,4.38,1,A,A,0,A,A,0,,E,A,,1,1,156,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O,0.955560564994812,0.6687607169151306,80.26422882080078,69.76495361328125,0.5146256685256958,1.1097108125686646,0.8241522908210754,0.7337148189544678,0.8647862672805786,0.6364964246749878,SAQKNQEQLLTLASILREDGKVFDEK,Low,"(4.319, 4.456]",val
3RO2,protein-peptide,Q14980 Q8VDU0,GSASCLELALEGERLCKSGDCRAGVSFFEAAVQVGTEDLKTLSAIYSQLGNAYFYLHDYAKALEYHHHDLTLARTIGDQLGEAKASGNLGNTLKVLGNFDEAIVCCQRHLDISRELNDKVGEARALYNLGNVYHAKGKSFGCPGPQDTGEFPEDVRNALQAAVDLYEENLSLVTALGDRAAQGRAFGNLGNTHYLLGNFRDAVIAHEQRLLIAKEFGDKAAERRAYSNLGNAYIFLGEFETASEYYKKTLLLARQLKDRAVEAQSCYSLGNTYTLLQDYEKAIDYHLKHLAIAQELKDRIGEGRACWSLGNAYTALGNHDQAMHFAEKHLEISREVGD,RNSFYMGTCQDEPEQLDDWNRIAELQQR,GLY-SER-ALA-SER-CYS-LEU-GLU-LEU-ALA-LEU-GLU-GLY-GLU-ARG-LEU-CYS-LYS-SER-GLY-ASP-CYS-ARG-ALA-GLY-VAL-SER-PHE-PHE-GLU-ALA-ALA-VAL-GLN-VAL-GLY-THR-GLU-ASP-LEU-LYS-THR-LEU-SER-ALA-ILE-TYR-SER-GLN-LEU-GLY-ASN-ALA-TYR-PHE-TYR-LEU-HIS-ASP-TYR-ALA-LYS-ALA-LEU-GLU-TYR-HIS-HIS-HIS-ASP-LEU-THR-LEU-ALA-ARG-THR-ILE-GLY-ASP-GLN-LEU-GLY-GLU-ALA-LYS-ALA-SER-GLY-ASN-LEU-GLY-ASN-THR-LEU-LYS-VAL-LEU-GLY-ASN-PHE-ASP-GLU-ALA-ILE-VAL-CYS-CYS-GLN-ARG-HIS-LEU-ASP-ILE-SER-ARG-GLU-LEU-ASN-ASP-LYS-VAL-GLY-GLU-ALA-ARG-ALA-LEU-TYR-ASN-LEU-GLY-ASN-VAL-TYR-HIS-ALA-LYS-GLY-LYS-SER-PHE-GLY-CYS-PRO-GLY-PRO-GLN-ASP-THR-GLY-GLU-PHE-PRO-GLU-ASP-VAL-ARG-ASN-ALA-LEU-GLN-ALA-ALA-VAL-ASP-LEU-TYR-GLU-GLU-ASN-LEU-SER-LEU-VAL-THR-ALA-LEU-GLY-ASP-ARG-ALA-ALA-GLN-GLY-ARG-ALA-PHE-GLY-ASN-LEU-GLY-ASN-THR-HIS-TYR-LEU-LEU-GLY-ASN-PHE-ARG-ASP-ALA-VAL-ILE-ALA-HIS-GLU-GLN-ARG-LEU-LEU-ILE-ALA-LYS-GLU-PHE-GLY-ASP-LYS-ALA-ALA-GLU-ARG-ARG-ALA-TYR-SER-ASN-LEU-GLY-ASN-ALA-TYR-ILE-PHE-LEU-GLY-GLU-PHE-GLU-THR-ALA-SER-GLU-TYR-TYR-LYS-LYS-THR-LEU-LEU-LEU-ALA-ARG-GLN-LEU-LYS-ASP-ARG-ALA-VAL-GLU-ALA-GLN-SER-CYS-TYR-SER-LEU-GLY-ASN-THR-TYR-THR-LEU-LEU-GLN-ASP-TYR-GLU-LYS-ALA-ILE-ASP-TYR-HIS-LEU-LYS-HIS-LEU-ALA-ILE-ALA-GLN-GLU-LEU-LYS-ASP-ARG-ILE-GLY-GLU-GLY-ARG-ALA-CYS-TRP-SER-LEU-GLY-ASN-ALA-TYR-THR-ALA-LEU-GLY-ASN-HIS-ASP-GLN-ALA-MET-HIS-PHE-ALA-GLU-LYS-HIS-LEU-GLU-ILE-SER-ARG-GLU-VAL-GLY-ASP,ARG-ASN-SER-PHE-TYR-MET-GLY-THR-CYS-GLN-ASP-GLU-PRO-GLU-GLN-LEU-ASP-ASP-TRP-ASN-ARG-ILE-ALA-GLU-LEU-GLN-GLN-ARG,338,28,,Kd=0.046uM,7.337242,7.34,1,A,A,0,A,A,0,,B,A,,1,1,338,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9000356197357178,0.7850496768951416,86.25337982177734,79.99803924560547,0.3684166371822357,0.8008930087089539,0.895286500453949,0.8531279563903809,0.853408694267273,0.7680301070213318,RNSFYMGTCQDEPEQLDDWNRIAELQQR,Moderate,"(7.268, 7.523]",val
3SRI,protein-peptide,P50489 Q8IKV6,EFIEIVERSNYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSKTTFLKPVATGNQDLKDGGFAFPPTEPLISPMTLNGMRDFYKNNEYVKNLDELTLCSRHAGNMNPDKDENSNYKYPAVYDDKDKKCHILYIAAQENNGPRYCNKDESKRNSMFCFRPAKDKSFQNYVYLSKNVVDNWEKVCPRKNLENAKFGLWVDGNCEDIPHVNEFSANDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNADMIKSAFLPTGAFKADRYKSHGKGYNWGNYNRKTHKCEIFNVKPTCLINDKSYIATTALSHPIEVENNFPMVPRAAAAASFLEQKLISEEDLNSAVDHHHHHH,KDIGAGPVASCFTTRMSPPQQICLNSVVN,GLU-PHE-ILE-GLU-ILE-VAL-GLU-ARG-SER-ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-LYS-THR-THR-PHE-LEU-LYS-PRO-VAL-ALA-THR-GLY-ASN-GLN-ASP-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-GLU-PRO-LEU-ILE-SER-PRO-MET-THR-LEU-ASN-GLY-MET-ARG-ASP-PHE-TYR-LYS-ASN-ASN-GLU-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ASN-PRO-ASP-LYS-ASP-GLU-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-ASP-LYS-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLU-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-LYS-SER-PHE-GLN-ASN-TYR-VAL-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-LYS-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLU-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-SER-ALA-ASN-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-ASP-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-ARG-LYS-THR-HIS-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASP-LYS-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU-ASN-ASN-PHE-PRO-MET-VAL-PRO-ARG-ALA-ALA-ALA-ALA-ALA-SER-PHE-LEU-GLU-GLN-LYS-LEU-ILE-SER-GLU-GLU-ASP-LEU-ASN-SER-ALA-VAL-ASP-HIS-HIS-HIS-HIS-HIS-HIS,LYS-ASP-ILE-GLY-ALA-GLY-PRO-VAL-ALA-SER-CYS-PHE-THR-THR-ARG-MET-SER-PRO-PRO-GLN-GLN-ILE-CYS-LEU-ASN-SER-VAL-VAL-ASN,381,29,,Kd=165nM,6.782516,6.78,1,A,A,0,A,A,0,,B,A,,1,1,381,29,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(C)C,0.7004003524780273,0.5675761699676514,40.1205940246582,37.03425216674805,1.524545669555664,1.9067426919937132,0.6104828119277954,0.5841260552406311,0.643611490726471,0.5240686535835266,KDIGAGPVASCFTTRMSPPQQICLNSVVN,Low,"(6.696, 6.824]",train
3TZ1,protein-peptide,Q7M3Y3 Q27428,MEDLDERELKEAFRVLDKEKKGVIKVDVLRWILKSLGDELTEDEIENMIAETDTDGSGTVDYEEFKCLMMSSDA,GLSPEKKKMLKKLIMQKAAEDLAN,MET-GLU-ASP-LEU-ASP-GLU-ARG-GLU-LEU-LYS-GLU-ALA-PHE-ARG-VAL-LEU-ASP-LYS-GLU-LYS-LYS-GLY-VAL-ILE-LYS-VAL-ASP-VAL-LEU-ARG-TRP-ILE-LEU-LYS-SER-LEU-GLY-ASP-GLU-LEU-THR-GLU-ASP-GLU-ILE-GLU-ASN-MET-ILE-ALA-GLU-THR-ASP-THR-ASP-GLY-SER-GLY-THR-VAL-ASP-TYR-GLU-GLU-PHE-LYS-CYS-LEU-MET-MET-SER-SER-ASP-ALA,GLY-LEU-SER-PRO-GLU-LYS-LYS-LYS-MET-LEU-LYS-LYS-LEU-ILE-MET-GLN-LYS-ALA-ALA-GLU-ASP-LEU-ALA-ASN,74,24,,Kd=0.141uM,6.850781,6.85,1,A,A,0,A,A,0,,B,A,,1,1,74,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8861186504364014,0.6866253614425659,85.24493408203125,71.790771484375,0.4305279552936554,0.9041097164154052,0.8147852420806885,0.7310898900032043,0.7508907318115234,0.6755091547966003,GLSPEKKKMLKKLIMQKAAEDLAN,Low,"(6.824, 7.049]",val
3WN7,protein-peptide,Q60795 Q9Z2X8,MGHHHHHHDYDIPTTENLYFQGAPKVGRLIYTAGGYFRQSLSYLEAYNPSNGSWLRLADLQVPRSGLAGCVVGGLLYAVGGRNNSPDGNTDSSALDCYNPMTNQWSPCASMSVPRNRIGVGVIDGHIYAVGGSHGCIHHSSVERYEPERDEWHLVAPMLTRRIGVGVAVLNRLLYAVGGFDGTNRLNSAECYYPERNEWRMITPMNTIRSGAGVCVLHNCIYAAGGYDGQDQLNSVERYDVETETWTFVAPMRHHRSALGITVHQGKIYVLGGYDGHTFLDSVECYDPDSDTWSEVTRMTSGRSGVGVAVT,MDLIDILWRQDIDLGVSREVFDFSQRQKDYELEKQ,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-ASP-TYR-ASP-ILE-PRO-THR-THR-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ALA-PRO-LYS-VAL-GLY-ARG-LEU-ILE-TYR-THR-ALA-GLY-GLY-TYR-PHE-ARG-GLN-SER-LEU-SER-TYR-LEU-GLU-ALA-TYR-ASN-PRO-SER-ASN-GLY-SER-TRP-LEU-ARG-LEU-ALA-ASP-LEU-GLN-VAL-PRO-ARG-SER-GLY-LEU-ALA-GLY-CYS-VAL-VAL-GLY-GLY-LEU-LEU-TYR-ALA-VAL-GLY-GLY-ARG-ASN-ASN-SER-PRO-ASP-GLY-ASN-THR-ASP-SER-SER-ALA-LEU-ASP-CYS-TYR-ASN-PRO-MET-THR-ASN-GLN-TRP-SER-PRO-CYS-ALA-SER-MET-SER-VAL-PRO-ARG-ASN-ARG-ILE-GLY-VAL-GLY-VAL-ILE-ASP-GLY-HIS-ILE-TYR-ALA-VAL-GLY-GLY-SER-HIS-GLY-CYS-ILE-HIS-HIS-SER-SER-VAL-GLU-ARG-TYR-GLU-PRO-GLU-ARG-ASP-GLU-TRP-HIS-LEU-VAL-ALA-PRO-MET-LEU-THR-ARG-ARG-ILE-GLY-VAL-GLY-VAL-ALA-VAL-LEU-ASN-ARG-LEU-LEU-TYR-ALA-VAL-GLY-GLY-PHE-ASP-GLY-THR-ASN-ARG-LEU-ASN-SER-ALA-GLU-CYS-TYR-TYR-PRO-GLU-ARG-ASN-GLU-TRP-ARG-MET-ILE-THR-PRO-MET-ASN-THR-ILE-ARG-SER-GLY-ALA-GLY-VAL-CYS-VAL-LEU-HIS-ASN-CYS-ILE-TYR-ALA-ALA-GLY-GLY-TYR-ASP-GLY-GLN-ASP-GLN-LEU-ASN-SER-VAL-GLU-ARG-TYR-ASP-VAL-GLU-THR-GLU-THR-TRP-THR-PHE-VAL-ALA-PRO-MET-ARG-HIS-HIS-ARG-SER-ALA-LEU-GLY-ILE-THR-VAL-HIS-GLN-GLY-LYS-ILE-TYR-VAL-LEU-GLY-GLY-TYR-ASP-GLY-HIS-THR-PHE-LEU-ASP-SER-VAL-GLU-CYS-TYR-ASP-PRO-ASP-SER-ASP-THR-TRP-SER-GLU-VAL-THR-ARG-MET-THR-SER-GLY-ARG-SER-GLY-VAL-GLY-VAL-ALA-VAL-THR,MET-ASP-LEU-ILE-ASP-ILE-LEU-TRP-ARG-GLN-ASP-ILE-ASP-LEU-GLY-VAL-SER-ARG-GLU-VAL-PHE-ASP-PHE-SER-GLN-ARG-GLN-LYS-ASP-TYR-GLU-LEU-GLU-LYS-GLN,311,35,,Kd=7.31nM,8.136083,8.14,1,A,A,0,A,A,0,,B,A,dimer,1,1,311,35,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)CC)C(=O)O,0.729849100112915,0.5611677765846252,83.84749603271484,82.44865417480469,0.4881447255611419,1.4823957681655884,0.8513264656066895,0.6880500912666321,0.6597397923469543,0.4852350056171417,MDLIDILWRQDIDLGVSREVFDFSQRQKDYELEKQ,Moderate,"(7.921, 8.383]",train
3ZRZ,protein-peptide,Q711B0 P02751,AEETCFDKYTGNTYRVGDTYERPKDSMIWDCTCIGAGRGRISCTIANRCHEGGQSYKIGDTWRRPHETGGYMLECVCLGNGKGEWTCKPI,TGMSGFSETVTIVEDTRP,ALA-GLU-GLU-THR-CYS-PHE-ASP-LYS-TYR-THR-GLY-ASN-THR-TYR-ARG-VAL-GLY-ASP-THR-TYR-GLU-ARG-PRO-LYS-ASP-SER-MET-ILE-TRP-ASP-CYS-THR-CYS-ILE-GLY-ALA-GLY-ARG-GLY-ARG-ILE-SER-CYS-THR-ILE-ALA-ASN-ARG-CYS-HIS-GLU-GLY-GLY-GLN-SER-TYR-LYS-ILE-GLY-ASP-THR-TRP-ARG-ARG-PRO-HIS-GLU-THR-GLY-GLY-TYR-MET-LEU-GLU-CYS-VAL-CYS-LEU-GLY-ASN-GLY-LYS-GLY-GLU-TRP-THR-CYS-LYS-PRO-ILE,ACE-THR-GLY-MET-SER-GLY-PHE-SER-GLU-THR-VAL-THR-ILE-VAL-GLU-ASP-THR-ARG-PRO-NH2,90,20,,Kd=0.030nM,10.522879,10.52,1,A,A,0,A,A,0,,C,A,,1,1,90,20,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)C(C)C,0.9199461936950684,0.7703815698623657,87.9057846069336,83.35845947265625,0.3632242083549499,0.6831899881362915,0.858484148979187,0.8154533505439758,0.8311450481414795,0.7591135501861572,TGMSGFSETVTIVEDTRP,High,"(8.824, 12.12]",val
3ZWH,protein-peptide,P35579 P26447,GSHMASPLEKALDVMVSTFHKYSGKEGDKFKLNKSELKELLTRELPSWLGKRTDEAAFQKLMSNLDSNRDNEVDFQEYCVFLSSIAMMSNEFFEGFPDKQPRKK,YRKLQRELEDATETADAMNREVSSLKNKLRRGDLPFVVPRRMARK,GLY-SER-HIS-MET-ALA-SER-PRO-LEU-GLU-LYS-ALA-LEU-ASP-VAL-MET-VAL-SER-THR-PHE-HIS-LYS-TYR-SER-GLY-LYS-GLU-GLY-ASP-LYS-PHE-LYS-LEU-ASN-LYS-SER-GLU-LEU-LYS-GLU-LEU-LEU-THR-ARG-GLU-LEU-PRO-SER-TRP-LEU-GLY-LYS-ARG-THR-ASP-GLU-ALA-ALA-PHE-GLN-LYS-LEU-MET-SER-ASN-LEU-ASP-SER-ASN-ARG-ASP-ASN-GLU-VAL-ASP-PHE-GLN-GLU-TYR-CYS-VAL-PHE-LEU-SER-SER-ILE-ALA-MET-MET-SER-ASN-GLU-PHE-PHE-GLU-GLY-PHE-PRO-ASP-LYS-GLN-PRO-ARG-LYS-LYS,TYR-ARG-LYS-LEU-GLN-ARG-GLU-LEU-GLU-ASP-ALA-THR-GLU-THR-ALA-ASP-ALA-MET-ASN-ARG-GLU-VAL-SER-SER-LEU-LYS-ASN-LYS-LEU-ARG-ARG-GLY-ASP-LEU-PRO-PHE-VAL-VAL-PRO-ARG-ARG-MET-ALA-ARG-LYS,104,45,,Kd=1540nM,5.812479,5.81,1,A,A,0,A,A,0,,Q,A,dimer,1,1,104,45,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C,0.9017691612243652,0.614393413066864,74.58262634277344,54.62495422363281,0.4543720483779907,1.2574098110198977,0.8064402341842651,0.5952825546264648,0.7452321648597717,0.5170076489448547,YRKLQRELEDATETADAMNREVSSLKNKLRRGDLPFVVPRRMARK,Low,"(5.699, 5.821]",val
3ZWL,protein-peptide,P06103 P40217,MGSSHHHHHHSSGENLYFQGSHMKAIKLTGHERPLTQVKYNKEGDLLFSCSKDSSASVWYSLNGERLGTLDGHTGTIWSIDVDCFTKYCVTGSADYSIKLWDVSNGQCVATWKSPVPVKRVEFSPCGNYFLAILDNVMKNPGSINIYEIERDSATHELTKVSEEPIHKIITHEGLDAATVAGWSTKGKYIIAGHKDGKISKYDVSNNYEYVDSIDLHEKSISDMQFSPDLTYFITSSRDTNSFLVDVSTLQVLKKYETDCPLNTAVITPLKEFIILGGGQEAKDVTTTSANEGKFEARFYHKIFEEEIGRVQGHFGPLNTVAISPQGTSYASGGEDGFIRLHHFEKSYFDFKYDVEKAAEAKEHMQEAN,GSHMEADTAMRDLILHQRELLKQWTEYREKIGQEMEKSMNFKIFDVQPED,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-GLU-ASN-LEU-TYR-PHE-GLN-GLY-SER-HIS-MET-LYS-ALA-ILE-LYS-LEU-THR-GLY-HIS-GLU-ARG-PRO-LEU-THR-GLN-VAL-LYS-TYR-ASN-LYS-GLU-GLY-ASP-LEU-LEU-PHE-SER-CYS-SER-LYS-ASP-SER-SER-ALA-SER-VAL-TRP-TYR-SER-LEU-ASN-GLY-GLU-ARG-LEU-GLY-THR-LEU-ASP-GLY-HIS-THR-GLY-THR-ILE-TRP-SER-ILE-ASP-VAL-ASP-CYS-PHE-THR-LYS-TYR-CYS-VAL-THR-GLY-SER-ALA-ASP-TYR-SER-ILE-LYS-LEU-TRP-ASP-VAL-SER-ASN-GLY-GLN-CYS-VAL-ALA-THR-TRP-LYS-SER-PRO-VAL-PRO-VAL-LYS-ARG-VAL-GLU-PHE-SER-PRO-CYS-GLY-ASN-TYR-PHE-LEU-ALA-ILE-LEU-ASP-ASN-VAL-MET-LYS-ASN-PRO-GLY-SER-ILE-ASN-ILE-TYR-GLU-ILE-GLU-ARG-ASP-SER-ALA-THR-HIS-GLU-LEU-THR-LYS-VAL-SER-GLU-GLU-PRO-ILE-HIS-LYS-ILE-ILE-THR-HIS-GLU-GLY-LEU-ASP-ALA-ALA-THR-VAL-ALA-GLY-TRP-SER-THR-LYS-GLY-LYS-TYR-ILE-ILE-ALA-GLY-HIS-LYS-ASP-GLY-LYS-ILE-SER-LYS-TYR-ASP-VAL-SER-ASN-ASN-TYR-GLU-TYR-VAL-ASP-SER-ILE-ASP-LEU-HIS-GLU-LYS-SER-ILE-SER-ASP-MET-GLN-PHE-SER-PRO-ASP-LEU-THR-TYR-PHE-ILE-THR-SER-SER-ARG-ASP-THR-ASN-SER-PHE-LEU-VAL-ASP-VAL-SER-THR-LEU-GLN-VAL-LEU-LYS-LYS-TYR-GLU-THR-ASP-CYS-PRO-LEU-ASN-THR-ALA-VAL-ILE-THR-PRO-LEU-LYS-GLU-PHE-ILE-ILE-LEU-GLY-GLY-GLY-GLN-GLU-ALA-LYS-ASP-VAL-THR-THR-THR-SER-ALA-ASN-GLU-GLY-LYS-PHE-GLU-ALA-ARG-PHE-TYR-HIS-LYS-ILE-PHE-GLU-GLU-GLU-ILE-GLY-ARG-VAL-GLN-GLY-HIS-PHE-GLY-PRO-LEU-ASN-THR-VAL-ALA-ILE-SER-PRO-GLN-GLY-THR-SER-TYR-ALA-SER-GLY-GLY-GLU-ASP-GLY-PHE-ILE-ARG-LEU-HIS-HIS-PHE-GLU-LYS-SER-TYR-PHE-ASP-PHE-LYS-TYR-ASP-VAL-GLU-LYS-ALA-ALA-GLU-ALA-LYS-GLU-HIS-MET-GLN-GLU-ALA-ASN,GLY-SER-HIS-MET-GLU-ALA-ASP-THR-ALA-MET-ARG-ASP-LEU-ILE-LEU-HIS-GLN-ARG-GLU-LEU-LEU-LYS-GLN-TRP-THR-GLU-TYR-ARG-GLU-LYS-ILE-GLY-GLN-GLU-MET-GLU-LYS-SER-MET-ASN-PHE-LYS-ILE-PHE-ASP-VAL-GLN-PRO-GLU-ASP,369,50,,Kd=160nM,6.79588,6.8,1,A,A,0,A,A,0,,E,B,,1,1,369,50,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.5262254476547241,,73.80347442626953,,0.8827899694442749,,0.7698367238044739,,0.3802987337112427,,GSHMEADTAMRDLILHQRELLKQWTEYREKIGQEMEKSMNFKIFDVQPED,Low,"(6.696, 6.824]",train
3ZWZ,protein-peptide,Q7KQK5 Q8IKV6,GSAMGNYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSNTTFLTPVATGNQYLKDGGFAFPPTEPLMSPMTLDEMRHFYKDNKYVKNLDELTLCSRHAGNMIPDNDKNSNYKYPAVYDDKDKKCHILYIAAQENNGPRYCNKDESKRNSMFCFRPAKDISFQNYTYLSKNVVDNWEKVCPRKNLQNAKFGLWVDGNCEDIPHVNEFPAIDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNASMIKSAFLPTGAFKADRYKSHGKGYNWGNYNTETQKCEIFNVKPTCLINNSSYIATTALSHPIEVEAAALVPR,DITQQAKDIGAGPVASCFTTRMSPPQQICLNSVVNTALS,GLY-SER-ALA-MET-GLY-ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-ASN-THR-THR-PHE-LEU-THR-PRO-VAL-ALA-THR-GLY-ASN-GLN-TYR-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-GLU-PRO-LEU-MET-SER-PRO-MET-THR-LEU-ASP-GLU-MET-ARG-HIS-PHE-TYR-LYS-ASP-ASN-LYS-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ILE-PRO-ASP-ASN-ASP-LYS-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-ASP-LYS-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLU-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-ILE-SER-PHE-GLN-ASN-TYR-THR-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-LYS-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLN-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-PRO-ALA-ILE-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-SER-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-THR-GLU-THR-GLN-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASN-SER-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU-ALA-ALA-ALA-LEU-VAL-PRO-ARG,ASP-ILE-THR-GLN-GLN-ALA-LYS-ASP-ILE-GLY-ALA-GLY-PRO-VAL-ALA-SER-CYS-PHE-THR-THR-ARG-MET-SER-PRO-PRO-GLN-GLN-ILE-CYS-LEU-ASN-SER-VAL-VAL-ASN-THR-ALA-LEU-SER,347,39,,Kd=20.3nM,7.692504,7.69,1,A,A,0,A,A,0,,B,A,,1,1,347,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C,0.6024227738380432,0.5674821734428406,46.72660446166992,40.276798248291016,1.3759711980819702,1.8683767318725584,0.6374436020851135,0.6356486678123474,0.525662362575531,0.5504405498504639,DITQQAKDIGAGPVASCFTTRMSPPQQICLNSVVNTALS,Moderate,"(7.523, 7.921]",train
4C5G,protein-peptide,Q8ST83 Q9VK33,MDPTHSYDWLPRLSKENFNAAPVTCFPHAPGCEVWDNLGVGMKVEVENTDCDSIEVIQPGQTPTSFWVATILEIKGYKALMSYEGFDTDSHDFWVNLCNAEVHSVGWCATRGKPLIPPRTIEHKYKDWKDFLVGRLSGARTLPSNFYNKINDSLQSRFRLGLNLECVDKDRISQVRLATVTKIVGKRLFLRYFDSDDGFWCHEDSPIIHPVGWATTVGHNLAAPQDYLERMLAGREAMIEVHEDDATIELFKMNFTFDEYYSDGKTNSFVEGMKLEAVDPLNLSSICPATVMAVLKFGYMMIRIDSYQPDASGSDWFCYHEKSPCIFPAGFCSVNNISVTPPNGYDSRTFTWEGYLRDTGAVAAGQHLFHRIIPDHGFEVGMSLECADLMDPRLVCVATVARVVGRLLKVHFDGWTDEYDQWLDCESADIYPVGWCVLVNHKLEGPPRVAH,AGMASRRWEQKLVHIKTMEGEFSVTMWASGIS,MET-ASP-PRO-THR-HIS-SER-TYR-ASP-TRP-LEU-PRO-ARG-LEU-SER-LYS-GLU-ASN-PHE-ASN-ALA-ALA-PRO-VAL-THR-CYS-PHE-PRO-HIS-ALA-PRO-GLY-CYS-GLU-VAL-TRP-ASP-ASN-LEU-GLY-VAL-GLY-MET-LYS-VAL-GLU-VAL-GLU-ASN-THR-ASP-CYS-ASP-SER-ILE-GLU-VAL-ILE-GLN-PRO-GLY-GLN-THR-PRO-THR-SER-PHE-TRP-VAL-ALA-THR-ILE-LEU-GLU-ILE-LYS-GLY-TYR-LYS-ALA-LEU-MET-SER-TYR-GLU-GLY-PHE-ASP-THR-ASP-SER-HIS-ASP-PHE-TRP-VAL-ASN-LEU-CYS-ASN-ALA-GLU-VAL-HIS-SER-VAL-GLY-TRP-CYS-ALA-THR-ARG-GLY-LYS-PRO-LEU-ILE-PRO-PRO-ARG-THR-ILE-GLU-HIS-LYS-TYR-LYS-ASP-TRP-LYS-ASP-PHE-LEU-VAL-GLY-ARG-LEU-SER-GLY-ALA-ARG-THR-LEU-PRO-SER-ASN-PHE-TYR-ASN-LYS-ILE-ASN-ASP-SER-LEU-GLN-SER-ARG-PHE-ARG-LEU-GLY-LEU-ASN-LEU-GLU-CYS-VAL-ASP-LYS-ASP-ARG-ILE-SER-GLN-VAL-ARG-LEU-ALA-THR-VAL-THR-LYS-ILE-VAL-GLY-LYS-ARG-LEU-PHE-LEU-ARG-TYR-PHE-ASP-SER-ASP-ASP-GLY-PHE-TRP-CYS-HIS-GLU-ASP-SER-PRO-ILE-ILE-HIS-PRO-VAL-GLY-TRP-ALA-THR-THR-VAL-GLY-HIS-ASN-LEU-ALA-ALA-PRO-GLN-ASP-TYR-LEU-GLU-ARG-MET-LEU-ALA-GLY-ARG-GLU-ALA-MET-ILE-GLU-VAL-HIS-GLU-ASP-ASP-ALA-THR-ILE-GLU-LEU-PHE-LYS-MET-ASN-PHE-THR-PHE-ASP-GLU-TYR-TYR-SER-ASP-GLY-LYS-THR-ASN-SER-PHE-VAL-GLU-GLY-MET-LYS-LEU-GLU-ALA-VAL-ASP-PRO-LEU-ASN-LEU-SER-SER-ILE-CYS-PRO-ALA-THR-VAL-MET-ALA-VAL-LEU-LYS-PHE-GLY-TYR-MET-MET-ILE-ARG-ILE-ASP-SER-TYR-GLN-PRO-ASP-ALA-SER-GLY-SER-ASP-TRP-PHE-CYS-TYR-HIS-GLU-LYS-SER-PRO-CYS-ILE-PHE-PRO-ALA-GLY-PHE-CYS-SER-VAL-ASN-ASN-ILE-SER-VAL-THR-PRO-PRO-ASN-GLY-TYR-ASP-SER-ARG-THR-PHE-THR-TRP-GLU-GLY-TYR-LEU-ARG-ASP-THR-GLY-ALA-VAL-ALA-ALA-GLY-GLN-HIS-LEU-PHE-HIS-ARG-ILE-ILE-PRO-ASP-HIS-GLY-PHE-GLU-VAL-GLY-MET-SER-LEU-GLU-CYS-ALA-ASP-LEU-MET-ASP-PRO-ARG-LEU-VAL-CYS-VAL-ALA-THR-VAL-ALA-ARG-VAL-VAL-GLY-ARG-LEU-LEU-LYS-VAL-HIS-PHE-ASP-GLY-TRP-THR-ASP-GLU-TYR-ASP-GLN-TRP-LEU-ASP-CYS-GLU-SER-ALA-ASP-ILE-TYR-PRO-VAL-GLY-TRP-CYS-VAL-LEU-VAL-ASN-HIS-LYS-LEU-GLU-GLY-PRO-PRO-ARG-VAL-ALA-HIS,ALA-GLY-MET-ALA-SER-ARG-ARG-TRP-GLU-GLN-LYS-LEU-VAL-HIS-ILE-LYS-THR-MET-GLU-GLY-GLU-PHE-SER-VAL-THR-MET-TRP-ALA-SER-GLY-ILE-SER,451,32,,Kd=1.03uM,5.987163,5.99,1,A,A,0,A,A,0,,B,A,,1,1,451,32,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](C)N)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,0.7102186679840088,0.5765371322631836,81.96045684814453,82.7115249633789,0.6543676853179932,1.6669048070907593,0.8647182583808899,0.7639265060424805,0.6379498243331909,0.5296897888183594,AGMASRRWEQKLVHIKTMEGEFSVTMWASGIS,Low,"(5.959, 6.097]",train
4CU4,protein-peptide,P06971 Q9X2V7,SAWGPAATIAARQSATGTKTDTPIQKVPQSISVVTAEEMALHQPKSVKEALSYTPGVSVGTRGASNTYDHLIIRGFAAEGQSQNNYLNGLKLQGNFYNDAVIDPYMLERAEIMRGPVSVLYGKSSPGGLLNMVSKRPTTEPLKEVQFKAGTDSLFQTGFDFSDSLDDDGVYSYRLTGLARSANAQQKGSEEQRYAIAPAFTWRPDDKTNFTFLSYFQNEPETGYYGWLPKEGTVEPLPNGKRLPTDFNEGAKNNTYSRNEKMVGYSFDHEFNDTFTVRQNLRFAENKTSQNSVYGYGVCSDPANAYSKQCAALAPADKGHYLARKYVVDDEKLQNFSVDTQLQSKFATGDIDHTLLTGVDFMRMRNDINAWFGYDDSVPLLNLYNPSSHHHHHHGSSVNTDFDFNAKDPANSGPYRILNKQKQTGVYVQDQAQWDKVLVTLGGRYDWADQESLNRVAGTTDKRDDKQFTWRGGVNYLFDNGVTPYFSYSESFEPSSQVGKDGNIFAPSKGKQYEVGVKYVPEDRPIVVTGAVYNLTKTNNLMADPEGSFFSVEGGEIRARGVEIEAKAALSASVNVVGSYTYTDAEYTTDTTYKGNTPAQVPKHMASLWADYTFFDGPLSGLTLGTGGRYTGSSYGDPANSFKVGSYTVVDALVRYDLARVGMAGSNVALHVNNLFDREYVASCFNTYGCFWGAERQVVATATFRF,GGAGHVPEYFVGIGTPISFYG,SER-ALA-TRP-GLY-PRO-ALA-ALA-THR-ILE-ALA-ALA-ARG-GLN-SER-ALA-THR-GLY-THR-LYS-THR-ASP-THR-PRO-ILE-GLN-LYS-VAL-PRO-GLN-SER-ILE-SER-VAL-VAL-THR-ALA-GLU-GLU-MET-ALA-LEU-HIS-GLN-PRO-LYS-SER-VAL-LYS-GLU-ALA-LEU-SER-TYR-THR-PRO-GLY-VAL-SER-VAL-GLY-THR-ARG-GLY-ALA-SER-ASN-THR-TYR-ASP-HIS-LEU-ILE-ILE-ARG-GLY-PHE-ALA-ALA-GLU-GLY-GLN-SER-GLN-ASN-ASN-TYR-LEU-ASN-GLY-LEU-LYS-LEU-GLN-GLY-ASN-PHE-TYR-ASN-ASP-ALA-VAL-ILE-ASP-PRO-TYR-MET-LEU-GLU-ARG-ALA-GLU-ILE-MET-ARG-GLY-PRO-VAL-SER-VAL-LEU-TYR-GLY-LYS-SER-SER-PRO-GLY-GLY-LEU-LEU-ASN-MET-VAL-SER-LYS-ARG-PRO-THR-THR-GLU-PRO-LEU-LYS-GLU-VAL-GLN-PHE-LYS-ALA-GLY-THR-ASP-SER-LEU-PHE-GLN-THR-GLY-PHE-ASP-PHE-SER-ASP-SER-LEU-ASP-ASP-ASP-GLY-VAL-TYR-SER-TYR-ARG-LEU-THR-GLY-LEU-ALA-ARG-SER-ALA-ASN-ALA-GLN-GLN-LYS-GLY-SER-GLU-GLU-GLN-ARG-TYR-ALA-ILE-ALA-PRO-ALA-PHE-THR-TRP-ARG-PRO-ASP-ASP-LYS-THR-ASN-PHE-THR-PHE-LEU-SER-TYR-PHE-GLN-ASN-GLU-PRO-GLU-THR-GLY-TYR-TYR-GLY-TRP-LEU-PRO-LYS-GLU-GLY-THR-VAL-GLU-PRO-LEU-PRO-ASN-GLY-LYS-ARG-LEU-PRO-THR-ASP-PHE-ASN-GLU-GLY-ALA-LYS-ASN-ASN-THR-TYR-SER-ARG-ASN-GLU-LYS-MET-VAL-GLY-TYR-SER-PHE-ASP-HIS-GLU-PHE-ASN-ASP-THR-PHE-THR-VAL-ARG-GLN-ASN-LEU-ARG-PHE-ALA-GLU-ASN-LYS-THR-SER-GLN-ASN-SER-VAL-TYR-GLY-TYR-GLY-VAL-CYS-SER-ASP-PRO-ALA-ASN-ALA-TYR-SER-LYS-GLN-CYS-ALA-ALA-LEU-ALA-PRO-ALA-ASP-LYS-GLY-HIS-TYR-LEU-ALA-ARG-LYS-TYR-VAL-VAL-ASP-ASP-GLU-LYS-LEU-GLN-ASN-PHE-SER-VAL-ASP-THR-GLN-LEU-GLN-SER-LYS-PHE-ALA-THR-GLY-ASP-ILE-ASP-HIS-THR-LEU-LEU-THR-GLY-VAL-ASP-PHE-MET-ARG-MET-ARG-ASN-ASP-ILE-ASN-ALA-TRP-PHE-GLY-TYR-ASP-ASP-SER-VAL-PRO-LEU-LEU-ASN-LEU-TYR-ASN-PRO-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-SER-SER-VAL-ASN-THR-ASP-PHE-ASP-PHE-ASN-ALA-LYS-ASP-PRO-ALA-ASN-SER-GLY-PRO-TYR-ARG-ILE-LEU-ASN-LYS-GLN-LYS-GLN-THR-GLY-VAL-TYR-VAL-GLN-ASP-GLN-ALA-GLN-TRP-ASP-LYS-VAL-LEU-VAL-THR-LEU-GLY-GLY-ARG-TYR-ASP-TRP-ALA-ASP-GLN-GLU-SER-LEU-ASN-ARG-VAL-ALA-GLY-THR-THR-ASP-LYS-ARG-ASP-ASP-LYS-GLN-PHE-THR-TRP-ARG-GLY-GLY-VAL-ASN-TYR-LEU-PHE-ASP-ASN-GLY-VAL-THR-PRO-TYR-PHE-SER-TYR-SER-GLU-SER-PHE-GLU-PRO-SER-SER-GLN-VAL-GLY-LYS-ASP-GLY-ASN-ILE-PHE-ALA-PRO-SER-LYS-GLY-LYS-GLN-TYR-GLU-VAL-GLY-VAL-LYS-TYR-VAL-PRO-GLU-ASP-ARG-PRO-ILE-VAL-VAL-THR-GLY-ALA-VAL-TYR-ASN-LEU-THR-LYS-THR-ASN-ASN-LEU-MET-ALA-ASP-PRO-GLU-GLY-SER-PHE-PHE-SER-VAL-GLU-GLY-GLY-GLU-ILE-ARG-ALA-ARG-GLY-VAL-GLU-ILE-GLU-ALA-LYS-ALA-ALA-LEU-SER-ALA-SER-VAL-ASN-VAL-VAL-GLY-SER-TYR-THR-TYR-THR-ASP-ALA-GLU-TYR-THR-THR-ASP-THR-THR-TYR-LYS-GLY-ASN-THR-PRO-ALA-GLN-VAL-PRO-LYS-HIS-MET-ALA-SER-LEU-TRP-ALA-ASP-TYR-THR-PHE-PHE-ASP-GLY-PRO-LEU-SER-GLY-LEU-THR-LEU-GLY-THR-GLY-GLY-ARG-TYR-THR-GLY-SER-SER-TYR-GLY-ASP-PRO-ALA-ASN-SER-PHE-LYS-VAL-GLY-SER-TYR-THR-VAL-VAL-ASP-ALA-LEU-VAL-ARG-TYR-ASP-LEU-ALA-ARG-VAL-GLY-MET-ALA-GLY-SER-ASN-VAL-ALA-LEU-HIS-VAL-ASN-ASN-LEU-PHE-ASP-ARG-GLU-TYR-VAL-ALA-SER-CYS-PHE-ASN-THR-TYR-GLY-CYS-PHE-TRP-GLY-ALA-GLU-ARG-GLN-VAL-VAL-ALA-THR-ALA-THR-PHE-ARG-PHE,GLY-GLY-ALA-GLY-HIS-VAL-PRO-GLU-TYR-PHE-VAL-GLY-ILE-GLY-THR-PRO-ILE-SER-PHE-TYR-GLY,706,21,,Kd=1.2uM,5.920819,5.92,1,A,A,0,A,A,0,,B,A,,1,1,706,21,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)CN)C(C)C)C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,0.7295834422111511,0.6839843392372131,79.5315170288086,81.08901977539062,0.5693682432174683,1.004147171974182,0.8947087526321411,0.8689680695533752,0.6762663125991821,0.6377384066581726,GGAGHVPEYFVGIGTPISFYG,Low,"(5.821, 5.959]",val
4DJ9,protein-peptide,P18206 Q9Y490,MPVFHTRTIESILEPVAQQISHLVIMHEEGEVDGKAIPDLTAPVAAVQAAVSNLVRVGKETVQTTEDQILKRDMPPAFIKVENACTKLVQAAQMLQSDPYSVPARDYLIDGSRGILSGTSDLLLTFDEAEVRKIIRVCKGILEYLTVAEVVETMEDLVTYTKNLGPGMTKMAKMIDERQQELTHQEHRVMLVNSMNTVKELLPVLISAMKIFVTTKNSKNQGIEEALKNRNFTVEKMSAEINEIIRVLQLTSWDEDAW,ETQVVLINAVKDVAKALGDLISATKAAAG,MET-PRO-VAL-PHE-HIS-THR-ARG-THR-ILE-GLU-SER-ILE-LEU-GLU-PRO-VAL-ALA-GLN-GLN-ILE-SER-HIS-LEU-VAL-ILE-MET-HIS-GLU-GLU-GLY-GLU-VAL-ASP-GLY-LYS-ALA-ILE-PRO-ASP-LEU-THR-ALA-PRO-VAL-ALA-ALA-VAL-GLN-ALA-ALA-VAL-SER-ASN-LEU-VAL-ARG-VAL-GLY-LYS-GLU-THR-VAL-GLN-THR-THR-GLU-ASP-GLN-ILE-LEU-LYS-ARG-ASP-MET-PRO-PRO-ALA-PHE-ILE-LYS-VAL-GLU-ASN-ALA-CYS-THR-LYS-LEU-VAL-GLN-ALA-ALA-GLN-MET-LEU-GLN-SER-ASP-PRO-TYR-SER-VAL-PRO-ALA-ARG-ASP-TYR-LEU-ILE-ASP-GLY-SER-ARG-GLY-ILE-LEU-SER-GLY-THR-SER-ASP-LEU-LEU-LEU-THR-PHE-ASP-GLU-ALA-GLU-VAL-ARG-LYS-ILE-ILE-ARG-VAL-CYS-LYS-GLY-ILE-LEU-GLU-TYR-LEU-THR-VAL-ALA-GLU-VAL-VAL-GLU-THR-MET-GLU-ASP-LEU-VAL-THR-TYR-THR-LYS-ASN-LEU-GLY-PRO-GLY-MET-THR-LYS-MET-ALA-LYS-MET-ILE-ASP-GLU-ARG-GLN-GLN-GLU-LEU-THR-HIS-GLN-GLU-HIS-ARG-VAL-MET-LEU-VAL-ASN-SER-MET-ASN-THR-VAL-LYS-GLU-LEU-LEU-PRO-VAL-LEU-ILE-SER-ALA-MET-LYS-ILE-PHE-VAL-THR-THR-LYS-ASN-SER-LYS-ASN-GLN-GLY-ILE-GLU-GLU-ALA-LEU-LYS-ASN-ARG-ASN-PHE-THR-VAL-GLU-LYS-MET-SER-ALA-GLU-ILE-ASN-GLU-ILE-ILE-ARG-VAL-LEU-GLN-LEU-THR-SER-TRP-ASP-GLU-ASP-ALA-TRP,GLU-THR-GLN-VAL-VAL-LEU-ILE-ASN-ALA-VAL-LYS-ASP-VAL-ALA-LYS-ALA-LEU-GLY-ASP-LEU-ILE-SER-ALA-THR-LYS-ALA-ALA-ALA-GLY,258,29,,Kd=99nM,7.004365,7.0,1,A,A,0,A,A,0,,B,A,,1,1,258,29,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O)C(C)C)C(=O)O,0.9445953369140624,0.5794158577919006,84.38888549804688,76.83232116699219,0.43257936835289,1.2439366579055786,0.8580109477043152,0.7268030047416687,0.9030881524086,0.5425690412521362,ETQVVLINAVKDVAKALGDLISATKAAAG,Moderate,"(6.824, 7.049]",val
4FT4,protein-peptide,P59226 Q9AXT8,SAGDHEPEFIGSPVAADEARSNWPKRYGRSTAAKKPDEEEELKARCHYRSAKVDNVVYCLGDDVYVKAGENEADYIGRITEFFEGTDQCHYFTCRWFFRAEDTVINSLVSISVDGHKHDPRRVFLSEEKNDNVLDCIISKVKIVHVDPNMDPKAKAQLIESCDLYYDMSYSVAYSTFANISSENGQSGSDTASGISSDDVDLETSSSMPTRTATLLDLYSGCGGMSTGLCLGAALSGLKLETRWAVDFNSFACQSLKYNHPQTEVRNEKADEFLALLKEWAVLCKKYVQDVDSNLASSEDQADEDSPLDKDEFVVEKLVGICYGGSDRENGIYFKVQWEGYGPEEDTWEPIDNLSDCPQKIREFVQEGHKRKILPLPGDVDVICGGPPCQGISGFNRYRNRDEPLKDEKNKQMVTFMDIVAYLKPKYVLMENVVDILKFADGYLGKYALSCLVAMKYQARLGMMVAGCYGLPQFRMRVFLWGALSSMVLPKYPLPTYDVVVRGGAPNAFSQCMVAYDETQKPSLKKALLLGDAISDLPKVQNHQPNDVMEYGGSPKTEFQRYIRLSRKDMLDWSFGEGAGPDEGKLLDHQPLRLNNDDYERVQQIPVKKGANFRDLKGVRVGANNIVEWDPEIERVKLSSGKPLVPDYAMSFIKGKSLKPFGRLWWDETVPTVVTRAEPHNQVIIHPTQARVLTIRENARLQGFPDYYRLFGPIKEKYIQVGNAVAVPVARALGYCLGQAYLGESEGSDPLYQLPPSFTSVGGRTAGQARASPVGTPAGEVVEQ,ARTKQTARKSTGGKAPRKQLATKAARKSAPAT,SER-ALA-GLY-ASP-HIS-GLU-PRO-GLU-PHE-ILE-GLY-SER-PRO-VAL-ALA-ALA-ASP-GLU-ALA-ARG-SER-ASN-TRP-PRO-LYS-ARG-TYR-GLY-ARG-SER-THR-ALA-ALA-LYS-LYS-PRO-ASP-GLU-GLU-GLU-GLU-LEU-LYS-ALA-ARG-CYS-HIS-TYR-ARG-SER-ALA-LYS-VAL-ASP-ASN-VAL-VAL-TYR-CYS-LEU-GLY-ASP-ASP-VAL-TYR-VAL-LYS-ALA-GLY-GLU-ASN-GLU-ALA-ASP-TYR-ILE-GLY-ARG-ILE-THR-GLU-PHE-PHE-GLU-GLY-THR-ASP-GLN-CYS-HIS-TYR-PHE-THR-CYS-ARG-TRP-PHE-PHE-ARG-ALA-GLU-ASP-THR-VAL-ILE-ASN-SER-LEU-VAL-SER-ILE-SER-VAL-ASP-GLY-HIS-LYS-HIS-ASP-PRO-ARG-ARG-VAL-PHE-LEU-SER-GLU-GLU-LYS-ASN-ASP-ASN-VAL-LEU-ASP-CYS-ILE-ILE-SER-LYS-VAL-LYS-ILE-VAL-HIS-VAL-ASP-PRO-ASN-MET-ASP-PRO-LYS-ALA-LYS-ALA-GLN-LEU-ILE-GLU-SER-CYS-ASP-LEU-TYR-TYR-ASP-MET-SER-TYR-SER-VAL-ALA-TYR-SER-THR-PHE-ALA-ASN-ILE-SER-SER-GLU-ASN-GLY-GLN-SER-GLY-SER-ASP-THR-ALA-SER-GLY-ILE-SER-SER-ASP-ASP-VAL-ASP-LEU-GLU-THR-SER-SER-SER-MET-PRO-THR-ARG-THR-ALA-THR-LEU-LEU-ASP-LEU-TYR-SER-GLY-CYS-GLY-GLY-MET-SER-THR-GLY-LEU-CYS-LEU-GLY-ALA-ALA-LEU-SER-GLY-LEU-LYS-LEU-GLU-THR-ARG-TRP-ALA-VAL-ASP-PHE-ASN-SER-PHE-ALA-CYS-GLN-SER-LEU-LYS-TYR-ASN-HIS-PRO-GLN-THR-GLU-VAL-ARG-ASN-GLU-LYS-ALA-ASP-GLU-PHE-LEU-ALA-LEU-LEU-LYS-GLU-TRP-ALA-VAL-LEU-CYS-LYS-LYS-TYR-VAL-GLN-ASP-VAL-ASP-SER-ASN-LEU-ALA-SER-SER-GLU-ASP-GLN-ALA-ASP-GLU-ASP-SER-PRO-LEU-ASP-LYS-ASP-GLU-PHE-VAL-VAL-GLU-LYS-LEU-VAL-GLY-ILE-CYS-TYR-GLY-GLY-SER-ASP-ARG-GLU-ASN-GLY-ILE-TYR-PHE-LYS-VAL-GLN-TRP-GLU-GLY-TYR-GLY-PRO-GLU-GLU-ASP-THR-TRP-GLU-PRO-ILE-ASP-ASN-LEU-SER-ASP-CYS-PRO-GLN-LYS-ILE-ARG-GLU-PHE-VAL-GLN-GLU-GLY-HIS-LYS-ARG-LYS-ILE-LEU-PRO-LEU-PRO-GLY-ASP-VAL-ASP-VAL-ILE-CYS-GLY-GLY-PRO-PRO-CYS-GLN-GLY-ILE-SER-GLY-PHE-ASN-ARG-TYR-ARG-ASN-ARG-ASP-GLU-PRO-LEU-LYS-ASP-GLU-LYS-ASN-LYS-GLN-MET-VAL-THR-PHE-MET-ASP-ILE-VAL-ALA-TYR-LEU-LYS-PRO-LYS-TYR-VAL-LEU-MET-GLU-ASN-VAL-VAL-ASP-ILE-LEU-LYS-PHE-ALA-ASP-GLY-TYR-LEU-GLY-LYS-TYR-ALA-LEU-SER-CYS-LEU-VAL-ALA-MET-LYS-TYR-GLN-ALA-ARG-LEU-GLY-MET-MET-VAL-ALA-GLY-CYS-TYR-GLY-LEU-PRO-GLN-PHE-ARG-MET-ARG-VAL-PHE-LEU-TRP-GLY-ALA-LEU-SER-SER-MET-VAL-LEU-PRO-LYS-TYR-PRO-LEU-PRO-THR-TYR-ASP-VAL-VAL-VAL-ARG-GLY-GLY-ALA-PRO-ASN-ALA-PHE-SER-GLN-CYS-MET-VAL-ALA-TYR-ASP-GLU-THR-GLN-LYS-PRO-SER-LEU-LYS-LYS-ALA-LEU-LEU-LEU-GLY-ASP-ALA-ILE-SER-ASP-LEU-PRO-LYS-VAL-GLN-ASN-HIS-GLN-PRO-ASN-ASP-VAL-MET-GLU-TYR-GLY-GLY-SER-PRO-LYS-THR-GLU-PHE-GLN-ARG-TYR-ILE-ARG-LEU-SER-ARG-LYS-ASP-MET-LEU-ASP-TRP-SER-PHE-GLY-GLU-GLY-ALA-GLY-PRO-ASP-GLU-GLY-LYS-LEU-LEU-ASP-HIS-GLN-PRO-LEU-ARG-LEU-ASN-ASN-ASP-ASP-TYR-GLU-ARG-VAL-GLN-GLN-ILE-PRO-VAL-LYS-LYS-GLY-ALA-ASN-PHE-ARG-ASP-LEU-LYS-GLY-VAL-ARG-VAL-GLY-ALA-ASN-ASN-ILE-VAL-GLU-TRP-ASP-PRO-GLU-ILE-GLU-ARG-VAL-LYS-LEU-SER-SER-GLY-LYS-PRO-LEU-VAL-PRO-ASP-TYR-ALA-MET-SER-PHE-ILE-LYS-GLY-LYS-SER-LEU-LYS-PRO-PHE-GLY-ARG-LEU-TRP-TRP-ASP-GLU-THR-VAL-PRO-THR-VAL-VAL-THR-ARG-ALA-GLU-PRO-HIS-ASN-GLN-VAL-ILE-ILE-HIS-PRO-THR-GLN-ALA-ARG-VAL-LEU-THR-ILE-ARG-GLU-ASN-ALA-ARG-LEU-GLN-GLY-PHE-PRO-ASP-TYR-TYR-ARG-LEU-PHE-GLY-PRO-ILE-LYS-GLU-LYS-TYR-ILE-GLN-VAL-GLY-ASN-ALA-VAL-ALA-VAL-PRO-VAL-ALA-ARG-ALA-LEU-GLY-TYR-CYS-LEU-GLY-GLN-ALA-TYR-LEU-GLY-GLU-SER-GLU-GLY-SER-ASP-PRO-LEU-TYR-GLN-LEU-PRO-PRO-SER-PHE-THR-SER-VAL-GLY-GLY-ARG-THR-ALA-GLY-GLN-ALA-ARG-ALA-SER-PRO-VAL-GLY-THR-PRO-ALA-GLY-GLU-VAL-VAL-GLU-GLN,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-LYS-SER-ALA-PRO-ALA-THR,784,32,,Kd=0.5uM,6.30103,6.3,1,A,A,0,A,A,0,,P,A,,1,1,784,32,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.6884726881980896,0.6114363670349121,67.0768051147461,67.53238677978516,0.7687245607376099,1.736030340194702,0.816688597202301,0.7656144499778748,0.5821233987808228,0.516291081905365,ARTKQTARKSTGGKAPRKQLATKAARKSAPAT,Low,"(6.26, 6.398]",train
4G35,protein-peptide,P97287,GPLGSPEFEDDLYRQSLEIISRYLREQATGSKDSKPLGEAGAAGRRALETLRRVGDGVQRNHETAFQGMLRKLDIKNEGDVKSFSRVMVHVFKDGVTNWGRIVTLISFGAFVAKHLKSVNQESFIEPLAETITDVLVRTKRDWLVKQRGWDGFVEFFHVQDLEGG,AACLRRIGDCVNLRQKLLN,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-GLU-ASP-ASP-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-SER-LYS-ASP-SER-LYS-PRO-LEU-GLY-GLU-ALA-GLY-ALA-ALA-GLY-ARG-ARG-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-GLY-ASP-VAL-LYS-SER-PHE-SER-ARG-VAL-MET-VAL-HIS-VAL-PHE-LYS-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-SER-VAL-ASN-GLN-GLU-SER-PHE-ILE-GLU-PRO-LEU-ALA-GLU-THR-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLN-ASP-LEU-GLU-GLY-GLY,ACE-ALA-ALA-DCY-LEU-ARG-ARG-ILE-GLY-ASP-CYS-VAL-ASN-LEU-ARG-GLN-LYS-LEU-LEU-ASN-NH2,165,21,,Ki=54nM,7.267606,7.27,1,A,A,0,A,A,0,,B,A,,1,1,165,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,0.8315574526786804,0.7489098310470581,81.91726684570312,86.89154052734375,0.4796217978000641,0.8649387955665588,0.874358057975769,0.824372410774231,0.752922534942627,0.7186805009841919,AACLRRIGDCVNLRQKLLN,Moderate,"(7.049, 7.268]",train
4GU0,protein-peptide,P84243 Q8NB78,PLGSRKCEKAGCTATCPVCFASASERCAKNGYTSRWYHLSCGEHFCNECFDHYYRSHKDGYDKYTTWKKIWTSNGKTEPSPKAFMADQQLPYWVQCTKPECRKWRQLTKEIQLTPQIAKTYRCGMKPNTAIKPETSDHCSLPEDLRVLEVSNHWWYSMLILPPLLKDSVAAPLLSAYYPDCVGMSPSCTSTNRAAATGNASPGKLEHSKAALSVHVPGMNRYFQPFYQPNECGKALCVRPDVMELDELYEFPEYSRDPTMYLALRNLILALWYTNCKEALTPQKCIPHIIVRGLVRIRCVQEVERILYFMTRKGLINTGVLSVGADQYLLPKDYHNKSVIIIGAGPAGLAAARQLHNFGIKVTVLEAKDRIGGRVWDDKSFKGVTVGRGAQIVNGCINNPVALMCEQLGISMHKFGERCDLIQEGGRITDPTIDKRMDFHFNALLDVVSEWRKDKTQLQDVPLGEKIEEIYKAFIKESGIQFSELEGQVLQFHLSNLEYACGSNLHQVSARSWDHNEFFAQFAGDHTLLTPGYSVIIEKLAEGLDIQLKSPVQCIDYSGDEVQVTTTDGTGYSAQKVLVTVPLALLQKGAIQFNPPLSEKKMKAINSLGAGIIEKIALQFPYRFWDSKVQGADFFGHVPPSASKRGLFAVFYDMDPQKKHSVLMSVIAGEAVASVRTLDDKQVLQQCMATLRELFKEQEVPDPTKYFVTRWSTDPWIQMAYSFVKTGGSGEAYDIIAEDIQGTVFFAGEATNRHFPQTVTGAYLSGVREASKIAAF,ARTMQTARKSTGGKAPRKQLATKAAR,PRO-LEU-GLY-SER-ARG-LYS-CYS-GLU-LYS-ALA-GLY-CYS-THR-ALA-THR-CYS-PRO-VAL-CYS-PHE-ALA-SER-ALA-SER-GLU-ARG-CYS-ALA-LYS-ASN-GLY-TYR-THR-SER-ARG-TRP-TYR-HIS-LEU-SER-CYS-GLY-GLU-HIS-PHE-CYS-ASN-GLU-CYS-PHE-ASP-HIS-TYR-TYR-ARG-SER-HIS-LYS-ASP-GLY-TYR-ASP-LYS-TYR-THR-THR-TRP-LYS-LYS-ILE-TRP-THR-SER-ASN-GLY-LYS-THR-GLU-PRO-SER-PRO-LYS-ALA-PHE-MET-ALA-ASP-GLN-GLN-LEU-PRO-TYR-TRP-VAL-GLN-CYS-THR-LYS-PRO-GLU-CYS-ARG-LYS-TRP-ARG-GLN-LEU-THR-LYS-GLU-ILE-GLN-LEU-THR-PRO-GLN-ILE-ALA-LYS-THR-TYR-ARG-CYS-GLY-MET-LYS-PRO-ASN-THR-ALA-ILE-LYS-PRO-GLU-THR-SER-ASP-HIS-CYS-SER-LEU-PRO-GLU-ASP-LEU-ARG-VAL-LEU-GLU-VAL-SER-ASN-HIS-TRP-TRP-TYR-SER-MET-LEU-ILE-LEU-PRO-PRO-LEU-LEU-LYS-ASP-SER-VAL-ALA-ALA-PRO-LEU-LEU-SER-ALA-TYR-TYR-PRO-ASP-CYS-VAL-GLY-MET-SER-PRO-SER-CYS-THR-SER-THR-ASN-ARG-ALA-ALA-ALA-THR-GLY-ASN-ALA-SER-PRO-GLY-LYS-LEU-GLU-HIS-SER-LYS-ALA-ALA-LEU-SER-VAL-HIS-VAL-PRO-GLY-MET-ASN-ARG-TYR-PHE-GLN-PRO-PHE-TYR-GLN-PRO-ASN-GLU-CYS-GLY-LYS-ALA-LEU-CYS-VAL-ARG-PRO-ASP-VAL-MET-GLU-LEU-ASP-GLU-LEU-TYR-GLU-PHE-PRO-GLU-TYR-SER-ARG-ASP-PRO-THR-MET-TYR-LEU-ALA-LEU-ARG-ASN-LEU-ILE-LEU-ALA-LEU-TRP-TYR-THR-ASN-CYS-LYS-GLU-ALA-LEU-THR-PRO-GLN-LYS-CYS-ILE-PRO-HIS-ILE-ILE-VAL-ARG-GLY-LEU-VAL-ARG-ILE-ARG-CYS-VAL-GLN-GLU-VAL-GLU-ARG-ILE-LEU-TYR-PHE-MET-THR-ARG-LYS-GLY-LEU-ILE-ASN-THR-GLY-VAL-LEU-SER-VAL-GLY-ALA-ASP-GLN-TYR-LEU-LEU-PRO-LYS-ASP-TYR-HIS-ASN-LYS-SER-VAL-ILE-ILE-ILE-GLY-ALA-GLY-PRO-ALA-GLY-LEU-ALA-ALA-ALA-ARG-GLN-LEU-HIS-ASN-PHE-GLY-ILE-LYS-VAL-THR-VAL-LEU-GLU-ALA-LYS-ASP-ARG-ILE-GLY-GLY-ARG-VAL-TRP-ASP-ASP-LYS-SER-PHE-LYS-GLY-VAL-THR-VAL-GLY-ARG-GLY-ALA-GLN-ILE-VAL-ASN-GLY-CYS-ILE-ASN-ASN-PRO-VAL-ALA-LEU-MET-CYS-GLU-GLN-LEU-GLY-ILE-SER-MET-HIS-LYS-PHE-GLY-GLU-ARG-CYS-ASP-LEU-ILE-GLN-GLU-GLY-GLY-ARG-ILE-THR-ASP-PRO-THR-ILE-ASP-LYS-ARG-MET-ASP-PHE-HIS-PHE-ASN-ALA-LEU-LEU-ASP-VAL-VAL-SER-GLU-TRP-ARG-LYS-ASP-LYS-THR-GLN-LEU-GLN-ASP-VAL-PRO-LEU-GLY-GLU-LYS-ILE-GLU-GLU-ILE-TYR-LYS-ALA-PHE-ILE-LYS-GLU-SER-GLY-ILE-GLN-PHE-SER-GLU-LEU-GLU-GLY-GLN-VAL-LEU-GLN-PHE-HIS-LEU-SER-ASN-LEU-GLU-TYR-ALA-CYS-GLY-SER-ASN-LEU-HIS-GLN-VAL-SER-ALA-ARG-SER-TRP-ASP-HIS-ASN-GLU-PHE-PHE-ALA-GLN-PHE-ALA-GLY-ASP-HIS-THR-LEU-LEU-THR-PRO-GLY-TYR-SER-VAL-ILE-ILE-GLU-LYS-LEU-ALA-GLU-GLY-LEU-ASP-ILE-GLN-LEU-LYS-SER-PRO-VAL-GLN-CYS-ILE-ASP-TYR-SER-GLY-ASP-GLU-VAL-GLN-VAL-THR-THR-THR-ASP-GLY-THR-GLY-TYR-SER-ALA-GLN-LYS-VAL-LEU-VAL-THR-VAL-PRO-LEU-ALA-LEU-LEU-GLN-LYS-GLY-ALA-ILE-GLN-PHE-ASN-PRO-PRO-LEU-SER-GLU-LYS-LYS-MET-LYS-ALA-ILE-ASN-SER-LEU-GLY-ALA-GLY-ILE-ILE-GLU-LYS-ILE-ALA-LEU-GLN-PHE-PRO-TYR-ARG-PHE-TRP-ASP-SER-LYS-VAL-GLN-GLY-ALA-ASP-PHE-PHE-GLY-HIS-VAL-PRO-PRO-SER-ALA-SER-LYS-ARG-GLY-LEU-PHE-ALA-VAL-PHE-TYR-ASP-MET-ASP-PRO-GLN-LYS-LYS-HIS-SER-VAL-LEU-MET-SER-VAL-ILE-ALA-GLY-GLU-ALA-VAL-ALA-SER-VAL-ARG-THR-LEU-ASP-ASP-LYS-GLN-VAL-LEU-GLN-GLN-CYS-MET-ALA-THR-LEU-ARG-GLU-LEU-PHE-LYS-GLU-GLN-GLU-VAL-PRO-ASP-PRO-THR-LYS-TYR-PHE-VAL-THR-ARG-TRP-SER-THR-ASP-PRO-TRP-ILE-GLN-MET-ALA-TYR-SER-PHE-VAL-LYS-THR-GLY-GLY-SER-GLY-GLU-ALA-TYR-ASP-ILE-ILE-ALA-GLU-ASP-ILE-GLN-GLY-THR-VAL-PHE-PHE-ALA-GLY-GLU-ALA-THR-ASN-ARG-HIS-PHE-PRO-GLN-THR-VAL-THR-GLY-ALA-TYR-LEU-SER-GLY-VAL-ARG-GLU-ALA-SER-LYS-ILE-ALA-ALA-PHE,ALA-ARG-THR-MET-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG,776,26,,Kd=0.741uM,6.130182,6.13,1,A,A,0,A,A,0,,E,A,dimer,1,1,776,26,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.7040342688560486,0.6417699456214905,78.85298919677734,76.92315673828125,0.622530996799469,1.3904061317443848,0.8752872347831726,0.8250519633293152,0.623814582824707,0.5774250030517578,ARTMQTARKSTGGKAPRKQLATKAAR,Low,"(6.097, 6.26]",train
4H3P,protein-peptide,P28482 Q15418,GSMAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVRVAIKKISPFEHQTYCQRTLREIKILLAFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLAQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,PQLKPIEASILAARRVRKLPSTTL,GLY-SER-MET-ALA-ALA-ALA-ALA-ALA-ALA-GLY-ALA-GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-VAL-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ALA-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-THR-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-CYS-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-THR-GLU-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-ILE-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-ALA-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,PRO-GLN-LEU-LYS-PRO-ILE-GLU-ALA-SER-ILE-LEU-ALA-ALA-ARG-ARG-VAL-ARG-LYS-LEU-PRO-SER-THR-THR-LEU,362,24,,Kd=2uM,5.69897,5.7,1,A,A,0,A,A,0,,B,A,,1,1,362,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,0.6960970163345337,0.6591739058494568,74.78089904785156,77.84432983398438,0.6522554159164429,1.279016375541687,0.8477711081504822,0.7955265045166016,0.5966499447822571,0.6043675541877747,PQLKPIEASILAARRVRKLPSTTL,Low,"(5.6, 5.699]",train
4HNJ,protein-peptide,Q9BXH1 Q07817,GSHMSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEMETPSAINGNPSWHLADSPAVNGATGHSSSLDAREVIPMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,EEQWAREIGAQLRRMADDLNAQYER,GLY-SER-HIS-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-MET-GLU-THR-PRO-SER-ALA-ILE-ASN-GLY-ASN-PRO-SER-TRP-HIS-LEU-ALA-ASP-SER-PRO-ALA-VAL-ASN-GLY-ALA-THR-GLY-HIS-SER-SER-SER-LEU-ASP-ALA-ARG-GLU-VAL-ILE-PRO-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,GLU-GLU-GLN-TRP-ALA-ARG-GLU-ILE-GLY-ALA-GLN-LEU-ARG-ARG-MET-ALA-ASP-ASP-LEU-ASN-ALA-GLN-TYR-GLU-ARG,212,25,,Kd=3nM,8.522879,8.52,1,A,A,0,A,A,0,,C,A,,1,1,212,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,1.0302104949951172,0.8051780462265015,71.56983947753906,65.22601318359375,0.5413233041763306,1.0621843338012695,0.7524903416633606,0.7151163816452026,0.9097671508789062,0.6773396134376526,EEQWAREIGAQLRRMADDLNAQYER,Moderate,"(8.383, 8.824]",train
4IHL,protein-peptide,P04049 P63104,GAMGSMDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTS,QHRYSTPHAFTFNTSSPSSEGSLSQRQRSTSTPNVH,GLY-ALA-MET-GLY-SER-MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,GLN-HIS-ARG-TYR-SEP-THR-PRO-HIS-ALA-PHE-THR-PHE-ASN-THR-SER-SER-PRO-SER-SER-GLU-GLY-SER-LEU-SER-GLN-ARG-GLN-ARG-SER-THR-SEP-THR-PRO-ASN-VAL-HIS,235,36,,Kd=346nM,6.460924,6.46,1,A,A,0,A,A,0,,P,A,dimer,0,1,235,36,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.8498903512954712,0.6089736819267273,81.80916595458984,82.34432983398438,0.4643843173980713,1.1525760889053345,0.8721333742141724,0.740852952003479,0.761303722858429,0.5760038495063782,QHRYSTPHAFTFNTSSPSSEGSLSQRQRSTSTPNVH,Low,"(6.398, 6.523]",train
4IKA,protein-peptide,B2ZUN0 I3UIB4,GEIQWVKPNKETGRLSINGPTRTKLEPSVFHDVFEGNKEPAVLHSKDPRLEVDFEQALFSKYVGNTLYEPDEYIKEAALHYANQLKQLEINTSQMSMEEACYGTENLEAIDLHTSAGYPYSALGIKKRDILDPTTRDVSKMKFYMDKYGLDLPYSTYVKDELRSIDKIKKGKSRLIEASSLNDSVYLRMAFGHLYETFHANPGTITGSAVGCNPDTFWSKLPILLPGSLFAFDYSGYDASLSPVWFRALELVLREIGYSEEAISLIEGINHTHHVYRNKTYCVLGGMPSGCSGTSIFNSMINNIIIRALLIKTFKGIDLDELNMVAYGDDVLASYPFPIDCLELAKTGKEYGLTMTPADKSPCFNEVNWDNATFLKRGFLPDEQFPFLIHPTMPMREIHESIRWTKDARNTQDHVRSLCLLAWHNGKQEYEKFVSTIRSVPVGRALAIPNYENLRRNWLELF,GAYSGAPKQVLKKPALRTATVQ,GLY-GLU-ILE-GLN-TRP-VAL-LYS-PRO-ASN-LYS-GLU-THR-GLY-ARG-LEU-SER-ILE-ASN-GLY-PRO-THR-ARG-THR-LYS-LEU-GLU-PRO-SER-VAL-PHE-HIS-ASP-VAL-PHE-GLU-GLY-ASN-LYS-GLU-PRO-ALA-VAL-LEU-HIS-SER-LYS-ASP-PRO-ARG-LEU-GLU-VAL-ASP-PHE-GLU-GLN-ALA-LEU-PHE-SER-LYS-TYR-VAL-GLY-ASN-THR-LEU-TYR-GLU-PRO-ASP-GLU-TYR-ILE-LYS-GLU-ALA-ALA-LEU-HIS-TYR-ALA-ASN-GLN-LEU-LYS-GLN-LEU-GLU-ILE-ASN-THR-SER-GLN-MET-SER-MET-GLU-GLU-ALA-CYS-TYR-GLY-THR-GLU-ASN-LEU-GLU-ALA-ILE-ASP-LEU-HIS-THR-SER-ALA-GLY-TYR-PRO-TYR-SER-ALA-LEU-GLY-ILE-LYS-LYS-ARG-ASP-ILE-LEU-ASP-PRO-THR-THR-ARG-ASP-VAL-SER-LYS-MET-LYS-PHE-TYR-MET-ASP-LYS-TYR-GLY-LEU-ASP-LEU-PRO-TYR-SER-THR-TYR-VAL-LYS-ASP-GLU-LEU-ARG-SER-ILE-ASP-LYS-ILE-LYS-LYS-GLY-LYS-SER-ARG-LEU-ILE-GLU-ALA-SER-SER-LEU-ASN-ASP-SER-VAL-TYR-LEU-ARG-MET-ALA-PHE-GLY-HIS-LEU-TYR-GLU-THR-PHE-HIS-ALA-ASN-PRO-GLY-THR-ILE-THR-GLY-SER-ALA-VAL-GLY-CYS-ASN-PRO-ASP-THR-PHE-TRP-SER-LYS-LEU-PRO-ILE-LEU-LEU-PRO-GLY-SER-LEU-PHE-ALA-PHE-ASP-TYR-SER-GLY-TYR-ASP-ALA-SER-LEU-SER-PRO-VAL-TRP-PHE-ARG-ALA-LEU-GLU-LEU-VAL-LEU-ARG-GLU-ILE-GLY-TYR-SER-GLU-GLU-ALA-ILE-SER-LEU-ILE-GLU-GLY-ILE-ASN-HIS-THR-HIS-HIS-VAL-TYR-ARG-ASN-LYS-THR-TYR-CYS-VAL-LEU-GLY-GLY-MET-PRO-SER-GLY-CYS-SER-GLY-THR-SER-ILE-PHE-ASN-SER-MET-ILE-ASN-ASN-ILE-ILE-ILE-ARG-ALA-LEU-LEU-ILE-LYS-THR-PHE-LYS-GLY-ILE-ASP-LEU-ASP-GLU-LEU-ASN-MET-VAL-ALA-TYR-GLY-ASP-ASP-VAL-LEU-ALA-SER-TYR-PRO-PHE-PRO-ILE-ASP-CYS-LEU-GLU-LEU-ALA-LYS-THR-GLY-LYS-GLU-TYR-GLY-LEU-THR-MET-THR-PRO-ALA-ASP-LYS-SER-PRO-CYS-PHE-ASN-GLU-VAL-ASN-TRP-ASP-ASN-ALA-THR-PHE-LEU-LYS-ARG-GLY-PHE-LEU-PRO-ASP-GLU-GLN-PHE-PRO-PHE-LEU-ILE-HIS-PRO-THR-MET-PRO-MET-ARG-GLU-ILE-HIS-GLU-SER-ILE-ARG-TRP-THR-LYS-ASP-ALA-ARG-ASN-THR-GLN-ASP-HIS-VAL-ARG-SER-LEU-CYS-LEU-LEU-ALA-TRP-HIS-ASN-GLY-LYS-GLN-GLU-TYR-GLU-LYS-PHE-VAL-SER-THR-ILE-ARG-SER-VAL-PRO-VAL-GLY-ARG-ALA-LEU-ALA-ILE-PRO-ASN-TYR-GLU-ASN-LEU-ARG-ARG-ASN-TRP-LEU-GLU-LEU-PHE,GLY-ALA-TYR-SER-GLY-ALA-PRO-LYS-GLN-VAL-LEU-LYS-LYS-PRO-ALA-LEU-ARG-THR-ALA-THR-VAL-GLN,462,22,,Kd=57.5uM,4.240332,4.24,1,A,A,0,A,A,0,,D,A,,1,1,462,22,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,0.7104476690292358,0.6495043635368347,88.10551452636719,83.59893798828125,0.505986213684082,1.17318594455719,0.9156654477119446,0.8419784903526306,0.6307340860366821,0.6013858318328857,GAYSGAPKQVLKKPALRTATVQ,Low,"(4.155, 4.319]",train
4JMF,protein-peptide,Q9I788 G3XD93,MNPLYRAAIHQLFLALDLPTPNDEESVLSLQVGPHLCHLAEHPTDHLLMFTRLEGQGDATANEQNLFSQDPCKPILGRDPESGERLLWNRQPLQLLDRAQIHHQLEQLVAAAEELR,EARQVATPREAQQLAQRQEAPKGEGLLSRLGAALARPFVAIIEWLGKLLG,MET-ASN-PRO-LEU-TYR-ARG-ALA-ALA-ILE-HIS-GLN-LEU-PHE-LEU-ALA-LEU-ASP-LEU-PRO-THR-PRO-ASN-ASP-GLU-GLU-SER-VAL-LEU-SER-LEU-GLN-VAL-GLY-PRO-HIS-LEU-CYS-HIS-LEU-ALA-GLU-HIS-PRO-THR-ASP-HIS-LEU-LEU-MET-PHE-THR-ARG-LEU-GLU-GLY-GLN-GLY-ASP-ALA-THR-ALA-ASN-GLU-GLN-ASN-LEU-PHE-SER-GLN-ASP-PRO-CYS-LYS-PRO-ILE-LEU-GLY-ARG-ASP-PRO-GLU-SER-GLY-GLU-ARG-LEU-LEU-TRP-ASN-ARG-GLN-PRO-LEU-GLN-LEU-LEU-ASP-ARG-ALA-GLN-ILE-HIS-HIS-GLN-LEU-GLU-GLN-LEU-VAL-ALA-ALA-ALA-GLU-GLU-LEU-ARG,GLU-ALA-ARG-GLN-VAL-ALA-THR-PRO-ARG-GLU-ALA-GLN-GLN-LEU-ALA-GLN-ARG-GLN-GLU-ALA-PRO-LYS-GLY-GLU-GLY-LEU-LEU-SER-ARG-LEU-GLY-ALA-ALA-LEU-ALA-ARG-PRO-PHE-VAL-ALA-ILE-ILE-GLU-TRP-LEU-GLY-LYS-LEU-LEU-GLY,116,50,,Kd=0.298uM,6.525784,6.53,1,A,A,0,A,A,0,,A,B,dimer,1,1,116,50,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.8227347135543823,,76.1960678100586,,0.4985767900943756,,0.8557324409484863,,0.7580093145370483,,EARQVATPREAQQLAQRQEAPKGEGLLSRLGAALARPFVAIIEWLGKLLG,Low,"(6.523, 6.696]",val
4JO6,protein-peptide,P22629,DPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAASIDAAKKAGVNNGNPLDAVQQ,MDEKTTGWRGGHVVEGLAGELEQLRARLEHHPQGQREP,ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER-ILE-ASP-ALA-ALA-LYS-LYS-ALA-GLY-VAL-ASN-ASN-GLY-ASN-PRO-LEU-ASP-ALA-VAL-GLN-GLN,MET-ASP-GLU-LYS-THR-THR-GLY-TRP-ARG-GLY-GLY-HIS-VAL-VAL-GLU-GLY-LEU-ALA-GLY-GLU-LEU-GLU-GLN-LEU-ARG-ALA-ARG-LEU-GLU-HIS-HIS-PRO-GLN-GLY-GLN-ARG-GLU-PRO,159,38,,Kd=1.53nM,8.815309,8.82,1,A,A,0,A,A,0,,Y,A,dimer,1,1,159,38,0,CSCC[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,0.7660629749298096,0.5503079295158386,72.56480407714844,75.48843383789062,0.682748019695282,1.2888071537017822,0.7851111888885498,0.5444459915161133,0.6217069625854492,0.5085344314575195,MDEKTTGWRGGHVVEGLAGELEQLRARLEHHPQGQREP,Moderate,"(8.383, 8.824]",train
4JS0,protein-peptide,Q9UQB8 P60953,MQTIKCVVVGDVAVGKTCLLISYTTNKFPSEYVPTVFDNYAVTVMIGGEPYTLGLFDTAGQEDYDRLRPLSYPQTDVFLVCFSVVSPSSFENVKEKWVPEITHHCPKTPFLLVGTQIDLRDDPSTIEKLAKNKQKPITPETAEKLARDLKAVKYVECSALTQKGLKNVFDEAILAALE,ASKSNLVISDPIPGAKPLPVPPELAPFVGRMS,MET-GLN-THR-ILE-LYS-CYS-VAL-VAL-VAL-GLY-ASP-VAL-ALA-VAL-GLY-LYS-THR-CYS-LEU-LEU-ILE-SER-TYR-THR-THR-ASN-LYS-PHE-PRO-SER-GLU-TYR-VAL-PRO-THR-VAL-PHE-ASP-ASN-TYR-ALA-VAL-THR-VAL-MET-ILE-GLY-GLY-GLU-PRO-TYR-THR-LEU-GLY-LEU-PHE-ASP-THR-ALA-GLY-GLN-GLU-ASP-TYR-ASP-ARG-LEU-ARG-PRO-LEU-SER-TYR-PRO-GLN-THR-ASP-VAL-PHE-LEU-VAL-CYS-PHE-SER-VAL-VAL-SER-PRO-SER-SER-PHE-GLU-ASN-VAL-LYS-GLU-LYS-TRP-VAL-PRO-GLU-ILE-THR-HIS-HIS-CYS-PRO-LYS-THR-PRO-PHE-LEU-LEU-VAL-GLY-THR-GLN-ILE-ASP-LEU-ARG-ASP-ASP-PRO-SER-THR-ILE-GLU-LYS-LEU-ALA-LYS-ASN-LYS-GLN-LYS-PRO-ILE-THR-PRO-GLU-THR-ALA-GLU-LYS-LEU-ALA-ARG-ASP-LEU-LYS-ALA-VAL-LYS-TYR-VAL-GLU-CYS-SER-ALA-LEU-THR-GLN-LYS-GLY-LEU-LYS-ASN-VAL-PHE-ASP-GLU-ALA-ILE-LEU-ALA-ALA-LEU-GLU,ALA-SER-LYS-SER-ASN-LEU-VAL-ILE-SER-ASP-PRO-ILE-PRO-GLY-ALA-LYS-PRO-LEU-PRO-VAL-PRO-PRO-GLU-LEU-ALA-PRO-PHE-VAL-GLY-ARG-MET-SER,178,32,,Kd=5uM,5.30103,5.3,1,A,A,0,A,A,0,,B,A,,1,1,178,32,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.9133313298225404,0.6870644092559814,83.71937561035156,85.94863891601562,0.4155503511428833,0.907451868057251,0.918348789215088,0.7916839718818665,0.8168388605117798,0.6609094738960266,ASKSNLVISDPIPGAKPLPVPPELAPFVGRMS,Low,"(5.222, 5.31]",train
4L67,protein-peptide,O96013,SHEQFRAALQLVVDPGDPRSYLDNFIKIGEGSTGIVCIATVRSSGKLVAVKKMDLRKQQRRELLFNEVVIMRDYQHENVVEMYNSYLVGDELWVVMEFLEGGALTDIVTHTRMNEEQIAAVCLAVLQALSVLHAQGVIHRDIKSDSILLTHDGRVKLSDFGFCAQVSKEVPRRKSLVGTPYWMAPELISRLPYGPEVDIWSLGIMVIEMVDGEPPYFNEPPLKAMKMIRDNLPPRLKNLHKVSPSLKGFLDRLLVRDPAQRATAAELLKHPFLAKAGPPASIVPLMRQNRTR,PRQWQSLIEESARRPKPLVDPACIT,SER-HIS-GLU-GLN-PHE-ARG-ALA-ALA-LEU-GLN-LEU-VAL-VAL-ASP-PRO-GLY-ASP-PRO-ARG-SER-TYR-LEU-ASP-ASN-PHE-ILE-LYS-ILE-GLY-GLU-GLY-SER-THR-GLY-ILE-VAL-CYS-ILE-ALA-THR-VAL-ARG-SER-SER-GLY-LYS-LEU-VAL-ALA-VAL-LYS-LYS-MET-ASP-LEU-ARG-LYS-GLN-GLN-ARG-ARG-GLU-LEU-LEU-PHE-ASN-GLU-VAL-VAL-ILE-MET-ARG-ASP-TYR-GLN-HIS-GLU-ASN-VAL-VAL-GLU-MET-TYR-ASN-SER-TYR-LEU-VAL-GLY-ASP-GLU-LEU-TRP-VAL-VAL-MET-GLU-PHE-LEU-GLU-GLY-GLY-ALA-LEU-THR-ASP-ILE-VAL-THR-HIS-THR-ARG-MET-ASN-GLU-GLU-GLN-ILE-ALA-ALA-VAL-CYS-LEU-ALA-VAL-LEU-GLN-ALA-LEU-SER-VAL-LEU-HIS-ALA-GLN-GLY-VAL-ILE-HIS-ARG-ASP-ILE-LYS-SER-ASP-SER-ILE-LEU-LEU-THR-HIS-ASP-GLY-ARG-VAL-LYS-LEU-SER-ASP-PHE-GLY-PHE-CYS-ALA-GLN-VAL-SER-LYS-GLU-VAL-PRO-ARG-ARG-LYS-SEP-LEU-VAL-GLY-THR-PRO-TYR-TRP-MET-ALA-PRO-GLU-LEU-ILE-SER-ARG-LEU-PRO-TYR-GLY-PRO-GLU-VAL-ASP-ILE-TRP-SER-LEU-GLY-ILE-MET-VAL-ILE-GLU-MET-VAL-ASP-GLY-GLU-PRO-PRO-TYR-PHE-ASN-GLU-PRO-PRO-LEU-LYS-ALA-MET-LYS-MET-ILE-ARG-ASP-ASN-LEU-PRO-PRO-ARG-LEU-LYS-ASN-LEU-HIS-LYS-VAL-SER-PRO-SER-LEU-LYS-GLY-PHE-LEU-ASP-ARG-LEU-LEU-VAL-ARG-ASP-PRO-ALA-GLN-ARG-ALA-THR-ALA-ALA-GLU-LEU-LEU-LYS-HIS-PRO-PHE-LEU-ALA-LYS-ALA-GLY-PRO-PRO-ALA-SER-ILE-VAL-PRO-LEU-MET-ARG-GLN-ASN-ARG-THR-ARG,PRO-ARG-GLN-TRP-GLN-SER-LEU-ILE-GLU-GLU-SER-ALA-ARG-ARG-PRO-LYS-PRO-LEU-VAL-ASP-PRO-ALA-CYS-ILE-THR,292,25,,Kd=0.32uM,6.49485,6.49,1,A,A,0,A,A,0,,B,A,,1,1,292,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.8654173612594604,0.8145602941513062,87.63993835449219,86.08568572998047,0.4221968650817871,0.7805492877960205,0.916981041431427,0.890968382358551,0.803236186504364,0.7954582571983337,PRQWQSLIEESARRPKPLVDPACIT,Low,"(6.398, 6.523]",train
4M38,protein-peptide,Q582G4 P62805,GYRPPDAFVNRIDRNIPVPARLRHTPVSLIEAVNDFHYAMMNDEERNNFYYEVLKKHVTPETGVLEIGAGSGLLSLMAAKLGAKWVVAVEGSEELAKLARENIRANNMEHQVKVLHMMSTELKSKHLPEPPDVLLSEIFGTMMLGESALDYVVDVRNRLLKPTTKIIPQFGTQYAVPIECDALHRISSVSGWRDLDLKHMMTLQDTVSIVFAKHYGIRMNSVNFRRLSDPIELFRVDFSSSNRNDIPRRKHFDVVAKESGTAHAMLFYWKVTDDEFVMSTDPEDTVNNFPRDMQWGQALQLLDASNGPLPTPVVFTEGKNYNFECNFSGDRVILHMQLCPESG,SGRGKGGKGLGKGGAKRHRKV,GLY-TYR-ARG-PRO-PRO-ASP-ALA-PHE-VAL-ASN-ARG-ILE-ASP-ARG-ASN-ILE-PRO-VAL-PRO-ALA-ARG-LEU-ARG-HIS-THR-PRO-VAL-SER-LEU-ILE-GLU-ALA-VAL-ASN-ASP-PHE-HIS-TYR-ALA-MET-MET-ASN-ASP-GLU-GLU-ARG-ASN-ASN-PHE-TYR-TYR-GLU-VAL-LEU-LYS-LYS-HIS-VAL-THR-PRO-GLU-THR-GLY-VAL-LEU-GLU-ILE-GLY-ALA-GLY-SER-GLY-LEU-LEU-SER-LEU-MET-ALA-ALA-LYS-LEU-GLY-ALA-LYS-TRP-VAL-VAL-ALA-VAL-GLU-GLY-SER-GLU-GLU-LEU-ALA-LYS-LEU-ALA-ARG-GLU-ASN-ILE-ARG-ALA-ASN-ASN-MET-GLU-HIS-GLN-VAL-LYS-VAL-LEU-HIS-MET-MET-SER-THR-GLU-LEU-LYS-SER-LYS-HIS-LEU-PRO-GLU-PRO-PRO-ASP-VAL-LEU-LEU-SER-GLU-ILE-PHE-GLY-THR-MET-MET-LEU-GLY-GLU-SER-ALA-LEU-ASP-TYR-VAL-VAL-ASP-VAL-ARG-ASN-ARG-LEU-LEU-LYS-PRO-THR-THR-LYS-ILE-ILE-PRO-GLN-PHE-GLY-THR-GLN-TYR-ALA-VAL-PRO-ILE-GLU-CYS-ASP-ALA-LEU-HIS-ARG-ILE-SER-SER-VAL-SER-GLY-TRP-ARG-ASP-LEU-ASP-LEU-LYS-HIS-MET-MET-THR-LEU-GLN-ASP-THR-VAL-SER-ILE-VAL-PHE-ALA-LYS-HIS-TYR-GLY-ILE-ARG-MET-ASN-SER-VAL-ASN-PHE-ARG-ARG-LEU-SER-ASP-PRO-ILE-GLU-LEU-PHE-ARG-VAL-ASP-PHE-SER-SER-SER-ASN-ARG-ASN-ASP-ILE-PRO-ARG-ARG-LYS-HIS-PHE-ASP-VAL-VAL-ALA-LYS-GLU-SER-GLY-THR-ALA-HIS-ALA-MET-LEU-PHE-TYR-TRP-LYS-VAL-THR-ASP-ASP-GLU-PHE-VAL-MET-SER-THR-ASP-PRO-GLU-ASP-THR-VAL-ASN-ASN-PHE-PRO-ARG-ASP-MET-GLN-TRP-GLY-GLN-ALA-LEU-GLN-LEU-LEU-ASP-ALA-SER-ASN-GLY-PRO-LEU-PRO-THR-PRO-VAL-VAL-PHE-THR-GLU-GLY-LYS-ASN-TYR-ASN-PHE-GLU-CYS-ASN-PHE-SER-GLY-ASP-ARG-VAL-ILE-LEU-HIS-MET-GLN-LEU-CYS-PRO-GLU-SER-GLY,SER-GLY-ARG-GLY-LYS-GLY-GLY-LYS-GLY-LEU-GLY-LYS-GLY-GLY-ALA-LYS-ARG-HIS-ARG-LYS-VAL,343,21,,Kd=12uM,4.920819,4.92,1,A,A,0,A,A,0,,E,A,,1,1,343,21,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.7836154103279114,0.6887174844741821,87.18315887451172,80.59596252441406,0.4709731042385101,0.8641186356544495,0.9011557698249816,0.8375565409660339,0.7147385478019714,0.6515077352523804,SGRGKGGKGLGKGGAKRHRKV,Low,"(4.866, 5.014]",train
4MQV,protein-peptide,P15927 Q9NZC9,ANGLTVAQNQVLNLIKACPRPEGLNFQDLKNQLKHMSVSSIKQAVDFLSNEGHIYSTVDDDHFKSTDAE,LTEEQRKKIEENRQKALARRAEKLLA,ALA-ASN-GLY-LEU-THR-VAL-ALA-GLN-ASN-GLN-VAL-LEU-ASN-LEU-ILE-LYS-ALA-CYS-PRO-ARG-PRO-GLU-GLY-LEU-ASN-PHE-GLN-ASP-LEU-LYS-ASN-GLN-LEU-LYS-HIS-MET-SER-VAL-SER-SER-ILE-LYS-GLN-ALA-VAL-ASP-PHE-LEU-SER-ASN-GLU-GLY-HIS-ILE-TYR-SER-THR-VAL-ASP-ASP-ASP-HIS-PHE-LYS-SER-THR-ASP-ALA-GLU,LEU-THR-GLU-GLU-GLN-ARG-LYS-LYS-ILE-GLU-GLU-ASN-ARG-GLN-LYS-ALA-LEU-ALA-ARG-ARG-ALA-GLU-LYS-LEU-LEU-ALA,69,26,,Kd=2.9uM,5.537602,5.54,1,A,A,0,A,A,0,,B,A,,1,1,69,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.9859259724617004,0.5698186159133911,96.49308776855467,73.7763900756836,0.2979626655578613,1.072999119758606,0.9198012351989746,0.64625483751297,0.9037728905677797,0.5507095456123352,LTEEQRKKIEENRQKALARRAEKLLA,Low,"(5.463, 5.6]",train
4NIQ,protein-peptide,P40080 P52917,SMSTGDFLTKGIELVQKAIDLDTATQYEEAYTAYYNGLDYLMLALKYEKNPKSKDLIRAKFTEYLNRAEQLKKHLESEEANAA,SENYSNTDPEELLRKHVFPSVPK,SER-MET-SER-THR-GLY-ASP-PHE-LEU-THR-LYS-GLY-ILE-GLU-LEU-VAL-GLN-LYS-ALA-ILE-ASP-LEU-ASP-THR-ALA-THR-GLN-TYR-GLU-GLU-ALA-TYR-THR-ALA-TYR-TYR-ASN-GLY-LEU-ASP-TYR-LEU-MET-LEU-ALA-LEU-LYS-TYR-GLU-LYS-ASN-PRO-LYS-SER-LYS-ASP-LEU-ILE-ARG-ALA-LYS-PHE-THR-GLU-TYR-LEU-ASN-ARG-ALA-GLU-GLN-LEU-LYS-LYS-HIS-LEU-GLU-SER-GLU-GLU-ALA-ASN-ALA-ALA,SER-GLU-ASN-TYR-SER-ASN-THR-ASP-PRO-GLU-GLU-LEU-LEU-ARG-LYS-HIS-VAL-PHE-PRO-SER-VAL-PRO-LYS,83,23,,Kd=5uM,5.30103,5.3,1,A,A,0,A,A,0,,C,A,,1,1,83,23,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,1.007204294204712,0.6842390298843384,95.7029800415039,90.30469512939452,0.2997757494449615,0.7616345286369324,0.9176366329193116,0.7525599598884583,0.8939829468727112,0.6671587824821472,SENYSNTDPEELLRKHVFPSVPK,Low,"(5.222, 5.31]",train
4OJK,protein-peptide,Q15907 Q64595,GSYDYLFKVVLIGDSGVGKSNLLSRFTRNEFNLESKSTIGVEFATRSIQVDGKTIKAQIWDTAGQERYRAITSAYYRGAVGALLVYDIAKHLTYENVERWLKELRDHADSNIVIMLVGNKSDLRHLRAVPTDEARAFAEKNNLSFIETSALDSTNVEEAFKNILTEIYRIVSQKQIADRAAHDESPGNNVVDISVPPTTD,GSKDAELQEREYHLKELREQLAKQTVAIAELTEELQSKCIQLNKLQ,GLY-SER-TYR-ASP-TYR-LEU-PHE-LYS-VAL-VAL-LEU-ILE-GLY-ASP-SER-GLY-VAL-GLY-LYS-SER-ASN-LEU-LEU-SER-ARG-PHE-THR-ARG-ASN-GLU-PHE-ASN-LEU-GLU-SER-LYS-SER-THR-ILE-GLY-VAL-GLU-PHE-ALA-THR-ARG-SER-ILE-GLN-VAL-ASP-GLY-LYS-THR-ILE-LYS-ALA-GLN-ILE-TRP-ASP-THR-ALA-GLY-GLN-GLU-ARG-TYR-ARG-ALA-ILE-THR-SER-ALA-TYR-TYR-ARG-GLY-ALA-VAL-GLY-ALA-LEU-LEU-VAL-TYR-ASP-ILE-ALA-LYS-HIS-LEU-THR-TYR-GLU-ASN-VAL-GLU-ARG-TRP-LEU-LYS-GLU-LEU-ARG-ASP-HIS-ALA-ASP-SER-ASN-ILE-VAL-ILE-MET-LEU-VAL-GLY-ASN-LYS-SER-ASP-LEU-ARG-HIS-LEU-ARG-ALA-VAL-PRO-THR-ASP-GLU-ALA-ARG-ALA-PHE-ALA-GLU-LYS-ASN-ASN-LEU-SER-PHE-ILE-GLU-THR-SER-ALA-LEU-ASP-SER-THR-ASN-VAL-GLU-GLU-ALA-PHE-LYS-ASN-ILE-LEU-THR-GLU-ILE-TYR-ARG-ILE-VAL-SER-GLN-LYS-GLN-ILE-ALA-ASP-ARG-ALA-ALA-HIS-ASP-GLU-SER-PRO-GLY-ASN-ASN-VAL-VAL-ASP-ILE-SER-VAL-PRO-PRO-THR-THR-ASP,GLY-SER-LYS-ASP-ALA-GLU-LEU-GLN-GLU-ARG-GLU-TYR-HIS-LEU-LYS-GLU-LEU-ARG-GLU-GLN-LEU-ALA-LYS-GLN-THR-VAL-ALA-ILE-ALA-GLU-LEU-THR-GLU-GLU-LEU-GLN-SER-LYS-CYS-ILE-GLN-LEU-ASN-LYS-LEU-GLN,200,46,,Kd=22uM,4.657577,4.66,1,A,A,0,A,A,0,,C,A,,1,1,200,46,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,0.8200637102127075,0.5585031509399414,71.05850982666016,70.0067367553711,0.5175778865814209,1.590792894363403,0.8148214221000671,0.610763430595398,0.6994230151176453,0.4798130691051483,GSKDAELQEREYHLKELREQLAKQTVAIAELTEELQSKCIQLNKLQ,Low,"(4.606, 4.745]",train
4PZ6,protein-peptide,P36594 P40997,SMAPSEKDIEEVSVPGVLAPRDDVRVLKTRIAKLLGTSPDTFPGSQPVSFSKKHLQALKEKNYFVCEKSDGIRCLLYMTEHPRYENRPSVYLFDRKMNFYHVEKIFYPVENDKSGKKYHVDTLLDGELVLDIYPGGKKQLRYLVFDCLACDGIVYMSRLLDKRLGIFAKSIQKPLDEYTKTHMRETAIFPFLTSLKKMELGHGILKLFNEVIPRLRHGNDGLIFTCTETPYVSGTDQSLLKWKPKEMNTIDFMLKLEFAQPEEGDIDYSAMPEFQLGVWEGRNMYSFFAFMYVDEKEWEKLKSFNVPLSERIVECYLDDENRWRFLRFRDDKRDANHISTVKSVLQSIEDGVSKEDLLKEMPIIREAYYNRKKPSVTKRKLDETSNDDAPAIKKVAKESEKEI,YSPTSPSYSPTSPSYSPTSPS,SER-MET-ALA-PRO-SER-GLU-LYS-ASP-ILE-GLU-GLU-VAL-SER-VAL-PRO-GLY-VAL-LEU-ALA-PRO-ARG-ASP-ASP-VAL-ARG-VAL-LEU-LYS-THR-ARG-ILE-ALA-LYS-LEU-LEU-GLY-THR-SER-PRO-ASP-THR-PHE-PRO-GLY-SER-GLN-PRO-VAL-SER-PHE-SER-LYS-LYS-HIS-LEU-GLN-ALA-LEU-LYS-GLU-LYS-ASN-TYR-PHE-VAL-CYS-GLU-LYS-SER-ASP-GLY-ILE-ARG-CYS-LEU-LEU-TYR-MET-THR-GLU-HIS-PRO-ARG-TYR-GLU-ASN-ARG-PRO-SER-VAL-TYR-LEU-PHE-ASP-ARG-LYS-MET-ASN-PHE-TYR-HIS-VAL-GLU-LYS-ILE-PHE-TYR-PRO-VAL-GLU-ASN-ASP-LYS-SER-GLY-LYS-LYS-TYR-HIS-VAL-ASP-THR-LEU-LEU-ASP-GLY-GLU-LEU-VAL-LEU-ASP-ILE-TYR-PRO-GLY-GLY-LYS-LYS-GLN-LEU-ARG-TYR-LEU-VAL-PHE-ASP-CYS-LEU-ALA-CYS-ASP-GLY-ILE-VAL-TYR-MET-SER-ARG-LEU-LEU-ASP-LYS-ARG-LEU-GLY-ILE-PHE-ALA-LYS-SER-ILE-GLN-LYS-PRO-LEU-ASP-GLU-TYR-THR-LYS-THR-HIS-MET-ARG-GLU-THR-ALA-ILE-PHE-PRO-PHE-LEU-THR-SER-LEU-LYS-LYS-MET-GLU-LEU-GLY-HIS-GLY-ILE-LEU-LYS-LEU-PHE-ASN-GLU-VAL-ILE-PRO-ARG-LEU-ARG-HIS-GLY-ASN-ASP-GLY-LEU-ILE-PHE-THR-CYS-THR-GLU-THR-PRO-TYR-VAL-SER-GLY-THR-ASP-GLN-SER-LEU-LEU-LYS-TRP-LYS-PRO-LYS-GLU-MET-ASN-THR-ILE-ASP-PHE-MET-LEU-LYS-LEU-GLU-PHE-ALA-GLN-PRO-GLU-GLU-GLY-ASP-ILE-ASP-TYR-SER-ALA-MET-PRO-GLU-PHE-GLN-LEU-GLY-VAL-TRP-GLU-GLY-ARG-ASN-MET-TYR-SER-PHE-PHE-ALA-PHE-MET-TYR-VAL-ASP-GLU-LYS-GLU-TRP-GLU-LYS-LEU-LYS-SER-PHE-ASN-VAL-PRO-LEU-SER-GLU-ARG-ILE-VAL-GLU-CYS-TYR-LEU-ASP-ASP-GLU-ASN-ARG-TRP-ARG-PHE-LEU-ARG-PHE-ARG-ASP-ASP-LYS-ARG-ASP-ALA-ASN-HIS-ILE-SER-THR-VAL-LYS-SER-VAL-LEU-GLN-SER-ILE-GLU-ASP-GLY-VAL-SER-LYS-GLU-ASP-LEU-LEU-LYS-GLU-MET-PRO-ILE-ILE-ARG-GLU-ALA-TYR-TYR-ASN-ARG-LYS-LYS-PRO-SER-VAL-THR-LYS-ARG-LYS-LEU-ASP-GLU-THR-SER-ASN-ASP-ASP-ALA-PRO-ALA-ILE-LYS-LYS-VAL-ALA-LYS-GLU-SER-GLU-LYS-GLU-ILE,TYR-SEP-PRO-THR-SEP-PRO-SER-TYR-SEP-PRO-THR-SEP-PRO-SER-TYR-SEP-PRO-THR-SEP-PRO-SER,403,21,,Kd=0.21uM,6.677781,6.68,1,A,A,0,A,A,0,,P,A,,0,1,403,21,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,0.6446732878684998,0.5159880518913269,63.78914260864258,66.04340362548828,0.7728777527809143,1.784111499786377,0.755362868309021,0.6640780568122864,0.5329796671867371,0.429337739944458,YSPTSPSYSPTSPSYSPTSPS,Low,"(6.523, 6.696]",train
4QLB,protein-peptide,H2KYQ5 Q9U2D9,GAMPDHARMPRNLSSNKIAKTIAGEDLDEEEVLEMDAGQSAREEGRFVFECAWEVANKVGGIYTVLRSKAQISTEELGDQYCMFGPMKDGKWRLEVDPIEPENRTIRAAMKRFQADGFRCMYGRWLIEGYPKVILFDLGSGAVKMNEWKHELFEQCKIGIPHEDIESNDAVILGFMVALFLKHFRESVTSYTPLVVAHFHEWQAGVGLLMTRLWKLDIATVYTTHATLLGRHLCAGGADLYNNLDSFDLDAEAGKRKIYHQYCLERAACQTAHIFTTVSEITGLEAEHFLCRKPDVLTPNGLNVVKFAALHEFQNLHAQNKEKINQFIRGHFHGHLDFDLDKTLYFFTAGRYEFSNKGGDMFIESLARLNHYLKTTSDPRHMGVTVVAFLIYPAPANSFNVESLKGQAVTKQLKEAVDRIKEKVGQRIFDICLQGHLPEPEELMSPADNILLKRCIMSLHNSSLPPICTHNMIRADDPVLESLRRTSLFNKPEDRVKVVFHPEFLSSVSPLIGLDYEDFVRGCHLGVFPSYYEPWGYTPAECTVMGIPSVSTNLSGFGCFMQEHVEDHEQKGIYVIDRRHKAAEESVQELAQVMYDFCGQSRRQRIILRNSNEGLSALLDWQNLGVFYRDCRRLALERLHPDVDKIMRDNEGKVPSAATSRRPSIHSSDGEDDE,PSTEERRAAWEAGQPDYLGRDAFVHIQEALNRALNE,GLY-ALA-MET-PRO-ASP-HIS-ALA-ARG-MET-PRO-ARG-ASN-LEU-SER-SER-ASN-LYS-ILE-ALA-LYS-THR-ILE-ALA-GLY-GLU-ASP-LEU-ASP-GLU-GLU-GLU-VAL-LEU-GLU-MET-ASP-ALA-GLY-GLN-SER-ALA-ARG-GLU-GLU-GLY-ARG-PHE-VAL-PHE-GLU-CYS-ALA-TRP-GLU-VAL-ALA-ASN-LYS-VAL-GLY-GLY-ILE-TYR-THR-VAL-LEU-ARG-SER-LYS-ALA-GLN-ILE-SER-THR-GLU-GLU-LEU-GLY-ASP-GLN-TYR-CYS-MET-PHE-GLY-PRO-MET-LYS-ASP-GLY-LYS-TRP-ARG-LEU-GLU-VAL-ASP-PRO-ILE-GLU-PRO-GLU-ASN-ARG-THR-ILE-ARG-ALA-ALA-MET-LYS-ARG-PHE-GLN-ALA-ASP-GLY-PHE-ARG-CYS-MET-TYR-GLY-ARG-TRP-LEU-ILE-GLU-GLY-TYR-PRO-LYS-VAL-ILE-LEU-PHE-ASP-LEU-GLY-SER-GLY-ALA-VAL-LYS-MET-ASN-GLU-TRP-LYS-HIS-GLU-LEU-PHE-GLU-GLN-CYS-LYS-ILE-GLY-ILE-PRO-HIS-GLU-ASP-ILE-GLU-SER-ASN-ASP-ALA-VAL-ILE-LEU-GLY-PHE-MET-VAL-ALA-LEU-PHE-LEU-LYS-HIS-PHE-ARG-GLU-SER-VAL-THR-SER-TYR-THR-PRO-LEU-VAL-VAL-ALA-HIS-PHE-HIS-GLU-TRP-GLN-ALA-GLY-VAL-GLY-LEU-LEU-MET-THR-ARG-LEU-TRP-LYS-LEU-ASP-ILE-ALA-THR-VAL-TYR-THR-THR-HIS-ALA-THR-LEU-LEU-GLY-ARG-HIS-LEU-CYS-ALA-GLY-GLY-ALA-ASP-LEU-TYR-ASN-ASN-LEU-ASP-SER-PHE-ASP-LEU-ASP-ALA-GLU-ALA-GLY-LYS-ARG-LYS-ILE-TYR-HIS-GLN-TYR-CYS-LEU-GLU-ARG-ALA-ALA-CYS-GLN-THR-ALA-HIS-ILE-PHE-THR-THR-VAL-SER-GLU-ILE-THR-GLY-LEU-GLU-ALA-GLU-HIS-PHE-LEU-CYS-ARG-LYS-PRO-ASP-VAL-LEU-THR-PRO-ASN-GLY-LEU-ASN-VAL-VAL-LYS-PHE-ALA-ALA-LEU-HIS-GLU-PHE-GLN-ASN-LEU-HIS-ALA-GLN-ASN-LYS-GLU-LYS-ILE-ASN-GLN-PHE-ILE-ARG-GLY-HIS-PHE-HIS-GLY-HIS-LEU-ASP-PHE-ASP-LEU-ASP-LYS-THR-LEU-TYR-PHE-PHE-THR-ALA-GLY-ARG-TYR-GLU-PHE-SER-ASN-LYS-GLY-GLY-ASP-MET-PHE-ILE-GLU-SER-LEU-ALA-ARG-LEU-ASN-HIS-TYR-LEU-LYS-THR-THR-SER-ASP-PRO-ARG-HIS-MET-GLY-VAL-THR-VAL-VAL-ALA-PHE-LEU-ILE-TYR-PRO-ALA-PRO-ALA-ASN-SER-PHE-ASN-VAL-GLU-SER-LEU-LYS-GLY-GLN-ALA-VAL-THR-LYS-GLN-LEU-LYS-GLU-ALA-VAL-ASP-ARG-ILE-LYS-GLU-LYS-VAL-GLY-GLN-ARG-ILE-PHE-ASP-ILE-CYS-LEU-GLN-GLY-HIS-LEU-PRO-GLU-PRO-GLU-GLU-LEU-MET-SER-PRO-ALA-ASP-ASN-ILE-LEU-LEU-LYS-ARG-CYS-ILE-MET-SER-LEU-HIS-ASN-SER-SER-LEU-PRO-PRO-ILE-CYS-THR-HIS-ASN-MET-ILE-ARG-ALA-ASP-ASP-PRO-VAL-LEU-GLU-SER-LEU-ARG-ARG-THR-SER-LEU-PHE-ASN-LYS-PRO-GLU-ASP-ARG-VAL-LYS-VAL-VAL-PHE-HIS-PRO-GLU-PHE-LEU-SER-SER-VAL-SER-PRO-LEU-ILE-GLY-LEU-ASP-TYR-GLU-ASP-PHE-VAL-ARG-GLY-CYS-HIS-LEU-GLY-VAL-PHE-PRO-SER-TYR-TYR-GLU-PRO-TRP-GLY-TYR-THR-PRO-ALA-GLU-CYS-THR-VAL-MET-GLY-ILE-PRO-SER-VAL-SER-THR-ASN-LEU-SER-GLY-PHE-GLY-CYS-PHE-MET-GLN-GLU-HIS-VAL-GLU-ASP-HIS-GLU-GLN-LYS-GLY-ILE-TYR-VAL-ILE-ASP-ARG-ARG-HIS-LYS-ALA-ALA-GLU-GLU-SER-VAL-GLN-GLU-LEU-ALA-GLN-VAL-MET-TYR-ASP-PHE-CYS-GLY-GLN-SER-ARG-ARG-GLN-ARG-ILE-ILE-LEU-ARG-ASN-SER-ASN-GLU-GLY-LEU-SER-ALA-LEU-LEU-ASP-TRP-GLN-ASN-LEU-GLY-VAL-PHE-TYR-ARG-ASP-CYS-ARG-ARG-LEU-ALA-LEU-GLU-ARG-LEU-HIS-PRO-ASP-VAL-ASP-LYS-ILE-MET-ARG-ASP-ASN-GLU-GLY-LYS-VAL-PRO-SER-ALA-ALA-THR-SER-ARG-ARG-PRO-SER-ILE-HIS-SER-SER-ASP-GLY-GLU-ASP-ASP-GLU,PRO-SER-THR-GLU-GLU-ARG-ARG-ALA-ALA-TRP-GLU-ALA-GLY-GLN-PRO-ASP-TYR-LEU-GLY-ARG-ASP-ALA-PHE-VAL-HIS-ILE-GLN-GLU-ALA-LEU-ASN-ARG-ALA-LEU-ASN-GLU,674,36,,Kd=1.6uM,5.79588,5.8,1,A,A,0,A,A,0,,E,A,,0,1,674,36,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.6995301246643066,0.5901716947555542,69.6965103149414,65.3669662475586,0.629300057888031,1.473799228668213,0.8068894147872925,0.7450573444366455,0.6233944892883301,0.5301223993301392,PSTEERRAAWEAGQPDYLGRDAFVHIQEALNRALNE,Low,"(5.699, 5.821]",val
4REY,protein-peptide,Q9BQQ3 Q08379,GPEIGLGVSAEQPAGGAEGFHLHGVQENSPAQQAGLEPYFDFIITIGHSRLNKENDTLKALLKANVEKPVKLEVFNMKTMRVREVEVVPSNMWGGQGLLGASVRFCSFRRASEQVWHVLDVEPSSPAALAGLRPYTDYVVGSDQILQESEDFFTLIESHEGKPLKLMVYNSKSDSCREVTVTPNAAWGGEGSLGCGIGYGYLHRIPTQPPSYH,GPEFGSNPCIPFFYRADENDEVKITVI,GLY-PRO-GLU-ILE-GLY-LEU-GLY-VAL-SER-ALA-GLU-GLN-PRO-ALA-GLY-GLY-ALA-GLU-GLY-PHE-HIS-LEU-HIS-GLY-VAL-GLN-GLU-ASN-SER-PRO-ALA-GLN-GLN-ALA-GLY-LEU-GLU-PRO-TYR-PHE-ASP-PHE-ILE-ILE-THR-ILE-GLY-HIS-SER-ARG-LEU-ASN-LYS-GLU-ASN-ASP-THR-LEU-LYS-ALA-LEU-LEU-LYS-ALA-ASN-VAL-GLU-LYS-PRO-VAL-LYS-LEU-GLU-VAL-PHE-ASN-MET-LYS-THR-MET-ARG-VAL-ARG-GLU-VAL-GLU-VAL-VAL-PRO-SER-ASN-MET-TRP-GLY-GLY-GLN-GLY-LEU-LEU-GLY-ALA-SER-VAL-ARG-PHE-CYS-SER-PHE-ARG-ARG-ALA-SER-GLU-GLN-VAL-TRP-HIS-VAL-LEU-ASP-VAL-GLU-PRO-SER-SER-PRO-ALA-ALA-LEU-ALA-GLY-LEU-ARG-PRO-TYR-THR-ASP-TYR-VAL-VAL-GLY-SER-ASP-GLN-ILE-LEU-GLN-GLU-SER-GLU-ASP-PHE-PHE-THR-LEU-ILE-GLU-SER-HIS-GLU-GLY-LYS-PRO-LEU-LYS-LEU-MET-VAL-TYR-ASN-SER-LYS-SER-ASP-SER-CYS-ARG-GLU-VAL-THR-VAL-THR-PRO-ASN-ALA-ALA-TRP-GLY-GLY-GLU-GLY-SER-LEU-GLY-CYS-GLY-ILE-GLY-TYR-GLY-TYR-LEU-HIS-ARG-ILE-PRO-THR-GLN-PRO-PRO-SER-TYR-HIS,GLY-PRO-GLU-PHE-GLY-SER-ASN-PRO-CYS-ILE-PRO-PHE-PHE-TYR-ARG-ALA-ASP-GLU-ASN-ASP-GLU-VAL-LYS-ILE-THR-VAL-ILE,213,27,,Kd=108nM,6.966576,6.97,1,A,A,0,A,A,0,,B,A,,1,1,213,27,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)C(=O)O,0.8080397248268127,0.7593389749526978,84.11683654785156,80.77362823486328,0.5810375213623047,0.895018994808197,0.8070748448371887,0.8035231828689575,0.7119267582893372,0.7277529835700989,GPEFGSNPCIPFFYRADENDEVKITVI,Low,"(6.824, 7.049]",val
4UF1,protein-peptide,Q08FX8 Q16611,MGSSHHHHHHSQDMEAAIEFDEIVKKLLNIYINDICTTGEKRLLNNYEKSILDRIYKSCEYIKKNYELDFNSMYNQININNITTSDIKSKIIEALLIDSRPSVKLATLSFISLIAEKWGEKNRAKIMEILSNEIVEKISNNGKDFIDFIDRDDDDIVDDYVLITNYLK,PSSTMGQVGRQLAIIGDDINRRYDSE,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-MET-GLU-ALA-ALA-ILE-GLU-PHE-ASP-GLU-ILE-VAL-LYS-LYS-LEU-LEU-ASN-ILE-TYR-ILE-ASN-ASP-ILE-CYS-THR-THR-GLY-GLU-LYS-ARG-LEU-LEU-ASN-ASN-TYR-GLU-LYS-SER-ILE-LEU-ASP-ARG-ILE-TYR-LYS-SER-CYS-GLU-TYR-ILE-LYS-LYS-ASN-TYR-GLU-LEU-ASP-PHE-ASN-SER-MET-TYR-ASN-GLN-ILE-ASN-ILE-ASN-ASN-ILE-THR-THR-SER-ASP-ILE-LYS-SER-LYS-ILE-ILE-GLU-ALA-LEU-LEU-ILE-ASP-SER-ARG-PRO-SER-VAL-LYS-LEU-ALA-THR-LEU-SER-PHE-ILE-SER-LEU-ILE-ALA-GLU-LYS-TRP-GLY-GLU-LYS-ASN-ARG-ALA-LYS-ILE-MET-GLU-ILE-LEU-SER-ASN-GLU-ILE-VAL-GLU-LYS-ILE-SER-ASN-ASN-GLY-LYS-ASP-PHE-ILE-ASP-PHE-ILE-ASP-ARG-ASP-ASP-ASP-ASP-ILE-VAL-ASP-ASP-TYR-VAL-LEU-ILE-THR-ASN-TYR-LEU-LYS,PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU,168,26,,Kd=6.98uM,5.156145,5.16,1,A,A,0,A,A,0,,B,A,,1,1,168,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.6268805265426636,0.5558562278747559,66.06961059570312,55.64165115356445,1.2505983114242554,1.4283971786499023,0.5390493869781494,0.606349766254425,0.5747403502464294,0.5171911716461182,PSSTMGQVGRQLAIIGDDINRRYDSE,Low,"(5.105, 5.222]",val
4UWX,protein-peptide,O08808 P60469,GSEFSAMMYIQELRSGLRDMHLLSCLESLRVSLNNNPVSWVQTFGAEGLASLLDILKRLHDEKEETSGNYDSRNQHEIIRCLKAFMNNKFGIKTMLETEEGILLLVRAMDPAVPNMMIDAAKLLSALCILPQPEDMNERVLEAMTERAEMDEVERFQPLLDGLKSGTSIALKVGCLQLINALITPAEELDFRVHIRSELMRLGLHQVLQELREIENEDMKVQLCVFDEQGDEDFFDLKG,TPRSARLERMAQALALQAGSP,GLY-SER-GLU-PHE-SER-ALA-MET-MET-TYR-ILE-GLN-GLU-LEU-ARG-SER-GLY-LEU-ARG-ASP-MET-HIS-LEU-LEU-SER-CYS-LEU-GLU-SER-LEU-ARG-VAL-SER-LEU-ASN-ASN-ASN-PRO-VAL-SER-TRP-VAL-GLN-THR-PHE-GLY-ALA-GLU-GLY-LEU-ALA-SER-LEU-LEU-ASP-ILE-LEU-LYS-ARG-LEU-HIS-ASP-GLU-LYS-GLU-GLU-THR-SER-GLY-ASN-TYR-ASP-SER-ARG-ASN-GLN-HIS-GLU-ILE-ILE-ARG-CYS-LEU-LYS-ALA-PHE-MET-ASN-ASN-LYS-PHE-GLY-ILE-LYS-THR-MET-LEU-GLU-THR-GLU-GLU-GLY-ILE-LEU-LEU-LEU-VAL-ARG-ALA-MET-ASP-PRO-ALA-VAL-PRO-ASN-MET-MET-ILE-ASP-ALA-ALA-LYS-LEU-LEU-SER-ALA-LEU-CYS-ILE-LEU-PRO-GLN-PRO-GLU-ASP-MET-ASN-GLU-ARG-VAL-LEU-GLU-ALA-MET-THR-GLU-ARG-ALA-GLU-MET-ASP-GLU-VAL-GLU-ARG-PHE-GLN-PRO-LEU-LEU-ASP-GLY-LEU-LYS-SER-GLY-THR-SER-ILE-ALA-LEU-LYS-VAL-GLY-CYS-LEU-GLN-LEU-ILE-ASN-ALA-LEU-ILE-THR-PRO-ALA-GLU-GLU-LEU-ASP-PHE-ARG-VAL-HIS-ILE-ARG-SER-GLU-LEU-MET-ARG-LEU-GLY-LEU-HIS-GLN-VAL-LEU-GLN-GLU-LEU-ARG-GLU-ILE-GLU-ASN-GLU-ASP-MET-LYS-VAL-GLN-LEU-CYS-VAL-PHE-ASP-GLU-GLN-GLY-ASP-GLU-ASP-PHE-PHE-ASP-LEU-LYS-GLY,THR-PRO-ARG-SER-ALA-ARG-LEU-GLU-ARG-MET-ALA-GLN-ALA-LEU-ALA-LEU-GLN-ALA-GLY-SER-PRO,239,21,,Kd=6.9uM,5.161151,5.16,1,A,A,0,A,A,0,,C,A,,1,1,239,21,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,0.9490606784820556,0.632500946521759,91.08980560302734,85.9916000366211,0.3390686511993408,1.1190677881240845,0.9395731687545776,0.7857263088226318,0.9057594537734984,0.5941945910453796,TPRSARLERMAQALALQAGSP,Low,"(5.105, 5.222]",val
4YIZ,protein-peptide,S8GKS3 U6KQJ2,GSAMGSASTSGNPFQANVEMKTFMERFNLTHHHQSGIYVDLGQDKEVDGTLYREPAGLCPIWGKHIELQQPDRPPYRNNFLEDVPTEKEYKQSGNPLPGGFNLNFVTPSGQRISPFPMELLEKNSNIKASTDLGRCAEFAFKTVAMDKNNKATKYRYPFVYDSKKRLCHILYVSMQLMEGKKYCSVKGEPPDLTWYCFKPRKSVTENHHLIYGSAYVGENPDAFISKCPNQALRGYRFGVWKKGRCLDYTELTDTVIERVESKAQCWVKTFENDGVASDQPGSGSGSGDQPHSGGVGRNYGFYYVDTTGEGKCALSDQVPDCLVSDSAAVSYTAAGSLSEETPNFIIPSNPSVTPPTPETALQCTADKFPDSFGACDVQACKRQKTSCVGGQIQSTSVDCTADEQNECGSNTAAALVPR,GSASDITQHLNDSGLGPAVECLENLVVGPVCPAAVVAPAV,GLY-SER-ALA-MET-GLY-SER-ALA-SER-THR-SER-GLY-ASN-PRO-PHE-GLN-ALA-ASN-VAL-GLU-MET-LYS-THR-PHE-MET-GLU-ARG-PHE-ASN-LEU-THR-HIS-HIS-HIS-GLN-SER-GLY-ILE-TYR-VAL-ASP-LEU-GLY-GLN-ASP-LYS-GLU-VAL-ASP-GLY-THR-LEU-TYR-ARG-GLU-PRO-ALA-GLY-LEU-CYS-PRO-ILE-TRP-GLY-LYS-HIS-ILE-GLU-LEU-GLN-GLN-PRO-ASP-ARG-PRO-PRO-TYR-ARG-ASN-ASN-PHE-LEU-GLU-ASP-VAL-PRO-THR-GLU-LYS-GLU-TYR-LYS-GLN-SER-GLY-ASN-PRO-LEU-PRO-GLY-GLY-PHE-ASN-LEU-ASN-PHE-VAL-THR-PRO-SER-GLY-GLN-ARG-ILE-SER-PRO-PHE-PRO-MET-GLU-LEU-LEU-GLU-LYS-ASN-SER-ASN-ILE-LYS-ALA-SER-THR-ASP-LEU-GLY-ARG-CYS-ALA-GLU-PHE-ALA-PHE-LYS-THR-VAL-ALA-MET-ASP-LYS-ASN-ASN-LYS-ALA-THR-LYS-TYR-ARG-TYR-PRO-PHE-VAL-TYR-ASP-SER-LYS-LYS-ARG-LEU-CYS-HIS-ILE-LEU-TYR-VAL-SER-MET-GLN-LEU-MET-GLU-GLY-LYS-LYS-TYR-CYS-SER-VAL-LYS-GLY-GLU-PRO-PRO-ASP-LEU-THR-TRP-TYR-CYS-PHE-LYS-PRO-ARG-LYS-SER-VAL-THR-GLU-ASN-HIS-HIS-LEU-ILE-TYR-GLY-SER-ALA-TYR-VAL-GLY-GLU-ASN-PRO-ASP-ALA-PHE-ILE-SER-LYS-CYS-PRO-ASN-GLN-ALA-LEU-ARG-GLY-TYR-ARG-PHE-GLY-VAL-TRP-LYS-LYS-GLY-ARG-CYS-LEU-ASP-TYR-THR-GLU-LEU-THR-ASP-THR-VAL-ILE-GLU-ARG-VAL-GLU-SER-LYS-ALA-GLN-CYS-TRP-VAL-LYS-THR-PHE-GLU-ASN-ASP-GLY-VAL-ALA-SER-ASP-GLN-PRO-GLY-SER-GLY-SER-GLY-SER-GLY-ASP-GLN-PRO-HIS-SER-GLY-GLY-VAL-GLY-ARG-ASN-TYR-GLY-PHE-TYR-TYR-VAL-ASP-THR-THR-GLY-GLU-GLY-LYS-CYS-ALA-LEU-SER-ASP-GLN-VAL-PRO-ASP-CYS-LEU-VAL-SER-ASP-SER-ALA-ALA-VAL-SER-TYR-THR-ALA-ALA-GLY-SER-LEU-SER-GLU-GLU-THR-PRO-ASN-PHE-ILE-ILE-PRO-SER-ASN-PRO-SER-VAL-THR-PRO-PRO-THR-PRO-GLU-THR-ALA-LEU-GLN-CYS-THR-ALA-ASP-LYS-PHE-PRO-ASP-SER-PHE-GLY-ALA-CYS-ASP-VAL-GLN-ALA-CYS-LYS-ARG-GLN-LYS-THR-SER-CYS-VAL-GLY-GLY-GLN-ILE-GLN-SER-THR-SER-VAL-ASP-CYS-THR-ALA-ASP-GLU-GLN-ASN-GLU-CYS-GLY-SER-ASN-THR-ALA-ALA-ALA-LEU-VAL-PRO-ARG,GLY-SER-ALA-SER-ASP-ILE-THR-GLN-HIS-LEU-ASN-ASP-SER-GLY-LEU-GLY-PRO-ALA-VAL-GLU-CYS-LEU-GLU-ASN-LEU-VAL-VAL-GLY-PRO-VAL-CYS-PRO-ALA-ALA-VAL-VAL-ALA-PRO-ALA-VAL,419,40,,Kd=8nM,8.09691,8.1,1,A,A,0,A,A,0,,B,A,,1,1,419,40,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C,0.8177955150604248,0.719561755657196,64.08952331542969,42.88254165649414,0.8452681303024292,1.3102542161941528,0.7881868481636047,0.7141293287277222,0.770731508731842,0.6895953416824341,GSASDITQHLNDSGLGPAVECLENLVVGPVCPAAVVAPAV,Moderate,"(7.921, 8.383]",train
4YL8,protein-peptide,P10040 P26041,GPGSEFMPKTISVRVTTMDAELEFAIQPNTTGKQLFDQVVKTIGLREVWFFGLQYQDTKAFSTWLKLNKKVTAQDVRKESPLLFKFRAKFYPEDVSEELIQDITQRLFFLQVKEGILNDDIYCPPETAVLLASYAVQSKYGDFNKEVHKSGYLAGDKLLPQRVLEQHKLNKDQWEERIQVWHEEHRGMLREDAVLEYLKIAQDLEMYGVNYFSIKNKKGSELWLGVDALGLNIYEQNDRLTPKIGFPWSEIRNISFNDKKFVIKPIDKKAPDFVFYAPRLRINKRILALCMGNHELYMRRRKP,GPGSEFRNKRATRGTYSPSAQEYCNPRLEMDNVLKPPPEERLI,GLY-PRO-GLY-SER-GLU-PHE-MET-PRO-LYS-THR-ILE-SER-VAL-ARG-VAL-THR-THR-MET-ASP-ALA-GLU-LEU-GLU-PHE-ALA-ILE-GLN-PRO-ASN-THR-THR-GLY-LYS-GLN-LEU-PHE-ASP-GLN-VAL-VAL-LYS-THR-ILE-GLY-LEU-ARG-GLU-VAL-TRP-PHE-PHE-GLY-LEU-GLN-TYR-GLN-ASP-THR-LYS-ALA-PHE-SER-THR-TRP-LEU-LYS-LEU-ASN-LYS-LYS-VAL-THR-ALA-GLN-ASP-VAL-ARG-LYS-GLU-SER-PRO-LEU-LEU-PHE-LYS-PHE-ARG-ALA-LYS-PHE-TYR-PRO-GLU-ASP-VAL-SER-GLU-GLU-LEU-ILE-GLN-ASP-ILE-THR-GLN-ARG-LEU-PHE-PHE-LEU-GLN-VAL-LYS-GLU-GLY-ILE-LEU-ASN-ASP-ASP-ILE-TYR-CYS-PRO-PRO-GLU-THR-ALA-VAL-LEU-LEU-ALA-SER-TYR-ALA-VAL-GLN-SER-LYS-TYR-GLY-ASP-PHE-ASN-LYS-GLU-VAL-HIS-LYS-SER-GLY-TYR-LEU-ALA-GLY-ASP-LYS-LEU-LEU-PRO-GLN-ARG-VAL-LEU-GLU-GLN-HIS-LYS-LEU-ASN-LYS-ASP-GLN-TRP-GLU-GLU-ARG-ILE-GLN-VAL-TRP-HIS-GLU-GLU-HIS-ARG-GLY-MET-LEU-ARG-GLU-ASP-ALA-VAL-LEU-GLU-TYR-LEU-LYS-ILE-ALA-GLN-ASP-LEU-GLU-MET-TYR-GLY-VAL-ASN-TYR-PHE-SER-ILE-LYS-ASN-LYS-LYS-GLY-SER-GLU-LEU-TRP-LEU-GLY-VAL-ASP-ALA-LEU-GLY-LEU-ASN-ILE-TYR-GLU-GLN-ASN-ASP-ARG-LEU-THR-PRO-LYS-ILE-GLY-PHE-PRO-TRP-SER-GLU-ILE-ARG-ASN-ILE-SER-PHE-ASN-ASP-LYS-LYS-PHE-VAL-ILE-LYS-PRO-ILE-ASP-LYS-LYS-ALA-PRO-ASP-PHE-VAL-PHE-TYR-ALA-PRO-ARG-LEU-ARG-ILE-ASN-LYS-ARG-ILE-LEU-ALA-LEU-CYS-MET-GLY-ASN-HIS-GLU-LEU-TYR-MET-ARG-ARG-ARG-LYS-PRO,GLY-PRO-GLY-SER-GLU-PHE-ARG-ASN-LYS-ARG-ALA-THR-ARG-GLY-THR-TYR-SER-PRO-SER-ALA-GLN-GLU-TYR-CYS-ASN-PRO-ARG-LEU-GLU-MET-ASP-ASN-VAL-LEU-LYS-PRO-PRO-PRO-GLU-GLU-ARG-LEU-ILE,303,43,,Kd=5.4uM,5.267606,5.27,1,A,A,0,A,A,0,,B,A,,1,1,303,43,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O,0.6400136947631836,,81.1902084350586,,0.6675628423690796,,0.8465070128440857,,0.5016852021217346,,GPGSEFRNKRATRGTYSPSAQEYCNPRLEMDNVLKPPPEERLI,Low,"(5.222, 5.31]",train
4YWC,protein-peptide,Q8W4J8 Q9FIP9,TSSINFLTSDDDASAAAMEAFIGTNHHSSLFPPPPQQPPQPQFNEDTLQQRLQALIESAGENWTYAIFWQISHDFDSSTGDNTVILGWGDGYYKGEEDKEKKKNNTNTAEQEHRKRVIRELNSLISGGIGVSDESNDEEVTDTEWFFLVSMTQSFVNGVGLPGESFLNSRVIWLSGSGALTGSGCERAGQGQIYGLKTMVCIATQNGVVELGSSEVISQSSDLMHKVNNLFNFNNGGG,SVPQARKASLARFLEKRKERLM,THR-SER-SER-ILE-ASN-PHE-LEU-THR-SER-ASP-ASP-ASP-ALA-SER-ALA-ALA-ALA-MET-GLU-ALA-PHE-ILE-GLY-THR-ASN-HIS-HIS-SER-SER-LEU-PHE-PRO-PRO-PRO-PRO-GLN-GLN-PRO-PRO-GLN-PRO-GLN-PHE-ASN-GLU-ASP-THR-LEU-GLN-GLN-ARG-LEU-GLN-ALA-LEU-ILE-GLU-SER-ALA-GLY-GLU-ASN-TRP-THR-TYR-ALA-ILE-PHE-TRP-GLN-ILE-SER-HIS-ASP-PHE-ASP-SER-SER-THR-GLY-ASP-ASN-THR-VAL-ILE-LEU-GLY-TRP-GLY-ASP-GLY-TYR-TYR-LYS-GLY-GLU-GLU-ASP-LYS-GLU-LYS-LYS-LYS-ASN-ASN-THR-ASN-THR-ALA-GLU-GLN-GLU-HIS-ARG-LYS-ARG-VAL-ILE-ARG-GLU-LEU-ASN-SER-LEU-ILE-SER-GLY-GLY-ILE-GLY-VAL-SER-ASP-GLU-SER-ASN-ASP-GLU-GLU-VAL-THR-ASP-THR-GLU-TRP-PHE-PHE-LEU-VAL-SER-MET-THR-GLN-SER-PHE-VAL-ASN-GLY-VAL-GLY-LEU-PRO-GLY-GLU-SER-PHE-LEU-ASN-SER-ARG-VAL-ILE-TRP-LEU-SER-GLY-SER-GLY-ALA-LEU-THR-GLY-SER-GLY-CYS-GLU-ARG-ALA-GLY-GLN-GLY-GLN-ILE-TYR-GLY-LEU-LYS-THR-MET-VAL-CYS-ILE-ALA-THR-GLN-ASN-GLY-VAL-VAL-GLU-LEU-GLY-SER-SER-GLU-VAL-ILE-SER-GLN-SER-SER-ASP-LEU-MET-HIS-LYS-VAL-ASN-ASN-LEU-PHE-ASN-PHE-ASN-ASN-GLY-GLY-GLY,SER-VAL-PRO-GLN-ALA-ARG-LYS-ALA-SER-LEU-ALA-ARG-PHE-LEU-GLU-LYS-ARG-LYS-GLU-ARG-LEU-MET,238,22,,IC50=0.49uM,6.309804,6.31,1,A,A,0,A,A,0,,C,A,dimer,1,1,238,22,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,0.9805806279182434,0.7472092509269714,74.14991760253906,65.75115966796875,0.5974993109703064,1.145929217338562,0.7899952530860901,0.7204510569572449,0.8743808269500732,0.643604576587677,SVPQARKASLARFLEKRKERLM,Low,"(6.26, 6.398]",train
4YYP,protein-peptide,O00444 Q15468,SAQLLKSVFVKNVGWATQLTSGAVWVQFNDGSQLVVQAGVSSISYTSPNGQTTRYGENEKLPDYIKQKLQCLSSILLMFSNPTPNFH,PDAYRFLTEQDRQLRLLQAQIQRLLEAQSLMP,SER-ALA-GLN-LEU-LEU-LYS-SER-VAL-PHE-VAL-LYS-ASN-VAL-GLY-TRP-ALA-THR-GLN-LEU-THR-SER-GLY-ALA-VAL-TRP-VAL-GLN-PHE-ASN-ASP-GLY-SER-GLN-LEU-VAL-VAL-GLN-ALA-GLY-VAL-SER-SER-ILE-SER-TYR-THR-SER-PRO-ASN-GLY-GLN-THR-THR-ARG-TYR-GLY-GLU-ASN-GLU-LYS-LEU-PRO-ASP-TYR-ILE-LYS-GLN-LYS-LEU-GLN-CYS-LEU-SER-SER-ILE-LEU-LEU-MET-PHE-SER-ASN-PRO-THR-PRO-ASN-PHE-HIS,PRO-ASP-ALA-TYR-ARG-PHE-LEU-THR-GLU-GLN-ASP-ARG-GLN-LEU-ARG-LEU-LEU-GLN-ALA-GLN-ILE-GLN-ARG-LEU-LEU-GLU-ALA-GLN-SER-LEU-MET-PRO,87,32,,Kd=280nM,6.552842,6.55,1,A,A,0,A,A,0,,B,A,,1,1,87,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.9411219358444214,0.6525191068649292,92.2664031982422,68.34398651123047,0.337279736995697,1.1352249383926392,0.8950022459030151,0.6750652194023132,0.8843744993209839,0.6109630465507507,PDAYRFLTEQDRQLRLLQAQIQRLLEAQSLMP,Low,"(6.523, 6.696]",train
4Z80,protein-peptide,B6KQU6 S7UIL3,GSAMGSSTSTSRATYMDRFNIPKNHVDLIWDKDGTKSHTRGNTTYRWTERKSNVGVYVGYSEMYDSSAQAYCQSSSAKIDTKTTVGAPYMAAGACPNYGKVIAFTKRDGSRSDMTRWKNEIHANVMPHSTTSCASRADPGAAEVAKSIEGFAMYAGYLTHCPYNVNVYRQDMVTDKEFDSTVCNFVTESNPLRFLDTTQRQSTQPYTEYAFHGKGGHKGYDYKGQTSHVGCPPYNPPHVTKGMKDSSWITGPFECSILSRCTTHCWPYKSGGNCFRSLPAMFDMSTGECRLLGYHTQDFRSSTCAELTTDDTNAFYCVRPMKTAASSNMVYVTSHTRPDHETKCPPREPLKNVRWGVVSKGKYCKPMNARASLSNATAEQCGQRLFMLSSADGSSLSSQVRGYHWATFVATDCNMGESCAATARGKCFFYSTVPECLIHSPTTMAFTSLSAVDPSIAIDPDSIAVLPEDKCVSVDCGAHGTCDVATGKCVCEPGFTGERCDAAALVPR,GSASQIVQNQSSLAPELSGCPPMGICMDGTIGDPIAS,GLY-SER-ALA-MET-GLY-SER-SER-THR-SER-THR-SER-ARG-ALA-THR-TYR-MET-ASP-ARG-PHE-ASN-ILE-PRO-LYS-ASN-HIS-VAL-ASP-LEU-ILE-TRP-ASP-LYS-ASP-GLY-THR-LYS-SER-HIS-THR-ARG-GLY-ASN-THR-THR-TYR-ARG-TRP-THR-GLU-ARG-LYS-SER-ASN-VAL-GLY-VAL-TYR-VAL-GLY-TYR-SER-GLU-MET-TYR-ASP-SER-SER-ALA-GLN-ALA-TYR-CYS-GLN-SER-SER-SER-ALA-LYS-ILE-ASP-THR-LYS-THR-THR-VAL-GLY-ALA-PRO-TYR-MET-ALA-ALA-GLY-ALA-CYS-PRO-ASN-TYR-GLY-LYS-VAL-ILE-ALA-PHE-THR-LYS-ARG-ASP-GLY-SER-ARG-SER-ASP-MET-THR-ARG-TRP-LYS-ASN-GLU-ILE-HIS-ALA-ASN-VAL-MET-PRO-HIS-SER-THR-THR-SER-CYS-ALA-SER-ARG-ALA-ASP-PRO-GLY-ALA-ALA-GLU-VAL-ALA-LYS-SER-ILE-GLU-GLY-PHE-ALA-MET-TYR-ALA-GLY-TYR-LEU-THR-HIS-CYS-PRO-TYR-ASN-VAL-ASN-VAL-TYR-ARG-GLN-ASP-MET-VAL-THR-ASP-LYS-GLU-PHE-ASP-SER-THR-VAL-CYS-ASN-PHE-VAL-THR-GLU-SER-ASN-PRO-LEU-ARG-PHE-LEU-ASP-THR-THR-GLN-ARG-GLN-SER-THR-GLN-PRO-TYR-THR-GLU-TYR-ALA-PHE-HIS-GLY-LYS-GLY-GLY-HIS-LYS-GLY-TYR-ASP-TYR-LYS-GLY-GLN-THR-SER-HIS-VAL-GLY-CYS-PRO-PRO-TYR-ASN-PRO-PRO-HIS-VAL-THR-LYS-GLY-MET-LYS-ASP-SER-SER-TRP-ILE-THR-GLY-PRO-PHE-GLU-CYS-SER-ILE-LEU-SER-ARG-CYS-THR-THR-HIS-CYS-TRP-PRO-TYR-LYS-SER-GLY-GLY-ASN-CYS-PHE-ARG-SER-LEU-PRO-ALA-MET-PHE-ASP-MET-SER-THR-GLY-GLU-CYS-ARG-LEU-LEU-GLY-TYR-HIS-THR-GLN-ASP-PHE-ARG-SER-SER-THR-CYS-ALA-GLU-LEU-THR-THR-ASP-ASP-THR-ASN-ALA-PHE-TYR-CYS-VAL-ARG-PRO-MET-LYS-THR-ALA-ALA-SER-SER-ASN-MET-VAL-TYR-VAL-THR-SER-HIS-THR-ARG-PRO-ASP-HIS-GLU-THR-LYS-CYS-PRO-PRO-ARG-GLU-PRO-LEU-LYS-ASN-VAL-ARG-TRP-GLY-VAL-VAL-SER-LYS-GLY-LYS-TYR-CYS-LYS-PRO-MET-ASN-ALA-ARG-ALA-SER-LEU-SER-ASN-ALA-THR-ALA-GLU-GLN-CYS-GLY-GLN-ARG-LEU-PHE-MET-LEU-SER-SER-ALA-ASP-GLY-SER-SER-LEU-SER-SER-GLN-VAL-ARG-GLY-TYR-HIS-TRP-ALA-THR-PHE-VAL-ALA-THR-ASP-CYS-ASN-MET-GLY-GLU-SER-CYS-ALA-ALA-THR-ALA-ARG-GLY-LYS-CYS-PHE-PHE-TYR-SER-THR-VAL-PRO-GLU-CYS-LEU-ILE-HIS-SER-PRO-THR-THR-MET-ALA-PHE-THR-SER-LEU-SER-ALA-VAL-ASP-PRO-SER-ILE-ALA-ILE-ASP-PRO-ASP-SER-ILE-ALA-VAL-LEU-PRO-GLU-ASP-LYS-CYS-VAL-SER-VAL-ASP-CYS-GLY-ALA-HIS-GLY-THR-CYS-ASP-VAL-ALA-THR-GLY-LYS-CYS-VAL-CYS-GLU-PRO-GLY-PHE-THR-GLY-GLU-ARG-CYS-ASP-ALA-ALA-ALA-LEU-VAL-PRO-ARG,GLY-SER-ALA-SER-GLN-ILE-VAL-GLN-ASN-GLN-SER-SER-LEU-ALA-PRO-GLU-LEU-SER-GLY-CYS-PRO-PRO-MET-GLY-ILE-CYS-MET-ASP-GLY-THR-ILE-GLY-ASP-PRO-ILE-ALA-SER,508,37,,Kd=12nM,7.920819,7.92,1,A,A,0,A,A,0,,C,A,,1,1,508,37,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,0.3381877839565277,0.4746309518814087,21.212499618530277,23.569652557373047,3.5118300914764404,2.37373948097229,0.4208196997642517,0.5196632146835327,0.2578967809677124,0.4473787844181061,GSASQIVQNQSSLAPELSGCPPMGICMDGTIGDPIAS,Moderate,"(7.523, 7.921]",train
4ZII,protein-peptide,Q07812 P55957,MDGSGEQPRGGGPTSSEQIMKTGALLLQGFIQDRAGRMGGEAPELALDPVPQDASTKKLSESLKRIGDELDSNMELQRMIAAVDTDSPREVFFRVAADMFSDGNFNWGRVVALFYFASKLVLKALSTKVPELIRTIMGWTLDFLRERLLGWIQDQGGWDGLLSYFGTPTW,SESQEDIIRNIARHLAQVGDSMDRSIPPGLVNGL,MET-ASP-GLY-SER-GLY-GLU-GLN-PRO-ARG-GLY-GLY-GLY-PRO-THR-SER-SER-GLU-GLN-ILE-MET-LYS-THR-GLY-ALA-LEU-LEU-LEU-GLN-GLY-PHE-ILE-GLN-ASP-ARG-ALA-GLY-ARG-MET-GLY-GLY-GLU-ALA-PRO-GLU-LEU-ALA-LEU-ASP-PRO-VAL-PRO-GLN-ASP-ALA-SER-THR-LYS-LYS-LEU-SER-GLU-SER-LEU-LYS-ARG-ILE-GLY-ASP-GLU-LEU-ASP-SER-ASN-MET-GLU-LEU-GLN-ARG-MET-ILE-ALA-ALA-VAL-ASP-THR-ASP-SER-PRO-ARG-GLU-VAL-PHE-PHE-ARG-VAL-ALA-ALA-ASP-MET-PHE-SER-ASP-GLY-ASN-PHE-ASN-TRP-GLY-ARG-VAL-VAL-ALA-LEU-PHE-TYR-PHE-ALA-SER-LYS-LEU-VAL-LEU-LYS-ALA-LEU-SER-THR-LYS-VAL-PRO-GLU-LEU-ILE-ARG-THR-ILE-MET-GLY-TRP-THR-LEU-ASP-PHE-LEU-ARG-GLU-ARG-LEU-LEU-GLY-TRP-ILE-GLN-ASP-GLN-GLY-GLY-TRP-ASP-GLY-LEU-LEU-SER-TYR-PHE-GLY-THR-PRO-THR-TRP,SER-GLU-SER-GLN-GLU-ASP-ILE-ILE-ARG-ASN-ILE-ALA-ARG-HIS-LEU-ALA-GLN-VAL-GLY-ASP-SER-MET-ASP-ARG-SER-ILE-PRO-PRO-GLY-LEU-VAL-ASN-GLY-LEU,170,34,,IC50=66nM,7.180456,7.18,1,A,A,0,A,A,0,,C,A,,1,1,170,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,0.7956454157829285,0.5799795389175415,74.5412368774414,67.70757293701172,0.9388346076011658,1.4419764280319214,0.7723758816719055,0.6779415607452393,0.7187422513961792,0.5444596409797668,SESQEDIIRNIARHLAQVGDSMDRSIPPGLVNGL,Moderate,"(7.049, 7.268]",train
4ZW2,protein-peptide,Q02789 Q8R3Z5,GPGSSDSDVSLEEDREALRKEAERQALAQLEKAKTKPVAFAVRTNVGYNPSPGDEVPVQGVAITFEPKDFLHIKEKYNNDWWIGRLVKEGCEVGFIPSPVKLDSLRLLQEQTLRQNRLSSSKHGKRIPFFKKTEHVPPYDVVPSMRPIILVGPSLKGYEVTDMMQKALFDFLKHRFDGRISITRVTADISLAKRSVLNNPSKHIIIERSNTRSSLAEVQSEIERIFELARTLQLVALDADTINHPAQLSKTSLAPIIVYIKITSPKVLQRLIKSRGKSQSKHLNVQIAASEKLAQCPPEMFDIILDENQLEDACEHLAEYLEAYWKATHPPSS,QQLEEDLRGYMSWITQGE,GLY-PRO-GLY-SER-SER-ASP-SER-ASP-VAL-SER-LEU-GLU-GLU-ASP-ARG-GLU-ALA-LEU-ARG-LYS-GLU-ALA-GLU-ARG-GLN-ALA-LEU-ALA-GLN-LEU-GLU-LYS-ALA-LYS-THR-LYS-PRO-VAL-ALA-PHE-ALA-VAL-ARG-THR-ASN-VAL-GLY-TYR-ASN-PRO-SER-PRO-GLY-ASP-GLU-VAL-PRO-VAL-GLN-GLY-VAL-ALA-ILE-THR-PHE-GLU-PRO-LYS-ASP-PHE-LEU-HIS-ILE-LYS-GLU-LYS-TYR-ASN-ASN-ASP-TRP-TRP-ILE-GLY-ARG-LEU-VAL-LYS-GLU-GLY-CYS-GLU-VAL-GLY-PHE-ILE-PRO-SER-PRO-VAL-LYS-LEU-ASP-SER-LEU-ARG-LEU-LEU-GLN-GLU-GLN-THR-LEU-ARG-GLN-ASN-ARG-LEU-SER-SER-SER-LYS-HIS-GLY-LYS-ARG-ILE-PRO-PHE-PHE-LYS-LYS-THR-GLU-HIS-VAL-PRO-PRO-TYR-ASP-VAL-VAL-PRO-SER-MET-ARG-PRO-ILE-ILE-LEU-VAL-GLY-PRO-SER-LEU-LYS-GLY-TYR-GLU-VAL-THR-ASP-MET-MET-GLN-LYS-ALA-LEU-PHE-ASP-PHE-LEU-LYS-HIS-ARG-PHE-ASP-GLY-ARG-ILE-SER-ILE-THR-ARG-VAL-THR-ALA-ASP-ILE-SER-LEU-ALA-LYS-ARG-SER-VAL-LEU-ASN-ASN-PRO-SER-LYS-HIS-ILE-ILE-ILE-GLU-ARG-SER-ASN-THR-ARG-SER-SER-LEU-ALA-GLU-VAL-GLN-SER-GLU-ILE-GLU-ARG-ILE-PHE-GLU-LEU-ALA-ARG-THR-LEU-GLN-LEU-VAL-ALA-LEU-ASP-ALA-ASP-THR-ILE-ASN-HIS-PRO-ALA-GLN-LEU-SER-LYS-THR-SER-LEU-ALA-PRO-ILE-ILE-VAL-TYR-ILE-LYS-ILE-THR-SER-PRO-LYS-VAL-LEU-GLN-ARG-LEU-ILE-LYS-SER-ARG-GLY-LYS-SER-GLN-SER-LYS-HIS-LEU-ASN-VAL-GLN-ILE-ALA-ALA-SER-GLU-LYS-LEU-ALA-GLN-CYS-PRO-PRO-GLU-MET-PHE-ASP-ILE-ILE-LEU-ASP-GLU-ASN-GLN-LEU-GLU-ASP-ALA-CYS-GLU-HIS-LEU-ALA-GLU-TYR-LEU-GLU-ALA-TYR-TRP-LYS-ALA-THR-HIS-PRO-PRO-SER-SER,ACE-GLN-GLN-LEU-GLU-GLU-ASP-LEU-ARG-GLY-TYR-MET-SER-TRP-ILE-THR-GLN-GLY-GLU-NH2,333,20,,Kd=4.9nM,8.309804,8.31,1,A,A,0,A,A,0,,B,A,,1,1,333,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,0.6511000990867615,0.7702929377555847,72.7278060913086,73.94258880615234,0.7551373839378357,1.01818585395813,0.7774879336357117,0.7907169461250305,0.5447168350219727,0.6938655376434326,QQLEEDLRGYMSWITQGE,Moderate,"(7.921, 8.383]",train
5AJJ,protein-peptide,Q85365 P55957,GPLGSKASNNDDHNYVYPLPENMVYRFNKSTNILDYLSTERDHVMMAVQYYMSKQRLDDLYRQLPTKTRSYIDIINMYCDKVNNDYNRDMNIMYDMASTESFTVYDINNEVNTMLLDNKGLGVRLATISFITELGKRCMNPVETIKMFTLLSHTICDDCFIDYITDIS,QEDIIRNIARHLAQVGDSMDRSIPPGLVNGLALQ,GLY-PRO-LEU-GLY-SER-LYS-ALA-SER-ASN-ASN-ASP-ASP-HIS-ASN-TYR-VAL-TYR-PRO-LEU-PRO-GLU-ASN-MET-VAL-TYR-ARG-PHE-ASN-LYS-SER-THR-ASN-ILE-LEU-ASP-TYR-LEU-SER-THR-GLU-ARG-ASP-HIS-VAL-MET-MET-ALA-VAL-GLN-TYR-TYR-MET-SER-LYS-GLN-ARG-LEU-ASP-ASP-LEU-TYR-ARG-GLN-LEU-PRO-THR-LYS-THR-ARG-SER-TYR-ILE-ASP-ILE-ILE-ASN-MET-TYR-CYS-ASP-LYS-VAL-ASN-ASN-ASP-TYR-ASN-ARG-ASP-MET-ASN-ILE-MET-TYR-ASP-MET-ALA-SER-THR-GLU-SER-PHE-THR-VAL-TYR-ASP-ILE-ASN-ASN-GLU-VAL-ASN-THR-MET-LEU-LEU-ASP-ASN-LYS-GLY-LEU-GLY-VAL-ARG-LEU-ALA-THR-ILE-SER-PHE-ILE-THR-GLU-LEU-GLY-LYS-ARG-CYS-MET-ASN-PRO-VAL-GLU-THR-ILE-LYS-MET-PHE-THR-LEU-LEU-SER-HIS-THR-ILE-CYS-ASP-ASP-CYS-PHE-ILE-ASP-TYR-ILE-THR-ASP-ILE-SER,GLN-GLU-ASP-ILE-ILE-ARG-ASN-ILE-ALA-ARG-HIS-LEU-ALA-GLN-VAL-GLY-ASP-SER-MET-ASP-ARG-SER-ILE-PRO-PRO-GLY-LEU-VAL-ASN-GLY-LEU-ALA-LEU-GLN,168,34,,Kd=3220nM,5.492144,5.49,1,A,A,0,A,A,0,,B,A,,1,1,168,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,0.8372153043746948,0.6942781209945679,60.48335647583008,54.811256408691406,0.6713816523551941,1.3369195461273191,0.7534665465354919,0.6761048436164856,0.7529544830322266,0.6095356941223145,QEDIIRNIARHLAQVGDSMDRSIPPGLVNGLALQ,Low,"(5.463, 5.6]",val
5AJK,protein-peptide,Q85365 Q16611,GPLGSKASNNDDHNYVYPLPENMVYRFNKSTNILDYLSTERDHVMMAVQYYMSKQRLDDLYRQLPTKTRSYIDIINMYCDKVNNDYNRDMNIMYDMASTESFTVYDINNEVNTILMDNKGLGVRLATISFITELGKRCMNPVETIKMFTLLSHTICDDCFIDYITDIS,PSSTMGQVGRQLAIIGDDINRRYDSE,GLY-PRO-LEU-GLY-SER-LYS-ALA-SER-ASN-ASN-ASP-ASP-HIS-ASN-TYR-VAL-TYR-PRO-LEU-PRO-GLU-ASN-MET-VAL-TYR-ARG-PHE-ASN-LYS-SER-THR-ASN-ILE-LEU-ASP-TYR-LEU-SER-THR-GLU-ARG-ASP-HIS-VAL-MET-MET-ALA-VAL-GLN-TYR-TYR-MET-SER-LYS-GLN-ARG-LEU-ASP-ASP-LEU-TYR-ARG-GLN-LEU-PRO-THR-LYS-THR-ARG-SER-TYR-ILE-ASP-ILE-ILE-ASN-MET-TYR-CYS-ASP-LYS-VAL-ASN-ASN-ASP-TYR-ASN-ARG-ASP-MET-ASN-ILE-MET-TYR-ASP-MET-ALA-SER-THR-GLU-SER-PHE-THR-VAL-TYR-ASP-ILE-ASN-ASN-GLU-VAL-ASN-THR-ILE-LEU-MET-ASP-ASN-LYS-GLY-LEU-GLY-VAL-ARG-LEU-ALA-THR-ILE-SER-PHE-ILE-THR-GLU-LEU-GLY-LYS-ARG-CYS-MET-ASN-PRO-VAL-GLU-THR-ILE-LYS-MET-PHE-THR-LEU-LEU-SER-HIS-THR-ILE-CYS-ASP-ASP-CYS-PHE-ILE-ASP-TYR-ILE-THR-ASP-ILE-SER,PRO-SER-SER-THR-MET-GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG-ARG-TYR-ASP-SER-GLU,168,26,,Kd=2640nM,5.578396,5.58,1,A,A,0,A,A,0,,B,A,,1,1,168,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.874750554561615,0.5872755646705627,75.21908569335938,56.78073120117188,0.7067314386367798,1.4153767824172974,0.7480521202087402,0.6307923793792725,0.8194405436515808,0.5057117938995361,PSSTMGQVGRQLAIIGDDINRRYDSE,Low,"(5.463, 5.6]",train
5C3F,protein-peptide,P55957 Q07820,SELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGG,EDIIRNIARHLALVGDLLDRSIW,SER-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL-GLU-ASP-LEU-GLU-GLY-GLY,ACE-GLU-ASP-ILE-ILE-ARG-ASN-ILE-ALA-ARG-HIS-LEU-ALA-NLE-VAL-GLY-ASP-NLE-NLE-ASP-ARG-SER-ILE-TRP,156,24,,IC50=1.6uM,5.79588,5.8,1,A,A,0,A,A,0,,B,A,,1,1,156,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC)C(C)C,0.993733286857605,0.6531997323036194,90.89295196533205,85.43048858642578,0.373488575220108,1.0976637601852417,0.9145737290382384,0.7546186447143555,0.9157577753067015,0.6158258318901062,EDIIRNIARHLALVGDLLDRSIW,Low,"(5.699, 5.821]",val
5CX3,protein-peptide,Q9BQS8 Q9H492,MPSDRPFKQRRSFADRCKEVQQIRDQHPSKIPVIIERYKGEKQLPVLDKTKFLVPDHVNMSELVKIIRRRLQLNPTQAFFLLVNQHSMVSVSTPIADIYEQEKDEDGFLYMVYASQETFGF,RPPDDAVFDIITDEELCQIQESGSSLVPRGS,MET-PRO-SER-ASP-ARG-PRO-PHE-LYS-GLN-ARG-ARG-SER-PHE-ALA-ASP-ARG-CYS-LYS-GLU-VAL-GLN-GLN-ILE-ARG-ASP-GLN-HIS-PRO-SER-LYS-ILE-PRO-VAL-ILE-ILE-GLU-ARG-TYR-LYS-GLY-GLU-LYS-GLN-LEU-PRO-VAL-LEU-ASP-LYS-THR-LYS-PHE-LEU-VAL-PRO-ASP-HIS-VAL-ASN-MET-SER-GLU-LEU-VAL-LYS-ILE-ILE-ARG-ARG-ARG-LEU-GLN-LEU-ASN-PRO-THR-GLN-ALA-PHE-PHE-LEU-LEU-VAL-ASN-GLN-HIS-SER-MET-VAL-SER-VAL-SER-THR-PRO-ILE-ALA-ASP-ILE-TYR-GLU-GLN-GLU-LYS-ASP-GLU-ASP-GLY-PHE-LEU-TYR-MET-VAL-TYR-ALA-SER-GLN-GLU-THR-PHE-GLY-PHE,ARG-PRO-PRO-ASP-ASP-ALA-VAL-PHE-ASP-ILE-ILE-THR-ASP-GLU-GLU-LEU-CYS-GLN-ILE-GLN-GLU-SER-GLY-SER-SER-LEU-VAL-PRO-ARG-GLY-SER,121,31,,Kd=0.54uM,6.267606,6.27,1,A,A,0,A,A,0,,E,A,,1,1,121,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O,0.9643242359161376,0.705285370349884,87.67701721191406,82.88751220703125,0.369424045085907,0.9120250344276428,0.9018825888633728,0.7699766159057617,0.8524674773216248,0.6891125440597534,RPPDDAVFDIITDEELCQIQESGSSLVPRGS,Low,"(6.26, 6.398]",train
5D3F,protein-peptide,P63104 P13569,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTS,AILPRISVISTGPTLQARRRQSVLNLMT,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,ALA-ILE-LEU-PRO-ARG-ILE-SEP-VAL-ILE-SER-THR-GLY-PRO-THR-LEU-GLN-ALA-ARG-ARG-ARG-GLN-SEP-VAL-LEU-ASN-LEU-MET-THR,230,28,,Kd=8.05uM,5.094204,5.09,1,A,A,0,A,A,0,,C,A,dimer,0,1,230,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,0.8545467257499695,0.6953427791595459,85.74517059326172,87.81239318847656,0.4017255902290344,1.073208212852478,0.9142382740974426,0.8062559366226196,0.771794319152832,0.6676144599914551,AILPRISVISTGPTLQARRRQSVLNLMT,Low,"(5.014, 5.105]",train
5ET1,protein-peptide,Q1EG27 Q9ET47,AMALEQALQAARRGDLDVLRSLHAAGLLGPSLRDSLDALPVHHAARSGKLHCLRYLVEEVALPAVSRARNGATPAHDAAATGYLSCLQWLLTQGGCRVQEKDNSGATVLHLAARFGHPDVVKWLLYQGGANSAITTDTGALPIHYAAAKGDLPSLKLLVGHYPEGVNAQTNNGATPLYLACQEGHLEVTKYLVQECSADPHLRAQDGMTPLHAAAQMGHNPVLVWLVSFADVSFSEQDHDGATAMHFAASRGHTKVLSWLLLHGAEISQDLWGGTPLHDAAENGELECCQILAVNGAGLDVRDHDGYTAADLAEFNGHTHCSRYLRTVQTLSLEHRVLSRDQSMDLEAKQLDS,QKQRAPRRRCQQPKMLSSPEDTMYYNQLNGTLEYQG,ALA-MET-ALA-LEU-GLU-GLN-ALA-LEU-GLN-ALA-ALA-ARG-ARG-GLY-ASP-LEU-ASP-VAL-LEU-ARG-SER-LEU-HIS-ALA-ALA-GLY-LEU-LEU-GLY-PRO-SER-LEU-ARG-ASP-SER-LEU-ASP-ALA-LEU-PRO-VAL-HIS-HIS-ALA-ALA-ARG-SER-GLY-LYS-LEU-HIS-CYS-LEU-ARG-TYR-LEU-VAL-GLU-GLU-VAL-ALA-LEU-PRO-ALA-VAL-SER-ARG-ALA-ARG-ASN-GLY-ALA-THR-PRO-ALA-HIS-ASP-ALA-ALA-ALA-THR-GLY-TYR-LEU-SER-CYS-LEU-GLN-TRP-LEU-LEU-THR-GLN-GLY-GLY-CYS-ARG-VAL-GLN-GLU-LYS-ASP-ASN-SER-GLY-ALA-THR-VAL-LEU-HIS-LEU-ALA-ALA-ARG-PHE-GLY-HIS-PRO-ASP-VAL-VAL-LYS-TRP-LEU-LEU-TYR-GLN-GLY-GLY-ALA-ASN-SER-ALA-ILE-THR-THR-ASP-THR-GLY-ALA-LEU-PRO-ILE-HIS-TYR-ALA-ALA-ALA-LYS-GLY-ASP-LEU-PRO-SER-LEU-LYS-LEU-LEU-VAL-GLY-HIS-TYR-PRO-GLU-GLY-VAL-ASN-ALA-GLN-THR-ASN-ASN-GLY-ALA-THR-PRO-LEU-TYR-LEU-ALA-CYS-GLN-GLU-GLY-HIS-LEU-GLU-VAL-THR-LYS-TYR-LEU-VAL-GLN-GLU-CYS-SER-ALA-ASP-PRO-HIS-LEU-ARG-ALA-GLN-ASP-GLY-MET-THR-PRO-LEU-HIS-ALA-ALA-ALA-GLN-MET-GLY-HIS-ASN-PRO-VAL-LEU-VAL-TRP-LEU-VAL-SER-PHE-ALA-ASP-VAL-SER-PHE-SER-GLU-GLN-ASP-HIS-ASP-GLY-ALA-THR-ALA-MET-HIS-PHE-ALA-ALA-SER-ARG-GLY-HIS-THR-LYS-VAL-LEU-SER-TRP-LEU-LEU-LEU-HIS-GLY-ALA-GLU-ILE-SER-GLN-ASP-LEU-TRP-GLY-GLY-THR-PRO-LEU-HIS-ASP-ALA-ALA-GLU-ASN-GLY-GLU-LEU-GLU-CYS-CYS-GLN-ILE-LEU-ALA-VAL-ASN-GLY-ALA-GLY-LEU-ASP-VAL-ARG-ASP-HIS-ASP-GLY-TYR-THR-ALA-ALA-ASP-LEU-ALA-GLU-PHE-ASN-GLY-HIS-THR-HIS-CYS-SER-ARG-TYR-LEU-ARG-THR-VAL-GLN-THR-LEU-SER-LEU-GLU-HIS-ARG-VAL-LEU-SER-ARG-ASP-GLN-SER-MET-ASP-LEU-GLU-ALA-LYS-GLN-LEU-ASP-SER,GLN-LYS-GLN-ARG-ALA-PRO-ARG-ARG-ARG-CYS-GLN-GLN-PRO-LYS-MET-LEU-SER-SER-PRO-GLU-ASP-THR-MET-TYR-TYR-ASN-GLN-LEU-ASN-GLY-THR-LEU-GLU-TYR-GLN-GLY,353,36,,Kd=107nM,6.970616,6.97,1,A,A,0,A,A,0,,C,A,,1,1,353,36,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O,0.8689873218536377,0.7264096140861511,85.6579818725586,79.81609344482422,0.4079196155071258,1.0791070461273191,0.8824500441551208,0.8032519817352295,0.7868940830230713,0.6841819882392883,QKQRAPRRRCQQPKMLSSPEDTMYYNQLNGTLEYQG,Low,"(6.824, 7.049]",val
5FW5,protein-peptide,P08411 Q13283,SMVMEKPSPLLVGREFVRQYYTLLNQAPDMLHRFYGKNSSYVHGGLDSNGKPADAVYGQKEIHRKVMSQNFTNCHTKIRHVDAHATLNDGVVVQVMGLLSNNNQALRRFMQTFVLAPEGSVANKFYVHNDIFRYQDEVFG,LTFGDFDEHEVDALASGITFGDFDD,SER-MET-VAL-MET-GLU-LYS-PRO-SER-PRO-LEU-LEU-VAL-GLY-ARG-GLU-PHE-VAL-ARG-GLN-TYR-TYR-THR-LEU-LEU-ASN-GLN-ALA-PRO-ASP-MET-LEU-HIS-ARG-PHE-TYR-GLY-LYS-ASN-SER-SER-TYR-VAL-HIS-GLY-GLY-LEU-ASP-SER-ASN-GLY-LYS-PRO-ALA-ASP-ALA-VAL-TYR-GLY-GLN-LYS-GLU-ILE-HIS-ARG-LYS-VAL-MET-SER-GLN-ASN-PHE-THR-ASN-CYS-HIS-THR-LYS-ILE-ARG-HIS-VAL-ASP-ALA-HIS-ALA-THR-LEU-ASN-ASP-GLY-VAL-VAL-VAL-GLN-VAL-MET-GLY-LEU-LEU-SER-ASN-ASN-ASN-GLN-ALA-LEU-ARG-ARG-PHE-MET-GLN-THR-PHE-VAL-LEU-ALA-PRO-GLU-GLY-SER-VAL-ALA-ASN-LYS-PHE-TYR-VAL-HIS-ASN-ASP-ILE-PHE-ARG-TYR-GLN-ASP-GLU-VAL-PHE-GLY,LEU-THR-PHE-GLY-ASP-PHE-ASP-GLU-HIS-GLU-VAL-ASP-ALA-LEU-ALA-SER-GLY-ILE-THR-PHE-GLY-ASP-PHE-ASP-ASP,140,25,,Kd=80nM,7.09691,7.1,1,A,A,0,A,A,0,,C,A,,1,1,140,25,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.9753449559211732,0.7857164144515991,91.39727783203124,87.55603790283203,0.376653254032135,0.8067891001701355,0.9100618362426758,0.8405290246009827,0.8856051564216614,0.772013247013092,LTFGDFDEHEVDALASGITFGDFDD,Moderate,"(7.049, 7.268]",train
5FZT,protein-peptide,Q96QB1 P26039,GIDPFTKHGQKECDNALRQLETVRELLENPVQPINDMSYFGCLDSVMENSKVLGEAMTGISQNAKNGNLPEFGDAIATASKALCGFTEAAAQAAYLVGVSDPNSQAGQQGLVEPTQFARANQAIQMACQSLGEPGCTQAQVLSAATIVAKHTSALCNSCRLASARTANPTAKRQFVQSAKEVANSTANLVKTIKALDGDFTEENRAQCRAATAPLLEAVDNLSAFASNPEFSSVPAQISPEGRAAMEPIVISAKTMLESAGGLIQTARALAVNPRDPPRWSVLAGHSRTVSDSIKKLITSMRDKAPGQL,PELDDILYHVKGMQRIVNQWSEK,GLY-ILE-ASP-PRO-PHE-THR-LYS-HIS-GLY-GLN-LYS-GLU-CYS-ASP-ASN-ALA-LEU-ARG-GLN-LEU-GLU-THR-VAL-ARG-GLU-LEU-LEU-GLU-ASN-PRO-VAL-GLN-PRO-ILE-ASN-ASP-MET-SER-TYR-PHE-GLY-CYS-LEU-ASP-SER-VAL-MET-GLU-ASN-SER-LYS-VAL-LEU-GLY-GLU-ALA-MET-THR-GLY-ILE-SER-GLN-ASN-ALA-LYS-ASN-GLY-ASN-LEU-PRO-GLU-PHE-GLY-ASP-ALA-ILE-ALA-THR-ALA-SER-LYS-ALA-LEU-CYS-GLY-PHE-THR-GLU-ALA-ALA-ALA-GLN-ALA-ALA-TYR-LEU-VAL-GLY-VAL-SER-ASP-PRO-ASN-SER-GLN-ALA-GLY-GLN-GLN-GLY-LEU-VAL-GLU-PRO-THR-GLN-PHE-ALA-ARG-ALA-ASN-GLN-ALA-ILE-GLN-MET-ALA-CYS-GLN-SER-LEU-GLY-GLU-PRO-GLY-CYS-THR-GLN-ALA-GLN-VAL-LEU-SER-ALA-ALA-THR-ILE-VAL-ALA-LYS-HIS-THR-SER-ALA-LEU-CYS-ASN-SER-CYS-ARG-LEU-ALA-SER-ALA-ARG-THR-ALA-ASN-PRO-THR-ALA-LYS-ARG-GLN-PHE-VAL-GLN-SER-ALA-LYS-GLU-VAL-ALA-ASN-SER-THR-ALA-ASN-LEU-VAL-LYS-THR-ILE-LYS-ALA-LEU-ASP-GLY-ASP-PHE-THR-GLU-GLU-ASN-ARG-ALA-GLN-CYS-ARG-ALA-ALA-THR-ALA-PRO-LEU-LEU-GLU-ALA-VAL-ASP-ASN-LEU-SER-ALA-PHE-ALA-SER-ASN-PRO-GLU-PHE-SER-SER-VAL-PRO-ALA-GLN-ILE-SER-PRO-GLU-GLY-ARG-ALA-ALA-MET-GLU-PRO-ILE-VAL-ILE-SER-ALA-LYS-THR-MET-LEU-GLU-SER-ALA-GLY-GLY-LEU-ILE-GLN-THR-ALA-ARG-ALA-LEU-ALA-VAL-ASN-PRO-ARG-ASP-PRO-PRO-ARG-TRP-SER-VAL-LEU-ALA-GLY-HIS-SER-ARG-THR-VAL-SER-ASP-SER-ILE-LYS-LYS-LEU-ILE-THR-SER-MET-ARG-ASP-LYS-ALA-PRO-GLY-GLN-LEU,PRO-GLU-LEU-ASP-ASP-ILE-LEU-TYR-HIS-VAL-LYS-GLY-MET-GLN-ARG-ILE-VAL-ASN-GLN-TRP-SER-GLU-LYS,309,23,,Kd=48uM,4.318759,4.32,1,A,A,0,A,A,0,,B,A,,1,1,309,23,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)CC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)CC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8661413192749023,0.6227782964706421,72.34813690185547,65.37279510498047,0.4319102764129638,1.616947054862976,0.7155230641365051,0.62306147813797,0.8604976534843445,0.6227074861526489,PELDDILYHVKGMQRIVNQWSEK,Low,"(4.155, 4.319]",val
5GLH,protein-peptide,P05305 P24530 P00720,GGGLAPAEVPKGDRTAGSPPRTISPPPCQGPIEIKETFKYINTVVSCLVFVLGIIGNSTLLYIIYKNKCMRNGPNILIASLALGDLLHIVIAIPINVYKLLAEDWPFGAEMCKLVPFIQKASVGITVLSLCALSIDRYRAVASWSRIKGIGVPKWTAVEIVLIWVVSVVLAVPEAIGFDIITMDYKGSYLRICLLHPVQKTAFMQFYATAKDWWLFSFYFCLPLAITAFFYTLMTCEMLRKNIFEMLRIDEGLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAIGRNTNGVITKDEAEKLFNQDVDAAVRGILRNAKLKPVYDSLDAVRRAALINMVFQMGETGVAGFTNSLRMLQQKRWDEAAVNLAKSRWYNQTPNRAKRVITTFRTGTWDAYLNDHLKQRREVAKTVFCLVLVFALCWLPLHLARILKLTLYNQNDPNRCELLSFLLVLDYIGINMASLNSCANPIALYLVSKRFKNAFKSALCCWAQS,CSCSSLMDKECVYFCHLDIIW,GLY-GLY-GLY-LEU-ALA-PRO-ALA-GLU-VAL-PRO-LYS-GLY-ASP-ARG-THR-ALA-GLY-SER-PRO-PRO-ARG-THR-ILE-SER-PRO-PRO-PRO-CYS-GLN-GLY-PRO-ILE-GLU-ILE-LYS-GLU-THR-PHE-LYS-TYR-ILE-ASN-THR-VAL-VAL-SER-CYS-LEU-VAL-PHE-VAL-LEU-GLY-ILE-ILE-GLY-ASN-SER-THR-LEU-LEU-TYR-ILE-ILE-TYR-LYS-ASN-LYS-CYS-MET-ARG-ASN-GLY-PRO-ASN-ILE-LEU-ILE-ALA-SER-LEU-ALA-LEU-GLY-ASP-LEU-LEU-HIS-ILE-VAL-ILE-ALA-ILE-PRO-ILE-ASN-VAL-TYR-LYS-LEU-LEU-ALA-GLU-ASP-TRP-PRO-PHE-GLY-ALA-GLU-MET-CYS-LYS-LEU-VAL-PRO-PHE-ILE-GLN-LYS-ALA-SER-VAL-GLY-ILE-THR-VAL-LEU-SER-LEU-CYS-ALA-LEU-SER-ILE-ASP-ARG-TYR-ARG-ALA-VAL-ALA-SER-TRP-SER-ARG-ILE-LYS-GLY-ILE-GLY-VAL-PRO-LYS-TRP-THR-ALA-VAL-GLU-ILE-VAL-LEU-ILE-TRP-VAL-VAL-SER-VAL-VAL-LEU-ALA-VAL-PRO-GLU-ALA-ILE-GLY-PHE-ASP-ILE-ILE-THR-MET-ASP-TYR-LYS-GLY-SER-TYR-LEU-ARG-ILE-CYS-LEU-LEU-HIS-PRO-VAL-GLN-LYS-THR-ALA-PHE-MET-GLN-PHE-TYR-ALA-THR-ALA-LYS-ASP-TRP-TRP-LEU-PHE-SER-PHE-TYR-PHE-CYS-LEU-PRO-LEU-ALA-ILE-THR-ALA-PHE-PHE-TYR-THR-LEU-MET-THR-CYS-GLU-MET-LEU-ARG-LYS-ASN-ILE-PHE-GLU-MET-LEU-ARG-ILE-ASP-GLU-GLY-LEU-ARG-LEU-LYS-ILE-TYR-LYS-ASP-THR-GLU-GLY-TYR-TYR-THR-ILE-GLY-ILE-GLY-HIS-LEU-LEU-THR-LYS-SER-PRO-SER-LEU-ASN-ALA-ALA-LYS-SER-GLU-LEU-ASP-LYS-ALA-ILE-GLY-ARG-ASN-THR-ASN-GLY-VAL-ILE-THR-LYS-ASP-GLU-ALA-GLU-LYS-LEU-PHE-ASN-GLN-ASP-VAL-ASP-ALA-ALA-VAL-ARG-GLY-ILE-LEU-ARG-ASN-ALA-LYS-LEU-LYS-PRO-VAL-TYR-ASP-SER-LEU-ASP-ALA-VAL-ARG-ARG-ALA-ALA-LEU-ILE-ASN-MET-VAL-PHE-GLN-MET-GLY-GLU-THR-GLY-VAL-ALA-GLY-PHE-THR-ASN-SER-LEU-ARG-MET-LEU-GLN-GLN-LYS-ARG-TRP-ASP-GLU-ALA-ALA-VAL-ASN-LEU-ALA-LYS-SER-ARG-TRP-TYR-ASN-GLN-THR-PRO-ASN-ARG-ALA-LYS-ARG-VAL-ILE-THR-THR-PHE-ARG-THR-GLY-THR-TRP-ASP-ALA-TYR-LEU-ASN-ASP-HIS-LEU-LYS-GLN-ARG-ARG-GLU-VAL-ALA-LYS-THR-VAL-PHE-CYS-LEU-VAL-LEU-VAL-PHE-ALA-LEU-CYS-TRP-LEU-PRO-LEU-HIS-LEU-ALA-ARG-ILE-LEU-LYS-LEU-THR-LEU-TYR-ASN-GLN-ASN-ASP-PRO-ASN-ARG-CYS-GLU-LEU-LEU-SER-PHE-LEU-LEU-VAL-LEU-ASP-TYR-ILE-GLY-ILE-ASN-MET-ALA-SER-LEU-ASN-SER-CYS-ALA-ASN-PRO-ILE-ALA-LEU-TYR-LEU-VAL-SER-LYS-ARG-PHE-LYS-ASN-ALA-PHE-LYS-SER-ALA-LEU-CYS-CYS-TRP-ALA-GLN-SER,CYS-SER-CYS-SER-SER-LEU-MET-ASP-LYS-GLU-CYS-VAL-TYR-PHE-CYS-HIS-LEU-ASP-ILE-ILE-TRP,498,21,,Kd=20.7pM,10.68403,10.68,1,A,A,0,A,A,0,,B,A,,1,1,498,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.7751619815826416,0.6009552478790283,56.67293167114258,55.95365905761719,0.6557515263557434,1.7243680953979492,0.6998188495635986,0.6960466504096985,0.7325815558433533,0.5395318269729614,CSCSSLMDKECVYFCHLDIIW,High,"(8.824, 12.12]",train
5GTB,protein-peptide,Q9FIG9 Q9XII1,RKDMVSSMESDVATIGSVRADDSEALPRMDARTAENIVSKWQKIKSLAFGPDHRIEMLPEVLDGRMLKIWTDRAAETAQLGLVYDYTLLKLSVDSVTVSADGTRALVEATLEESACLSDLVHPENNATDVRTYTTRYEVFWSKSGWKITEGSVLAS,LVKERVEIPFDSVVAKRDVTYGYG,ARG-LYS-ASP-MET-VAL-SER-SER-MET-GLU-SER-ASP-VAL-ALA-THR-ILE-GLY-SER-VAL-ARG-ALA-ASP-ASP-SER-GLU-ALA-LEU-PRO-ARG-MET-ASP-ALA-ARG-THR-ALA-GLU-ASN-ILE-VAL-SER-LYS-TRP-GLN-LYS-ILE-LYS-SER-LEU-ALA-PHE-GLY-PRO-ASP-HIS-ARG-ILE-GLU-MET-LEU-PRO-GLU-VAL-LEU-ASP-GLY-ARG-MET-LEU-LYS-ILE-TRP-THR-ASP-ARG-ALA-ALA-GLU-THR-ALA-GLN-LEU-GLY-LEU-VAL-TYR-ASP-TYR-THR-LEU-LEU-LYS-LEU-SER-VAL-ASP-SER-VAL-THR-VAL-SER-ALA-ASP-GLY-THR-ARG-ALA-LEU-VAL-GLU-ALA-THR-LEU-GLU-GLU-SER-ALA-CYS-LEU-SER-ASP-LEU-VAL-HIS-PRO-GLU-ASN-ASN-ALA-THR-ASP-VAL-ARG-THR-TYR-THR-THR-ARG-TYR-GLU-VAL-PHE-TRP-SER-LYS-SER-GLY-TRP-LYS-ILE-THR-GLU-GLY-SER-VAL-LEU-ALA-SER,LEU-VAL-LYS-GLU-ARG-VAL-GLU-ILE-PRO-PHE-ASP-SER-VAL-VAL-ALA-LYS-ARG-ASP-VAL-THR-TYR-GLY-TYR-GLY,156,24,,Kd=46uM,4.337242,4.34,1,A,A,0,A,A,0,,B,A,,1,1,156,24,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.933053731918335,0.79448401927948,81.62174224853516,75.1660385131836,0.455986738204956,0.9803953170776368,0.813036322593689,0.7633563876152039,0.7963914275169373,0.7021056413650513,LVKERVEIPFDSVVAKRDVTYGYG,Low,"(4.319, 4.456]",train
5H3J,protein-peptide,Q8R2X8 Q99JX3,GPEIGSSQSVEIPGGGTEGYHVLRVQENSPGHRAGLEPFFDFIVSINGSRLNKDNDTLKDLLKANVEKPVKMLIYSSKTLELREASVTPSNLWGGQGLLGVSIRFCSFDGANENVWHVLEVESNSPAALAGLRPHSDYIIGADTVMNESEDLFSLIETHEAKPLKLYVYNTDTDNCREVIITPNSAWGGEGSLGCGIGYGYLHRIPTRPFE,GPEFHPYTRYENITFNCCNHCQGELIAL,GLY-PRO-GLU-ILE-GLY-SER-SER-GLN-SER-VAL-GLU-ILE-PRO-GLY-GLY-GLY-THR-GLU-GLY-TYR-HIS-VAL-LEU-ARG-VAL-GLN-GLU-ASN-SER-PRO-GLY-HIS-ARG-ALA-GLY-LEU-GLU-PRO-PHE-PHE-ASP-PHE-ILE-VAL-SER-ILE-ASN-GLY-SER-ARG-LEU-ASN-LYS-ASP-ASN-ASP-THR-LEU-LYS-ASP-LEU-LEU-LYS-ALA-ASN-VAL-GLU-LYS-PRO-VAL-LYS-MET-LEU-ILE-TYR-SER-SER-LYS-THR-LEU-GLU-LEU-ARG-GLU-ALA-SER-VAL-THR-PRO-SER-ASN-LEU-TRP-GLY-GLY-GLN-GLY-LEU-LEU-GLY-VAL-SER-ILE-ARG-PHE-CYS-SER-PHE-ASP-GLY-ALA-ASN-GLU-ASN-VAL-TRP-HIS-VAL-LEU-GLU-VAL-GLU-SER-ASN-SER-PRO-ALA-ALA-LEU-ALA-GLY-LEU-ARG-PRO-HIS-SER-ASP-TYR-ILE-ILE-GLY-ALA-ASP-THR-VAL-MET-ASN-GLU-SER-GLU-ASP-LEU-PHE-SER-LEU-ILE-GLU-THR-HIS-GLU-ALA-LYS-PRO-LEU-LYS-LEU-TYR-VAL-TYR-ASN-THR-ASP-THR-ASP-ASN-CYS-ARG-GLU-VAL-ILE-ILE-THR-PRO-ASN-SER-ALA-TRP-GLY-GLY-GLU-GLY-SER-LEU-GLY-CYS-GLY-ILE-GLY-TYR-GLY-TYR-LEU-HIS-ARG-ILE-PRO-THR-ARG-PRO-PHE-GLU,GLY-PRO-GLU-PHE-HIS-PRO-TYR-THR-ARG-TYR-GLU-ASN-ILE-THR-PHE-ASN-CYS-CYS-ASN-HIS-CYS-GLN-GLY-GLU-LEU-ILE-ALA-LEU,211,28,,Kd=0.27uM,6.568636,6.57,1,A,A,0,A,A,0,,B,A,,1,1,211,28,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8782961964607239,0.6759984493255615,88.86599731445312,86.07544708251953,0.4804138839244842,1.2146766185760498,0.8666513562202454,0.744389533996582,0.7844499945640564,0.6411281228065491,GPEFHPYTRYENITFNCCNHCQGELIAL,Low,"(6.523, 6.696]",train
5H7Y,protein-peptide,Q9I3K2 Q9I3K3,MGSSHHHHHHSSGLVPRGSHMSSSRSSSMDKTGWITHCFGRFLIDLPPDAVINAGYYLWGDRIEYLDDKPTELAARVDRLEQEWRTQRHKSKGNMFLRKIDFGNESVGLLSWSSEVASKTYLLDTYVTSKPTWHVYRWKGKVSVDREQHAVEISRALARNLRSRAPKEIPSEPGFCIDHAYIAGDSFQVERFGVGVTFPEHPGARFEFRSSTGAELNSLLERVDGFVQNMLSTFAGMETLRKGKHPVGSLPGEEYLVAGSDKGQRGYTFMWEVQGKEESLTEPNLTAGLAVLERSNENGKPPPPAFKSDKEALELWDTIVDSIRVRPTSSSPRGGNAGPSPAPKPATPGGQTLGDHYVYEEFLSSLKPKDSWLDDL,DDLFASIGALWTWAWRGPKARQELLKA,MSE-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MSE-SER-SER-SER-ARG-SER-SER-SER-MSE-ASP-LYS-THR-GLY-TRP-ILE-THR-HIS-CYS-PHE-GLY-ARG-PHE-LEU-ILE-ASP-LEU-PRO-PRO-ASP-ALA-VAL-ILE-ASN-ALA-GLY-TYR-TYR-LEU-TRP-GLY-ASP-ARG-ILE-GLU-TYR-LEU-ASP-ASP-LYS-PRO-THR-GLU-LEU-ALA-ALA-ARG-VAL-ASP-ARG-LEU-GLU-GLN-GLU-TRP-ARG-THR-GLN-ARG-HIS-LYS-SER-LYS-GLY-ASN-MSE-PHE-LEU-ARG-LYS-ILE-ASP-PHE-GLY-ASN-GLU-SER-VAL-GLY-LEU-LEU-SER-TRP-SER-SER-GLU-VAL-ALA-SER-LYS-THR-TYR-LEU-LEU-ASP-THR-TYR-VAL-THR-SER-LYS-PRO-THR-TRP-HIS-VAL-TYR-ARG-TRP-LYS-GLY-LYS-VAL-SER-VAL-ASP-ARG-GLU-GLN-HIS-ALA-VAL-GLU-ILE-SER-ARG-ALA-LEU-ALA-ARG-ASN-LEU-ARG-SER-ARG-ALA-PRO-LYS-GLU-ILE-PRO-SER-GLU-PRO-GLY-PHE-CYS-ILE-ASP-HIS-ALA-TYR-ILE-ALA-GLY-ASP-SER-PHE-GLN-VAL-GLU-ARG-PHE-GLY-VAL-GLY-VAL-THR-PHE-PRO-GLU-HIS-PRO-GLY-ALA-ARG-PHE-GLU-PHE-ARG-SER-SER-THR-GLY-ALA-GLU-LEU-ASN-SER-LEU-LEU-GLU-ARG-VAL-ASP-GLY-PHE-VAL-GLN-ASN-MSE-LEU-SER-THR-PHE-ALA-GLY-MSE-GLU-THR-LEU-ARG-LYS-GLY-LYS-HIS-PRO-VAL-GLY-SER-LEU-PRO-GLY-GLU-GLU-TYR-LEU-VAL-ALA-GLY-SER-ASP-LYS-GLY-GLN-ARG-GLY-TYR-THR-PHE-MSE-TRP-GLU-VAL-GLN-GLY-LYS-GLU-GLU-SER-LEU-THR-GLU-PRO-ASN-LEU-THR-ALA-GLY-LEU-ALA-VAL-LEU-GLU-ARG-SER-ASN-GLU-ASN-GLY-LYS-PRO-PRO-PRO-PRO-ALA-PHE-LYS-SER-ASP-LYS-GLU-ALA-LEU-GLU-LEU-TRP-ASP-THR-ILE-VAL-ASP-SER-ILE-ARG-VAL-ARG-PRO-THR-SER-SER-SER-PRO-ARG-GLY-GLY-ASN-ALA-GLY-PRO-SER-PRO-ALA-PRO-LYS-PRO-ALA-THR-PRO-GLY-GLY-GLN-THR-LEU-GLY-ASP-HIS-TYR-VAL-TYR-GLU-GLU-PHE-LEU-SER-SER-LEU-LYS-PRO-LYS-ASP-SER-TRP-LEU-ASP-ASP-LEU,ASP-ASP-LEU-PHE-ALA-SER-ILE-GLY-ALA-LEU-TRP-THR-TRP-ALA-TRP-ARG-GLY-PRO-LYS-ALA-ARG-GLN-GLU-LEU-LEU-LYS-ALA,376,27,,Kd=125nM,6.90309,6.9,1,A,A,0,A,A,0,,B,A,,1,1,376,27,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.8853912949562073,0.686966061592102,68.55950164794922,65.731689453125,0.700631320476532,1.5043952465057373,0.7502961754798889,0.6944204568862915,0.7656291127204895,0.5820438861846924,DDLFASIGALWTWAWRGPKARQELLKA,Low,"(6.824, 7.049]",val
5HYC,protein-peptide,G4MTS7 G4NCW2,MAAQGPSPIPTNRLKQIAADACNDAIGSAEFYDHAKTEQWNHQIINTILKAVIAESQPSDSTTPPQFKFAVNSTIVQHLVPSSKLNKPAGGADDKPASTATSTDGKPHVGRRGMHSATGAFWNDKTDGMWTYKHEGDESKGMDVVVMLIWIAVLEHHHHHH,AAPQNLTTVPLTTIYECPPSPVKEIFSYSKGIQTQ,MET-ALA-ALA-GLN-GLY-PRO-SER-PRO-ILE-PRO-THR-ASN-ARG-LEU-LYS-GLN-ILE-ALA-ALA-ASP-ALA-CYS-ASN-ASP-ALA-ILE-GLY-SER-ALA-GLU-PHE-TYR-ASP-HIS-ALA-LYS-THR-GLU-GLN-TRP-ASN-HIS-GLN-ILE-ILE-ASN-THR-ILE-LEU-LYS-ALA-VAL-ILE-ALA-GLU-SER-GLN-PRO-SER-ASP-SER-THR-THR-PRO-PRO-GLN-PHE-LYS-PHE-ALA-VAL-ASN-SER-THR-ILE-VAL-GLN-HIS-LEU-VAL-PRO-SER-SER-LYS-LEU-ASN-LYS-PRO-ALA-GLY-GLY-ALA-ASP-ASP-LYS-PRO-ALA-SER-THR-ALA-THR-SER-THR-ASP-GLY-LYS-PRO-HIS-VAL-GLY-ARG-ARG-GLY-MET-HIS-SER-ALA-THR-GLY-ALA-PHE-TRP-ASN-ASP-LYS-THR-ASP-GLY-MET-TRP-THR-TYR-LYS-HIS-GLU-GLY-ASP-GLU-SER-LYS-GLY-MET-ASP-VAL-VAL-VAL-MET-LEU-ILE-TRP-ILE-ALA-VAL-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ALA-ALA-PRO-GLN-ASN-LEU-THR-THR-VAL-PRO-LEU-THR-THR-ILE-TYR-GLU-CYS-PRO-PRO-SER-PRO-VAL-LYS-GLU-ILE-PHE-SER-TYR-SER-LYS-GLY-ILE-GLN-THR-GLN,161,35,,Kd=15.2uM,4.818156,4.82,1,A,A,0,A,A,0,,C,A,dimer,1,1,161,35,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C)C(=O)O,0.8025159239768982,0.6177294850349426,70.04159545898438,62.91567993164063,0.875065267086029,1.3643282651901243,0.7141433358192444,0.6229968667030334,0.6141499280929565,0.5271268486976624,AAPQNLTTVPLTTIYECPPSPVKEIFSYSKGIQTQ,Low,"(4.745, 4.866]",train
5IBW,protein-peptide,P42522 Q54HC2,GSHMNHINTKAQVIEAFKVFDRDGNGYVTVDYLRKVLNELGDMMPADEIEEMIYEADPQNSGYVQYETFVGMLFLWD,GSRYWHDMASRIKNAYRNYKAFQFECSNRIKNAFRNYKLYRQR,GLY-SER-HIS-MET-ASN-HIS-ILE-ASN-THR-LYS-ALA-GLN-VAL-ILE-GLU-ALA-PHE-LYS-VAL-PHE-ASP-ARG-ASP-GLY-ASN-GLY-TYR-VAL-THR-VAL-ASP-TYR-LEU-ARG-LYS-VAL-LEU-ASN-GLU-LEU-GLY-ASP-MET-MET-PRO-ALA-ASP-GLU-ILE-GLU-GLU-MET-ILE-TYR-GLU-ALA-ASP-PRO-GLN-ASN-SER-GLY-TYR-VAL-GLN-TYR-GLU-THR-PHE-VAL-GLY-MET-LEU-PHE-LEU-TRP-ASP,GLY-SER-ARG-TYR-TRP-HIS-ASP-MET-ALA-SER-ARG-ILE-LYS-ASN-ALA-TYR-ARG-ASN-TYR-LYS-ALA-PHE-GLN-PHE-GLU-CYS-SER-ASN-ARG-ILE-LYS-ASN-ALA-PHE-ARG-ASN-TYR-LYS-LEU-TYR-ARG-GLN-ARG,77,43,,Kd=0.25nM,9.60206,9.6,1,A,A,0,A,A,0,,C,A,dimer,1,1,77,43,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,0.90817528963089,,85.36772155761719,,0.4548280835151672,,0.8007321953773499,,0.7631611227989197,,GSRYWHDMASRIKNAYRNYKAFQFECSNRIKNAFRNYKLYRQR,High,"(8.824, 12.12]",train
5LI1,protein-peptide,P41743 Q28E03,GPLSFSLGLQDFDLLRVIGRGSYAKVLLVRLKKTDRIYAMKVVKKELVNDDEDIDWVQTEKHVFEQASNHPFLVGLHSCFQTESRLFFVIEYVNGGDLMFHMQRQRKLPEEHARFYSAEISLALNYLHERGIIYRDLKLDNVLLDSEGHIKLTDYGMCKEGLRPGDTTSTFCGTPNYIAPEILRGEDYGFSVDWWALGVLMFEMMAGRSPFDIVGSSDNPDQNTEDYLFQVILEKQIRIPRSLSVKAASVLKSFLNKDPKERLGCHPQTGFADIQGHPFFRNVDWDMMEQKQVVPPFKPNISGEFGLDNFDSQFTNEPVQLTPDDDDIVRKIDQSEFEGFEYINPLLMSAEECV,LAFQREGFGRQSMSEKRTKQ,GLY-PRO-LEU-SER-PHE-SER-LEU-GLY-LEU-GLN-ASP-PHE-ASP-LEU-LEU-ARG-VAL-ILE-GLY-ARG-GLY-SER-TYR-ALA-LYS-VAL-LEU-LEU-VAL-ARG-LEU-LYS-LYS-THR-ASP-ARG-ILE-TYR-ALA-MET-LYS-VAL-VAL-LYS-LYS-GLU-LEU-VAL-ASN-ASP-ASP-GLU-ASP-ILE-ASP-TRP-VAL-GLN-THR-GLU-LYS-HIS-VAL-PHE-GLU-GLN-ALA-SER-ASN-HIS-PRO-PHE-LEU-VAL-GLY-LEU-HIS-SER-CYS-PHE-GLN-THR-GLU-SER-ARG-LEU-PHE-PHE-VAL-ILE-GLU-TYR-VAL-ASN-GLY-GLY-ASP-LEU-MET-PHE-HIS-MET-GLN-ARG-GLN-ARG-LYS-LEU-PRO-GLU-GLU-HIS-ALA-ARG-PHE-TYR-SER-ALA-GLU-ILE-SER-LEU-ALA-LEU-ASN-TYR-LEU-HIS-GLU-ARG-GLY-ILE-ILE-TYR-ARG-ASP-LEU-LYS-LEU-ASP-ASN-VAL-LEU-LEU-ASP-SER-GLU-GLY-HIS-ILE-LYS-LEU-THR-ASP-TYR-GLY-MET-CYS-LYS-GLU-GLY-LEU-ARG-PRO-GLY-ASP-THR-THR-SER-TPO-PHE-CYS-GLY-THR-PRO-ASN-TYR-ILE-ALA-PRO-GLU-ILE-LEU-ARG-GLY-GLU-ASP-TYR-GLY-PHE-SER-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-MET-PHE-GLU-MET-MET-ALA-GLY-ARG-SER-PRO-PHE-ASP-ILE-VAL-GLY-SER-SER-ASP-ASN-PRO-ASP-GLN-ASN-THR-GLU-ASP-TYR-LEU-PHE-GLN-VAL-ILE-LEU-GLU-LYS-GLN-ILE-ARG-ILE-PRO-ARG-SEP-LEU-SER-VAL-LYS-ALA-ALA-SER-VAL-LEU-LYS-SER-PHE-LEU-ASN-LYS-ASP-PRO-LYS-GLU-ARG-LEU-GLY-CYS-HIS-PRO-GLN-THR-GLY-PHE-ALA-ASP-ILE-GLN-GLY-HIS-PRO-PHE-PHE-ARG-ASN-VAL-ASP-TRP-ASP-MET-MET-GLU-GLN-LYS-GLN-VAL-VAL-PRO-PRO-PHE-LYS-PRO-ASN-ILE-SER-GLY-GLU-PHE-GLY-LEU-ASP-ASN-PHE-ASP-SER-GLN-PHE-THR-ASN-GLU-PRO-VAL-GLN-LEU-TPO-PRO-ASP-ASP-ASP-ASP-ILE-VAL-ARG-LYS-ILE-ASP-GLN-SER-GLU-PHE-GLU-GLY-PHE-GLU-TYR-ILE-ASN-PRO-LEU-LEU-MET-SER-ALA-GLU-GLU-CYS-VAL,LEU-ALA-PHE-GLN-ARG-GLU-GLY-PHE-GLY-ARG-GLN-SER-MET-SER-GLU-LYS-ARG-THR-LYS-GLN,354,20,,Kd=0.47uM,6.327902,6.33,1,A,A,0,A,A,0,,B,A,,1,1,354,20,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,0.8075205683708191,0.7335011959075928,81.55035400390625,75.48785400390625,0.5492790937423706,1.0502058267593384,0.8789904713630676,0.8466340899467468,0.7562305331230164,0.7052178978919983,LAFQREGFGRQSMSEKRTKQ,Low,"(6.26, 6.398]",train
5LXM,protein-peptide,Q9ULW0 O14965,MESKKRQWALEDFEIGRPLGKGKFGNVYLAREKQSKFILALKVLFKAQLEKAGVEHQLRREVEIQSHLRHPNILRLYGYFHDATRVYLILEYAPLGTVYRELQKLSKFDEQRTATYITELANALSYCHSKRVIHRDIKPENLLLGSAGELKIADFGWSVHAPSSRRTTLAGTLDYLPPEMIEGRMHDEKVDLWSLGVLCYEFLVGKPPFEANTYQETYKRISRVEFTFPDFVTEGARDLISRLLKHNPSQRPMLREVLEHPWITANSSKPSNAQNKESASKQS,SSYSYDAPSDFINFSSLDDEGDTQNIDSWFELKANLEN,MET-GLU-SER-LYS-LYS-ARG-GLN-TRP-ALA-LEU-GLU-ASP-PHE-GLU-ILE-GLY-ARG-PRO-LEU-GLY-LYS-GLY-LYS-PHE-GLY-ASN-VAL-TYR-LEU-ALA-ARG-GLU-LYS-GLN-SER-LYS-PHE-ILE-LEU-ALA-LEU-LYS-VAL-LEU-PHE-LYS-ALA-GLN-LEU-GLU-LYS-ALA-GLY-VAL-GLU-HIS-GLN-LEU-ARG-ARG-GLU-VAL-GLU-ILE-GLN-SER-HIS-LEU-ARG-HIS-PRO-ASN-ILE-LEU-ARG-LEU-TYR-GLY-TYR-PHE-HIS-ASP-ALA-THR-ARG-VAL-TYR-LEU-ILE-LEU-GLU-TYR-ALA-PRO-LEU-GLY-THR-VAL-TYR-ARG-GLU-LEU-GLN-LYS-LEU-SER-LYS-PHE-ASP-GLU-GLN-ARG-THR-ALA-THR-TYR-ILE-THR-GLU-LEU-ALA-ASN-ALA-LEU-SER-TYR-CYS-HIS-SER-LYS-ARG-VAL-ILE-HIS-ARG-ASP-ILE-LYS-PRO-GLU-ASN-LEU-LEU-LEU-GLY-SER-ALA-GLY-GLU-LEU-LYS-ILE-ALA-ASP-PHE-GLY-TRP-SER-VAL-HIS-ALA-PRO-SER-SER-ARG-ARG-THR-TPO-LEU-ALA-GLY-THR-LEU-ASP-TYR-LEU-PRO-PRO-GLU-MET-ILE-GLU-GLY-ARG-MET-HIS-ASP-GLU-LYS-VAL-ASP-LEU-TRP-SER-LEU-GLY-VAL-LEU-CYS-TYR-GLU-PHE-LEU-VAL-GLY-LYS-PRO-PRO-PHE-GLU-ALA-ASN-THR-TYR-GLN-GLU-THR-TYR-LYS-ARG-ILE-SER-ARG-VAL-GLU-PHE-THR-PHE-PRO-ASP-PHE-VAL-THR-GLU-GLY-ALA-ARG-ASP-LEU-ILE-SER-ARG-LEU-LEU-LYS-HIS-ASN-PRO-SER-GLN-ARG-PRO-MET-LEU-ARG-GLU-VAL-LEU-GLU-HIS-PRO-TRP-ILE-THR-ALA-ASN-SER-SER-LYS-PRO-SER-ASN-ALA-GLN-ASN-LYS-GLU-SER-ALA-SER-LYS-GLN-SER,SER-SER-TYR-SER-TYR-ASP-ALA-PRO-SER-ASP-PHE-ILE-ASN-PHE-SER-SER-LEU-ASP-ASP-GLU-GLY-ASP-THR-GLN-ASN-ILE-ASP-SER-TRP-PHE-GLU-MK8-LYS-ALA-ASN-MK8-GLU-ASN,283,38,,Kd=0.18uM,6.744727,6.74,1,A,A,0,A,A,0,,D,A,,1,1,283,38,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(=O)NCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(=O)NCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)O,0.6911619305610657,0.6644352674484253,73.35595703125,68.69058990478516,0.7493975162506104,1.3603384494781494,0.8054686784744263,0.7392365336418152,0.5438157916069031,0.5949398279190063,SSYSYDAPSDFINFSSLDDEGDTQNIDSWFELKANLEN,Low,"(6.696, 6.824]",train
5M36,protein-peptide,P30307 P63104,DKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTS,SRSGLYRSPSMPENLNRPRLKQVEKFKDNTIPDKVKKK,ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CSO-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,SER-ARG-SER-GLY-LEU-TYR-ARG-SER-PRO-SEP-MET-PRO-GLU-ASN-LEU-ASN-ARG-PRO-ARG-LEU-LYS-GLN-VAL-GLU-LYS-PHE-LYS-ASP-ASN-THR-ILE-PRO-ASP-LYS-VAL-LYS-LYS-LYS,229,38,,Kd=2.75uM,5.560667,5.56,1,A,A,0,A,A,0,,C,A,,0,1,229,38,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.7840604782104492,0.7206994295120239,84.86555480957031,86.4254150390625,0.4506192803382873,0.9496761560440063,0.8881546854972839,0.8059006929397583,0.6690856218338013,0.6993991136550903,SRSGLYRSPSMPENLNRPRLKQVEKFKDNTIPDKVKKK,Low,"(5.463, 5.6]",train
5NQF,protein-peptide,A0A024UZE1 A5K3N8,EFIEIVERSNYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSKTTFLKPVATGNQDLKDGGFAFPPTNPLISPMTLNGMRDFYKNNEYVKNLDELTLCSRHAGNMNPDNDKNSNYKYPAVYDYNDKKCHILYIAAQENNGPRYCNKDQSKRNSMFCFRPAKDKLFENYVYLSKNVVDNWEEVCPRKNLENAKFGLWVDGNCEDIPHVNEFSANDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNADMIKSAFLPTGAFKADRYKSHGKGYNWGNYNRETQKCEIFNVKPTCLINDKSYIATTALSHPIEVEHNFPGLEQKLISEEDLNSAVDHHHHHH,MDISQHATDIGMGPATSCYTSTIPPPKQVCIQQAVKATL,GLU-PHE-ILE-GLU-ILE-VAL-GLU-ARG-SER-ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-LYS-THR-THR-PHE-LEU-LYS-PRO-VAL-ALA-THR-GLY-ASN-GLN-ASP-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-ASN-PRO-LEU-ILE-SER-PRO-MET-THR-LEU-ASN-GLY-MET-ARG-ASP-PHE-TYR-LYS-ASN-ASN-GLU-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ASN-PRO-ASP-ASN-ASP-LYS-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-TYR-ASN-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLN-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-LYS-LEU-PHE-GLU-ASN-TYR-VAL-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-GLU-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLU-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-SER-ALA-ASN-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-ASP-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-ARG-GLU-THR-GLN-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASP-LYS-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU-HIS-ASN-PHE-PRO-GLY-LEU-GLU-GLN-LYS-LEU-ILE-SER-GLU-GLU-ASP-LEU-ASN-SER-ALA-VAL-ASP-HIS-HIS-HIS-HIS-HIS-HIS,MET-ASP-ILE-SER-GLN-HIS-ALA-THR-ASP-ILE-GLY-MET-GLY-PRO-ALA-THR-SER-CYS-TYR-THR-SER-THR-ILE-PRO-PRO-PRO-LYS-GLN-VAL-CYS-ILE-GLN-GLN-ALA-VAL-LYS-ALA-THR-LEU,371,39,,Kd=169nM,6.772113,6.77,1,A,A,0,A,A,0,,B,A,,1,1,371,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.5990768074989319,0.7349110245704651,58.81365203857422,55.61246109008789,1.05668044090271,1.2653677463531494,0.7108268141746521,0.7553285956382751,0.4674807786941528,0.6910600662231445,MDISQHATDIGMGPATSCYTSTIPPPKQVCIQQAVKATL,Low,"(6.696, 6.824]",train
5NQG,protein-peptide,A5K3N8 A5K4Z2,EASIPTVERSTRMSNPWKAFMEKYDIERTHSSGVRVDLGEDAEVENAKYRIPAGRCPVFGKGIVIENSDVSFLRPVATGDEKLKDGGFAFPNANDHISPMTLANLKERYKDNVEMMKLNDIALCRTHAASFVMAGDQNSNYRHPAVYDEKEKTCHMLYLSAQENMGPRYCSPDAQNRDAVFCFKPDKDESFENLVYLSKNVRNDWDKKCPRKNLGNAKFGLWVDGNCEEIPYVKEVEAEDLRECNRIVFGASASDQPTQYEEEMTDYQKIQQGFRQNNREMIKSAFLPVGAFNSDNFKSKGRGFNWANFDSVKKKCYIFNTKPTCLINDKNFIATTALSHPQEVDLEFPCSIYKDEIEREIKKQSRNMNLYSVDGERIVLPRIFISNDKESIKCPCEPERISQSTCNFYVCNCVEKRAEIKENNQVVIKEEFRDYYENGEEKSNKQMLLLEQKLISEEDLNSAVDHHHHHH,MDISQHATDIGMGPATSCYTSTIPPPKQVCIQQAVKATL,GLU-ALA-SER-ILE-PRO-THR-VAL-GLU-ARG-SER-THR-ARG-MET-SER-ASN-PRO-TRP-LYS-ALA-PHE-MET-GLU-LYS-TYR-ASP-ILE-GLU-ARG-THR-HIS-SER-SER-GLY-VAL-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-GLU-ASN-ALA-LYS-TYR-ARG-ILE-PRO-ALA-GLY-ARG-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-VAL-ILE-GLU-ASN-SER-ASP-VAL-SER-PHE-LEU-ARG-PRO-VAL-ALA-THR-GLY-ASP-GLU-LYS-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-ASN-ALA-ASN-ASP-HIS-ILE-SER-PRO-MET-THR-LEU-ALA-ASN-LEU-LYS-GLU-ARG-TYR-LYS-ASP-ASN-VAL-GLU-MET-MET-LYS-LEU-ASN-ASP-ILE-ALA-LEU-CYS-ARG-THR-HIS-ALA-ALA-SER-PHE-VAL-MET-ALA-GLY-ASP-GLN-ASN-SER-ASN-TYR-ARG-HIS-PRO-ALA-VAL-TYR-ASP-GLU-LYS-GLU-LYS-THR-CYS-HIS-MET-LEU-TYR-LEU-SER-ALA-GLN-GLU-ASN-MET-GLY-PRO-ARG-TYR-CYS-SER-PRO-ASP-ALA-GLN-ASN-ARG-ASP-ALA-VAL-PHE-CYS-PHE-LYS-PRO-ASP-LYS-ASP-GLU-SER-PHE-GLU-ASN-LEU-VAL-TYR-LEU-SER-LYS-ASN-VAL-ARG-ASN-ASP-TRP-ASP-LYS-LYS-CYS-PRO-ARG-LYS-ASN-LEU-GLY-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-GLU-ILE-PRO-TYR-VAL-LYS-GLU-VAL-GLU-ALA-GLU-ASP-LEU-ARG-GLU-CYS-ASN-ARG-ILE-VAL-PHE-GLY-ALA-SER-ALA-SER-ASP-GLN-PRO-THR-GLN-TYR-GLU-GLU-GLU-MET-THR-ASP-TYR-GLN-LYS-ILE-GLN-GLN-GLY-PHE-ARG-GLN-ASN-ASN-ARG-GLU-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-VAL-GLY-ALA-PHE-ASN-SER-ASP-ASN-PHE-LYS-SER-LYS-GLY-ARG-GLY-PHE-ASN-TRP-ALA-ASN-PHE-ASP-SER-VAL-LYS-LYS-LYS-CYS-TYR-ILE-PHE-ASN-THR-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASP-LYS-ASN-PHE-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-GLN-GLU-VAL-ASP-LEU-GLU-PHE-PRO-CYS-SER-ILE-TYR-LYS-ASP-GLU-ILE-GLU-ARG-GLU-ILE-LYS-LYS-GLN-SER-ARG-ASN-MET-ASN-LEU-TYR-SER-VAL-ASP-GLY-GLU-ARG-ILE-VAL-LEU-PRO-ARG-ILE-PHE-ILE-SER-ASN-ASP-LYS-GLU-SER-ILE-LYS-CYS-PRO-CYS-GLU-PRO-GLU-ARG-ILE-SER-GLN-SER-THR-CYS-ASN-PHE-TYR-VAL-CYS-ASN-CYS-VAL-GLU-LYS-ARG-ALA-GLU-ILE-LYS-GLU-ASN-ASN-GLN-VAL-VAL-ILE-LYS-GLU-GLU-PHE-ARG-ASP-TYR-TYR-GLU-ASN-GLY-GLU-GLU-LYS-SER-ASN-LYS-GLN-MET-LEU-LEU-LEU-GLU-GLN-LYS-LEU-ILE-SER-GLU-GLU-ASP-LEU-ASN-SER-ALA-VAL-ASP-HIS-HIS-HIS-HIS-HIS-HIS,MET-ASP-ILE-SER-GLN-HIS-ALA-THR-ASP-ILE-GLY-MET-GLY-PRO-ALA-THR-SER-CYS-TYR-THR-SER-THR-ILE-PRO-PRO-PRO-LYS-GLN-VAL-CYS-ILE-GLN-GLN-ALA-VAL-LYS-ALA-THR-LEU,471,39,,Kd=50nM,7.30103,7.3,1,A,A,0,A,A,0,,B,A,,1,1,471,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.6831156611442566,0.5939976572990417,43.17951202392578,46.7903938293457,1.3103047609329224,1.5949640274047852,0.6259785890579224,0.6538469195365906,0.5920077562332153,0.5179949402809143,MDISQHATDIGMGPATSCYTSTIPPPKQVCIQQAVKATL,Moderate,"(7.268, 7.523]",val
5NWM,protein-peptide,Q15788 P42226,GHMTGVESFMTKQDTTGKIISIDTSSLRAAGRTGWEDLVRKCIYAFFQPQGREPSYARQLFQEVMTRGTASSPSYRFILNDGTMLSAHTRCKLCYPQSPDMQPFIMGIHIIDREHSGLSPQDDTNSGMSIPR,GTWIGEDIFPPLLPPTEQDLTKLLLEGQGESG,GLY-HIS-MET-THR-GLY-VAL-GLU-SER-PHE-MET-THR-LYS-GLN-ASP-THR-THR-GLY-LYS-ILE-ILE-SER-ILE-ASP-THR-SER-SER-LEU-ARG-ALA-ALA-GLY-ARG-THR-GLY-TRP-GLU-ASP-LEU-VAL-ARG-LYS-CYS-ILE-TYR-ALA-PHE-PHE-GLN-PRO-GLN-GLY-ARG-GLU-PRO-SER-TYR-ALA-ARG-GLN-LEU-PHE-GLN-GLU-VAL-MET-THR-ARG-GLY-THR-ALA-SER-SER-PRO-SER-TYR-ARG-PHE-ILE-LEU-ASN-ASP-GLY-THR-MET-LEU-SER-ALA-HIS-THR-ARG-CYS-LYS-LEU-CYS-TYR-PRO-GLN-SER-PRO-ASP-MET-GLN-PRO-PHE-ILE-MET-GLY-ILE-HIS-ILE-ILE-ASP-ARG-GLU-HIS-SER-GLY-LEU-SER-PRO-GLN-ASP-ASP-THR-ASN-SER-GLY-MET-SER-ILE-PRO-ARG,GLY-THR-TRP-ILE-GLY-GLU-ASP-ILE-PHE-PRO-PRO-LEU-LEU-PRO-PRO-THR-GLU-GLN-ASP-LEU-THR-LYS-LEU-LEU-LEU-GLU-GLY-GLN-GLY-GLU-SER-GLY,132,32,,Kd=0.04uM,7.39794,7.4,1,A,A,0,A,A,0,,B,A,,1,1,132,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.9558008313179016,0.7967252731323242,80.50147247314453,78.18453979492188,0.4374064803123474,0.8210993409156799,0.8427807092666626,0.7814866900444031,0.8087509870529175,0.7295122146606445,GTWIGEDIFPPLLPPTEQDLTKLLLEGQGESG,Moderate,"(7.268, 7.523]",train
5O90,protein-peptide,P47811 Q15750,MSQERPTFYRQELNKTIWEVPERYQNLSPVGSGAYGSVCAAFDTKTGHRVAVKKLSRPFQSIIHAKRTYRELRLLKHMKHENVIGLLDVFTPARSLEEFNDVYLVTHLMGADLNNIVKCQKLTDDHVQFLIYQILRGLKYIHSADIIHRDLKPSNLAVNEDCELKILDFGLARHTDDEMTGYVAGRWYRAPEIMLNWMHYNQTVDIWSVGCIMAELLTGRTLFPGTDHIDQLKLILRLVGTPGAELLKKISSESARNYIQSLAQMPKMNFANVFIGANPLAVDLLEKMLVLDSDKRITAAQALAHAYFAQYHDPDDEPVADPYDQSFESRDLLIDEWKSLTYDEVISFVPPPLDQEEMES,RVYPVSVPYSSAQSTSKTSVTLSLVMPSQ,MET-SER-GLN-GLU-ARG-PRO-THR-PHE-TYR-ARG-GLN-GLU-LEU-ASN-LYS-THR-ILE-TRP-GLU-VAL-PRO-GLU-ARG-TYR-GLN-ASN-LEU-SER-PRO-VAL-GLY-SER-GLY-ALA-TYR-GLY-SER-VAL-CYS-ALA-ALA-PHE-ASP-THR-LYS-THR-GLY-HIS-ARG-VAL-ALA-VAL-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-SER-ILE-ILE-HIS-ALA-LYS-ARG-THR-TYR-ARG-GLU-LEU-ARG-LEU-LEU-LYS-HIS-MET-LYS-HIS-GLU-ASN-VAL-ILE-GLY-LEU-LEU-ASP-VAL-PHE-THR-PRO-ALA-ARG-SER-LEU-GLU-GLU-PHE-ASN-ASP-VAL-TYR-LEU-VAL-THR-HIS-LEU-MET-GLY-ALA-ASP-LEU-ASN-ASN-ILE-VAL-LYS-CYS-GLN-LYS-LEU-THR-ASP-ASP-HIS-VAL-GLN-PHE-LEU-ILE-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASP-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-ALA-VAL-ASN-GLU-ASP-CYS-GLU-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-HIS-THR-ASP-ASP-GLU-MET-THR-GLY-TYR-VAL-ALA-GLY-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-TRP-MET-HIS-TYR-ASN-GLN-THR-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-ALA-GLU-LEU-LEU-THR-GLY-ARG-THR-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-LEU-LYS-LEU-ILE-LEU-ARG-LEU-VAL-GLY-THR-PRO-GLY-ALA-GLU-LEU-LEU-LYS-LYS-ILE-SER-SER-GLU-SER-ALA-ARG-ASN-TYR-ILE-GLN-SER-LEU-ALA-GLN-MET-PRO-LYS-MET-ASN-PHE-ALA-ASN-VAL-PHE-ILE-GLY-ALA-ASN-PRO-LEU-ALA-VAL-ASP-LEU-LEU-GLU-LYS-MET-LEU-VAL-LEU-ASP-SER-ASP-LYS-ARG-ILE-THR-ALA-ALA-GLN-ALA-LEU-ALA-HIS-ALA-TYR-PHE-ALA-GLN-TYR-HIS-ASP-PRO-ASP-ASP-GLU-PRO-VAL-ALA-ASP-PRO-TYR-ASP-GLN-SER-PHE-GLU-SER-ARG-ASP-LEU-LEU-ILE-ASP-GLU-TRP-LYS-SER-LEU-THR-TYR-ASP-GLU-VAL-ILE-SER-PHE-VAL-PRO-PRO-PRO-LEU-ASP-GLN-GLU-GLU-MET-GLU-SER,ARG-VAL-TYR-PRO-VAL-SER-VAL-PRO-TYR-SER-SER-ALA-GLN-SER-THR-SER-LYS-THR-SER-VAL-THR-LEU-SER-LEU-VAL-MET-PRO-SER-GLN,360,29,,Kd=1.1uM,5.958607,5.96,1,A,A,0,A,A,0,,B,A,,1,1,360,29,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.659248948097229,0.6272583603858948,76.87683868408203,76.6258316040039,0.689191460609436,1.3726046085357666,0.8442661166191101,0.7786675095558167,0.5551539659500122,0.5894060730934143,RVYPVSVPYSSAQSTSKTSVTLSLVMPSQ,Low,"(5.821, 5.959]",train
5OAQ,protein-peptide,P46937 Q15561,GPRSVASSKLWMLEFSAFLEQQQDPDTYNKHLFVHIGQSSPSYSDPYLEAVDIRQIYDKFPEKKGGLKDLFERGPSNAFFLVKFWADLNTNIEDEGSSFYGVSSQYESPENMIITCSTKVCSFGKQVVEKVETEYARYENGHYSYRIHRSPLCEYMINFIHKLKHLPEKYMMNSVLENFTILQVVTNRDTQETLLCIAYVFEVSASEHGAQHHIYRLVKE,DSETDLEALFNAVMNPKTANVPQTVPMRLRKLPDSFFKPPE,GLY-PRO-ARG-SER-VAL-ALA-SER-SER-LYS-LEU-TRP-MET-LEU-GLU-PHE-SER-ALA-PHE-LEU-GLU-GLN-GLN-GLN-ASP-PRO-ASP-THR-TYR-ASN-LYS-HIS-LEU-PHE-VAL-HIS-ILE-GLY-GLN-SER-SER-PRO-SER-TYR-SER-ASP-PRO-TYR-LEU-GLU-ALA-VAL-ASP-ILE-ARG-GLN-ILE-TYR-ASP-LYS-PHE-PRO-GLU-LYS-LYS-GLY-GLY-LEU-LYS-ASP-LEU-PHE-GLU-ARG-GLY-PRO-SER-ASN-ALA-PHE-PHE-LEU-VAL-LYS-PHE-TRP-ALA-ASP-LEU-ASN-THR-ASN-ILE-GLU-ASP-GLU-GLY-SER-SER-PHE-TYR-GLY-VAL-SER-SER-GLN-TYR-GLU-SER-PRO-GLU-ASN-MET-ILE-ILE-THR-CYS-SER-THR-LYS-VAL-CYS-SER-PHE-GLY-LYS-GLN-VAL-VAL-GLU-LYS-VAL-GLU-THR-GLU-TYR-ALA-ARG-TYR-GLU-ASN-GLY-HIS-TYR-SER-TYR-ARG-ILE-HIS-ARG-SER-PRO-LEU-CYS-GLU-TYR-MET-ILE-ASN-PHE-ILE-HIS-LYS-LEU-LYS-HIS-LEU-PRO-GLU-LYS-TYR-MET-MET-ASN-SER-VAL-LEU-GLU-ASN-PHE-THR-ILE-LEU-GLN-VAL-VAL-THR-ASN-ARG-ASP-THR-GLN-GLU-THR-LEU-LEU-CYS-ILE-ALA-TYR-VAL-PHE-GLU-VAL-SER-ALA-SER-GLU-HIS-GLY-ALA-GLN-HIS-HIS-ILE-TYR-ARG-LEU-VAL-LYS-GLU,ASP-SER-GLU-THR-ASP-LEU-GLU-ALA-LEU-PHE-ASN-ALA-VAL-MET-ASN-PRO-LYS-THR-ALA-ASN-VAL-PRO-GLN-THR-VAL-PRO-MET-ARG-LEU-ARG-LYS-LEU-PRO-ASP-SER-PHE-PHE-LYS-PRO-PRO-GLU,220,41,,Kd=58nM,7.236572,7.24,1,A,A,0,A,A,0,,L,A,,1,1,220,41,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,0.9641748070716858,0.6867724061012268,84.59306335449219,82.41989135742188,0.4151450395584106,0.9870616793632508,0.9189281463623048,0.7773804068565369,0.8773064017295837,0.6641203761100769,DSETDLEALFNAVMNPKTANVPQTVPMRLRKLPDSFFKPPE,Moderate,"(7.049, 7.268]",val
5OTX,protein-peptide,P43220 P01275,RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFVNVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEE,HCEGCFTSDVSSYLEGQAAKEFIAWLVKGRG,ARG-PRO-GLN-GLY-ALA-THR-VAL-SER-LEU-TRP-GLU-THR-VAL-GLN-LYS-TRP-ARG-GLU-TYR-ARG-ARG-GLN-CYS-GLN-ARG-SER-LEU-THR-GLU-ASP-PRO-PRO-PRO-ALA-THR-ASP-LEU-PHE-CYS-ASN-ARG-THR-PHE-ASP-GLU-TYR-ALA-CYS-TRP-PRO-ASP-GLY-GLU-PRO-GLY-SER-PHE-VAL-ASN-VAL-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-ALA-SER-SER-VAL-PRO-GLN-GLY-HIS-VAL-TYR-ARG-PHE-CYS-THR-ALA-GLU-GLY-LEU-TRP-LEU-GLN-LYS-ASP-ASN-SER-SER-LEU-PRO-TRP-ARG-ASP-LEU-SER-GLU-CYS-GLU-GLU-SER-LYS-ARG-GLY-GLU-ARG-SER-SER-PRO-GLU-GLU,HIS-CYS-GLU-GLY-CYS-PHE-THR-SER-ASP-VAL-SER-SER-TYR-LEU-GLU-GLY-GLN-ALA-ALA-LYS-GLU-PHE-ILE-ALA-TRP-LEU-VAL-LYS-GLY-ARG-GLY,116,31,,IC50=187nM,6.728158,6.73,1,A,A,0,A,A,0,,B,A,,1,1,116,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.96248596906662,0.6411949396133423,82.67316436767578,76.24910736083984,0.4373982548713684,1.1195361614227295,0.8270599842071533,0.6932815313339233,0.7965124845504761,0.6012336611747742,HCEGCFTSDVSSYLEGQAAKEFIAWLVKGRG,Low,"(6.696, 6.824]",val
5T0F,protein-peptide,Q93ZM9 Q9FIP9,QPQFNEDTLQQRLQALIESAGENWTYAIFWQISHDFDSSTGDNTVILGWGDGYYKGEEDKEKKKNNTNTAEQEHRKRVIRELNSLISGGIGVSDESNDEEVTDTEWFFLVSMTQSFVNGVGLPGESFLNSRVIWLSGSGALTGSGCERAGQGQIYGLKTMVCIATQNGVVELGSSEVISQSSDLMHKVNNLFNFNNGGG,KQTNNAPKPKFQKFLDRRRSFRDIQGAISKIDPEIIKSLLAST,GLN-PRO-GLN-PHE-ASN-GLU-ASP-THR-LEU-GLN-GLN-ARG-LEU-GLN-ALA-LEU-ILE-GLU-SER-ALA-GLY-GLU-ASN-TRP-THR-TYR-ALA-ILE-PHE-TRP-GLN-ILE-SER-HIS-ASP-PHE-ASP-SER-SER-THR-GLY-ASP-ASN-THR-VAL-ILE-LEU-GLY-TRP-GLY-ASP-GLY-TYR-TYR-LYS-GLY-GLU-GLU-ASP-LYS-GLU-LYS-LYS-LYS-ASN-ASN-THR-ASN-THR-ALA-GLU-GLN-GLU-HIS-ARG-LYS-ARG-VAL-ILE-ARG-GLU-LEU-ASN-SER-LEU-ILE-SER-GLY-GLY-ILE-GLY-VAL-SER-ASP-GLU-SER-ASN-ASP-GLU-GLU-VAL-THR-ASP-THR-GLU-TRP-PHE-PHE-LEU-VAL-SER-MET-THR-GLN-SER-PHE-VAL-ASN-GLY-VAL-GLY-LEU-PRO-GLY-GLU-SER-PHE-LEU-ASN-SER-ARG-VAL-ILE-TRP-LEU-SER-GLY-SER-GLY-ALA-LEU-THR-GLY-SER-GLY-CYS-GLU-ARG-ALA-GLY-GLN-GLY-GLN-ILE-TYR-GLY-LEU-LYS-THR-MET-VAL-CYS-ILE-ALA-THR-GLN-ASN-GLY-VAL-VAL-GLU-LEU-GLY-SER-SER-GLU-VAL-ILE-SER-GLN-SER-SER-ASP-LEU-MET-HIS-LYS-VAL-ASN-ASN-LEU-PHE-ASN-PHE-ASN-ASN-GLY-GLY-GLY,LYS-GLN-THR-ASN-ASN-ALA-PRO-LYS-PRO-LYS-PHE-GLN-LYS-PHE-LEU-ASP-ARG-ARG-ARG-SER-PHE-ARG-ASP-ILE-GLN-GLY-ALA-ILE-SER-LYS-ILE-ASP-PRO-GLU-ILE-ILE-LYS-SER-LEU-LEU-ALA-SER-THR,199,43,,IC50=58nM,7.236572,7.24,1,A,A,0,A,A,0,,B,A,,1,1,199,43,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,0.841597318649292,,81.0644302368164,,0.5084946155548096,,0.8632322549819946,,0.7871182560920715,,KQTNNAPKPKFQKFLDRRRSFRDIQGAISKIDPEIIKSLLAST,Moderate,"(7.049, 7.268]",val
5TDY,protein-peptide,Q9WY63 Q9WY64,MPEKKIDGRRKAAVLLVALGPEKAAQVMKHLDEETVEQLVVEIANIGRVTPEEKKQVLEEFLSLAKAKEMISEGGIEYAKKVLEKAFGPERARKIIER,MPEEKELLELLEELENIFSRSPSDIAEIVRLWFFERGLENLYF,MSE-PRO-GLU-LYS-LYS-ILE-ASP-GLY-ARG-ARG-LYS-ALA-ALA-VAL-LEU-LEU-VAL-ALA-LEU-GLY-PRO-GLU-LYS-ALA-ALA-GLN-VAL-MSE-LYS-HIS-LEU-ASP-GLU-GLU-THR-VAL-GLU-GLN-LEU-VAL-VAL-GLU-ILE-ALA-ASN-ILE-GLY-ARG-VAL-THR-PRO-GLU-GLU-LYS-LYS-GLN-VAL-LEU-GLU-GLU-PHE-LEU-SER-LEU-ALA-LYS-ALA-LYS-GLU-MSE-ILE-SER-GLU-GLY-GLY-ILE-GLU-TYR-ALA-LYS-LYS-VAL-LEU-GLU-LYS-ALA-PHE-GLY-PRO-GLU-ARG-ALA-ARG-LYS-ILE-ILE-GLU-ARG,MSE-PRO-GLU-GLU-LYS-GLU-LEU-LEU-GLU-LEU-LEU-GLU-GLU-LEU-GLU-ASN-ILE-PHE-SER-ARG-SER-PRO-SER-ASP-ILE-ALA-GLU-ILE-VAL-ARG-LEU-TRP-PHE-PHE-GLU-ARG-GLY-LEU-GLU-ASN-LEU-TYR-PHE,98,43,,Kd=40nM,7.39794,7.4,1,A,A,0,A,A,0,,A,B,,1,1,98,43,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCSC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)C(CC[Se]C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)C(CC[Se]C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O,0.88144451379776,0.4917990267276764,73.54779052734375,55.73089218139648,0.5061906576156616,1.620213508605957,0.7696211934089661,0.5390000343322754,0.7985846996307373,0.479998767375946,MPEEKELLELLEELENIFSRSPSDIAEIVRLWFFERGLENLYF,Moderate,"(7.268, 7.523]",train
5TP6,protein-peptide,P35228 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFAKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREAAIDGDGQVNYEEFVQMMTAK,AGHMRPKRREIPLKVLVKAVLFACMLMRK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ALA-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ALA-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ALA-GLY-HIS-MET-ARG-PRO-LYS-ARG-ARG-GLU-ILE-PRO-LEU-LYS-VAL-LEU-VAL-LYS-ALA-VAL-LEU-PHE-ALA-CYS-MET-LEU-MET-ARG-LYS,148,29,,Kd=1.9nM,8.721246,8.72,1,A,A,0,A,A,0,,B,A,,1,1,148,29,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.8853627443313599,0.5503336191177368,77.5555419921875,52.55245590209961,0.4773397147655487,1.302683711051941,0.808373749256134,0.6238935589790344,0.8022088408470154,0.5319436192512512,AGHMRPKRREIPLKVLVKAVLFACMLMRK,Moderate,"(8.383, 8.824]",train
5TWA,protein-peptide,Q1RPT5 Q967D2,GPLGSSRLYLQNTAVMEELYRRNLSEDLVRDNGLSCGGREYWREPASTVGAASDGLSEEERRTAADAAERMTAVIAGTPGIAVERNVRDFRRGGWDVTPDNVESEFREVERRTFSDGVHWGRVIAFLAFSMSFAAYVNSRGIDGGAYSVFNWTLRVLNDSLADFIQRENGWRGFIVYADTLLRAQGS,ASSMASEVGRRLAEFGDQVDGQFYQ,GLY-PRO-LEU-GLY-SER-SER-ARG-LEU-TYR-LEU-GLN-ASN-THR-ALA-VAL-MET-GLU-GLU-LEU-TYR-ARG-ARG-ASN-LEU-SER-GLU-ASP-LEU-VAL-ARG-ASP-ASN-GLY-LEU-SER-CYS-GLY-GLY-ARG-GLU-TYR-TRP-ARG-GLU-PRO-ALA-SER-THR-VAL-GLY-ALA-ALA-SER-ASP-GLY-LEU-SER-GLU-GLU-GLU-ARG-ARG-THR-ALA-ALA-ASP-ALA-ALA-GLU-ARG-MET-THR-ALA-VAL-ILE-ALA-GLY-THR-PRO-GLY-ILE-ALA-VAL-GLU-ARG-ASN-VAL-ARG-ASP-PHE-ARG-ARG-GLY-GLY-TRP-ASP-VAL-THR-PRO-ASP-ASN-VAL-GLU-SER-GLU-PHE-ARG-GLU-VAL-GLU-ARG-ARG-THR-PHE-SER-ASP-GLY-VAL-HIS-TRP-GLY-ARG-VAL-ILE-ALA-PHE-LEU-ALA-PHE-SER-MET-SER-PHE-ALA-ALA-TYR-VAL-ASN-SER-ARG-GLY-ILE-ASP-GLY-GLY-ALA-TYR-SER-VAL-PHE-ASN-TRP-THR-LEU-ARG-VAL-LEU-ASN-ASP-SER-LEU-ALA-ASP-PHE-ILE-GLN-ARG-GLU-ASN-GLY-TRP-ARG-GLY-PHE-ILE-VAL-TYR-ALA-ASP-THR-LEU-LEU-ARG-ALA-GLN-GLY-SER,ALA-SER-SER-MET-ALA-SER-GLU-VAL-GLY-ARG-ARG-LEU-ALA-GLU-PHE-GLY-ASP-GLN-VAL-ASP-GLY-GLN-PHE-TYR-GLN,187,25,,Kd=66nM,7.180456,7.18,1,A,A,0,A,A,0,,C,A,,0,1,187,25,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,0.9540371298789978,0.763565719127655,92.52947998046876,89.49836730957031,0.4033894836902618,0.8313217163085938,0.9245688915252686,0.8425557017326355,0.9437154531478882,0.7438182234764099,ASSMASEVGRRLAEFGDQVDGQFYQ,Moderate,"(7.049, 7.268]",train
5U52,protein-peptide,P01857,GGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSREEMTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSL,FNMQCQRRFYEALHDPNLNEEQRNAKIKSIRDDC,GLY-GLY-GLY-PRO-SER-VAL-PHE-LEU-PHE-PRO-PRO-LYS-PRO-LYS-ASP-THR-LEU-MET-ILE-SER-ARG-THR-PRO-GLU-VAL-THR-CYS-VAL-VAL-VAL-ASP-VAL-SER-HIS-GLU-ASP-PRO-GLU-VAL-LYS-PHE-ASN-TRP-TYR-VAL-ASP-GLY-VAL-GLU-VAL-HIS-ASN-ALA-LYS-THR-LYS-PRO-ARG-GLU-GLU-GLN-TYR-ASN-SER-THR-TYR-ARG-VAL-VAL-SER-VAL-LEU-THR-VAL-LEU-HIS-GLN-ASP-TRP-LEU-ASN-GLY-LYS-GLU-TYR-LYS-CYS-LYS-VAL-SER-ASN-LYS-ALA-LEU-PRO-ALA-PRO-ILE-GLU-LYS-THR-ILE-SER-LYS-ALA-LYS-GLY-GLN-PRO-ARG-GLU-PRO-GLN-VAL-TYR-THR-LEU-PRO-PRO-SER-ARG-GLU-GLU-MET-THR-LYS-ASN-GLN-VAL-SER-LEU-THR-CYS-LEU-VAL-LYS-GLY-PHE-TYR-PRO-SER-ASP-ILE-ALA-VAL-GLU-TRP-GLU-SER-ASN-GLY-GLN-PRO-GLU-ASN-ASN-TYR-LYS-THR-THR-PRO-PRO-VAL-LEU-ASP-SER-ASP-GLY-SER-PHE-PHE-LEU-TYR-SER-LYS-LEU-THR-VAL-ASP-LYS-SER-ARG-TRP-GLN-GLN-GLY-ASN-VAL-PHE-SER-CYS-SER-VAL-MET-HIS-GLU-ALA-LEU-HIS-ASN-HIS-TYR-THR-GLN-LYS-SER-LEU-SER-LEU,PHE-ASN-MET-GLN-CYS-GLN-ARG-ARG-PHE-TYR-GLU-ALA-LEU-HIS-ASP-PRO-ASN-LEU-ASN-GLU-GLU-GLN-ARG-ASN-ALA-LYS-ILE-LYS-SER-ILE-ARG-ASP-ASP-CYS,209,34,,Kd=27nM,7.568636,7.57,1,A,A,0,A,A,0,,E,A,,1,1,209,34,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8217023015022278,0.6339837312698364,82.81704711914062,81.80497741699219,0.4067631363868713,1.1270703077316284,0.8291109800338745,0.7226116061210632,0.8198500871658325,0.6118267774581909,FNMQCQRRFYEALHDPNLNEEQRNAKIKSIRDDC,Moderate,"(7.523, 7.921]",train
5UA4,protein-peptide,Q4JHS0 P42485,GPLGSMEGEELIYHNIINEILVGYIKYYINDISEHELSPYQQQIKKILTYYDECLNKQVTITFSLTSVQEIKTQFTGVVTELFKDLINWGRICGFIVFSAKMAKYCKDANNHLESTVITTAYNFMKHNLLPWMISHGGQEEFLAFSLHSDMYS,SESQEAVIRDIARHLARIGDRMEYGIRPGLVDSL,GLY-PRO-LEU-GLY-SER-MET-GLU-GLY-GLU-GLU-LEU-ILE-TYR-HIS-ASN-ILE-ILE-ASN-GLU-ILE-LEU-VAL-GLY-TYR-ILE-LYS-TYR-TYR-ILE-ASN-ASP-ILE-SER-GLU-HIS-GLU-LEU-SER-PRO-TYR-GLN-GLN-GLN-ILE-LYS-LYS-ILE-LEU-THR-TYR-TYR-ASP-GLU-CYS-LEU-ASN-LYS-GLN-VAL-THR-ILE-THR-PHE-SER-LEU-THR-SER-VAL-GLN-GLU-ILE-LYS-THR-GLN-PHE-THR-GLY-VAL-VAL-THR-GLU-LEU-PHE-LYS-ASP-LEU-ILE-ASN-TRP-GLY-ARG-ILE-CYS-GLY-PHE-ILE-VAL-PHE-SER-ALA-LYS-MET-ALA-LYS-TYR-CYS-LYS-ASP-ALA-ASN-ASN-HIS-LEU-GLU-SER-THR-VAL-ILE-THR-THR-ALA-TYR-ASN-PHE-MET-LYS-HIS-ASN-LEU-LEU-PRO-TRP-MET-ILE-SER-HIS-GLY-GLY-GLN-GLU-GLU-PHE-LEU-ALA-PHE-SER-LEU-HIS-SER-ASP-MET-TYR-SER,SER-GLU-SER-GLN-GLU-ALA-VAL-ILE-ARG-ASP-ILE-ALA-ARG-HIS-LEU-ALA-ARG-ILE-GLY-ASP-ARG-MET-GLU-TYR-GLY-ILE-ARG-PRO-GLY-LEU-VAL-ASP-SER-LEU,153,34,,Kd=26nM,7.585027,7.59,1,A,A,0,A,A,0,,B,A,,1,1,153,34,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(C)C)[C@@H](C)CC)C(=O)O)[C@@H](C)CC,0.9234018921852112,0.626833438873291,89.4269790649414,71.99047088623047,0.3923971354961395,1.1016753911972046,0.9092135429382324,0.6915909051895142,0.8768151998519897,0.5902191996574402,SESQEAVIRDIARHLARIGDRMEYGIRPGLVDSL,Moderate,"(7.523, 7.921]",train
5V62,protein-peptide,P28482 Q15418,GPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,KGTAQLKPIESSILAQRRVRK,GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-VAL-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ARG-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-THR-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-CYS-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-TPO-GLU-PTR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-ILE-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-GLU-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,AZK-GLY-THR-ALA-GLN-LEU-LYS-PRO-ILE-GLU-SER-SER-ILE-LEU-ALA-GLN-ARG-ARG-VAL-ARG-LYS,351,21,,IC50=25nM,7.60206,7.6,1,A,A,0,A,A,0,,I,A,,1,1,351,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,0.7309780120849609,0.770261824131012,78.47732543945312,81.89966583251953,0.563380777835846,0.8158342242240906,0.8726558685302734,0.8710442781448364,0.6602762937545776,0.7450661659240723,KGTAQLKPIESSILAQRRVRK,Moderate,"(7.523, 7.921]",train
5W89,protein-peptide,Q07820,GDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHV,IWLLQELLRLGDEINARYAR,GLY-ASP-GLU-LEU-TYR-ARG-GLN-SER-LEU-GLU-ILE-ILE-SER-ARG-TYR-LEU-ARG-GLU-GLN-ALA-THR-GLY-ALA-LYS-ASP-THR-LYS-PRO-MET-GLY-ARG-SER-GLY-ALA-THR-SER-ARG-LYS-ALA-LEU-GLU-THR-LEU-ARG-ARG-VAL-GLY-ASP-GLY-VAL-GLN-ARG-ASN-HIS-GLU-THR-ALA-PHE-GLN-GLY-MET-LEU-ARG-LYS-LEU-ASP-ILE-LYS-ASN-GLU-ASP-ASP-VAL-LYS-SER-LEU-SER-ARG-VAL-MET-ILE-HIS-VAL-PHE-SER-ASP-GLY-VAL-THR-ASN-TRP-GLY-ARG-ILE-VAL-THR-LEU-ILE-SER-PHE-GLY-ALA-PHE-VAL-ALA-LYS-HIS-LEU-LYS-THR-ILE-ASN-GLN-GLU-SER-CYS-ILE-GLU-PRO-LEU-ALA-GLU-SER-ILE-THR-ASP-VAL-LEU-VAL-ARG-THR-LYS-ARG-ASP-TRP-LEU-VAL-LYS-GLN-ARG-GLY-TRP-ASP-GLY-PHE-VAL-GLU-PHE-PHE-HIS-VAL,ACE-ILE-TRP-NLE-MK8-GLN-GLU-LEU-MK8-ARG-LEU-GLY-ASP-GLU-ILE-ASN-ALA-ARG-TYR-ALA-ARG-NH2,151,22,,IC50=25nM,7.60206,7.6,1,A,A,0,A,A,0,,B,A,,1,1,151,22,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,0.9784173369407654,0.7967168092727661,94.09025573730467,88.3935546875,0.3578673303127289,0.7602173686027527,0.9268165230751038,0.8576363325119019,0.9182181358337402,0.7814869284629822,IWLLQELLRLGDEINARYAR,Moderate,"(7.523, 7.921]",val
5WGG,protein-peptide,A3DDW1 A3DDW2,SNAMAMIHKFSMMGTNIVVDVNSGAVHVVDDISFDILDYYKNFTAGEIKNKLAHKYNADEIDEALREIESLEAEGLLFSEDPYKEYVSSMDRKSVVKALCLHISHDCNLRCKYCFASTGNFGGQRNMMSLEVGKKAIDFLISESGNRKNLEIDFFGGEPMMNFDVVKGIIEYARQKEKEHNKNFRFTLTTNGLLLNDENIKYINENMQNIVLSIDGRKEVNDRMRIRIDGSGCYDDILPKFKYVAESRNQDNYYVRGTFTRENMDFSNDVLHLADEGFRQISVEPVVAAKDSGYDLREEDLPRLFEEYEKLAYEYVKRRKEGNWFNFFHFMIDLTQGPCIVKRLTGCGSGHEYLAVTPEGDIYPCHQFVGNEKFKMGNVKEGVLNRDIQNYFKNSNVYTKKECDSCWAKFYCSGGCAANSYNFHKDINTVYKVGCELEKKRVECALWIKAQEM,MKHIKILNGSTLKDSLKKGGC,SER-ASN-ALA-MET-ALA-MET-ILE-HIS-LYS-PHE-SER-MET-MET-GLY-THR-ASN-ILE-VAL-VAL-ASP-VAL-ASN-SER-GLY-ALA-VAL-HIS-VAL-VAL-ASP-ASP-ILE-SER-PHE-ASP-ILE-LEU-ASP-TYR-TYR-LYS-ASN-PHE-THR-ALA-GLY-GLU-ILE-LYS-ASN-LYS-LEU-ALA-HIS-LYS-TYR-ASN-ALA-ASP-GLU-ILE-ASP-GLU-ALA-LEU-ARG-GLU-ILE-GLU-SER-LEU-GLU-ALA-GLU-GLY-LEU-LEU-PHE-SER-GLU-ASP-PRO-TYR-LYS-GLU-TYR-VAL-SER-SER-MET-ASP-ARG-LYS-SER-VAL-VAL-LYS-ALA-LEU-CYS-LEU-HIS-ILE-SER-HIS-ASP-CYS-ASN-LEU-ARG-CYS-LYS-TYR-CYS-PHE-ALA-SER-THR-GLY-ASN-PHE-GLY-GLY-GLN-ARG-ASN-MET-MET-SER-LEU-GLU-VAL-GLY-LYS-LYS-ALA-ILE-ASP-PHE-LEU-ILE-SER-GLU-SER-GLY-ASN-ARG-LYS-ASN-LEU-GLU-ILE-ASP-PHE-PHE-GLY-GLY-GLU-PRO-MET-MET-ASN-PHE-ASP-VAL-VAL-LYS-GLY-ILE-ILE-GLU-TYR-ALA-ARG-GLN-LYS-GLU-LYS-GLU-HIS-ASN-LYS-ASN-PHE-ARG-PHE-THR-LEU-THR-THR-ASN-GLY-LEU-LEU-LEU-ASN-ASP-GLU-ASN-ILE-LYS-TYR-ILE-ASN-GLU-ASN-MET-GLN-ASN-ILE-VAL-LEU-SER-ILE-ASP-GLY-ARG-LYS-GLU-VAL-ASN-ASP-ARG-MET-ARG-ILE-ARG-ILE-ASP-GLY-SER-GLY-CYS-TYR-ASP-ASP-ILE-LEU-PRO-LYS-PHE-LYS-TYR-VAL-ALA-GLU-SER-ARG-ASN-GLN-ASP-ASN-TYR-TYR-VAL-ARG-GLY-THR-PHE-THR-ARG-GLU-ASN-MET-ASP-PHE-SER-ASN-ASP-VAL-LEU-HIS-LEU-ALA-ASP-GLU-GLY-PHE-ARG-GLN-ILE-SER-VAL-GLU-PRO-VAL-VAL-ALA-ALA-LYS-ASP-SER-GLY-TYR-ASP-LEU-ARG-GLU-GLU-ASP-LEU-PRO-ARG-LEU-PHE-GLU-GLU-TYR-GLU-LYS-LEU-ALA-TYR-GLU-TYR-VAL-LYS-ARG-ARG-LYS-GLU-GLY-ASN-TRP-PHE-ASN-PHE-PHE-HIS-PHE-MET-ILE-ASP-LEU-THR-GLN-GLY-PRO-CYS-ILE-VAL-LYS-ARG-LEU-THR-GLY-CYS-GLY-SER-GLY-HIS-GLU-TYR-LEU-ALA-VAL-THR-PRO-GLU-GLY-ASP-ILE-TYR-PRO-CYS-HIS-GLN-PHE-VAL-GLY-ASN-GLU-LYS-PHE-LYS-MET-GLY-ASN-VAL-LYS-GLU-GLY-VAL-LEU-ASN-ARG-ASP-ILE-GLN-ASN-TYR-PHE-LYS-ASN-SER-ASN-VAL-TYR-THR-LYS-LYS-GLU-CYS-ASP-SER-CYS-TRP-ALA-LYS-PHE-TYR-CYS-SER-GLY-GLY-CYS-ALA-ALA-ASN-SER-TYR-ASN-PHE-HIS-LYS-ASP-ILE-ASN-THR-VAL-TYR-LYS-VAL-GLY-CYS-GLU-LEU-GLU-LYS-LYS-ARG-VAL-GLU-CYS-ALA-LEU-TRP-ILE-LYS-ALA-GLN-GLU-MET,MET-LYS-HIS-ILE-LYS-ILE-LEU-ASN-GLY-SER-THR-LEU-LYS-ASP-SER-LEU-LYS-LYS-GLY-GLY-CYS,453,21,,Kd=0.7uM,6.154902,6.15,1,A,A,0,A,A,0,,B,A,,1,1,453,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CS)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CS)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O,0.7435672879219055,0.7333096265792847,79.9863510131836,80.00584411621094,0.5727242231369019,1.0369491577148438,0.8792181015014648,0.8527876138687134,0.6819646954536438,0.7034400701522827,MKHIKILNGSTLKDSLKKGGC,Low,"(6.097, 6.26]",val
5WOS,protein-peptide,O43521 Q6VZT9,GPLGSMDPSVKKDEIYYTILNIIQNYFIEYCTGKNRNFHVEDENTYIIVKNMCDIILRDNIVEFRKDIDRCSDIENEIPEIVYDTIHDKITWGRVISIIAFGAYVTKVFKEKGRDNVVDLMPDIITESLLSRCRSWLSDQNCWDGLKA,DMRPEIWIAQELRRIGDEFNAYYARR,GLY-PRO-LEU-GLY-SER-MET-ASP-PRO-SER-VAL-LYS-LYS-ASP-GLU-ILE-TYR-TYR-THR-ILE-LEU-ASN-ILE-ILE-GLN-ASN-TYR-PHE-ILE-GLU-TYR-CYS-THR-GLY-LYS-ASN-ARG-ASN-PHE-HIS-VAL-GLU-ASP-GLU-ASN-THR-TYR-ILE-ILE-VAL-LYS-ASN-MET-CYS-ASP-ILE-ILE-LEU-ARG-ASP-ASN-ILE-VAL-GLU-PHE-ARG-LYS-ASP-ILE-ASP-ARG-CYS-SER-ASP-ILE-GLU-ASN-GLU-ILE-PRO-GLU-ILE-VAL-TYR-ASP-THR-ILE-HIS-ASP-LYS-ILE-THR-TRP-GLY-ARG-VAL-ILE-SER-ILE-ILE-ALA-PHE-GLY-ALA-TYR-VAL-THR-LYS-VAL-PHE-LYS-GLU-LYS-GLY-ARG-ASP-ASN-VAL-VAL-ASP-LEU-MET-PRO-ASP-ILE-ILE-THR-GLU-SER-LEU-LEU-SER-ARG-CYS-ARG-SER-TRP-LEU-SER-ASP-GLN-ASN-CYS-TRP-ASP-GLY-LEU-LYS-ALA,ASP-MET-ARG-PRO-GLU-ILE-TRP-ILE-ALA-GLN-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-PHE-ASN-ALA-TYR-TYR-ALA-ARG-ARG,148,26,,Kd=353nM,6.452225,6.45,1,A,A,0,A,A,0,,B,A,,1,1,148,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,1.003883719444275,0.5436506271362305,89.51629638671875,80.43600463867188,0.3313234746456146,1.2331457138061523,0.9347512125968932,0.6778641939163208,0.9421437978744508,0.5100972652435303,DMRPEIWIAQELRRIGDEFNAYYARR,Low,"(6.398, 6.523]",train
5WUJ,protein-peptide,O25119 O25118,PKQKAQLDELSMSEKIAILLIQVGEDTTGEILRHLDIDSITEISKQIVQLNGTDKQIGAAVLEEFFAIFQSNQYINTGGLEYARELLTRTLGSEEAKKVMDKLTK,FSEEEVRYEIILEKIRGTLKERPDEIAMLFKLLIKDE,PRO-LYS-GLN-LYS-ALA-GLN-LEU-ASP-GLU-LEU-SER-MET-SER-GLU-LYS-ILE-ALA-ILE-LEU-LEU-ILE-GLN-VAL-GLY-GLU-ASP-THR-THR-GLY-GLU-ILE-LEU-ARG-HIS-LEU-ASP-ILE-ASP-SER-ILE-THR-GLU-ILE-SER-LYS-GLN-ILE-VAL-GLN-LEU-ASN-GLY-THR-ASP-LYS-GLN-ILE-GLY-ALA-ALA-VAL-LEU-GLU-GLU-PHE-PHE-ALA-ILE-PHE-GLN-SER-ASN-GLN-TYR-ILE-ASN-THR-GLY-GLY-LEU-GLU-TYR-ALA-ARG-GLU-LEU-LEU-THR-ARG-THR-LEU-GLY-SER-GLU-GLU-ALA-LYS-LYS-VAL-MET-ASP-LYS-LEU-THR-LYS,PHE-SER-GLU-GLU-GLU-VAL-ARG-TYR-GLU-ILE-ILE-LEU-GLU-LYS-ILE-ARG-GLY-THR-LEU-LYS-GLU-ARG-PRO-ASP-GLU-ILE-ALA-MET-LEU-PHE-LYS-LEU-LEU-ILE-LYS-ASP-GLU,105,37,,Kd=422nM,6.374688,6.37,1,A,A,0,A,A,0,,A,B,,1,1,105,37,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9389323592185974,0.4913403689861297,91.6925277709961,54.53615188598633,0.3822162449359894,1.486553430557251,0.8788111805915833,0.5486586093902588,0.9011457562446594,0.4770107865333557,FSEEEVRYEIILEKIRGTLKERPDEIAMLFKLLIKDE,Low,"(6.26, 6.398]",train
5WY2,protein-peptide,Q9Y5X3 B7SCI5,GGSVSVDLNVDPSLQIDIPDALSERDKVKFTVHTKTTLSTFQSPEFSVTRQHEDFVWLHDTLTETTDYAGLIIPPAPTKPDFDGPREKMQKLGEGEGSMTKEEFAKMKQELEAEYLAVFKKTVSTHEVFLQRLSSHPVLSKDRNFHVFLEYDQDLSVRRKNTK,GPAVQFFKGKNGSADQVILVT,GLY-GLY-SER-VAL-SER-VAL-ASP-LEU-ASN-VAL-ASP-PRO-SER-LEU-GLN-ILE-ASP-ILE-PRO-ASP-ALA-LEU-SER-GLU-ARG-ASP-LYS-VAL-LYS-PHE-THR-VAL-HIS-THR-LYS-THR-THR-LEU-SER-THR-PHE-GLN-SER-PRO-GLU-PHE-SER-VAL-THR-ARG-GLN-HIS-GLU-ASP-PHE-VAL-TRP-LEU-HIS-ASP-THR-LEU-THR-GLU-THR-THR-ASP-TYR-ALA-GLY-LEU-ILE-ILE-PRO-PRO-ALA-PRO-THR-LYS-PRO-ASP-PHE-ASP-GLY-PRO-ARG-GLU-LYS-MET-GLN-LYS-LEU-GLY-GLU-GLY-GLU-GLY-SER-MET-THR-LYS-GLU-GLU-PHE-ALA-LYS-MET-LYS-GLN-GLU-LEU-GLU-ALA-GLU-TYR-LEU-ALA-VAL-PHE-LYS-LYS-THR-VAL-SER-THR-HIS-GLU-VAL-PHE-LEU-GLN-ARG-LEU-SER-SER-HIS-PRO-VAL-LEU-SER-LYS-ASP-ARG-ASN-PHE-HIS-VAL-PHE-LEU-GLU-TYR-ASP-GLN-ASP-LEU-SER-VAL-ARG-ARG-LYS-ASN-THR-LYS,GLY-PRO-ALA-VAL-GLN-PHE-PHE-LYS-GLY-LYS-ASN-GLY-SER-ALA-ASP-GLN-VAL-ILE-LEU-VAL-THR,163,21,,Kd=0.54uM,6.267606,6.27,1,A,A,0,A,A,0,,B,A,,1,1,163,21,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,0.9095790386199952,0.7549750208854675,84.14397430419922,82.65755462646484,0.4358747601509094,0.8372958302497864,0.8650726079940796,0.8152126669883728,0.8391839265823364,0.7399156093597412,GPAVQFFKGKNGSADQVILVT,Low,"(6.26, 6.398]",train
5XCO,protein-peptide,P01116,GSMTEYKLVVVGADGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETCLLDILDTAGQEEYSAMRDQYMRTGEGFLCVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKCDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK,RRRRCPLYISYDPVCRRRR,GLY-SER-MET-THR-GLU-TYR-LYS-LEU-VAL-VAL-VAL-GLY-ALA-ASP-GLY-VAL-GLY-LYS-SER-ALA-LEU-THR-ILE-GLN-LEU-ILE-GLN-ASN-HIS-PHE-VAL-ASP-GLU-TYR-ASP-PRO-THR-ILE-GLU-ASP-SER-TYR-ARG-LYS-GLN-VAL-VAL-ILE-ASP-GLY-GLU-THR-CYS-LEU-LEU-ASP-ILE-LEU-ASP-THR-ALA-GLY-GLN-GLU-GLU-TYR-SER-ALA-MET-ARG-ASP-GLN-TYR-MET-ARG-THR-GLY-GLU-GLY-PHE-LEU-CYS-VAL-PHE-ALA-ILE-ASN-ASN-THR-LYS-SER-PHE-GLU-ASP-ILE-HIS-HIS-TYR-ARG-GLU-GLN-ILE-LYS-ARG-VAL-LYS-ASP-SER-GLU-ASP-VAL-PRO-MET-VAL-LEU-VAL-GLY-ASN-LYS-CYS-ASP-LEU-PRO-SER-ARG-THR-VAL-ASP-THR-LYS-GLN-ALA-GLN-ASP-LEU-ALA-ARG-SER-TYR-GLY-ILE-PRO-PHE-ILE-GLU-THR-SER-ALA-LYS-THR-ARG-GLN-GLY-VAL-ASP-ASP-ALA-PHE-TYR-THR-LEU-VAL-ARG-GLU-ILE-ARG-LYS-HIS-LYS-GLU-LYS,ACE-ARG-ARG-ARG-ARG-CYS-PRO-LEU-TYR-ILE-SER-TYR-ASP-PRO-VAL-CYS-ARG-ARG-ARG-ARG-NH2,171,21,,Kd=8.9nM,8.05061,8.05,1,A,A,0,A,A,0,,B,A,,1,1,171,21,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.7970908284187317,0.7474854588508606,82.21558380126953,85.86201477050781,0.4119554758071899,0.80991530418396,0.910126805305481,0.8333438634872437,0.7096213102340698,0.726020872592926,RRRRCPLYISYDPVCRRRR,Moderate,"(7.921, 8.383]",train
5XOD,protein-peptide,P12755 Q15796,GPDLQPVTYSEPAFWCSIAYYELNQRVGETFHASQPSLTVDGFTDPSNSERFCLGLLSNVNRNATVEMTRRHIGRGVRLYYIGGEVFAECLSDSAIFVQSPNCNQRYGWHPATVCKIPPGCNLKIFNNQEFAALLAQSVNQGFEAVYQLTRMCTIRMSFVKGWGAEYRRQTVTSTPCWIELHLNGPLQWLDKVLTQMGS,GPGLQKTLEQFHLSSMSSLGGPAAFSASDED,GLY-PRO-ASP-LEU-GLN-PRO-VAL-THR-TYR-SER-GLU-PRO-ALA-PHE-TRP-CYS-SER-ILE-ALA-TYR-TYR-GLU-LEU-ASN-GLN-ARG-VAL-GLY-GLU-THR-PHE-HIS-ALA-SER-GLN-PRO-SER-LEU-THR-VAL-ASP-GLY-PHE-THR-ASP-PRO-SER-ASN-SER-GLU-ARG-PHE-CYS-LEU-GLY-LEU-LEU-SER-ASN-VAL-ASN-ARG-ASN-ALA-THR-VAL-GLU-MET-THR-ARG-ARG-HIS-ILE-GLY-ARG-GLY-VAL-ARG-LEU-TYR-TYR-ILE-GLY-GLY-GLU-VAL-PHE-ALA-GLU-CYS-LEU-SER-ASP-SER-ALA-ILE-PHE-VAL-GLN-SER-PRO-ASN-CYS-ASN-GLN-ARG-TYR-GLY-TRP-HIS-PRO-ALA-THR-VAL-CYS-LYS-ILE-PRO-PRO-GLY-CYS-ASN-LEU-LYS-ILE-PHE-ASN-ASN-GLN-GLU-PHE-ALA-ALA-LEU-LEU-ALA-GLN-SER-VAL-ASN-GLN-GLY-PHE-GLU-ALA-VAL-TYR-GLN-LEU-THR-ARG-MET-CYS-THR-ILE-ARG-MET-SER-PHE-VAL-LYS-GLY-TRP-GLY-ALA-GLU-TYR-ARG-ARG-GLN-THR-VAL-THR-SER-THR-PRO-CYS-TRP-ILE-GLU-LEU-HIS-LEU-ASN-GLY-PRO-LEU-GLN-TRP-LEU-ASP-LYS-VAL-LEU-THR-GLN-MET-GLY-SER,GLY-PRO-GLY-LEU-GLN-LYS-THR-LEU-GLU-GLN-PHE-HIS-LEU-SER-SER-MET-SER-SER-LEU-GLY-GLY-PRO-ALA-ALA-PHE-SER-ALA-SER-ASP-GLU-ASP,199,31,,Kd=28.1nM,7.551294,7.55,1,A,A,0,A,A,0,,B,A,,1,1,199,31,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8947129249572754,0.7468235492706299,85.77824401855469,89.39017486572266,0.3974286913871765,0.829535186290741,0.915497362613678,0.8308098316192627,0.8052776455879211,0.7258269786834717,GPGLQKTLEQFHLSSMSSLGGPAAFSASDED,Moderate,"(7.523, 7.921]",val
5XSQ,protein-peptide,Q6UY68 Q6UY69,VRNKKVILFDTNHQVSICNQIIDAINSGIDLGDLLEGGLLTLCVEHYYNSDKDKFNTSPIAKYLRDAGYEFDVIKNADATRFLDVIPNEPHYSPLILALKTLESTESQRGRIGLFLSFCSLFLPKLVVGDRASIEKALRQVTVHQEQGIVTYPNHWLTTGHMKVIFGILRSSFILKFVLIHQGVNLVTGHDAYDSIISNSVGQTRFSGLLIVKTVLEFILQKTDSGVTLHPLVRTSKVKNEVASFKQALSNLARHGEYAPFARVLNLSGINNLEHGLYPQLSAIALGVATAHGSTLAGVNVGEQYQQLREAAHDAEVKLQRRHEHQE,MWDSSYMQQVSEGLMTGKVPIDQVFGAN,VAL-ARG-ASN-LYS-LYS-VAL-ILE-LEU-PHE-ASP-THR-ASN-HIS-GLN-VAL-SER-ILE-CYS-ASN-GLN-ILE-ILE-ASP-ALA-ILE-ASN-SER-GLY-ILE-ASP-LEU-GLY-ASP-LEU-LEU-GLU-GLY-GLY-LEU-LEU-THR-LEU-CYS-VAL-GLU-HIS-TYR-TYR-ASN-SER-ASP-LYS-ASP-LYS-PHE-ASN-THR-SER-PRO-ILE-ALA-LYS-TYR-LEU-ARG-ASP-ALA-GLY-TYR-GLU-PHE-ASP-VAL-ILE-LYS-ASN-ALA-ASP-ALA-THR-ARG-PHE-LEU-ASP-VAL-ILE-PRO-ASN-GLU-PRO-HIS-TYR-SER-PRO-LEU-ILE-LEU-ALA-LEU-LYS-THR-LEU-GLU-SER-THR-GLU-SER-GLN-ARG-GLY-ARG-ILE-GLY-LEU-PHE-LEU-SER-PHE-CYS-SER-LEU-PHE-LEU-PRO-LYS-LEU-VAL-VAL-GLY-ASP-ARG-ALA-SER-ILE-GLU-LYS-ALA-LEU-ARG-GLN-VAL-THR-VAL-HIS-GLN-GLU-GLN-GLY-ILE-VAL-THR-TYR-PRO-ASN-HIS-TRP-LEU-THR-THR-GLY-HIS-MET-LYS-VAL-ILE-PHE-GLY-ILE-LEU-ARG-SER-SER-PHE-ILE-LEU-LYS-PHE-VAL-LEU-ILE-HIS-GLN-GLY-VAL-ASN-LEU-VAL-THR-GLY-HIS-ASP-ALA-TYR-ASP-SER-ILE-ILE-SER-ASN-SER-VAL-GLY-GLN-THR-ARG-PHE-SER-GLY-LEU-LEU-ILE-VAL-LYS-THR-VAL-LEU-GLU-PHE-ILE-LEU-GLN-LYS-THR-ASP-SER-GLY-VAL-THR-LEU-HIS-PRO-LEU-VAL-ARG-THR-SER-LYS-VAL-LYS-ASN-GLU-VAL-ALA-SER-PHE-LYS-GLN-ALA-LEU-SER-ASN-LEU-ALA-ARG-HIS-GLY-GLU-TYR-ALA-PRO-PHE-ALA-ARG-VAL-LEU-ASN-LEU-SER-GLY-ILE-ASN-ASN-LEU-GLU-HIS-GLY-LEU-TYR-PRO-GLN-LEU-SER-ALA-ILE-ALA-LEU-GLY-VAL-ALA-THR-ALA-HIS-GLY-SER-THR-LEU-ALA-GLY-VAL-ASN-VAL-GLY-GLU-GLN-TYR-GLN-GLN-LEU-ARG-GLU-ALA-ALA-HIS-ASP-ALA-GLU-VAL-LYS-LEU-GLN-ARG-ARG-HIS-GLU-HIS-GLN-GLU,MET-TRP-ASP-SER-SER-TYR-MET-GLN-GLN-VAL-SER-GLU-GLY-LEU-MET-THR-GLY-LYS-VAL-PRO-ILE-ASP-GLN-VAL-PHE-GLY-ALA-ASN,327,28,,Kd=7.35nM,8.133713,8.13,1,A,A,0,A,A,0,,B,A,,1,1,327,28,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCSC)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)O,0.7950082421302795,0.6430149078369141,61.18441009521485,42.88657379150391,0.8093302845954895,1.331592679023743,0.7613261342048645,0.7062811851501465,0.7928653359413147,0.6271982789039612,MWDSSYMQQVSEGLMTGKVPIDQVFGAN,Moderate,"(7.921, 8.383]",train
5YI8,protein-peptide,P16554 Q9W4I7,GSKPHQWQADEEAVRSATCSFSVKYLGCVEVFESRGMQVCEEALKVLRQSRRRPVRGLLHVSGDGLRVVDDETKGLIVDQTIEKVSFCAPDRNHERGFSYICRDGTTRRWMCHGFLACKDSGERLSHAVGCAFAVCLERKQ,KKKKREHACFENPGLNLELPEKQFNPYEVVRSA,GLY-SER-LYS-PRO-HIS-GLN-TRP-GLN-ALA-ASP-GLU-GLU-ALA-VAL-ARG-SER-ALA-THR-CYS-SER-PHE-SER-VAL-LYS-TYR-LEU-GLY-CYS-VAL-GLU-VAL-PHE-GLU-SER-ARG-GLY-MET-GLN-VAL-CYS-GLU-GLU-ALA-LEU-LYS-VAL-LEU-ARG-GLN-SER-ARG-ARG-ARG-PRO-VAL-ARG-GLY-LEU-LEU-HIS-VAL-SER-GLY-ASP-GLY-LEU-ARG-VAL-VAL-ASP-ASP-GLU-THR-LYS-GLY-LEU-ILE-VAL-ASP-GLN-THR-ILE-GLU-LYS-VAL-SER-PHE-CYS-ALA-PRO-ASP-ARG-ASN-HIS-GLU-ARG-GLY-PHE-SER-TYR-ILE-CYS-ARG-ASP-GLY-THR-THR-ARG-ARG-TRP-MET-CYS-HIS-GLY-PHE-LEU-ALA-CYS-LYS-ASP-SER-GLY-GLU-ARG-LEU-SER-HIS-ALA-VAL-GLY-CYS-ALA-PHE-ALA-VAL-CYS-LEU-GLU-ARG-LYS-GLN,LYS-LYS-LYS-LYS-ARG-GLU-HIS-ALA-CYS-PHE-GLU-ASN-PRO-GLY-LEU-ASN-LEU-GLU-LEU-PRO-GLU-LYS-GLN-PHE-ASN-PRO-TYR-GLU-VAL-VAL-ARG-SER-ALA,141,33,,Kd=1.8uM,5.744727,5.74,1,A,A,0,A,A,0,,B,A,,1,1,141,33,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,0.9702861309051514,0.6356299519538879,82.70013427734375,81.333251953125,0.3984517753124237,0.973860800266266,0.8991777896881104,0.7262630462646484,0.8695287108421326,0.6129716634750366,KKKKREHACFENPGLNLELPEKQFNPYEVVRSA,Low,"(5.699, 5.821]",train
5YIP,protein-peptide,O70511 Q8R3R8,GPGSEFMKFQYKEDHPFEYRKKEGEKIRKKYPDRVPVIVEKAPKARVPDLDKRKYLVPSDLTVGQFYFLIRKRIHLRPEDALFFFVNNTIPPTSATMGQLYEDNHEEDYFLYVAYSDESVYGK,PEDDWTEFSSEEIREARQAAASHAPS,GLY-PRO-GLY-SER-GLU-PHE-MET-LYS-PHE-GLN-TYR-LYS-GLU-ASP-HIS-PRO-PHE-GLU-TYR-ARG-LYS-LYS-GLU-GLY-GLU-LYS-ILE-ARG-LYS-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-ALA-ARG-VAL-PRO-ASP-LEU-ASP-LYS-ARG-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-HIS-LEU-ARG-PRO-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-THR-ILE-PRO-PRO-THR-SER-ALA-THR-MET-GLY-GLN-LEU-TYR-GLU-ASP-ASN-HIS-GLU-GLU-ASP-TYR-PHE-LEU-TYR-VAL-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR-GLY-LYS,PRO-GLU-ASP-ASP-TRP-THR-GLU-PHE-SER-SER-GLU-GLU-ILE-ARG-GLU-ALA-ARG-GLN-ALA-ALA-ALA-SER-HIS-ALA-PRO-SER,123,26,,Kd=3.7nM,8.431798,8.43,1,A,A,0,A,A,0,,B,A,,1,1,123,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,0.9758446216583252,0.7537941932678223,91.773681640625,86.81452178955078,0.3500424325466156,0.8057739734649658,0.9206819534301758,0.8150164484977722,0.8805748820304871,0.7384886741638184,PEDDWTEFSSEEIREARQAAASHAPS,Moderate,"(8.383, 8.824]",train
5YQZ,protein-peptide,P00720 P01275,GAPQVMDFLFEKWKLYGDQCHHNLSLLPPPTELVCNRTFDKYSCWPDTPANTTANISCPWYLPWHHKVQHRFVFKRCGPDGQWVRGPRGQPWRDASQCQMDGEEIEVQKEVAKMYSSFQVMYTVGYSLSLGALLLALAILGGLSKLHCTANAIHANLFASFVLKASSVLVIDGLLRTRYSQKIGDDLSVSTWLSDGAVAGCRVAAVFMQYGIVANYCWLLVEGLYLHNLLGLATNIFEMLRIDEGLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAIGRNTNGVITKDEAEKLFNQDVDAAVRGILRNAKLKPVYDSLDAVRRAALINMVFQMGETGVAGFTNSLRMLQQKRWDEAAVNLAKSRWYNQTPNRAKRVITTFRTGTWDAYERSFFSLYLGIGWGAPMLFVVPWAVVKCLFENVQCWTSNDNMGFWWILRFPVFLAILINFFIFVRIVQLLVAKLRARQMHHTDYKFRLAKSTLTLIPLLGVHEVVFAFVTDEHAQGTLRSAKLFFDLFLSSFQGLLVAVLYCFLNKEVQSELRRRWHRWRLGKVLWEERNTSNEFLEVLFQ,SQGTFTSEYSKYLDSRRAQDFVKWLLNT,GLY-ALA-PRO-GLN-VAL-MET-ASP-PHE-LEU-PHE-GLU-LYS-TRP-LYS-LEU-TYR-GLY-ASP-GLN-CYS-HIS-HIS-ASN-LEU-SER-LEU-LEU-PRO-PRO-PRO-THR-GLU-LEU-VAL-CYS-ASN-ARG-THR-PHE-ASP-LYS-TYR-SER-CYS-TRP-PRO-ASP-THR-PRO-ALA-ASN-THR-THR-ALA-ASN-ILE-SER-CYS-PRO-TRP-TYR-LEU-PRO-TRP-HIS-HIS-LYS-VAL-GLN-HIS-ARG-PHE-VAL-PHE-LYS-ARG-CYS-GLY-PRO-ASP-GLY-GLN-TRP-VAL-ARG-GLY-PRO-ARG-GLY-GLN-PRO-TRP-ARG-ASP-ALA-SER-GLN-CYS-GLN-MET-ASP-GLY-GLU-GLU-ILE-GLU-VAL-GLN-LYS-GLU-VAL-ALA-LYS-MET-TYR-SER-SER-PHE-GLN-VAL-MET-TYR-THR-VAL-GLY-TYR-SER-LEU-SER-LEU-GLY-ALA-LEU-LEU-LEU-ALA-LEU-ALA-ILE-LEU-GLY-GLY-LEU-SER-LYS-LEU-HIS-CYS-THR-ALA-ASN-ALA-ILE-HIS-ALA-ASN-LEU-PHE-ALA-SER-PHE-VAL-LEU-LYS-ALA-SER-SER-VAL-LEU-VAL-ILE-ASP-GLY-LEU-LEU-ARG-THR-ARG-TYR-SER-GLN-LYS-ILE-GLY-ASP-ASP-LEU-SER-VAL-SER-THR-TRP-LEU-SER-ASP-GLY-ALA-VAL-ALA-GLY-CYS-ARG-VAL-ALA-ALA-VAL-PHE-MET-GLN-TYR-GLY-ILE-VAL-ALA-ASN-TYR-CYS-TRP-LEU-LEU-VAL-GLU-GLY-LEU-TYR-LEU-HIS-ASN-LEU-LEU-GLY-LEU-ALA-THR-ASN-ILE-PHE-GLU-MET-LEU-ARG-ILE-ASP-GLU-GLY-LEU-ARG-LEU-LYS-ILE-TYR-LYS-ASP-THR-GLU-GLY-TYR-TYR-THR-ILE-GLY-ILE-GLY-HIS-LEU-LEU-THR-LYS-SER-PRO-SER-LEU-ASN-ALA-ALA-LYS-SER-GLU-LEU-ASP-LYS-ALA-ILE-GLY-ARG-ASN-THR-ASN-GLY-VAL-ILE-THR-LYS-ASP-GLU-ALA-GLU-LYS-LEU-PHE-ASN-GLN-ASP-VAL-ASP-ALA-ALA-VAL-ARG-GLY-ILE-LEU-ARG-ASN-ALA-LYS-LEU-LYS-PRO-VAL-TYR-ASP-SER-LEU-ASP-ALA-VAL-ARG-ARG-ALA-ALA-LEU-ILE-ASN-MET-VAL-PHE-GLN-MET-GLY-GLU-THR-GLY-VAL-ALA-GLY-PHE-THR-ASN-SER-LEU-ARG-MET-LEU-GLN-GLN-LYS-ARG-TRP-ASP-GLU-ALA-ALA-VAL-ASN-LEU-ALA-LYS-SER-ARG-TRP-TYR-ASN-GLN-THR-PRO-ASN-ARG-ALA-LYS-ARG-VAL-ILE-THR-THR-PHE-ARG-THR-GLY-THR-TRP-ASP-ALA-TYR-GLU-ARG-SER-PHE-PHE-SER-LEU-TYR-LEU-GLY-ILE-GLY-TRP-GLY-ALA-PRO-MET-LEU-PHE-VAL-VAL-PRO-TRP-ALA-VAL-VAL-LYS-CYS-LEU-PHE-GLU-ASN-VAL-GLN-CYS-TRP-THR-SER-ASN-ASP-ASN-MET-GLY-PHE-TRP-TRP-ILE-LEU-ARG-PHE-PRO-VAL-PHE-LEU-ALA-ILE-LEU-ILE-ASN-PHE-PHE-ILE-PHE-VAL-ARG-ILE-VAL-GLN-LEU-LEU-VAL-ALA-LYS-LEU-ARG-ALA-ARG-GLN-MET-HIS-HIS-THR-ASP-TYR-LYS-PHE-ARG-LEU-ALA-LYS-SER-THR-LEU-THR-LEU-ILE-PRO-LEU-LEU-GLY-VAL-HIS-GLU-VAL-VAL-PHE-ALA-PHE-VAL-THR-ASP-GLU-HIS-ALA-GLN-GLY-THR-LEU-ARG-SER-ALA-LYS-LEU-PHE-PHE-ASP-LEU-PHE-LEU-SER-SER-PHE-GLN-GLY-LEU-LEU-VAL-ALA-VAL-LEU-TYR-CYS-PHE-LEU-ASN-LYS-GLU-VAL-GLN-SER-GLU-LEU-ARG-ARG-ARG-TRP-HIS-ARG-TRP-ARG-LEU-GLY-LYS-VAL-LEU-TRP-GLU-GLU-ARG-ASN-THR-SER-ASN-GLU-PHE-LEU-GLU-VAL-LEU-PHE-GLN,SER-GLN-GLY-THR-PHE-THR-SER-GLU-TYR-SER-LYS-TYR-LEU-ASP-SER-ARG-ARG-ALA-GLN-ASP-PHE-VAL-LYS-TRP-LEU-LEU-ASN-THR,575,28,,IC50=8.1nM,8.091515,8.09,1,A,A,0,A,A,0,,P,R,,1,1,575,28,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8628761172294617,0.6395663022994995,57.336952209472656,50.5926628112793,0.5858634114265442,1.6471256017684937,0.7690282464027405,0.7200682759284973,0.8583529591560364,0.6042234301567078,SQGTFTSEYSKYLDSRRAQDFVKWLLNT,Moderate,"(7.921, 8.383]",train
6AAF,protein-peptide,O94272 Q09906,GPHMRSQFKDDFSFEKRKTESQRIREKYPDRIPVICEKVDKSDIAAIDKKKYLVPSDLTVGQFVYVIRKRIKLSPEKAIFIFIDEILPPTAALMSTIYEEHKSEDGFLYITYSGENTFG,MLQFEIDDEMEPLYNQAKQMRYGDYLEVLFQ,GLY-PRO-HIS-MET-ARG-SER-GLN-PHE-LYS-ASP-ASP-PHE-SER-PHE-GLU-LYS-ARG-LYS-THR-GLU-SER-GLN-ARG-ILE-ARG-GLU-LYS-TYR-PRO-ASP-ARG-ILE-PRO-VAL-ILE-CYS-GLU-LYS-VAL-ASP-LYS-SER-ASP-ILE-ALA-ALA-ILE-ASP-LYS-LYS-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-VAL-TYR-VAL-ILE-ARG-LYS-ARG-ILE-LYS-LEU-SER-PRO-GLU-LYS-ALA-ILE-PHE-ILE-PHE-ILE-ASP-GLU-ILE-LEU-PRO-PRO-THR-ALA-ALA-LEU-MET-SER-THR-ILE-TYR-GLU-GLU-HIS-LYS-SER-GLU-ASP-GLY-PHE-LEU-TYR-ILE-THR-TYR-SER-GLY-GLU-ASN-THR-PHE-GLY,MET-LEU-GLN-PHE-GLU-ILE-ASP-ASP-GLU-MET-GLU-PRO-LEU-TYR-ASN-GLN-ALA-LYS-GLN-MET-ARG-TYR-GLY-ASP-TYR-LEU-GLU-VAL-LEU-PHE-GLN,119,31,,Kd=161nM,6.793174,6.79,1,A,A,0,A,A,0,,B,A,,1,1,119,31,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.9862405061721802,0.6765590906143188,92.5968246459961,84.80091094970703,0.368923544883728,1.0362313985824585,0.909192681312561,0.7448766827583313,0.8930023908615112,0.6594796776771545,MLQFEIDDEMEPLYNQAKQMRYGDYLEVLFQ,Low,"(6.696, 6.824]",train
6CBP,protein-peptide,Q74448,QVQLVQSGAQMKNPGASVKVSCAPSGYTFTDFYIHWLRQAPGQGLQWMGWMNPQTGRTNTARNFQGRVTMTRDTSIGTAYMELRSLTSDDTAIYYCTTGGWISLYYDSSYYPNFDHWGQGTLLTVSGGSGGGGSGGGGSGGTSALTQPASVSGSPGQSITISCTGTKYDVGSHDLVSWYQQYPGKVPKYMIYEVNKRPSGVSNRFSGSKSGNTASLTISGLRAEDEADYYCCSFGGSATVVCGGGTKVTVHHHHHH,EINCTRPNNNTRPGEIIGDIRQAHCNISRA,GLN-VAL-GLN-LEU-VAL-GLN-SER-GLY-ALA-GLN-MET-LYS-ASN-PRO-GLY-ALA-SER-VAL-LYS-VAL-SER-CYS-ALA-PRO-SER-GLY-TYR-THR-PHE-THR-ASP-PHE-TYR-ILE-HIS-TRP-LEU-ARG-GLN-ALA-PRO-GLY-GLN-GLY-LEU-GLN-TRP-MET-GLY-TRP-MET-ASN-PRO-GLN-THR-GLY-ARG-THR-ASN-THR-ALA-ARG-ASN-PHE-GLN-GLY-ARG-VAL-THR-MET-THR-ARG-ASP-THR-SER-ILE-GLY-THR-ALA-TYR-MET-GLU-LEU-ARG-SER-LEU-THR-SER-ASP-ASP-THR-ALA-ILE-TYR-TYR-CYS-THR-THR-GLY-GLY-TRP-ILE-SER-LEU-TYR-TYR-ASP-SER-SER-TYR-TYR-PRO-ASN-PHE-ASP-HIS-TRP-GLY-GLN-GLY-THR-LEU-LEU-THR-VAL-SER-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-THR-SER-ALA-LEU-THR-GLN-PRO-ALA-SER-VAL-SER-GLY-SER-PRO-GLY-GLN-SER-ILE-THR-ILE-SER-CYS-THR-GLY-THR-LYS-TYR-ASP-VAL-GLY-SER-HIS-ASP-LEU-VAL-SER-TRP-TYR-GLN-GLN-TYR-PRO-GLY-LYS-VAL-PRO-LYS-TYR-MET-ILE-TYR-GLU-VAL-ASN-LYS-ARG-PRO-SER-GLY-VAL-SER-ASN-ARG-PHE-SER-GLY-SER-LYS-SER-GLY-ASN-THR-ALA-SER-LEU-THR-ILE-SER-GLY-LEU-ARG-ALA-GLU-ASP-GLU-ALA-ASP-TYR-TYR-CYS-CYS-SER-PHE-GLY-GLY-SER-ALA-THR-VAL-VAL-CYS-GLY-GLY-GLY-THR-LYS-VAL-THR-VAL-HIS-HIS-HIS-HIS-HIS-HIS,GLU-ILE-ASN-CYS-THR-ARG-PRO-ASN-ASN-ASN-THR-ARG-PRO-GLY-GLU-ILE-ILE-GLY-ASP-ILE-ARG-GLN-ALA-HIS-CYS-ASN-ILE-SER-ARG-ALA,256,30,,Kd=7uM,5.154902,5.15,1,A,A,0,A,A,0,,P,A,,1,1,256,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)O,0.8531690239906311,0.665485143661499,83.3799819946289,83.59748077392578,0.5049612522125244,1.1095008850097656,0.8763913512229919,0.7685850858688354,0.7512096166610718,0.6079718470573425,EINCTRPNNNTRPGEIIGDIRQAHCNISRA,Low,"(5.105, 5.222]",train
6DSL,protein-peptide,,DYKDDDDKMFKLNTKNIKVLTPSGFKSFSGIQKVYKPFYHHIIFDDGSEIKCSDNHSFGKDKIKASTIKVGDYLQGKKVLYNEIVEEGIYLYDLLNVGEDNLYYTNGIVSHACESRGK,EFEALSGDTMIEILDDDGIIQKISMEDLYQRLA,ASP-TYR-LYS-ASP-ASP-ASP-ASP-LYS-MET-PHE-LYS-LEU-ASN-THR-LYS-ASN-ILE-LYS-VAL-LEU-THR-PRO-SER-GLY-PHE-LYS-SER-PHE-SER-GLY-ILE-GLN-LYS-VAL-TYR-LYS-PRO-PHE-TYR-HIS-HIS-ILE-ILE-PHE-ASP-ASP-GLY-SER-GLU-ILE-LYS-CYS-SER-ASP-ASN-HIS-SER-PHE-GLY-LYS-ASP-LYS-ILE-LYS-ALA-SER-THR-ILE-LYS-VAL-GLY-ASP-TYR-LEU-GLN-GLY-LYS-LYS-VAL-LEU-TYR-ASN-GLU-ILE-VAL-GLU-GLU-GLY-ILE-TYR-LEU-TYR-ASP-LEU-LEU-ASN-VAL-GLY-GLU-ASP-ASN-LEU-TYR-TYR-THR-ASN-GLY-ILE-VAL-SER-HIS-ALA-CYS-GLU-SER-ARG-GLY-LYS,GLU-PHE-GLU-ALA-LEU-SER-GLY-ASP-THR-MET-ILE-GLU-ILE-LEU-ASP-ASP-ASP-GLY-ILE-ILE-GLN-LYS-ILE-SER-MET-GLU-ASP-LEU-TYR-GLN-ARG-LEU-ALA,118,33,,Kd=500pM,9.30103,9.3,1,A,A,0,A,A,0,,A,B,,1,1,118,33,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,0.9935490489006042,0.5606971383094788,91.56290435791016,71.46858215332031,0.3654044270515442,1.3857544660568235,0.9027657508850098,0.5980205535888672,0.9210461974143982,0.4878069460391998,EFEALSGDTMIEILDDDGIIQKISMEDLYQRLA,High,"(8.824, 12.12]",train
6G04,protein-peptide,P39938 Q06672,SGSHMSTQYIDETAFVQAEQGKTNLMFSDEKQQARFELGVSMVIYKWDALDVAVENSWGGPDSAEKRDWITGIVVDLFKNEKVVDAALIEETLLYAMIDEFETNVEDDSALPIAVEVINIYNDCFNLNYNKVEKLYLEWQEKQRTKKSKRVVHIEG,SGSQHMRPRFNRENKVSPADAAKKAL,SER-GLY-SER-HIS-MET-SER-THR-GLN-TYR-ILE-ASP-GLU-THR-ALA-PHE-VAL-GLN-ALA-GLU-GLN-GLY-LYS-THR-ASN-LEU-MET-PHE-SER-ASP-GLU-LYS-GLN-GLN-ALA-ARG-PHE-GLU-LEU-GLY-VAL-SER-MET-VAL-ILE-TYR-LYS-TRP-ASP-ALA-LEU-ASP-VAL-ALA-VAL-GLU-ASN-SER-TRP-GLY-GLY-PRO-ASP-SER-ALA-GLU-LYS-ARG-ASP-TRP-ILE-THR-GLY-ILE-VAL-VAL-ASP-LEU-PHE-LYS-ASN-GLU-LYS-VAL-VAL-ASP-ALA-ALA-LEU-ILE-GLU-GLU-THR-LEU-LEU-TYR-ALA-MET-ILE-ASP-GLU-PHE-GLU-THR-ASN-VAL-GLU-ASP-ASP-SER-ALA-LEU-PRO-ILE-ALA-VAL-GLU-VAL-ILE-ASN-ILE-TYR-ASN-ASP-CYS-PHE-ASN-LEU-ASN-TYR-ASN-LYS-VAL-GLU-LYS-LEU-TYR-LEU-GLU-TRP-GLN-GLU-LYS-GLN-ARG-THR-LYS-LYS-SER-LYS-ARG-VAL-VAL-HIS-ILE-GLU-GLY,SER-GLY-SER-GLN-HIS-MET-ARG-PRO-ARG-PHE-ASN-ARG-GLU-ASN-LYS-VAL-SER-PRO-ALA-ASP-ALA-ALA-LYS-LYS-ALA-LEU,156,26,,Kd=0.7uM,6.154902,6.15,1,A,A,0,A,A,0,,B,A,,1,1,156,26,0,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C,1.0208261013031006,0.7429549694061279,89.5184097290039,83.88202667236328,0.3547469675540924,1.0241131782531738,0.9076789617538452,0.7651737928390503,0.8911458253860474,0.6492592096328735,SGSQHMRPRFNRENKVSPADAAKKAL,Low,"(6.097, 6.26]",train
6GD5,protein-peptide,P0ADV1 P55788,VTGDTDQPIHIESDQQSLDMQGNVVTFTGNVIVTQGTIKINADKVVVTRPGGEQGKEVIDGYGKPATFYQMQDNGKPVEGHASQMHYELAKDFVVLTGNAYLQQVDSNIKGDKITYL,GSKKPVPIIYCNRRTGKCQRM,VAL-THR-GLY-ASP-THR-ASP-GLN-PRO-ILE-HIS-ILE-GLU-SER-ASP-GLN-GLN-SER-LEU-ASP-MET-GLN-GLY-ASN-VAL-VAL-THR-PHE-THR-GLY-ASN-VAL-ILE-VAL-THR-GLN-GLY-THR-ILE-LYS-ILE-ASN-ALA-ASP-LYS-VAL-VAL-VAL-THR-ARG-PRO-GLY-GLY-GLU-GLN-GLY-LYS-GLU-VAL-ILE-ASP-GLY-TYR-GLY-LYS-PRO-ALA-THR-PHE-TYR-GLN-MET-GLN-ASP-ASN-GLY-LYS-PRO-VAL-GLU-GLY-HIS-ALA-SER-GLN-MET-HIS-TYR-GLU-LEU-ALA-LYS-ASP-PHE-VAL-VAL-LEU-THR-GLY-ASN-ALA-TYR-LEU-GLN-GLN-VAL-ASP-SER-ASN-ILE-LYS-GLY-ASP-LYS-ILE-THR-TYR-LEU,GLY-SER-LYS-LYS-PRO-VAL-PRO-ILE-ILE-TYR-CYS-ASN-ARG-ARG-THR-GLY-LYS-CYS-GLN-ARG-MET,117,21,,Kd=3.8nM,8.420216,8.42,1,A,A,0,A,A,0,,B,A,,1,1,117,21,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)CC,0.9285413026809692,0.7769665122032166,92.36482238769533,79.0884017944336,0.4697388112545013,0.7795549631118774,0.8500319719314575,0.8339768648147583,0.8394730091094971,0.7627139091491699,GSKKPVPIIYCNRRTGKCQRM,Moderate,"(8.383, 8.824]",train
6R2G,protein-peptide,P03377,ARQELSGIVQKQNNLLRQIEAQQHLLQLTVSKIKQLQARILAVERYLKDQQLGKGNQPQQDKLYREVALIRAQLQKIESETLQLLHQQAEIERELNNQEQEIGSLKQRGLIDGPLLSGIDQQQNNLKRAIEAQKHLLQLTVWGIKQLQARILTVERYLKDQQLGGGGSHHHHHHLEHHHHHH,WMEWDREINNYTSLIHSLIEESQNQQEKNEQELL,ALA-ARG-GLN-GLU-LEU-SER-GLY-ILE-VAL-GLN-LYS-GLN-ASN-ASN-LEU-LEU-ARG-GLN-ILE-GLU-ALA-GLN-GLN-HIS-LEU-LEU-GLN-LEU-THR-VAL-SER-LYS-ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU-ALA-VAL-GLU-ARG-TYR-LEU-LYS-ASP-GLN-GLN-LEU-GLY-LYS-GLY-ASN-GLN-PRO-GLN-GLN-ASP-LYS-LEU-TYR-ARG-GLU-VAL-ALA-LEU-ILE-ARG-ALA-GLN-LEU-GLN-LYS-ILE-GLU-SER-GLU-THR-LEU-GLN-LEU-LEU-HIS-GLN-GLN-ALA-GLU-ILE-GLU-ARG-GLU-LEU-ASN-ASN-GLN-GLU-GLN-GLU-ILE-GLY-SER-LEU-LYS-GLN-ARG-GLY-LEU-ILE-ASP-GLY-PRO-LEU-LEU-SER-GLY-ILE-ASP-GLN-GLN-GLN-ASN-ASN-LEU-LYS-ARG-ALA-ILE-GLU-ALA-GLN-LYS-HIS-LEU-LEU-GLN-LEU-THR-VAL-TRP-GLY-ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU-THR-VAL-GLU-ARG-TYR-LEU-LYS-ASP-GLN-GLN-LEU-GLY-GLY-GLY-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ACE-TRP-MET-GLU-TRP-ASP-ARG-GLU-ILE-ASN-ASN-TYR-THR-SER-LEU-ILE-HIS-SER-LEU-ILE-GLU-GLU-SER-GLN-ASN-GLN-GLN-GLU-LYS-ASN-GLU-GLN-GLU-LEU-LEU-NH2,182,36,,Kd=0.758pM,12.120331,12.12,1,A,A,0,A,A,0,,C,A,,1,1,182,36,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.968530535697937,0.6820927262306213,78.56108093261719,66.0680160522461,0.3859496116638183,1.213021755218506,0.844825029373169,0.6956484913825989,0.9213319420814514,0.6203246712684631,WMEWDREINNYTSLIHSLIEESQNQQEKNEQELL,High,"(8.824, 12.12]",val
6JWJ,protein-peptide,P33755 P53044,GPLGSIKELAVDEELAAADGLIPRQKSKLCKHGDRGMCEYCSPLPPWDKEYHEKNKIKHISFHSYLKKLNENANKKENGSSYISPLSEPDFRINKRCHNGHEPWPRGICSKCQPSAITLQQQEFRMVDHVEFQKSEIINEFIQAWRYTGMQRFGYMYGSYSKYDNTPLGIKAVVEAIYEPPQHDEQDGLTMDVEQVKNEMLQIDRQAQEMGLSRIGLIFTDLSDAGAGDGSVFCKRHKDSFFLSSLEVIMAARHQTRHPNVSKYSEQGFFSSKFVTCVISGNLEGEIDISSYQVSTEAEALVTADMISGSTFPSMAYINDTTDERYVPEIFYMKSNEYGITVKENAKPAFPVDYLLVTLTHGFPNTDTETNSKFVSSTGFPWSNRQAMGQSQDYQELKKYLFNVASSGDFNLLHEKISNFHLLLYINSLQILSPDEWKLLIESAVKNEWEESLLKLVSSAGWQTLVMILQESG,GPGHMEPAKLDLPEGQLFFGFPM,GLY-PRO-LEU-GLY-SER-ILE-LYS-GLU-LEU-ALA-VAL-ASP-GLU-GLU-LEU-ALA-ALA-ALA-ASP-GLY-LEU-ILE-PRO-ARG-GLN-LYS-SER-LYS-LEU-CYS-LYS-HIS-GLY-ASP-ARG-GLY-MET-CYS-GLU-TYR-CYS-SER-PRO-LEU-PRO-PRO-TRP-ASP-LYS-GLU-TYR-HIS-GLU-LYS-ASN-LYS-ILE-LYS-HIS-ILE-SER-PHE-HIS-SER-TYR-LEU-LYS-LYS-LEU-ASN-GLU-ASN-ALA-ASN-LYS-LYS-GLU-ASN-GLY-SER-SER-TYR-ILE-SER-PRO-LEU-SER-GLU-PRO-ASP-PHE-ARG-ILE-ASN-LYS-ARG-CYS-HIS-ASN-GLY-HIS-GLU-PRO-TRP-PRO-ARG-GLY-ILE-CYS-SER-LYS-CYS-GLN-PRO-SER-ALA-ILE-THR-LEU-GLN-GLN-GLN-GLU-PHE-ARG-MET-VAL-ASP-HIS-VAL-GLU-PHE-GLN-LYS-SER-GLU-ILE-ILE-ASN-GLU-PHE-ILE-GLN-ALA-TRP-ARG-TYR-THR-GLY-MET-GLN-ARG-PHE-GLY-TYR-MET-TYR-GLY-SER-TYR-SER-LYS-TYR-ASP-ASN-THR-PRO-LEU-GLY-ILE-LYS-ALA-VAL-VAL-GLU-ALA-ILE-TYR-GLU-PRO-PRO-GLN-HIS-ASP-GLU-GLN-ASP-GLY-LEU-THR-MET-ASP-VAL-GLU-GLN-VAL-LYS-ASN-GLU-MET-LEU-GLN-ILE-ASP-ARG-GLN-ALA-GLN-GLU-MET-GLY-LEU-SER-ARG-ILE-GLY-LEU-ILE-PHE-THR-ASP-LEU-SER-ASP-ALA-GLY-ALA-GLY-ASP-GLY-SER-VAL-PHE-CYS-LYS-ARG-HIS-LYS-ASP-SER-PHE-PHE-LEU-SER-SER-LEU-GLU-VAL-ILE-MET-ALA-ALA-ARG-HIS-GLN-THR-ARG-HIS-PRO-ASN-VAL-SER-LYS-TYR-SER-GLU-GLN-GLY-PHE-PHE-SER-SER-LYS-PHE-VAL-THR-CYS-VAL-ILE-SER-GLY-ASN-LEU-GLU-GLY-GLU-ILE-ASP-ILE-SER-SER-TYR-GLN-VAL-SER-THR-GLU-ALA-GLU-ALA-LEU-VAL-THR-ALA-ASP-MET-ILE-SER-GLY-SER-THR-PHE-PRO-SER-MET-ALA-TYR-ILE-ASN-ASP-THR-THR-ASP-GLU-ARG-TYR-VAL-PRO-GLU-ILE-PHE-TYR-MET-LYS-SER-ASN-GLU-TYR-GLY-ILE-THR-VAL-LYS-GLU-ASN-ALA-LYS-PRO-ALA-PHE-PRO-VAL-ASP-TYR-LEU-LEU-VAL-THR-LEU-THR-HIS-GLY-PHE-PRO-ASN-THR-ASP-THR-GLU-THR-ASN-SER-LYS-PHE-VAL-SER-SER-THR-GLY-PHE-PRO-TRP-SER-ASN-ARG-GLN-ALA-MET-GLY-GLN-SER-GLN-ASP-TYR-GLN-GLU-LEU-LYS-LYS-TYR-LEU-PHE-ASN-VAL-ALA-SER-SER-GLY-ASP-PHE-ASN-LEU-LEU-HIS-GLU-LYS-ILE-SER-ASN-PHE-HIS-LEU-LEU-LEU-TYR-ILE-ASN-SER-LEU-GLN-ILE-LEU-SER-PRO-ASP-GLU-TRP-LYS-LEU-LEU-ILE-GLU-SER-ALA-VAL-LYS-ASN-GLU-TRP-GLU-GLU-SER-LEU-LEU-LYS-LEU-VAL-SER-SER-ALA-GLY-TRP-GLN-THR-LEU-VAL-MET-ILE-LEU-GLN-GLU-SER-GLY,GLY-PRO-GLY-HIS-MET-GLU-PRO-ALA-LYS-LEU-ASP-LEU-PRO-GLU-GLY-GLN-LEU-PHE-PHE-GLY-PHE-PRO-MET,473,23,,Kd=85.7nM,7.067019,7.07,1,A,A,0,A,A,0,,C,A,,1,1,473,23,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O)C(=O)O,0.7254008054733276,0.6171743869781494,78.833984375,76.08272552490234,0.5900738835334778,1.373793601989746,0.8639611005783081,0.8086655735969543,0.6617788076400757,0.5693015456199646,GPGHMEPAKLDLPEGQLFFGFPM,Moderate,"(7.049, 7.268]",train
6JJW,protein-peptide,Q15678 Q5SXA9,GPGSEFELPLPEGWEEARDFDGKVYYIDHRNRTTSWIDPRDRYTKPLTFADCISDELPLGWEEAYDPQVGDYFIDHNTKTTQIEDPRVQWRREQEHMLKDYLVVAQEALSAQKEIYQVKQQRLELAQQEYQQLH,GPGSSHRHSAIIVPSYRPTPDYETVMRQMKRG,GLY-PRO-GLY-SER-GLU-PHE-GLU-LEU-PRO-LEU-PRO-GLU-GLY-TRP-GLU-GLU-ALA-ARG-ASP-PHE-ASP-GLY-LYS-VAL-TYR-TYR-ILE-ASP-HIS-ARG-ASN-ARG-THR-THR-SER-TRP-ILE-ASP-PRO-ARG-ASP-ARG-TYR-THR-LYS-PRO-LEU-THR-PHE-ALA-ASP-CYS-ILE-SER-ASP-GLU-LEU-PRO-LEU-GLY-TRP-GLU-GLU-ALA-TYR-ASP-PRO-GLN-VAL-GLY-ASP-TYR-PHE-ILE-ASP-HIS-ASN-THR-LYS-THR-THR-GLN-ILE-GLU-ASP-PRO-ARG-VAL-GLN-TRP-ARG-ARG-GLU-GLN-GLU-HIS-MET-LEU-LYS-ASP-TYR-LEU-VAL-VAL-ALA-GLN-GLU-ALA-LEU-SER-ALA-GLN-LYS-GLU-ILE-TYR-GLN-VAL-LYS-GLN-GLN-ARG-LEU-GLU-LEU-ALA-GLN-GLN-GLU-TYR-GLN-GLN-LEU-HIS,GLY-PRO-GLY-SER-SER-HIS-ARG-HIS-SER-ALA-ILE-ILE-VAL-PRO-SER-TYR-ARG-PRO-THR-PRO-ASP-TYR-GLU-THR-VAL-MET-ARG-GLN-MET-LYS-ARG-GLY,134,32,,Kd=8.2nM,8.086186,8.09,1,A,A,0,A,A,0,,U,A,,1,1,134,32,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)CC,0.8397963047027588,0.7086985111236572,69.14678192138672,70.01774597167969,0.4825014472007751,1.1206698417663574,0.6952468752861023,0.6322624683380127,0.6575600504875183,0.5598970651626587,GPGSSHRHSAIIVPSYRPTPDYETVMRQMKRG,Moderate,"(7.921, 8.383]",train
6J7W,protein-peptide,Q02223,EVQLVESGGGLVQPGGSLRLSCAASGFTVSSYGMSWVRQAPGKGPEWVSGIRGSDGSTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAKQGENDGPFDHRGQGTLVTVS,GQCSQNEYFDSLLHACIPCQLRCSSNTPPLTCQRYCNAS,GLU-VAL-GLN-LEU-VAL-GLU-SER-GLY-GLY-GLY-LEU-VAL-GLN-PRO-GLY-GLY-SER-LEU-ARG-LEU-SER-CYS-ALA-ALA-SER-GLY-PHE-THR-VAL-SER-SER-TYR-GLY-MET-SER-TRP-VAL-ARG-GLN-ALA-PRO-GLY-LYS-GLY-PRO-GLU-TRP-VAL-SER-GLY-ILE-ARG-GLY-SER-ASP-GLY-SER-THR-TYR-TYR-ALA-ASP-SER-VAL-LYS-GLY-ARG-PHE-THR-ILE-SER-ARG-ASP-ASN-SER-LYS-ASN-THR-LEU-TYR-LEU-GLN-MET-ASN-SER-LEU-ARG-ALA-GLU-ASP-THR-ALA-VAL-TYR-TYR-CYS-ALA-LYS-GLN-GLY-GLU-ASN-ASP-GLY-PRO-PHE-ASP-HIS-ARG-GLY-GLN-GLY-THR-LEU-VAL-THR-VAL-SER,GLY-GLN-CYS-SER-GLN-ASN-GLU-TYR-PHE-ASP-SER-LEU-LEU-HIS-ALA-CYS-ILE-PRO-CYS-GLN-LEU-ARG-CYS-SER-SER-ASN-THR-PRO-PRO-LEU-THR-CYS-GLN-ARG-TYR-CYS-ASN-ALA-SER,118,39,,Kd=0.3nM,9.522879,9.52,1,A,A,0,A,A,0,,C,A,,1,1,118,39,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.7864825129508972,0.6489317417144775,88.4800796508789,81.76488494873047,0.438010573387146,1.0220887660980225,0.8914469480514526,0.7244062423706055,0.7602413296699524,0.6300631165504456,GQCSQNEYFDSLLHACIPCQLRCSSNTPPLTCQRYCNAS,High,"(8.824, 12.12]",train
6J56,protein-peptide,O60784 Q9UM54,ARQREIEMNRQQRFFRIPFIRPADQYKDPQSKKKGWWYAHFDGPWIARQMELHPDKPPILLVAGKDDMEMCELNLEETGLTRKRGAEILPRQFEEIWERCGGIQYLQNAIESRQARPTYATAMLQSLLK,GVTSEGKFDKFLEERAKAADRLPNLSS,ALA-ARG-GLN-ARG-GLU-ILE-GLU-MET-ASN-ARG-GLN-GLN-ARG-PHE-PHE-ARG-ILE-PRO-PHE-ILE-ARG-PRO-ALA-ASP-GLN-TYR-LYS-ASP-PRO-GLN-SER-LYS-LYS-LYS-GLY-TRP-TRP-TYR-ALA-HIS-PHE-ASP-GLY-PRO-TRP-ILE-ALA-ARG-GLN-MET-GLU-LEU-HIS-PRO-ASP-LYS-PRO-PRO-ILE-LEU-LEU-VAL-ALA-GLY-LYS-ASP-ASP-MET-GLU-MET-CYS-GLU-LEU-ASN-LEU-GLU-GLU-THR-GLY-LEU-THR-ARG-LYS-ARG-GLY-ALA-GLU-ILE-LEU-PRO-ARG-GLN-PHE-GLU-GLU-ILE-TRP-GLU-ARG-CYS-GLY-GLY-ILE-GLN-TYR-LEU-GLN-ASN-ALA-ILE-GLU-SER-ARG-GLN-ALA-ARG-PRO-THR-TYR-ALA-THR-ALA-MET-LEU-GLN-SER-LEU-LEU-LYS,GLY-VAL-THR-SER-GLU-GLY-LYS-PHE-ASP-LYS-PHE-LEU-GLU-GLU-ARG-ALA-LYS-ALA-ALA-ASP-ARG-LEU-PRO-ASN-LEU-SER-SER,129,27,,Kd=0.67uM,6.173925,6.17,1,A,A,0,A,A,0,,C,A,,1,1,129,27,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.9052720069885254,0.538726806640625,89.67729949951172,81.85748291015625,0.4338351786136627,1.1772953271865845,0.8681315779685974,0.66106778383255,0.8063839673995972,0.5081415772438049,GVTSEGKFDKFLEERAKAADRLPNLSS,Low,"(6.097, 6.26]",val
6IDX,protein-peptide,Q3UHD1 Q96JJ3,GPGSMPPPSDIVKVAIEWPGANAQLLEIDQKRPLASIIKEVCDGWSLPNPEYYTLRYADGPQLYITEQTRSDIKNGTILQLAISPSRAARQLMERTQSSNMETRLDAMKELAKLSADVTFATEFINMDGIIVLTRLVESGTKLLSHYSEMLAFTLTAFLELMDHGIVSWDMVSITFIKQIAGYVSQPMVDVSILQRSLAILESMVLNSQSLYQKIAEEITVGQLISHLQVSNQEIQTYAIALINALFLKAPEDKRQDMANAFAQKHLRSIILNHVIRGNRPIKTEMAHQLYVLQVLTFNLLEERMMTKMDPNDQAQRDIIFELRRIAFDAESDPSNAPGSGTEKRKAMYTKDYKMLGFTNHINPAMDFTQTPPGMLALDNMLYLAKVHQDTYIRIVLENSSREDKHECPFGRSAIELTKMLCEILQVGELPNEGRNDYHPMFFTHDRAFEELFGICIQLLNKTWKEMRATAEDFNKVMQVVREQITRALPSKPNSLDQFKSKLRSLSYSEILRLRQSERMSQDD,RKSRYAELDFEKIMHTRKRHQDMFQ,GLY-PRO-GLY-SER-MET-PRO-PRO-PRO-SER-ASP-ILE-VAL-LYS-VAL-ALA-ILE-GLU-TRP-PRO-GLY-ALA-ASN-ALA-GLN-LEU-LEU-GLU-ILE-ASP-GLN-LYS-ARG-PRO-LEU-ALA-SER-ILE-ILE-LYS-GLU-VAL-CYS-ASP-GLY-TRP-SER-LEU-PRO-ASN-PRO-GLU-TYR-TYR-THR-LEU-ARG-TYR-ALA-ASP-GLY-PRO-GLN-LEU-TYR-ILE-THR-GLU-GLN-THR-ARG-SER-ASP-ILE-LYS-ASN-GLY-THR-ILE-LEU-GLN-LEU-ALA-ILE-SER-PRO-SER-ARG-ALA-ALA-ARG-GLN-LEU-MET-GLU-ARG-THR-GLN-SER-SER-ASN-MET-GLU-THR-ARG-LEU-ASP-ALA-MET-LYS-GLU-LEU-ALA-LYS-LEU-SER-ALA-ASP-VAL-THR-PHE-ALA-THR-GLU-PHE-ILE-ASN-MET-ASP-GLY-ILE-ILE-VAL-LEU-THR-ARG-LEU-VAL-GLU-SER-GLY-THR-LYS-LEU-LEU-SER-HIS-TYR-SER-GLU-MET-LEU-ALA-PHE-THR-LEU-THR-ALA-PHE-LEU-GLU-LEU-MET-ASP-HIS-GLY-ILE-VAL-SER-TRP-ASP-MET-VAL-SER-ILE-THR-PHE-ILE-LYS-GLN-ILE-ALA-GLY-TYR-VAL-SER-GLN-PRO-MET-VAL-ASP-VAL-SER-ILE-LEU-GLN-ARG-SER-LEU-ALA-ILE-LEU-GLU-SER-MET-VAL-LEU-ASN-SER-GLN-SER-LEU-TYR-GLN-LYS-ILE-ALA-GLU-GLU-ILE-THR-VAL-GLY-GLN-LEU-ILE-SER-HIS-LEU-GLN-VAL-SER-ASN-GLN-GLU-ILE-GLN-THR-TYR-ALA-ILE-ALA-LEU-ILE-ASN-ALA-LEU-PHE-LEU-LYS-ALA-PRO-GLU-ASP-LYS-ARG-GLN-ASP-MET-ALA-ASN-ALA-PHE-ALA-GLN-LYS-HIS-LEU-ARG-SER-ILE-ILE-LEU-ASN-HIS-VAL-ILE-ARG-GLY-ASN-ARG-PRO-ILE-LYS-THR-GLU-MET-ALA-HIS-GLN-LEU-TYR-VAL-LEU-GLN-VAL-LEU-THR-PHE-ASN-LEU-LEU-GLU-GLU-ARG-MET-MET-THR-LYS-MET-ASP-PRO-ASN-ASP-GLN-ALA-GLN-ARG-ASP-ILE-ILE-PHE-GLU-LEU-ARG-ARG-ILE-ALA-PHE-ASP-ALA-GLU-SER-ASP-PRO-SER-ASN-ALA-PRO-GLY-SER-GLY-THR-GLU-LYS-ARG-LYS-ALA-MET-TYR-THR-LYS-ASP-TYR-LYS-MET-LEU-GLY-PHE-THR-ASN-HIS-ILE-ASN-PRO-ALA-MET-ASP-PHE-THR-GLN-THR-PRO-PRO-GLY-MET-LEU-ALA-LEU-ASP-ASN-MET-LEU-TYR-LEU-ALA-LYS-VAL-HIS-GLN-ASP-THR-TYR-ILE-ARG-ILE-VAL-LEU-GLU-ASN-SER-SER-ARG-GLU-ASP-LYS-HIS-GLU-CYS-PRO-PHE-GLY-ARG-SER-ALA-ILE-GLU-LEU-THR-LYS-MET-LEU-CYS-GLU-ILE-LEU-GLN-VAL-GLY-GLU-LEU-PRO-ASN-GLU-GLY-ARG-ASN-ASP-TYR-HIS-PRO-MET-PHE-PHE-THR-HIS-ASP-ARG-ALA-PHE-GLU-GLU-LEU-PHE-GLY-ILE-CYS-ILE-GLN-LEU-LEU-ASN-LYS-THR-TRP-LYS-GLU-MET-ARG-ALA-THR-ALA-GLU-ASP-PHE-ASN-LYS-VAL-MET-GLN-VAL-VAL-ARG-GLU-GLN-ILE-THR-ARG-ALA-LEU-PRO-SER-LYS-PRO-ASN-SER-LEU-ASP-GLN-PHE-LYS-SER-LYS-LEU-ARG-SER-LEU-SER-TYR-SER-GLU-ILE-LEU-ARG-LEU-ARG-GLN-SER-GLU-ARG-MET-SER-GLN-ASP-ASP,ARG-LYS-SER-ARG-TYR-ALA-GLU-LEU-ASP-PHE-GLU-LYS-ILE-MET-HIS-THR-ARG-LYS-ARG-HIS-GLN-ASP-MET-PHE-GLN,524,25,,Kd=3.36uM,5.473661,5.47,1,A,A,0,A,A,0,,C,A,,1,1,524,25,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.7656351923942566,0.5739505887031555,71.13545989990234,67.04164123535156,0.5370066165924072,1.5848476886749268,0.8286396265029907,0.724093496799469,0.7054851651191711,0.5221018195152283,RKSRYAELDFEKIMHTRKRHQDMFQ,Low,"(5.463, 5.6]",val
6GVK,protein-peptide,P16144,GSHMVPDTPTRLVFSALGPTSLRVSWQEPRCERPLQGYSVEYQLLNGGELHRLNIPNPAQTSVVVEDLLPNHSYVFRVRAQSQEGWGREREGVITIESQVHPQSPLCPLPGSAFTLSTPSAPGPLVFTALSPDSLQLSWERPRRPNGDIVGYLVTCEMAQGGGPATAFRVDGDSPESRLTVPGLSENVPYKFKVQARTTEGFGPEREGIIRIES,DSNENLLLVHCGPTLINSCISFGSESFDGH,GLY-SER-HIS-MET-VAL-PRO-ASP-THR-PRO-THR-ARG-LEU-VAL-PHE-SER-ALA-LEU-GLY-PRO-THR-SER-LEU-ARG-VAL-SER-TRP-GLN-GLU-PRO-ARG-CYS-GLU-ARG-PRO-LEU-GLN-GLY-TYR-SER-VAL-GLU-TYR-GLN-LEU-LEU-ASN-GLY-GLY-GLU-LEU-HIS-ARG-LEU-ASN-ILE-PRO-ASN-PRO-ALA-GLN-THR-SER-VAL-VAL-VAL-GLU-ASP-LEU-LEU-PRO-ASN-HIS-SER-TYR-VAL-PHE-ARG-VAL-ARG-ALA-GLN-SER-GLN-GLU-GLY-TRP-GLY-ARG-GLU-ARG-GLU-GLY-VAL-ILE-THR-ILE-GLU-SER-GLN-VAL-HIS-PRO-GLN-SER-PRO-LEU-CYS-PRO-LEU-PRO-GLY-SER-ALA-PHE-THR-LEU-SER-THR-PRO-SER-ALA-PRO-GLY-PRO-LEU-VAL-PHE-THR-ALA-LEU-SER-PRO-ASP-SER-LEU-GLN-LEU-SER-TRP-GLU-ARG-PRO-ARG-ARG-PRO-ASN-GLY-ASP-ILE-VAL-GLY-TYR-LEU-VAL-THR-CYS-GLU-MET-ALA-GLN-GLY-GLY-GLY-PRO-ALA-THR-ALA-PHE-ARG-VAL-ASP-GLY-ASP-SER-PRO-GLU-SER-ARG-LEU-THR-VAL-PRO-GLY-LEU-SER-GLU-ASN-VAL-PRO-TYR-LYS-PHE-LYS-VAL-GLN-ALA-ARG-THR-THR-GLU-GLY-PHE-GLY-PRO-GLU-ARG-GLU-GLY-ILE-ILE-ARG-ILE-GLU-SER,ASP-SER-ASN-GLU-ASN-LEU-LEU-LEU-VAL-HIS-CYS-GLY-PRO-THR-LEU-ILE-ASN-SER-CYS-ILE-SER-PHE-GLY-SER-GLU-SER-PHE-ASP-GLY-HIS,214,30,,Kd=2.0uM,5.69897,5.7,1,A,A,0,A,A,0,,B,A,,1,1,214,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC,0.7343652844429016,0.5195768475532532,79.84638977050781,61.47041702270508,0.6902537941932678,1.4219856262207031,0.7134249210357666,0.611965000629425,0.662756085395813,0.4964798390865326,DSNENLLLVHCGPTLINSCISFGSESFDGH,Low,"(5.6, 5.699]",train
6GTQ,protein-peptide,A0A1V3CQ74 J7QA90,MGASDDLTIEILTDDADYDLQRFDCGEEALNLFLTTHLVRQHRNKILRAYILCRNTPERQVLGYYTLCGSCFERAALPSKSKQKKIPYKNIPSVTLGRLAIDRSLQGQGWGATLVAHAMNVVWSASLAVGIHGLFVEALNEKAHTFFKSLGFIPLVGENENALFFPTKSIELLFTQSD,MAAEVIEQHRRVILNEESWTRVMDALSNPPSPGEKLKRAAKRLQGM,MET-GLY-ALA-SER-ASP-ASP-LEU-THR-ILE-GLU-ILE-LEU-THR-ASP-ASP-ALA-ASP-TYR-ASP-LEU-GLN-ARG-PHE-ASP-CYS-GLY-GLU-GLU-ALA-LEU-ASN-LEU-PHE-LEU-THR-THR-HIS-LEU-VAL-ARG-GLN-HIS-ARG-ASN-LYS-ILE-LEU-ARG-ALA-TYR-ILE-LEU-CYS-ARG-ASN-THR-PRO-GLU-ARG-GLN-VAL-LEU-GLY-TYR-TYR-THR-LEU-CYS-GLY-SER-CYS-PHE-GLU-ARG-ALA-ALA-LEU-PRO-SER-LYS-SER-LYS-GLN-LYS-LYS-ILE-PRO-TYR-LYS-ASN-ILE-PRO-SER-VAL-THR-LEU-GLY-ARG-LEU-ALA-ILE-ASP-ARG-SER-LEU-GLN-GLY-GLN-GLY-TRP-GLY-ALA-THR-LEU-VAL-ALA-HIS-ALA-MET-ASN-VAL-VAL-TRP-SER-ALA-SER-LEU-ALA-VAL-GLY-ILE-HIS-GLY-LEU-PHE-VAL-GLU-ALA-LEU-ASN-GLU-LYS-ALA-HIS-THR-PHE-PHE-LYS-SER-LEU-GLY-PHE-ILE-PRO-LEU-VAL-GLY-GLU-ASN-GLU-ASN-ALA-LEU-PHE-PHE-PRO-THR-LYS-SER-ILE-GLU-LEU-LEU-PHE-THR-GLN-SER-ASP,MET-ALA-ALA-GLU-VAL-ILE-GLU-GLN-HIS-ARG-ARG-VAL-ILE-LEU-ASN-GLU-GLU-SER-TRP-THR-ARG-VAL-MET-ASP-ALA-LEU-SER-ASN-PRO-PRO-SER-PRO-GLY-GLU-LYS-LEU-LYS-ARG-ALA-ALA-LYS-ARG-LEU-GLN-GLY-MET,178,46,,Kd=367nM,6.435334,6.44,1,A,A,0,A,A,0,,C,A,dimer,1,1,178,46,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCSC)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(C)C,0.9389718770980836,0.6313871145248413,78.44047546386719,72.41695404052734,0.5256491899490356,1.204673409461975,0.8855016827583313,0.7142065763473511,0.8239911198616028,0.6106822490692139,MAAEVIEQHRRVILNEESWTRVMDALSNPPSPGEKLKRAAKRLQGM,Low,"(6.398, 6.523]",train
6FBX,protein-peptide,Q4V925 Q8UWD5,GPLSMSCWLREQTLLLAEDYISFCSGIQQTPPSESAEAMRYLAKEMEQQHRTKFRSLSQEFLDTCGADPSKCLQSVMRELVGDGKMNWGRVVSIFTFTGVLASELLSRGENSEGSRRLAETIADYLGGEKQDWLVENGGWEGFCRFFHNARQ,ALWAAKKYGQQLRRMSDEFDKGQMKR,GLY-PRO-LEU-SER-MET-SER-CYS-TRP-LEU-ARG-GLU-GLN-THR-LEU-LEU-LEU-ALA-GLU-ASP-TYR-ILE-SER-PHE-CYS-SER-GLY-ILE-GLN-GLN-THR-PRO-PRO-SER-GLU-SER-ALA-GLU-ALA-MET-ARG-TYR-LEU-ALA-LYS-GLU-MET-GLU-GLN-GLN-HIS-ARG-THR-LYS-PHE-ARG-SER-LEU-SER-GLN-GLU-PHE-LEU-ASP-THR-CYS-GLY-ALA-ASP-PRO-SER-LYS-CYS-LEU-GLN-SER-VAL-MET-ARG-GLU-LEU-VAL-GLY-ASP-GLY-LYS-MET-ASN-TRP-GLY-ARG-VAL-VAL-SER-ILE-PHE-THR-PHE-THR-GLY-VAL-LEU-ALA-SER-GLU-LEU-LEU-SER-ARG-GLY-GLU-ASN-SER-GLU-GLY-SER-ARG-ARG-LEU-ALA-GLU-THR-ILE-ALA-ASP-TYR-LEU-GLY-GLY-GLU-LYS-GLN-ASP-TRP-LEU-VAL-GLU-ASN-GLY-GLY-TRP-GLU-GLY-PHE-CYS-ARG-PHE-PHE-HIS-ASN-ALA-ARG-GLN,ALA-LEU-TRP-ALA-ALA-LYS-LYS-TYR-GLY-GLN-GLN-LEU-ARG-ARG-MET-SER-ASP-GLU-PHE-ASP-LYS-GLY-GLN-MET-LYS-ARG,152,26,,Kd=343nM,6.464706,6.46,1,A,A,0,A,A,0,,B,A,,1,1,152,26,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.932449221611023,0.7027503252029419,93.61830139160156,86.67399597167969,0.3704572916030884,1.0204331874847412,0.925587832927704,0.7884606719017029,0.8920297622680664,0.6813226938247681,ALWAAKKYGQQLRRMSDEFDKGQMKR,Low,"(6.398, 6.523]",train
6DCN,protein-peptide,Q07817 Q14457,PLGSMSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQE,DGGTMENLSRRLKVTGDLFDIMSGQT,PRO-LEU-GLY-SER-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU,ASP-GLY-GLY-TPO-MET-GLU-ASN-LEU-SER-ARG-ARG-LEU-LYS-VAL-THR-GLY-ASP-LEU-PHE-ASP-ILE-MET-SER-GLY-GLN-THR,156,26,,Kd=1.4uM,5.853872,5.85,1,A,A,0,A,A,0,,C,A,,0,1,156,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)NC(C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)NC(C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.942077338695526,0.6429877877235413,80.57183837890625,72.01606750488281,0.5526724457740784,1.1127564907073977,0.826009213924408,0.723318338394165,0.8543360829353333,0.614892303943634,DGGTMENLSRRLKVTGDLFDIMSGQT,Low,"(5.821, 5.959]",train
6BW9,protein-peptide,O00629 P0C1C6,SGDYRVQNTSLEAIVQNASSDNQGIQLSAVQAARKLLSSDRNPPIDDLIKSGILPILVHCLERDDNPSLQFEAAWALTNIASGTSEQTQAVVQSNAVPLFLRLLHSPHQNVCEQAVWALGNIIGDGPQCRDYVISLGVVKPLLSFISPSIPITFLRNVTWVMVNLCRHKDPPPPMETIQEILPALCVLIHHTDVNILVDTVWALSYLTDAGNEQIQMVIDSGIVPHLVPLLSHQEVKVQTAALRAVGNIVTGTDEQTQVVLNCDALSHFPALLTHPKEKINKEAVWFLSNITAGNQQQVQAVIDANLVPMIIHLLDKGDFGTQKEAAWAISNLTISGRKDQVAYLIQQNVIPPFCNLLTVKDAQVVQVVLDGLSNILKMAEDEAETIGNLIEECGGLEKIEQLQNHENEDIYKLAYEIIDQFFSSDDIDEDPSLVPEAIQGGTFGFNSSANVPTEGFQF,SRSLNMLGRKTCLGRRVVQPGMFADYPPTKKARVLLRRMSN,SER-GLY-ASP-TYR-ARG-VAL-GLN-ASN-THR-SER-LEU-GLU-ALA-ILE-VAL-GLN-ASN-ALA-SER-SER-ASP-ASN-GLN-GLY-ILE-GLN-LEU-SER-ALA-VAL-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-SER-ASP-ARG-ASN-PRO-PRO-ILE-ASP-ASP-LEU-ILE-LYS-SER-GLY-ILE-LEU-PRO-ILE-LEU-VAL-HIS-CYS-LEU-GLU-ARG-ASP-ASP-ASN-PRO-SER-LEU-GLN-PHE-GLU-ALA-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-GLN-ALA-VAL-VAL-GLN-SER-ASN-ALA-VAL-PRO-LEU-PHE-LEU-ARG-LEU-LEU-HIS-SER-PRO-HIS-GLN-ASN-VAL-CYS-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ILE-GLY-ASP-GLY-PRO-GLN-CYS-ARG-ASP-TYR-VAL-ILE-SER-LEU-GLY-VAL-VAL-LYS-PRO-LEU-LEU-SER-PHE-ILE-SER-PRO-SER-ILE-PRO-ILE-THR-PHE-LEU-ARG-ASN-VAL-THR-TRP-VAL-MET-VAL-ASN-LEU-CYS-ARG-HIS-LYS-ASP-PRO-PRO-PRO-PRO-MET-GLU-THR-ILE-GLN-GLU-ILE-LEU-PRO-ALA-LEU-CYS-VAL-LEU-ILE-HIS-HIS-THR-ASP-VAL-ASN-ILE-LEU-VAL-ASP-THR-VAL-TRP-ALA-LEU-SER-TYR-LEU-THR-ASP-ALA-GLY-ASN-GLU-GLN-ILE-GLN-MET-VAL-ILE-ASP-SER-GLY-ILE-VAL-PRO-HIS-LEU-VAL-PRO-LEU-LEU-SER-HIS-GLN-GLU-VAL-LYS-VAL-GLN-THR-ALA-ALA-LEU-ARG-ALA-VAL-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-VAL-VAL-LEU-ASN-CYS-ASP-ALA-LEU-SER-HIS-PHE-PRO-ALA-LEU-LEU-THR-HIS-PRO-LYS-GLU-LYS-ILE-ASN-LYS-GLU-ALA-VAL-TRP-PHE-LEU-SER-ASN-ILE-THR-ALA-GLY-ASN-GLN-GLN-GLN-VAL-GLN-ALA-VAL-ILE-ASP-ALA-ASN-LEU-VAL-PRO-MET-ILE-ILE-HIS-LEU-LEU-ASP-LYS-GLY-ASP-PHE-GLY-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-SER-ASN-LEU-THR-ILE-SER-GLY-ARG-LYS-ASP-GLN-VAL-ALA-TYR-LEU-ILE-GLN-GLN-ASN-VAL-ILE-PRO-PRO-PHE-CYS-ASN-LEU-LEU-THR-VAL-LYS-ASP-ALA-GLN-VAL-VAL-GLN-VAL-VAL-LEU-ASP-GLY-LEU-SER-ASN-ILE-LEU-LYS-MET-ALA-GLU-ASP-GLU-ALA-GLU-THR-ILE-GLY-ASN-LEU-ILE-GLU-GLU-CYS-GLY-GLY-LEU-GLU-LYS-ILE-GLU-GLN-LEU-GLN-ASN-HIS-GLU-ASN-GLU-ASP-ILE-TYR-LYS-LEU-ALA-TYR-GLU-ILE-ILE-ASP-GLN-PHE-PHE-SER-SER-ASP-ASP-ILE-ASP-GLU-ASP-PRO-SER-LEU-VAL-PRO-GLU-ALA-ILE-GLN-GLY-GLY-THR-PHE-GLY-PHE-ASN-SER-SER-ALA-ASN-VAL-PRO-THR-GLU-GLY-PHE-GLN-PHE,SER-ARG-SER-LEU-ASN-MET-LEU-GLY-ARG-LYS-THR-CYS-LEU-GLY-ARG-ARG-VAL-VAL-GLN-PRO-GLY-MET-PHE-ALA-ASP-TYR-PRO-PRO-THR-LYS-LYS-ALA-ARG-VAL-LEU-LEU-ARG-ARG-MET-SER-ASN,459,41,,Kd=4.39nM,8.357535,8.36,1,A,A,0,A,A,0,,B,A,,1,1,459,41,0,CSCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.7277095317840576,0.6663291454315186,77.00092315673828,76.30095672607422,0.6075853705406189,1.4086496829986572,0.8299074769020081,0.7493565678596497,0.6109099984169006,0.5870210528373718,SRSLNMLGRKTCLGRRVVQPGMFADYPPTKKARVLLRRMSN,Moderate,"(7.921, 8.383]",train
5Z2W,protein-peptide,P06136 P0A6S5,QRLPLSKLVLTGERHYTRNDDIRQSILALGEPGTFMTQDVNIIQTQIEQRLPWIKQVSVRKQWPDELKIHLVEYVPIARWNDQHMVDAEGNTFSVPPERTSKQVLPMLYGPEGSANEVLQGYREMGQMLAKDRFTLKEAAMTARRSWQLTLNNDIKLNLGRGDTMKRLARFVELYPVLQQQAQTDGKRISYVDLRYDSGAAVGWAPLPP,NGGQEALEERARNELSMTRPGETFYRLVPDASKRA,GLN-ARG-LEU-PRO-LEU-SER-LYS-LEU-VAL-LEU-THR-GLY-GLU-ARG-HIS-TYR-THR-ARG-ASN-ASP-ASP-ILE-ARG-GLN-SER-ILE-LEU-ALA-LEU-GLY-GLU-PRO-GLY-THR-PHE-MET-THR-GLN-ASP-VAL-ASN-ILE-ILE-GLN-THR-GLN-ILE-GLU-GLN-ARG-LEU-PRO-TRP-ILE-LYS-GLN-VAL-SER-VAL-ARG-LYS-GLN-TRP-PRO-ASP-GLU-LEU-LYS-ILE-HIS-LEU-VAL-GLU-TYR-VAL-PRO-ILE-ALA-ARG-TRP-ASN-ASP-GLN-HIS-MET-VAL-ASP-ALA-GLU-GLY-ASN-THR-PHE-SER-VAL-PRO-PRO-GLU-ARG-THR-SER-LYS-GLN-VAL-LEU-PRO-MET-LEU-TYR-GLY-PRO-GLU-GLY-SER-ALA-ASN-GLU-VAL-LEU-GLN-GLY-TYR-ARG-GLU-MET-GLY-GLN-MET-LEU-ALA-LYS-ASP-ARG-PHE-THR-LEU-LYS-GLU-ALA-ALA-MET-THR-ALA-ARG-ARG-SER-TRP-GLN-LEU-THR-LEU-ASN-ASN-ASP-ILE-LYS-LEU-ASN-LEU-GLY-ARG-GLY-ASP-THR-MET-LYS-ARG-LEU-ALA-ARG-PHE-VAL-GLU-LEU-TYR-PRO-VAL-LEU-GLN-GLN-GLN-ALA-GLN-THR-ASP-GLY-LYS-ARG-ILE-SER-TYR-VAL-ASP-LEU-ARG-TYR-ASP-SER-GLY-ALA-ALA-VAL-GLY-TRP-ALA-PRO-LEU-PRO-PRO,ASN-GLY-GLY-GLN-GLU-ALA-LEU-GLU-GLU-ARG-ALA-ARG-ASN-GLU-LEU-SER-MET-THR-ARG-PRO-GLY-GLU-THR-PHE-TYR-ARG-LEU-VAL-PRO-ASP-ALA-SER-LYS-ARG-ALA,209,35,,Kd=0.67uM,6.173925,6.17,1,A,A,0,A,A,0,,B,A,,1,1,209,35,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)NCC(=O)O,0.829702615737915,0.5387372970581055,87.47518157958984,81.800537109375,0.4586644172668457,1.374651312828064,0.8452047109603882,0.6654035449028015,0.7822819352149963,0.5070707201957703,NGGQEALEERARNELSMTRPGETFYRLVPDASKRA,Low,"(6.097, 6.26]",train
5XLN,protein-peptide,O60573 P26639,KAVVPGPAEHPLQYNYTFWYSRRTPGRPTSSQSYEQNIKQIGTFASVEQFWRFYSHMVRPGDLTGHSDFHLFKEGIKPMWEDDANKNGGKWIIRLRKGLASRCWENLILAMLGEQFMVGEEICGAVVSVRFQEDIISIWNKTASDQATTARIRDTLRRVLNLPPNTIMEYKTHTDSIKMPGRLGPQRLLF,GGKKKNKEGSGDGGRAELNPWPEYIYTRLEMYNILKAEHDSILAE,LYS-ALA-VAL-VAL-PRO-GLY-PRO-ALA-GLU-HIS-PRO-LEU-GLN-TYR-ASN-TYR-THR-PHE-TRP-TYR-SER-ARG-ARG-THR-PRO-GLY-ARG-PRO-THR-SER-SER-GLN-SER-TYR-GLU-GLN-ASN-ILE-LYS-GLN-ILE-GLY-THR-PHE-ALA-SER-VAL-GLU-GLN-PHE-TRP-ARG-PHE-TYR-SER-HIS-MET-VAL-ARG-PRO-GLY-ASP-LEU-THR-GLY-HIS-SER-ASP-PHE-HIS-LEU-PHE-LYS-GLU-GLY-ILE-LYS-PRO-MET-TRP-GLU-ASP-ASP-ALA-ASN-LYS-ASN-GLY-GLY-LYS-TRP-ILE-ILE-ARG-LEU-ARG-LYS-GLY-LEU-ALA-SER-ARG-CYS-TRP-GLU-ASN-LEU-ILE-LEU-ALA-MET-LEU-GLY-GLU-GLN-PHE-MET-VAL-GLY-GLU-GLU-ILE-CYS-GLY-ALA-VAL-VAL-SER-VAL-ARG-PHE-GLN-GLU-ASP-ILE-ILE-SER-ILE-TRP-ASN-LYS-THR-ALA-SER-ASP-GLN-ALA-THR-THR-ALA-ARG-ILE-ARG-ASP-THR-LEU-ARG-ARG-VAL-LEU-ASN-LEU-PRO-PRO-ASN-THR-ILE-MET-GLU-TYR-LYS-THR-HIS-THR-ASP-SER-ILE-LYS-MET-PRO-GLY-ARG-LEU-GLY-PRO-GLN-ARG-LEU-LEU-PHE,GLY-GLY-LYS-LYS-LYS-ASN-LYS-GLU-GLY-SER-GLY-ASP-GLY-GLY-ARG-ALA-GLU-LEU-ASN-PRO-TRP-PRO-GLU-TYR-ILE-TYR-THR-ARG-LEU-GLU-MET-TYR-ASN-ILE-LEU-LYS-ALA-GLU-HIS-ASP-SER-ILE-LEU-ALA-GLU,190,45,,Kd=2.48uM,5.605548,5.61,1,A,A,0,A,A,0,,B,A,,1,1,190,45,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CN)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)O,0.7533950805664062,,75.07640838623047,,0.6530202031135559,,0.7956209182739258,,0.5965620279312134,,GGKKKNKEGSGDGGRAELNPWPEYIYTRLEMYNILKAEHDSILAE,Low,"(5.6, 5.699]",val
5VMO,protein-peptide,B8JK68 Q5GAF0,GPLGSMTNINFSALLRGERMCPLTREIHSQMLIVTKSYSLVETFRAFPRLPNILEIGNNIVSDGNLNWGRILILLGISQLYFTKSESESERTQITEQLERFFRQDAISNWIASNGGWVTCASLDLRNYSSVT,ALPPEMVVARELRRIGDEFNRLYCEA,GLY-PRO-LEU-GLY-SER-MET-THR-ASN-ILE-ASN-PHE-SER-ALA-LEU-LEU-ARG-GLY-GLU-ARG-MET-CYS-PRO-LEU-THR-ARG-GLU-ILE-HIS-SER-GLN-MET-LEU-ILE-VAL-THR-LYS-SER-TYR-SER-LEU-VAL-GLU-THR-PHE-ARG-ALA-PHE-PRO-ARG-LEU-PRO-ASN-ILE-LEU-GLU-ILE-GLY-ASN-ASN-ILE-VAL-SER-ASP-GLY-ASN-LEU-ASN-TRP-GLY-ARG-ILE-LEU-ILE-LEU-LEU-GLY-ILE-SER-GLN-LEU-TYR-PHE-THR-LYS-SER-GLU-SER-GLU-SER-GLU-ARG-THR-GLN-ILE-THR-GLU-GLN-LEU-GLU-ARG-PHE-PHE-ARG-GLN-ASP-ALA-ILE-SER-ASN-TRP-ILE-ALA-SER-ASN-GLY-GLY-TRP-VAL-THR-CYS-ALA-SER-LEU-ASP-LEU-ARG-ASN-TYR-SER-SER-VAL-THR,ALA-LEU-PRO-PRO-GLU-MET-VAL-VAL-ALA-ARG-GLU-LEU-ARG-ARG-ILE-GLY-ASP-GLU-PHE-ASN-ARG-LEU-TYR-CYS-GLU-ALA,132,26,,Kd=887nM,6.052076,6.05,1,A,A,0,A,A,0,,B,A,,1,1,132,26,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9470633268356324,0.685695230960846,91.48837280273438,79.1136474609375,0.3743156492710113,1.0509331226348877,0.9149364829063416,0.7547539472579956,0.9194937348365784,0.6636956930160522,ALPPEMVVARELRRIGDEFNRLYCEA,Low,"(5.959, 6.097]",train
6GVL,protein-peptide,P16144,GSHMVPDTPTRLVFSALGPTSLRVSWQEPRCERPLQGYSVEYQLLNGGELHRLNIPNPAQTSVVVEDLLPNHSYVFRVRAQSQEGWGREREGVITIESQVHPQSPLCPLPGSAFTLSTPSAPGPLVFTALSPDSLQLSWERPRRPNGDIVGYLVTCEMAQGGGPATAFRVDGDSPESRLTVPGLSENVPYKFKVQARTTEGFGPEREGIITIES,DSNENLLLVHCGPTLINSCISFGSESFDGH,GLY-SER-HIS-MET-VAL-PRO-ASP-THR-PRO-THR-ARG-LEU-VAL-PHE-SER-ALA-LEU-GLY-PRO-THR-SER-LEU-ARG-VAL-SER-TRP-GLN-GLU-PRO-ARG-CYS-GLU-ARG-PRO-LEU-GLN-GLY-TYR-SER-VAL-GLU-TYR-GLN-LEU-LEU-ASN-GLY-GLY-GLU-LEU-HIS-ARG-LEU-ASN-ILE-PRO-ASN-PRO-ALA-GLN-THR-SER-VAL-VAL-VAL-GLU-ASP-LEU-LEU-PRO-ASN-HIS-SER-TYR-VAL-PHE-ARG-VAL-ARG-ALA-GLN-SER-GLN-GLU-GLY-TRP-GLY-ARG-GLU-ARG-GLU-GLY-VAL-ILE-THR-ILE-GLU-SER-GLN-VAL-HIS-PRO-GLN-SER-PRO-LEU-CYS-PRO-LEU-PRO-GLY-SER-ALA-PHE-THR-LEU-SER-THR-PRO-SER-ALA-PRO-GLY-PRO-LEU-VAL-PHE-THR-ALA-LEU-SER-PRO-ASP-SER-LEU-GLN-LEU-SER-TRP-GLU-ARG-PRO-ARG-ARG-PRO-ASN-GLY-ASP-ILE-VAL-GLY-TYR-LEU-VAL-THR-CYS-GLU-MET-ALA-GLN-GLY-GLY-GLY-PRO-ALA-THR-ALA-PHE-ARG-VAL-ASP-GLY-ASP-SER-PRO-GLU-SER-ARG-LEU-THR-VAL-PRO-GLY-LEU-SER-GLU-ASN-VAL-PRO-TYR-LYS-PHE-LYS-VAL-GLN-ALA-ARG-THR-THR-GLU-GLY-PHE-GLY-PRO-GLU-ARG-GLU-GLY-ILE-ILE-THR-ILE-GLU-SER,ASP-SER-ASN-GLU-ASN-LEU-LEU-LEU-VAL-HIS-CYS-GLY-PRO-THR-LEU-ILE-ASN-SER-CYS-ILE-SER-PHE-GLY-SER-GLU-SER-PHE-ASP-GLY-HIS,214,30,,Kd=44uM,4.356547,4.36,1,A,A,0,A,A,0,,B,A,,1,1,214,30,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC,0.7563953399658203,0.5858193039894104,80.84696960449219,72.6258773803711,0.6581360101699829,1.2658456563949585,0.7353234887123108,0.6817968487739563,0.6848190426826477,0.5618249177932739,DSNENLLLVHCGPTLINSCISFGSESFDGH,Low,"(4.319, 4.456]",train
6WGN,protein-peptide,P01116,MTEYKLVVVGADGVGKSALTIQLIQNHFVDEYDPTIEDSYRKQVVIDGETSLLDILDTAGQEEYSAMRDQYMRTGEGFLLVFAINNTKSFEDIHHYREQIKRVKDSEDVPMVLVGNKSDLPSRTVDTKQAQDLARSYGIPFIETSAKTRQGVDDAFYTLVREIRKHKEK,GYFVNFRNFRTFRCG,MET-THR-GLU-TYR-LYS-LEU-VAL-VAL-VAL-GLY-ALA-ASP-GLY-VAL-GLY-LYS-SER-ALA-LEU-THR-ILE-GLN-LEU-ILE-GLN-ASN-HIS-PHE-VAL-ASP-GLU-TYR-ASP-PRO-THR-ILE-GLU-ASP-SER-TYR-ARG-LYS-GLN-VAL-VAL-ILE-ASP-GLY-GLU-THR-SER-LEU-LEU-ASP-ILE-LEU-ASP-THR-ALA-GLY-GLN-GLU-GLU-TYR-SER-ALA-MET-ARG-ASP-GLN-TYR-MET-ARG-THR-GLY-GLU-GLY-PHE-LEU-LEU-VAL-PHE-ALA-ILE-ASN-ASN-THR-LYS-SER-PHE-GLU-ASP-ILE-HIS-HIS-TYR-ARG-GLU-GLN-ILE-LYS-ARG-VAL-LYS-ASP-SER-GLU-ASP-VAL-PRO-MET-VAL-LEU-VAL-GLY-ASN-LYS-SER-ASP-LEU-PRO-SER-ARG-THR-VAL-ASP-THR-LYS-GLN-ALA-GLN-ASP-LEU-ALA-ARG-SER-TYR-GLY-ILE-PRO-PHE-ILE-GLU-THR-SER-ALA-LYS-THR-ARG-GLN-GLY-VAL-ASP-ASP-ALA-PHE-TYR-THR-LEU-VAL-ARG-GLU-ILE-ARG-LYS-HIS-LYS-GLU-LYS,GLY-DTY-PHE-VAL-ASN-PHE-ARG-ASN-PHE-ARG-THR-PHE-ARG-CYS-GLY,169,15,,Kd=6.8uM,5.167491,5.167491087,1,A,A,0,A,A,0,KRAS,E,A,,0,1,169,15,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O,0.7783605456352234,0.6680895090103149,86.92240905761719,82.52885437011719,0.4603069126605987,0.9571583271026612,0.8975427150726318,0.7998476028442383,0.6976138949394226,0.6351500153541565,GYFVNFRNFRTFRCG,Low,"(5.105, 5.222]",train
1FHR,protein-peptide,P14737 P22216,GNGRFLTLKPLPDSIIQESLEIQQGVNPFFIGRSEDCNCKIEDNRLSRVHCFIFKKRHAVGKSMYESPAQGLDDIWYCHTGTNVSYLNNNRMIQGTKFLLQDGDEIKIIWDKNNKFVIGFKVEINDTTGLFNEGLGMLQEQRVVLKQTAEEKDLVKKL,EDIYYLD,GLY-ASN-GLY-ARG-PHE-LEU-THR-LEU-LYS-PRO-LEU-PRO-ASP-SER-ILE-ILE-GLN-GLU-SER-LEU-GLU-ILE-GLN-GLN-GLY-VAL-ASN-PRO-PHE-PHE-ILE-GLY-ARG-SER-GLU-ASP-CYS-ASN-CYS-LYS-ILE-GLU-ASP-ASN-ARG-LEU-SER-ARG-VAL-HIS-CYS-PHE-ILE-PHE-LYS-LYS-ARG-HIS-ALA-VAL-GLY-LYS-SER-MET-TYR-GLU-SER-PRO-ALA-GLN-GLY-LEU-ASP-ASP-ILE-TRP-TYR-CYS-HIS-THR-GLY-THR-ASN-VAL-SER-TYR-LEU-ASN-ASN-ASN-ARG-MET-ILE-GLN-GLY-THR-LYS-PHE-LEU-LEU-GLN-ASP-GLY-ASP-GLU-ILE-LYS-ILE-ILE-TRP-ASP-LYS-ASN-ASN-LYS-PHE-VAL-ILE-GLY-PHE-LYS-VAL-GLU-ILE-ASN-ASP-THR-THR-GLY-LEU-PHE-ASN-GLU-GLY-LEU-GLY-MET-LEU-GLN-GLU-GLN-ARG-VAL-VAL-LEU-LYS-GLN-THR-ALA-GLU-GLU-LYS-ASP-LEU-VAL-LYS-LYS-LEU,GLU-ASP-ILE-PTR-TYR-LEU-ASP,158,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)C,Kd=100uM,4.0,4.0,1,M,S,1,M,S,0,,P,A,,1,1,158,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.8455089926719666,0.8432756662368774,87.9615707397461,81.8577651977539,0.4340986013412475,0.6275286674499512,0.8962546586990356,0.87359619140625,0.8063073754310608,0.8356955051422119,EDIYYLD,Low,"(3.924, 4.155]",val
1J4P,protein-peptide,P14737 P22216,ATQRFLIEKFSQEQIGENIVCRVICTTGQIPIRDLSADISQVLKEKRSIKKVWTFGRNPACDYHLGNISRLSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSNQLLSQGDEITVGVGVESDILSLVIFINDKFKQCLEQNKVDRIR,KKMTFQTPTDPLE,ALA-THR-GLN-ARG-PHE-LEU-ILE-GLU-LYS-PHE-SER-GLN-GLU-GLN-ILE-GLY-GLU-ASN-ILE-VAL-CYS-ARG-VAL-ILE-CYS-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-LEU-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-SER-ARG-LEU-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-ASN-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-GLY-VAL-GLY-VAL-GLU-SER-ASP-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-CYS-LEU-GLU-GLN-ASN-LYS-VAL-ASP-ARG-ILE-ARG,LYS-LYS-MET-THR-PHE-GLN-TPO-PRO-THR-ASP-PRO-LEU-GLU,151,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(C)C)CC(=O)O)[C@H](O)C)[C@H](OP(O)(O)O)C)CCC(=O)N)Cc1ccccc1)[C@H](O)C)CCSC)NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=10.2uM,4.9914,4.99,1,M,S,1,M,S,0,,B,A,,1,1,151,13,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.9186568260192872,0.8739429712295532,79.69105529785156,84.72379302978516,0.4082426428794861,0.577768862247467,0.8954205513000488,0.8780244588851929,0.821569561958313,0.8149755597114563,KKMTFQTPTDPLE,Low,"(4.866, 5.014]",train
1OW6,protein-peptide,Q05397 P49023,SSPADSYNEGVKLQPQEISPPPTANLDRSNDKVYENVTGLVKAVIEMSSKIQPAPPEEYVPMVKEVGLALRTLLATVDETIPLLPASTHREIEMAQKLLNSDLGELINKMKLAQQYVMTSLQQEYKKQMLTAAHALAVDAKNLLDVIDQARLKMLGQTRPH,ATRELDELMASLS,SER-SER-PRO-ALA-ASP-SER-TYR-ASN-GLU-GLY-VAL-LYS-LEU-GLN-PRO-GLN-GLU-ILE-SER-PRO-PRO-PRO-THR-ALA-ASN-LEU-ASP-ARG-SER-ASN-ASP-LYS-VAL-TYR-GLU-ASN-VAL-THR-GLY-LEU-VAL-LYS-ALA-VAL-ILE-GLU-MET-SER-SER-LYS-ILE-GLN-PRO-ALA-PRO-PRO-GLU-GLU-TYR-VAL-PRO-MET-VAL-LYS-GLU-VAL-GLY-LEU-ALA-LEU-ARG-THR-LEU-LEU-ALA-THR-VAL-ASP-GLU-THR-ILE-PRO-LEU-LEU-PRO-ALA-SER-THR-HIS-ARG-GLU-ILE-GLU-MET-ALA-GLN-LYS-LEU-LEU-ASN-SER-ASP-LEU-GLY-GLU-LEU-ILE-ASN-LYS-MET-LYS-LEU-ALA-GLN-GLN-TYR-VAL-MET-THR-SER-LEU-GLN-GLN-GLU-TYR-LYS-LYS-GLN-MET-LEU-THR-ALA-ALA-HIS-ALA-LEU-ALA-VAL-ASP-ALA-LYS-ASN-LEU-LEU-ASP-VAL-ILE-ASP-GLN-ALA-ARG-LEU-LYS-MET-LEU-GLY-GLN-THR-ARG-PRO-HIS,ALA-THR-ARG-GLU-LEU-ASP-GLU-LEU-MET-ALA-SER-LEU-SER,161,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCC[NH+]=C(N)N)CCC(=O)O)CC(C)C)CC(=O)O)CCC(=O)O)CC(C)C,Kd=4uM,5.39794,5.4,1,M,S,1,M,S,0,,D,A,,1,1,161,13,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,1.0127793550491333,0.8085626363754272,75.39869689941406,81.41231536865234,0.4037917256355285,0.7864168882369995,0.8489128947257996,0.8362451791763306,0.9208437204360962,0.7628220915794373,ATRELDELMASLS,Low,"(5.31, 5.463]",train
1PRL,protein-peptide,P00523,GALAGGVTTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS,AFAPPLPRR,GLY-ALA-LEU-ALA-GLY-GLY-VAL-THR-THR-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-SER-ARG-THR-GLU-THR-ASP-LEU-SER-PHE-LYS-LYS-GLY-GLU-ARG-LEU-GLN-ILE-VAL-ASN-ASN-THR-GLU-GLY-ASP-TRP-TRP-LEU-ALA-HIS-SER-LEU-THR-THR-GLY-GLN-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-SER,ALA-PHE-ALA-PRO-PRO-LEU-PRO-ARG-ARG,64,9,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]([NH3+])C)C)C,Kd=59uM,4.229148,4.23,1,M,S,1,M,S,0,,A,C,,1,1,64,9,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.97694993019104,0.8097051382064819,92.49079895019533,86.79545593261719,0.3284200727939605,0.5076802968978882,0.8677532076835632,0.8529715538024902,0.8330161571502686,0.7988885045051575,AFAPPLPRR,Low,"(4.155, 4.319]",train
1RLP,protein-peptide,P00523,GALAGGVTTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS,RALPPLPRY,GLY-ALA-LEU-ALA-GLY-GLY-VAL-THR-THR-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-SER-ARG-THR-GLU-THR-ASP-LEU-SER-PHE-LYS-LYS-GLY-GLU-ARG-LEU-GLN-ILE-VAL-ASN-ASN-THR-GLU-GLY-ASP-TRP-TRP-LEU-ALA-HIS-SER-LEU-THR-THR-GLY-GLN-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-SER,ARG-ALA-LEU-PRO-PRO-LEU-PRO-ARG-TYR,64,9,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)CC(C)C)C,Kd=8.0uM,5.09691,5.1,1,M,S,1,M,S,0,,R,C,,1,1,64,9,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.979382336139679,0.8346874713897705,93.86754608154295,86.42752838134766,0.3501115143299103,0.5394367575645447,0.8433496356010437,0.8478954434394836,0.8335959911346436,0.8020886182785034,RALPPLPRY,Low,"(5.014, 5.105]",val
4TK3,protein-peptide,P20236 Q03555,MSPFPLTSMDKAFITVLEMTPVLGTEIINYRDGMGRVLAQDVYAKDNLPPFPASVKDGYAVRAADGPGDRFIIGESQAGEQPTQTVMPGQVMRVTTGAPIPCGADAVVQVEDTELIRESDDGTEELEVRILVQARPGQDIRPIGHDIKRGECVLAKGTHMGPSEIGLLATVGVTEVEVNKFPVVAVMSTGNELLNPEDDLLPGKIRDSNRSTLLATIQEHGYPTINLGIVGDNPDDLLNALNEGISRADVIITSGGVSMGEKDYLKQVLDIDLHAQIHFGRVFMKPGLPTTFATLDIDGVRKIIFALPGNPVSAVVTCNLFVVPALRKMQGILDPRPTIIKARLSCDVKLDPRPEYHRCILTWHHQEPLPWAQSTGNQMSSRLMSMRSANGLLMLPPKTEQYVELHKGEVVDVMVIGRL,FSIVGTLYPIN,MET-SER-PRO-PHE-PRO-LEU-THR-SER-MET-ASP-LYS-ALA-PHE-ILE-THR-VAL-LEU-GLU-MET-THR-PRO-VAL-LEU-GLY-THR-GLU-ILE-ILE-ASN-TYR-ARG-ASP-GLY-MET-GLY-ARG-VAL-LEU-ALA-GLN-ASP-VAL-TYR-ALA-LYS-ASP-ASN-LEU-PRO-PRO-PHE-PRO-ALA-SER-VAL-LYS-ASP-GLY-TYR-ALA-VAL-ARG-ALA-ALA-ASP-GLY-PRO-GLY-ASP-ARG-PHE-ILE-ILE-GLY-GLU-SER-GLN-ALA-GLY-GLU-GLN-PRO-THR-GLN-THR-VAL-MET-PRO-GLY-GLN-VAL-MET-ARG-VAL-THR-THR-GLY-ALA-PRO-ILE-PRO-CYS-GLY-ALA-ASP-ALA-VAL-VAL-GLN-VAL-GLU-ASP-THR-GLU-LEU-ILE-ARG-GLU-SER-ASP-ASP-GLY-THR-GLU-GLU-LEU-GLU-VAL-ARG-ILE-LEU-VAL-GLN-ALA-ARG-PRO-GLY-GLN-ASP-ILE-ARG-PRO-ILE-GLY-HIS-ASP-ILE-LYS-ARG-GLY-GLU-CYS-VAL-LEU-ALA-LYS-GLY-THR-HIS-MET-GLY-PRO-SER-GLU-ILE-GLY-LEU-LEU-ALA-THR-VAL-GLY-VAL-THR-GLU-VAL-GLU-VAL-ASN-LYS-PHE-PRO-VAL-VAL-ALA-VAL-MET-SER-THR-GLY-ASN-GLU-LEU-LEU-ASN-PRO-GLU-ASP-ASP-LEU-LEU-PRO-GLY-LYS-ILE-ARG-ASP-SER-ASN-ARG-SER-THR-LEU-LEU-ALA-THR-ILE-GLN-GLU-HIS-GLY-TYR-PRO-THR-ILE-ASN-LEU-GLY-ILE-VAL-GLY-ASP-ASN-PRO-ASP-ASP-LEU-LEU-ASN-ALA-LEU-ASN-GLU-GLY-ILE-SER-ARG-ALA-ASP-VAL-ILE-ILE-THR-SER-GLY-GLY-VAL-SER-MET-GLY-GLU-LYS-ASP-TYR-LEU-LYS-GLN-VAL-LEU-ASP-ILE-ASP-LEU-HIS-ALA-GLN-ILE-HIS-PHE-GLY-ARG-VAL-PHE-MET-LYS-PRO-GLY-LEU-PRO-THR-THR-PHE-ALA-THR-LEU-ASP-ILE-ASP-GLY-VAL-ARG-LYS-ILE-ILE-PHE-ALA-LEU-PRO-GLY-ASN-PRO-VAL-SER-ALA-VAL-VAL-THR-CYS-ASN-LEU-PHE-VAL-VAL-PRO-ALA-LEU-ARG-LYS-MET-GLN-GLY-ILE-LEU-ASP-PRO-ARG-PRO-THR-ILE-ILE-LYS-ALA-ARG-LEU-SER-CYS-ASP-VAL-LYS-LEU-ASP-PRO-ARG-PRO-GLU-TYR-HIS-ARG-CYS-ILE-LEU-THR-TRP-HIS-HIS-GLN-GLU-PRO-LEU-PRO-TRP-ALA-GLN-SER-THR-GLY-ASN-GLN-MET-SER-SER-ARG-LEU-MET-SER-MET-ARG-SER-ALA-ASN-GLY-LEU-LEU-MET-LEU-PRO-PRO-LYS-THR-GLU-GLN-TYR-VAL-GLU-LEU-HIS-LYS-GLY-GLU-VAL-VAL-ASP-VAL-MET-VAL-ILE-GLY-ARG-LEU,PHE-SER-ILE-VAL-GLY-THR-LEU-TYR-PRO-ILE-ASN,419,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1ccc(cc1)O)CC(C)C)[C@H](O)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CO)C,Kd=8uM,5.09691,5.1,1,M,S,1,M,S,0,,C,A,dimer,1,1,419,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.7507704496383667,0.5990718007087708,80.61048889160156,83.22669982910156,0.4981378018856048,1.149379849433899,0.8370406627655029,0.8137066960334778,0.7132144570350647,0.545413076877594,FSIVGTLYPIN,Low,"(5.014, 5.105]",train
4U0C,protein-peptide,P49790 P12493,PIVQNLQGQMVHQCISPRTLNAWVKVVEEKAFSPEVIPMFSALSCGATPQDLNTMLNTVGGHQAAMQMLKETINEEAAEWDRLHPVHAGPIAPGQMREPRGSDIAGTTSTLQEQIGWMTHNPPIPVGEIYKRWIILGLNKIVRMYSPTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKNAATETLLVQNANPDCKTILKALGPGATLEEMMTACQGVGGPGHKARVL,TNNSPSGVFTFGANSST,PRO-ILE-VAL-GLN-ASN-LEU-GLN-GLY-GLN-MET-VAL-HIS-GLN-CYS-ILE-SER-PRO-ARG-THR-LEU-ASN-ALA-TRP-VAL-LYS-VAL-VAL-GLU-GLU-LYS-ALA-PHE-SER-PRO-GLU-VAL-ILE-PRO-MET-PHE-SER-ALA-LEU-SER-CYS-GLY-ALA-THR-PRO-GLN-ASP-LEU-ASN-THR-MET-LEU-ASN-THR-VAL-GLY-GLY-HIS-GLN-ALA-ALA-MET-GLN-MET-LEU-LYS-GLU-THR-ILE-ASN-GLU-GLU-ALA-ALA-GLU-TRP-ASP-ARG-LEU-HIS-PRO-VAL-HIS-ALA-GLY-PRO-ILE-ALA-PRO-GLY-GLN-MET-ARG-GLU-PRO-ARG-GLY-SER-ASP-ILE-ALA-GLY-THR-THR-SER-THR-LEU-GLN-GLU-GLN-ILE-GLY-TRP-MET-THR-HIS-ASN-PRO-PRO-ILE-PRO-VAL-GLY-GLU-ILE-TYR-LYS-ARG-TRP-ILE-ILE-LEU-GLY-LEU-ASN-LYS-ILE-VAL-ARG-MET-TYR-SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-ALA-ALA-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,THR-ASN-ASN-SER-PRO-SER-GLY-VAL-PHE-THR-PHE-GLY-ALA-ASN-SER-SER-THR,231,17,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccccc1)[C@H](O)C)Cc1ccccc1)C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)[NH3+],Kd=49uM,4.309804,4.31,1,M,S,1,M,S,0,,B,A,,1,1,231,17,0,CC(C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.726678192615509,0.5791422724723816,69.60860443115234,69.83451843261719,0.6379510760307312,1.1717326641082764,0.6921942830085754,0.687067985534668,0.6899362206459045,0.5521607995033264,TNNSPSGVFTFGANSST,Low,"(4.155, 4.319]",train
6ERW,protein-peptide,P25321 G3HK48,GHMGNAAAAKKGSEQESVKEFLAKAKEEFLKKWESPSQNTAQLDHFDRIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGRRNAI,GLY-HIS-MET-GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SEP-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-GLU-PHE-LEU-LYS-LYS-TRP-GLU-SER-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-HIS-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-PRO-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SEP-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-ARG-ARG-ASN-ALA-ILE,353,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C)CC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](O)C)CCC[NH+]=C(N)N)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O)C)CC(=O)O)Cc1ccccc1)C,Kd=4.32uM,5.364516,5.36,1,M,S,1,M,S,0,,D,A,,0,1,353,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.9683915972709656,0.7488284707069397,87.77328491210938,82.6702651977539,0.3705700635910034,0.9750299453735352,0.9277753233909608,0.8667649626731873,0.929691195487976,0.6980978846549988,TTYADFIASGRTGRRNAI,Low,"(5.31, 5.463]",train
6EM7,protein-peptide,P25321 G3HK48,GHMGNAAAAKKGSEQESVKEFLAKAKEEFLKKWESPSQNTAQLDHFDRIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGRRSAI,GLY-HIS-MET-GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SER-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-GLU-PHE-LEU-LYS-LYS-TRP-GLU-SER-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-HIS-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-PRO-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SEP-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-ARG-ARG-SER-ALA-ILE,353,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C)CO)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](O)C)CCC[NH+]=C(N)N)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O)C)CC(=O)O)Cc1ccccc1)C,Kd=29.6uM,4.528708,4.53,1,M,S,1,M,S,0,,D,A,,0,1,353,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.9717244505882264,0.7496545910835266,88.72166442871094,82.57954406738281,0.3598460257053375,0.914289116859436,0.9341424703598022,0.8708464503288269,0.9356347322463988,0.7034217715263367,TTYADFIASGRTGRRSAI,Low,"(4.456, 4.606]",val
6DA1,protein-peptide,P27577,KGTFKDYVRDRADLNKDKPVIPAAALAGYTGSGPIQLWQFLLELLTDKSCQSFISWTGDGWEFKLSDPDEVARRWGKRKNKPKMNYEKLSRGLRYYYDKNIIHKTAGKRYVYRFVCDLQSLLGYTPEELHAMLDVKPDAD,PSFDSFDFEDFPAALW,LYS-GLY-THR-PHE-LYS-ASP-TYR-VAL-ARG-ASP-ARG-ALA-ASP-LEU-ASN-LYS-ASP-LYS-PRO-VAL-ILE-PRO-ALA-ALA-ALA-LEU-ALA-GLY-TYR-THR-GLY-SER-GLY-PRO-ILE-GLN-LEU-TRP-GLN-PHE-LEU-LEU-GLU-LEU-LEU-THR-ASP-LYS-SER-CYS-GLN-SER-PHE-ILE-SER-TRP-THR-GLY-ASP-GLY-TRP-GLU-PHE-LYS-LEU-SER-ASP-PRO-ASP-GLU-VAL-ALA-ARG-ARG-TRP-GLY-LYS-ARG-LYS-ASN-LYS-PRO-LYS-MET-ASN-TYR-GLU-LYS-LEU-SER-ARG-GLY-LEU-ARG-TYR-TYR-TYR-ASP-LYS-ASN-ILE-ILE-HIS-LYS-THR-ALA-GLY-LYS-ARG-TYR-VAL-TYR-ARG-PHE-VAL-CYS-ASP-LEU-GLN-SER-LEU-LEU-GLY-TYR-THR-PRO-GLU-GLU-LEU-HIS-ALA-MET-LEU-ASP-VAL-LYS-PRO-ASP-ALA-ASP,PRO-SEP-PF5-ASP-SEP-PF5-ASP-PF5-GLU-ASP-PF5-PRO-ALA-ALA-LEU-TRP-NH2,140,17,CC(C[C@@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c(F)c(F)c(c(c1F)F)F)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c(F)c(F)c(c(c1F)F)F)NC(=O)[C@@H](NC(=O)[C@H](Cc1c(F)c(F)c(c(c1F)F)F)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c(F)c(F)c(c(c1F)F)F)NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)COP(O)(O)O)CC(=O)O)COP(O)(O)O)CC(=O)O)CCC(=O)O)CC(=O)O)C)C)C,Kd=9uM,5.045757,5.05,1,M,S,1,M,S,0,,C,A,dimer,1,1,140,17,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)O)NC(=O)C(Cc1c(F)c(F)c(F)c(F)c1F)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)O)NC(=O)C(Cc1c(F)c(F)c(F)c(F)c1F)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O,0.9139273762702942,0.883884072303772,91.65728759765624,83.05067443847656,0.3996906876564026,0.6394236087799072,0.9013659358024596,0.8788707256317139,0.8529651761054993,0.8494231104850769,PSFDSFDFEDFPAALW,Low,"(5.014, 5.105]",train
3T6B,protein-peptide,Q9NY33,MADTQYILPNDIGVSSLDCREAFRLLSPTERLYAYHLSRAAWYGGLAVLLQTSPEAPYIYALLSRLFRAQDPDQLRQHALAEGLTEEEYQAFLVYAAGVYSNMGNYKSFGDTKFVPNLPKEKLERVILGSEAAQQHPEEVRGLWQTCGELMFSLEPRLRHLGLGKEGITTYFSGNCTMEDAKLAQDFLDSQNLSAYNTRLFKEVDGEGKPYYEVRLASVLGSEPSLDSEVTSKLKSYEFRGSPFQVTRGDYAPILQKVVEQLEKAKAYAANSHQGQMLAQYIESFTQGSIEAHKRGSRFWIQDKGPIVESYIGFIESYRDPFGSRGEFEGFVAVVNKAMSAKFERLVASAEQLLKELPWPPTFEKDKFLTPDFTSLDVLTFAGSGIPAGINIPNYDDLRQTEGFKNVSLGNVLAVAYATQREKLTFLEEDDKDLYILWKGPSFDVQVGLHALLGHGSGKLFVQDEKGAFNFDQETVINPETGEQIQSWYRSGETWDSKFSTIASSYEECRAESVGLYLCLHPQVLEIFGFEGADAEDVIYVNWLNMVRAGLLALEFYTPEAFNWRQAHMQARFVILRVLLEAGEGLVTITPTTGSDGRPDARVRLDRSKIRSVGKPALERFLRRLQVLKSTGDVAGGRALYEGYATVTDAPPECFLTLRDTVLLRKESRKLIVQPNTRLEGSDVQLLEYEASAAGLIRSFSERFPEDGPELEEILTQLATADARFW,VVYPW,MET-ALA-ASP-THR-GLN-TYR-ILE-LEU-PRO-ASN-ASP-ILE-GLY-VAL-SER-SER-LEU-ASP-CYS-ARG-GLU-ALA-PHE-ARG-LEU-LEU-SER-PRO-THR-GLU-ARG-LEU-TYR-ALA-TYR-HIS-LEU-SER-ARG-ALA-ALA-TRP-TYR-GLY-GLY-LEU-ALA-VAL-LEU-LEU-GLN-THR-SER-PRO-GLU-ALA-PRO-TYR-ILE-TYR-ALA-LEU-LEU-SER-ARG-LEU-PHE-ARG-ALA-GLN-ASP-PRO-ASP-GLN-LEU-ARG-GLN-HIS-ALA-LEU-ALA-GLU-GLY-LEU-THR-GLU-GLU-GLU-TYR-GLN-ALA-PHE-LEU-VAL-TYR-ALA-ALA-GLY-VAL-TYR-SER-ASN-MET-GLY-ASN-TYR-LYS-SER-PHE-GLY-ASP-THR-LYS-PHE-VAL-PRO-ASN-LEU-PRO-LYS-GLU-LYS-LEU-GLU-ARG-VAL-ILE-LEU-GLY-SER-GLU-ALA-ALA-GLN-GLN-HIS-PRO-GLU-GLU-VAL-ARG-GLY-LEU-TRP-GLN-THR-CYS-GLY-GLU-LEU-MET-PHE-SER-LEU-GLU-PRO-ARG-LEU-ARG-HIS-LEU-GLY-LEU-GLY-LYS-GLU-GLY-ILE-THR-THR-TYR-PHE-SER-GLY-ASN-CYS-THR-MET-GLU-ASP-ALA-LYS-LEU-ALA-GLN-ASP-PHE-LEU-ASP-SER-GLN-ASN-LEU-SER-ALA-TYR-ASN-THR-ARG-LEU-PHE-LYS-GLU-VAL-ASP-GLY-GLU-GLY-LYS-PRO-TYR-TYR-GLU-VAL-ARG-LEU-ALA-SER-VAL-LEU-GLY-SER-GLU-PRO-SER-LEU-ASP-SER-GLU-VAL-THR-SER-LYS-LEU-LYS-SER-TYR-GLU-PHE-ARG-GLY-SER-PRO-PHE-GLN-VAL-THR-ARG-GLY-ASP-TYR-ALA-PRO-ILE-LEU-GLN-LYS-VAL-VAL-GLU-GLN-LEU-GLU-LYS-ALA-LYS-ALA-TYR-ALA-ALA-ASN-SER-HIS-GLN-GLY-GLN-MET-LEU-ALA-GLN-TYR-ILE-GLU-SER-PHE-THR-GLN-GLY-SER-ILE-GLU-ALA-HIS-LYS-ARG-GLY-SER-ARG-PHE-TRP-ILE-GLN-ASP-LYS-GLY-PRO-ILE-VAL-GLU-SER-TYR-ILE-GLY-PHE-ILE-GLU-SER-TYR-ARG-ASP-PRO-PHE-GLY-SER-ARG-GLY-GLU-PHE-GLU-GLY-PHE-VAL-ALA-VAL-VAL-ASN-LYS-ALA-MET-SER-ALA-LYS-PHE-GLU-ARG-LEU-VAL-ALA-SER-ALA-GLU-GLN-LEU-LEU-LYS-GLU-LEU-PRO-TRP-PRO-PRO-THR-PHE-GLU-LYS-ASP-LYS-PHE-LEU-THR-PRO-ASP-PHE-THR-SER-LEU-ASP-VAL-LEU-THR-PHE-ALA-GLY-SER-GLY-ILE-PRO-ALA-GLY-ILE-ASN-ILE-PRO-ASN-TYR-ASP-ASP-LEU-ARG-GLN-THR-GLU-GLY-PHE-LYS-ASN-VAL-SER-LEU-GLY-ASN-VAL-LEU-ALA-VAL-ALA-TYR-ALA-THR-GLN-ARG-GLU-LYS-LEU-THR-PHE-LEU-GLU-GLU-ASP-ASP-LYS-ASP-LEU-TYR-ILE-LEU-TRP-LYS-GLY-PRO-SER-PHE-ASP-VAL-GLN-VAL-GLY-LEU-HIS-ALA-LEU-LEU-GLY-HIS-GLY-SER-GLY-LYS-LEU-PHE-VAL-GLN-ASP-GLU-LYS-GLY-ALA-PHE-ASN-PHE-ASP-GLN-GLU-THR-VAL-ILE-ASN-PRO-GLU-THR-GLY-GLU-GLN-ILE-GLN-SER-TRP-TYR-ARG-SER-GLY-GLU-THR-TRP-ASP-SER-LYS-PHE-SER-THR-ILE-ALA-SER-SER-TYR-GLU-GLU-CYS-ARG-ALA-GLU-SER-VAL-GLY-LEU-TYR-LEU-CYS-LEU-HIS-PRO-GLN-VAL-LEU-GLU-ILE-PHE-GLY-PHE-GLU-GLY-ALA-ASP-ALA-GLU-ASP-VAL-ILE-TYR-VAL-ASN-TRP-LEU-ASN-MET-VAL-ARG-ALA-GLY-LEU-LEU-ALA-LEU-GLU-PHE-TYR-THR-PRO-GLU-ALA-PHE-ASN-TRP-ARG-GLN-ALA-HIS-MET-GLN-ALA-ARG-PHE-VAL-ILE-LEU-ARG-VAL-LEU-LEU-GLU-ALA-GLY-GLU-GLY-LEU-VAL-THR-ILE-THR-PRO-THR-THR-GLY-SER-ASP-GLY-ARG-PRO-ASP-ALA-ARG-VAL-ARG-LEU-ASP-ARG-SER-LYS-ILE-ARG-SER-VAL-GLY-LYS-PRO-ALA-LEU-GLU-ARG-PHE-LEU-ARG-ARG-LEU-GLN-VAL-LEU-LYS-SER-THR-GLY-ASP-VAL-ALA-GLY-GLY-ARG-ALA-LEU-TYR-GLU-GLY-TYR-ALA-THR-VAL-THR-ASP-ALA-PRO-PRO-GLU-CYS-PHE-LEU-THR-LEU-ARG-ASP-THR-VAL-LEU-LEU-ARG-LYS-GLU-SER-ARG-LYS-LEU-ILE-VAL-GLN-PRO-ASN-THR-ARG-LEU-GLU-GLY-SER-ASP-VAL-GLN-LEU-LEU-GLU-TYR-GLU-ALA-SER-ALA-ALA-GLY-LEU-ILE-ARG-SER-PHE-SER-GLU-ARG-PHE-PRO-GLU-ASP-GLY-PRO-GLU-LEU-GLU-GLU-ILE-LEU-THR-GLN-LEU-ALA-THR-ALA-ASP-ALA-ARG-PHE-TRP,VAL-VAL-TYR-PRO-TRP,726,5,OC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)[NH3+],Kd=0.44uM,6.356547,6.36,1,M,S,1,M,S,0,,C,A,,1,1,726,5,0,CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,0.941153645515442,0.9136239290237428,89.17964935302734,87.19481658935547,0.3770602643489837,0.458658903837204,0.9240679144859314,0.9127925038337708,0.9411500692367554,0.9138317108154296,VVYPW,Low,"(6.26, 6.398]",train
1G1E,protein-peptide,Q05195 Q60520,SLQNNQPVEFNHAINYVNKIKNRFQGQPDIYKAFLEILHTYQKEQRNAKEAGGNYTPALTEQEVYAQVARLFKNQEDLLSEFGQFLPDA,RMNIQMLLEAADYLER,SER-LEU-GLN-ASN-ASN-GLN-PRO-VAL-GLU-PHE-ASN-HIS-ALA-ILE-ASN-TYR-VAL-ASN-LYS-ILE-LYS-ASN-ARG-PHE-GLN-GLY-GLN-PRO-ASP-ILE-TYR-LYS-ALA-PHE-LEU-GLU-ILE-LEU-HIS-THR-TYR-GLN-LYS-GLU-GLN-ARG-ASN-ALA-LYS-GLU-ALA-GLY-GLY-ASN-TYR-THR-PRO-ALA-LEU-THR-GLU-GLN-GLU-VAL-TYR-ALA-GLN-VAL-ALA-ARG-LEU-PHE-LYS-ASN-GLN-GLU-ASP-LEU-LEU-SER-GLU-PHE-GLY-GLN-PHE-LEU-PRO-ASP-ALA,ARG-MET-ASN-ILE-GLN-MET-LEU-LEU-GLU-ALA-ALA-ASP-TYR-LEU-GLU-ARG,89,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC(=O)O)CC(C)C)Cc1ccc(cc1)O)CC(=O)O)C)C)CCC(=O)O)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCSC)CC(=O)N)CCC(=O)N,Kd=29nM,7.537602,7.54,1,M,T,1,M,T,0,,A,B,,1,1,89,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,1.0375573635101318,0.7246644496917725,85.4950942993164,85.59500885009766,0.3407523334026336,0.905049443244934,0.8991998434066772,0.7706727385520935,0.911432445049286,0.6850724220275879,RMNIQMLLEAADYLER,Moderate,"(7.523, 7.921]",train
1GBQ,protein-peptide,Q60631 Q62245,GSRRASVGSMEAIAKYDFKATADDELSFKRGDILKVLNEECDQNWYKAELNGKDGFIPKNYIEMKPHPEFIVTD,VPPPVPPRRR,GLY-SER-ARG-ARG-ALA-SER-VAL-GLY-SER-MET-GLU-ALA-ILE-ALA-LYS-TYR-ASP-PHE-LYS-ALA-THR-ALA-ASP-ASP-GLU-LEU-SER-PHE-LYS-ARG-GLY-ASP-ILE-LEU-LYS-VAL-LEU-ASN-GLU-GLU-CYS-ASP-GLN-ASN-TRP-TYR-LYS-ALA-GLU-LEU-ASN-GLY-LYS-ASP-GLY-PHE-ILE-PRO-LYS-ASN-TYR-ILE-GLU-MET-LYS-PRO-HIS-PRO-GLU-PHE-ILE-VAL-THR-ASP,ACE-VAL-PRO-PRO-PRO-VAL-PRO-PRO-ARG-ARG-ARG-NH2,74,12,CC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C(C)C)C(C)C,Kd=3.5mM,2.455932,2.46,1,M,T,1,M,T,0,,B,A,,1,1,74,12,0,CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,,CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,1.0133365392684937,0.9932512640953064,89.18037414550781,84.16038513183594,0.3741063475608825,0.503009557723999,0.8292811512947083,0.8568124771118164,0.8435765504837036,0.8584420084953308,VPPPVPPRRR,Low,"(2.044, 3.548]",train
1J7Z,protein-peptide,P61823,SSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,KETAAAKFERQHMDS,SER-SER-SER-ASN-TYR-CYS-ASN-GLN-MET-MET-LYS-SER-ARG-ASN-LEU-THR-LYS-ASP-ARG-CYS-LYS-PRO-VAL-ASN-THR-PHE-VAL-HIS-GLU-SER-LEU-ALA-ASP-VAL-GLN-ALA-VAL-CYS-SER-GLN-LYS-ASN-VAL-ALA-CYS-LYS-ASN-GLY-GLN-THR-ASN-CYS-TYR-GLN-SER-TYR-SER-THR-MET-SER-ILE-THR-ASP-CYS-ARG-GLU-THR-GLY-SER-SER-LYS-TYR-PRO-ASN-CYS-ALA-TYR-LYS-THR-THR-GLN-ALA-ASN-LYS-HIS-ILE-ILE-VAL-ALA-CYS-GLU-GLY-ASN-PRO-TYR-VAL-PRO-VAL-HIS-PHE-ASP-ALA-SER-VAL,LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-NH2,104,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CC(=O)O)CCSC)Cc1nc[nH]c1)CCC(=O)N)CCC[NH+]=C(N)N)CCC(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)O)C)C)C,Kd=0.02uM,7.69897,7.7,1,M,T,1,M,T,0,,A,B,,1,1,104,16,0,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9940691590309144,0.7797436714172363,97.88999938964844,90.59931182861328,0.2957324087619781,0.747259259223938,0.9322038888931274,0.8388468027114868,0.9307539463043212,0.7649678587913513,KETAAAKFERQHMDS,Moderate,"(7.523, 7.921]",train
1MXL,protein-peptide,P19429 P63316,MDDIYKAAVEQLTEEQKNEFKAAFDIFVLGAEDGCISTKELGKVMRMLGQNPTPEELQEMIDEVDEDGSGTVDFDEFLVMMVRCMKDDS,RISADAMMQALLGARAK,MET-ASP-ASP-ILE-TYR-LYS-ALA-ALA-VAL-GLU-GLN-LEU-THR-GLU-GLU-GLN-LYS-ASN-GLU-PHE-LYS-ALA-ALA-PHE-ASP-ILE-PHE-VAL-LEU-GLY-ALA-GLU-ASP-GLY-CYS-ILE-SER-THR-LYS-GLU-LEU-GLY-LYS-VAL-MET-ARG-MET-LEU-GLY-GLN-ASN-PRO-THR-PRO-GLU-GLU-LEU-GLN-GLU-MET-ILE-ASP-GLU-VAL-ASP-GLU-ASP-GLY-SER-GLY-THR-VAL-ASP-PHE-ASP-GLU-PHE-LEU-VAL-MET-MET-VAL-ARG-CYS-MET-LYS-ASP-ASP-SER,ARG-ILE-SER-ALA-ASP-ALA-MET-MET-GLN-ALA-LEU-LEU-GLY-ALA-ARG-ALA-LYS,89,17,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO)C)CC(=O)O)C)CCSC)CCSC)CCC(=O)N)C)CC(C)C)CC(C)C)C)CCC[NH+]=C(N)N)C,Kd=154uM,3.812479,3.81,1,M,T,1,M,T,0,,I,C,,0,1,89,17,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8274192810058594,0.7461811900138855,76.3915023803711,66.53656005859375,0.4580540359020233,0.8088176250457764,0.8104564547538757,0.7988189458847046,0.73142409324646,0.7330216765403748,RISADAMMQALLGARAK,Low,"(3.548, 3.924]",train
4X1N,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAYHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKE,CPAYSAYLDC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU,CYS-PRO-ALA-TYR-SER-ALA-TYR-LEU-ASP-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)Cc1ccc(cc1)O)CC(C)C)CC(=O)O)C(=O)O,Kd=0.38uM,6.420216,6.42,1,M,T,1,M,T,0,,P,U,,0,1,247,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,0.9089052081108092,0.789559006690979,95.27230072021484,94.69644927978516,0.3317539989948272,0.6615520715713501,0.9570128321647644,0.9119446277618408,0.8725592494010925,0.7589625120162964,CPAYSAYLDC,Low,"(6.398, 6.523]",val
4Y32,protein-peptide,P31947 P10636,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,RTPSLPT,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,ARG-THR-PRO-SEP-LEU-PRO-THR,236,7,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])COP(O)(O)O)C,IC50=90.1uM,4.045275,4.05,1,M,T,1,M,T,0,,C,A,,1,1,236,7,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9602588415145874,0.8742997646331787,91.98480987548828,91.53380584716795,0.3117548525333404,0.4819217324256897,0.9464130401611328,0.9244203567504884,0.9457162022590636,0.8617696166038513,RTPSLPT,Low,"(3.924, 4.155]",train
5A2J,protein-peptide,P01727 P01801,QVQLQESGGGLVQPGGSMKLSCVASGFTFSNYWMNWVRQSPEKGLEWVAEIRLKSNNYATHYAESVKGRFTISRDDSKSSVYLQMNNLRAEDTGIYYCTGVGQFAYWGQGTTVTVSASSGGGGSGGGGGSSGSSDIVVTQESALTTSPGETVTLTCRSSTGAVTTSNYANWVQEKPDHLFTGLIGGTNNRAPGVPARFSGSLIGDKAALTITGAQTEDEAIYFCALWYSNHWVFGGGTKLTVLG,APDTRP,GLN-VAL-GLN-LEU-GLN-GLU-SER-GLY-GLY-GLY-LEU-VAL-GLN-PRO-GLY-GLY-SER-MET-LYS-LEU-SER-CYS-VAL-ALA-SER-GLY-PHE-THR-PHE-SER-ASN-TYR-TRP-MET-ASN-TRP-VAL-ARG-GLN-SER-PRO-GLU-LYS-GLY-LEU-GLU-TRP-VAL-ALA-GLU-ILE-ARG-LEU-LYS-SER-ASN-ASN-TYR-ALA-THR-HIS-TYR-ALA-GLU-SER-VAL-LYS-GLY-ARG-PHE-THR-ILE-SER-ARG-ASP-ASP-SER-LYS-SER-SER-VAL-TYR-LEU-GLN-MET-ASN-ASN-LEU-ARG-ALA-GLU-ASP-THR-GLY-ILE-TYR-TYR-CYS-THR-GLY-VAL-GLY-GLN-PHE-ALA-TYR-TRP-GLY-GLN-GLY-THR-THR-VAL-THR-VAL-SER-ALA-SER-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-GLY-SER-SER-GLY-SER-SER-ASP-ILE-VAL-VAL-THR-GLN-GLU-SER-ALA-LEU-THR-THR-SER-PRO-GLY-GLU-THR-VAL-THR-LEU-THR-CYS-ARG-SER-SER-THR-GLY-ALA-VAL-THR-THR-SER-ASN-TYR-ALA-ASN-TRP-VAL-GLN-GLU-LYS-PRO-ASP-HIS-LEU-PHE-THR-GLY-LEU-ILE-GLY-GLY-THR-ASN-ASN-ARG-ALA-PRO-GLY-VAL-PRO-ALA-ARG-PHE-SER-GLY-SER-LEU-ILE-GLY-ASP-LYS-ALA-ALA-LEU-THR-ILE-THR-GLY-ALA-GLN-THR-GLU-ASP-GLU-ALA-ILE-TYR-PHE-CYS-ALA-LEU-TRP-TYR-SER-ASN-HIS-TRP-VAL-PHE-GLY-GLY-GLY-THR-LYS-LEU-THR-VAL-LEU-GLY,ALA-PRO-ASP-THR-ARG-PRO,244,6,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC[NH+]=C(N)N)[C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C,Kd=1.4uM,5.853872,5.85,1,M,T,1,M,T,0,,P,H,,1,1,244,6,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9636625051498412,0.8660576939582825,94.45539855957033,93.16511535644533,0.3449439108371734,0.5424516201019287,0.9243724346160888,0.9031391143798828,0.910984992980957,0.8081192970275879,APDTRP,Low,"(5.821, 5.959]",train
5NWI,protein-peptide,Q39128 P93343,PGMAVAPTAREENVYMAKLAEQAERYEEMVEFMEKVSNSLGSEELTVEERNLLSVAYKNVIGARRASWRIISSIEQKEESRGNEEHVNSIREYRSKIENELSKICDGILKLLDAKLIPSAASGDSKVFYLKMKGDYHRYLAEFKTGAERKEAAESTLTAYKAAQDIATTELAPTHPIRLGLALNFSVFYYEILNSPDRACNLAKQAFDEAIAELDTLGEESYKDSTLIMQLLRDNLTLWTSDMQDDGADEIKEDPKPDEAKN,YFSSN,PRO-GLY-MET-ALA-VAL-ALA-PRO-THR-ALA-ARG-GLU-GLU-ASN-VAL-TYR-MET-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-GLU-MET-VAL-GLU-PHE-MET-GLU-LYS-VAL-SER-ASN-SER-LEU-GLY-SER-GLU-GLU-LEU-THR-VAL-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-ILE-GLY-ALA-ARG-ARG-ALA-SER-TRP-ARG-ILE-ILE-SER-SER-ILE-GLU-GLN-LYS-GLU-GLU-SER-ARG-GLY-ASN-GLU-GLU-HIS-VAL-ASN-SER-ILE-ARG-GLU-TYR-ARG-SER-LYS-ILE-GLU-ASN-GLU-LEU-SER-LYS-ILE-CYS-ASP-GLY-ILE-LEU-LYS-LEU-LEU-ASP-ALA-LYS-LEU-ILE-PRO-SER-ALA-ALA-SER-GLY-ASP-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-HIS-ARG-TYR-LEU-ALA-GLU-PHE-LYS-THR-GLY-ALA-GLU-ARG-LYS-GLU-ALA-ALA-GLU-SER-THR-LEU-THR-ALA-TYR-LYS-ALA-ALA-GLN-ASP-ILE-ALA-THR-THR-GLU-LEU-ALA-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-ASP-ARG-ALA-CYS-ASN-LEU-ALA-LYS-GLN-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-GLY-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-MET-GLN-ASP-ASP-GLY-ALA-ASP-GLU-ILE-LYS-GLU-ASP-PRO-LYS-PRO-ASP-GLU-ALA-LYS-ASN,TYR-PHE-SER-SEP-ASN,262,5,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)COP(O)(O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+],Kd=0.69uM,6.161151,6.16,1,M,T,1,M,T,0,,P,A,,1,1,262,5,0,NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O,NC(=O)C[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,NC(=O)C[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9770779609680176,0.95420503616333,80.07951354980469,81.56975555419922,0.3520701825618744,0.478413462638855,0.9023590683937072,0.886790931224823,0.9255329370498656,0.909035623073578,YFSSN,Low,"(6.097, 6.26]",train
5UL6,protein-peptide,P46108 Q99AU3,AEYVRALFDFNGNDEEDLPFKKGDILRIRDKPEEQWWNAEDSEGKRGMIPVPYVEKYR,YGRPPLPPKQKRK,ALA-GLU-TYR-VAL-ARG-ALA-LEU-PHE-ASP-PHE-ASN-GLY-ASN-ASP-GLU-GLU-ASP-LEU-PRO-PHE-LYS-LYS-GLY-ASP-ILE-LEU-ARG-ILE-ARG-ASP-LYS-PRO-GLU-GLU-GLN-TRP-TRP-ASN-ALA-GLU-ASP-SER-GLU-GLY-LYS-ARG-GLY-MET-ILE-PRO-VAL-PRO-TYR-VAL-GLU-LYS-TYR-ARG,ACE-TYR-GLY-ARG-PRO-PRO-LEU-PRO-PRO-LYS-GLN-LYS-ARG-LYS-NH2,58,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCCC[NH3+])CCC[NH+]=C(N)N)CCCC[NH3+])CCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C)CCC[NH+]=C(N)N)CC(C)C,Kd=0.006uM,8.221849,8.22,1,M,S,1,M,S,0,,M,A,,1,1,58,15,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9528594613075256,0.797360897064209,95.9962387084961,94.83643341064452,0.2984058856964111,0.6012235283851624,0.9029077887535096,0.842498779296875,0.8509107828140259,0.7860763669013977,YGRPPLPPKQKRK,Moderate,"(7.921, 8.383]",train
6ASZ,protein-peptide,P05205 P02299,MKKHHHHHHAEEEEEEFAVEKIIDRRVRKGMVEYYLKWKGYPETENTWEPENNLDCQDLIQQYEASRKD,QTARKS,MET-LYS-LYS-HIS-HIS-HIS-HIS-HIS-HIS-ALA-GLU-GLU-GLU-GLU-GLU-GLU-PHE-ALA-VAL-GLU-LYS-ILE-ILE-ASP-ARG-ARG-VAL-ARG-LYS-GLY-MET-VAL-GLU-TYR-TYR-LEU-LYS-TRP-LYS-GLY-TYR-PRO-GLU-THR-GLU-ASN-THR-TRP-GLU-PRO-GLU-ASN-ASN-LEU-ASP-CYS-GLN-ASP-LEU-ILE-GLN-GLN-TYR-GLU-ALA-SER-ARG-LYS-ASP,GLN-THR-ALA-ARG-M3L-SER,69,6,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=19uM,4.721246,4.72,1,M,T,1,M,T,0,,P,A,,1,1,69,6,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.99556702375412,0.8808252215385437,88.21456146240234,86.06007385253906,0.3521806597709656,0.6119272112846375,0.803919792175293,0.8050990700721741,0.8768121600151062,0.7820031642913818,QTARKS,Low,"(4.606, 4.745]",train
6HMT,protein-peptide,P31947,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSNEERCLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,AEGFPATV,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-ASN-GLU-GLU-ARG-CYS-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,ALA-GLU-GLY-PHE-PRO-ALA-TPO-VAL,236,8,O=C([C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)[NH3+])C)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)O)C(C)C,Kd=92nM,7.036212,7.04,1,M,T,1,M,T,0,,B,A,,0,1,236,8,0,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,0.933489203453064,0.8409947156906128,95.32080841064452,88.30476379394531,0.3154054880142212,0.5322436094284058,0.94550621509552,0.9167988300323486,0.9099931716918944,0.8220437169075012,AEGFPATV,Moderate,"(6.824, 7.049]",train
2KS9,protein-peptide,P20366 P25103,MDNVLPVDSDLSPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAHKRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPSRVVCMIEWPEHPNKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQGSVYKVSRLETTISTVVGA,RPKPQQFFGLM,MET-ASP-ASN-VAL-LEU-PRO-VAL-ASP-SER-ASP-LEU-SER-PRO-ASN-ILE-SER-THR-ASN-THR-SER-GLU-PRO-ASN-GLN-PHE-VAL-GLN-PRO-ALA-TRP-GLN-ILE-VAL-LEU-TRP-ALA-ALA-ALA-TYR-THR-VAL-ILE-VAL-VAL-THR-SER-VAL-VAL-GLY-ASN-VAL-VAL-VAL-MET-TRP-ILE-ILE-LEU-ALA-HIS-LYS-ARG-MET-ARG-THR-VAL-THR-ASN-TYR-PHE-LEU-VAL-ASN-LEU-ALA-PHE-ALA-GLU-ALA-SER-MET-ALA-ALA-PHE-ASN-THR-VAL-VAL-ASN-PHE-THR-TYR-ALA-VAL-HIS-ASN-GLU-TRP-TYR-TYR-GLY-LEU-PHE-TYR-CYS-LYS-PHE-HIS-ASN-PHE-PHE-PRO-ILE-ALA-ALA-VAL-PHE-ALA-SER-ILE-TYR-SER-MET-THR-ALA-VAL-ALA-PHE-ASP-ARG-TYR-MET-ALA-ILE-ILE-HIS-PRO-LEU-GLN-PRO-ARG-LEU-SER-ALA-THR-ALA-THR-LYS-VAL-VAL-ILE-CYS-VAL-ILE-TRP-VAL-LEU-ALA-LEU-LEU-LEU-ALA-PHE-PRO-GLN-GLY-TYR-TYR-SER-THR-THR-GLU-THR-MET-PRO-SER-ARG-VAL-VAL-CYS-MET-ILE-GLU-TRP-PRO-GLU-HIS-PRO-ASN-LYS-ILE-TYR-GLU-LYS-VAL-TYR-HIS-ILE-CYS-VAL-THR-VAL-LEU-ILE-TYR-PHE-LEU-PRO-LEU-LEU-VAL-ILE-GLY-TYR-ALA-TYR-THR-VAL-VAL-GLY-ILE-THR-LEU-TRP-ALA-SER-GLU-ILE-PRO-GLY-ASP-SER-SER-ASP-ARG-TYR-HIS-GLU-GLN-VAL-SER-ALA-LYS-ARG-LYS-VAL-VAL-LYS-MET-MET-ILE-VAL-VAL-VAL-CYS-THR-PHE-ALA-ILE-CYS-TRP-LEU-PRO-PHE-HIS-ILE-PHE-PHE-LEU-LEU-PRO-TYR-ILE-ASN-PRO-ASP-LEU-TYR-LEU-LYS-LYS-PHE-ILE-GLN-GLN-VAL-TYR-LEU-ALA-ILE-MET-TRP-LEU-ALA-MET-SER-SER-THR-MET-TYR-ASN-PRO-ILE-ILE-TYR-CYS-CYS-LEU-ASN-ASP-ARG-PHE-ARG-LEU-GLY-PHE-LYS-HIS-ALA-PHE-ARG-CYS-CYS-PRO-PHE-ILE-SER-ALA-GLY-ASP-TYR-GLU-GLY-LEU-GLU-MET-LYS-SER-THR-ARG-TYR-LEU-GLN-THR-GLN-GLY-SER-VAL-TYR-LYS-VAL-SER-ARG-LEU-GLU-THR-THR-ILE-SER-THR-VAL-VAL-GLY-ALA,ARG-PRO-LYS-PRO-GLN-GLN-PHE-PHE-GLY-LEU-MET,364,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCSC)CC(C)C)Cc1ccccc1)Cc1ccccc1)CCC(=O)N)CCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Ki=9.02mM,2.044793,2.04,1,M,T,1,M,T,0,,B,A,,1,1,364,11,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.7224243879318237,0.809859037399292,61.47234725952149,64.51387023925781,0.6210418939590454,0.9045614004135132,0.7933351397514343,0.7677806615829468,0.6646966934204102,0.7568483948707581,RPKPQQFFGLM,Low,"(2.044, 3.548]",val
3IQU,protein-peptide,P31947 P04049,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,QRSTST,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CSO-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,GLN-ARG-SER-THR-SEP-THR,236,6,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)COP(O)(O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC[NH+]=C(N)N,Kd=17.0uM,4.769551,4.77,1,M,T,1,M,T,0,,P,A,,1,1,236,6,0,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,C[C@@H](O)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.9634313583374025,0.8902651071548462,89.88780212402344,91.67777252197266,0.3080813884735107,0.478435069322586,0.9486843347549438,0.9300410151481628,0.951622188091278,0.8803210854530334,QRSTST,Low,"(4.745, 4.866]",train
5IXQ,protein-peptide,P47735 Q8LAD7,GSSMGSLNQDATILRQAKLGLSDPAQSLSSWSDNNDVTPCKWLGVSCDATSNVVSVDLSSFMLVGPFPSILCHLPSLHSLSLYNNSINGSLSADDFDTCHNLISLDLSENLLVGSIPKSLPFNLPNLKFLEISGNNLSDTIPSSFGEFRKLESLNLAGNFLSGTIPASLGNVTTLKELKLAYNLFSPSQIPSQLGNLTELQVLWLAGCNLVGPIPPSLSRLTSLVNLDLTFNQLTGSIPSWITQLKTVEQIELFNNSFSGELPESMGNMTTLKRFDASMNKLTGKIPDNLNLLNLESLNLFENMLEGPLPESITRSKTLSELKLFNNRLTGVLPSQLGANSPLQYVDLSYNRFSGEIPANVCGEGKLEYLILIDNSFSGEISNNLGKCKSLTRVRLSNNKLSGQIPHGFWGLPRLSLLELSDNSFTGSIPKTIIGAKNLSNLRISKNRFSGSIPNEIGSLNGIIEISGAENDFSGEIPESLVKLKQLSRLDLSKNQLSGEIPRELRGWKNLNELNLANNHLSGEIPKEVGILPVLNYLDLSSNQFSGEIPLELQNLKLNVLNLSYNHLSGKIPPLYANKIYAHDFIGNPGLCVDLDGLCRKITRSKLEGSENLYFQ,PIPPSAPSKRHN,GLY-SER-SER-MET-GLY-SER-LEU-ASN-GLN-ASP-ALA-THR-ILE-LEU-ARG-GLN-ALA-LYS-LEU-GLY-LEU-SER-ASP-PRO-ALA-GLN-SER-LEU-SER-SER-TRP-SER-ASP-ASN-ASN-ASP-VAL-THR-PRO-CYS-LYS-TRP-LEU-GLY-VAL-SER-CYS-ASP-ALA-THR-SER-ASN-VAL-VAL-SER-VAL-ASP-LEU-SER-SER-PHE-MET-LEU-VAL-GLY-PRO-PHE-PRO-SER-ILE-LEU-CYS-HIS-LEU-PRO-SER-LEU-HIS-SER-LEU-SER-LEU-TYR-ASN-ASN-SER-ILE-ASN-GLY-SER-LEU-SER-ALA-ASP-ASP-PHE-ASP-THR-CYS-HIS-ASN-LEU-ILE-SER-LEU-ASP-LEU-SER-GLU-ASN-LEU-LEU-VAL-GLY-SER-ILE-PRO-LYS-SER-LEU-PRO-PHE-ASN-LEU-PRO-ASN-LEU-LYS-PHE-LEU-GLU-ILE-SER-GLY-ASN-ASN-LEU-SER-ASP-THR-ILE-PRO-SER-SER-PHE-GLY-GLU-PHE-ARG-LYS-LEU-GLU-SER-LEU-ASN-LEU-ALA-GLY-ASN-PHE-LEU-SER-GLY-THR-ILE-PRO-ALA-SER-LEU-GLY-ASN-VAL-THR-THR-LEU-LYS-GLU-LEU-LYS-LEU-ALA-TYR-ASN-LEU-PHE-SER-PRO-SER-GLN-ILE-PRO-SER-GLN-LEU-GLY-ASN-LEU-THR-GLU-LEU-GLN-VAL-LEU-TRP-LEU-ALA-GLY-CYS-ASN-LEU-VAL-GLY-PRO-ILE-PRO-PRO-SER-LEU-SER-ARG-LEU-THR-SER-LEU-VAL-ASN-LEU-ASP-LEU-THR-PHE-ASN-GLN-LEU-THR-GLY-SER-ILE-PRO-SER-TRP-ILE-THR-GLN-LEU-LYS-THR-VAL-GLU-GLN-ILE-GLU-LEU-PHE-ASN-ASN-SER-PHE-SER-GLY-GLU-LEU-PRO-GLU-SER-MET-GLY-ASN-MET-THR-THR-LEU-LYS-ARG-PHE-ASP-ALA-SER-MET-ASN-LYS-LEU-THR-GLY-LYS-ILE-PRO-ASP-ASN-LEU-ASN-LEU-LEU-ASN-LEU-GLU-SER-LEU-ASN-LEU-PHE-GLU-ASN-MET-LEU-GLU-GLY-PRO-LEU-PRO-GLU-SER-ILE-THR-ARG-SER-LYS-THR-LEU-SER-GLU-LEU-LYS-LEU-PHE-ASN-ASN-ARG-LEU-THR-GLY-VAL-LEU-PRO-SER-GLN-LEU-GLY-ALA-ASN-SER-PRO-LEU-GLN-TYR-VAL-ASP-LEU-SER-TYR-ASN-ARG-PHE-SER-GLY-GLU-ILE-PRO-ALA-ASN-VAL-CYS-GLY-GLU-GLY-LYS-LEU-GLU-TYR-LEU-ILE-LEU-ILE-ASP-ASN-SER-PHE-SER-GLY-GLU-ILE-SER-ASN-ASN-LEU-GLY-LYS-CYS-LYS-SER-LEU-THR-ARG-VAL-ARG-LEU-SER-ASN-ASN-LYS-LEU-SER-GLY-GLN-ILE-PRO-HIS-GLY-PHE-TRP-GLY-LEU-PRO-ARG-LEU-SER-LEU-LEU-GLU-LEU-SER-ASP-ASN-SER-PHE-THR-GLY-SER-ILE-PRO-LYS-THR-ILE-ILE-GLY-ALA-LYS-ASN-LEU-SER-ASN-LEU-ARG-ILE-SER-LYS-ASN-ARG-PHE-SER-GLY-SER-ILE-PRO-ASN-GLU-ILE-GLY-SER-LEU-ASN-GLY-ILE-ILE-GLU-ILE-SER-GLY-ALA-GLU-ASN-ASP-PHE-SER-GLY-GLU-ILE-PRO-GLU-SER-LEU-VAL-LYS-LEU-LYS-GLN-LEU-SER-ARG-LEU-ASP-LEU-SER-LYS-ASN-GLN-LEU-SER-GLY-GLU-ILE-PRO-ARG-GLU-LEU-ARG-GLY-TRP-LYS-ASN-LEU-ASN-GLU-LEU-ASN-LEU-ALA-ASN-ASN-HIS-LEU-SER-GLY-GLU-ILE-PRO-LYS-GLU-VAL-GLY-ILE-LEU-PRO-VAL-LEU-ASN-TYR-LEU-ASP-LEU-SER-SER-ASN-GLN-PHE-SER-GLY-GLU-ILE-PRO-LEU-GLU-LEU-GLN-ASN-LEU-LYS-LEU-ASN-VAL-LEU-ASN-LEU-SER-TYR-ASN-HIS-LEU-SER-GLY-LYS-ILE-PRO-PRO-LEU-TYR-ALA-ASN-LYS-ILE-TYR-ALA-HIS-ASP-PHE-ILE-GLY-ASN-PRO-GLY-LEU-CYS-VAL-ASP-LEU-ASP-GLY-LEU-CYS-ARG-LYS-ILE-THR-ARG-SER-LYS-LEU-GLU-GLY-SER-GLU-ASN-LEU-TYR-PHE-GLN,PRO-ILE-PRO-PRO-SER-ALA-HYP-SER-LYS-ARG-HIS-ASN,616,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1c[nH]cn1)CCC[NH+]=C(N)N)CCCC[NH3+])NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCC[NH2+]1)CO)C)O,Kd=20uM,4.69897,4.7,1,A,A,1,M,T,0,,B,A,,1,1,616,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8355697989463806,0.7695775628089905,78.8447494506836,81.01323699951172,0.4587034583091736,0.7065175771713257,0.8510063886642456,0.8551846742630005,0.8028491139411926,0.7319419980049133,PIPPSAPSKRHN,Low,"(4.606, 4.745]",train
5IXT,protein-peptide,P47735 Q8LAD7,GSSMGSLNQDATILRQAKLGLSDPAQSLSSWSDNNDVTPCKWLGVSCDATSNVVSVDLSSFMLVGPFPSILCHLPSLHSLSLYNNSINGSLSADDFDTCHNLISLDLSENLLVGSIPKSLPFNLPNLKFLEISGNNLSDTIPSSFGEFRKLESLNLAGNFLSGTIPASLGNVTTLKELKLAYNLFSPSQIPSQLGNLTELQVLWLAGCNLVGPIPPSLSRLTSLVNLDLTFNQLTGSIPSWITQLKTVEQIELFNNSFSGELPESMGNMTTLKRFDASMNKLTGKIPDNLNLLNLESLNLFENMLEGPLPESITRSKTLSELKLFNNRLTGVLPSQLGANSPLQYVDLSYNRFSGEIPANVCGEGKLEYLILIDNSFSGEISNNLGKCKSLTRVRLSNNKLSGQIPHGFWGLPRLSLLELSDNSFTGSIPKTIIGAKNLSNLRISKNRFSGSIPNEIGSLNGIIEISGAENDFSGEIPESLVKLKQLSRLDLSKNQLSGEIPRELRGWKNLNELNLANNHLSGEIPKEVGILPVLNYLDLSSNQFSGEIPLELQNLKLNVLNLSYNHLSGKIPPLYANKIYAHDFIGNPGLCVDLDGLCRKITRSKLEGSENLYFQ,YPKGVPIPPSAPSKRHN,GLY-SER-SER-MET-GLY-SER-LEU-ASN-GLN-ASP-ALA-THR-ILE-LEU-ARG-GLN-ALA-LYS-LEU-GLY-LEU-SER-ASP-PRO-ALA-GLN-SER-LEU-SER-SER-TRP-SER-ASP-ASN-ASN-ASP-VAL-THR-PRO-CYS-LYS-TRP-LEU-GLY-VAL-SER-CYS-ASP-ALA-THR-SER-ASN-VAL-VAL-SER-VAL-ASP-LEU-SER-SER-PHE-MET-LEU-VAL-GLY-PRO-PHE-PRO-SER-ILE-LEU-CYS-HIS-LEU-PRO-SER-LEU-HIS-SER-LEU-SER-LEU-TYR-ASN-ASN-SER-ILE-ASN-GLY-SER-LEU-SER-ALA-ASP-ASP-PHE-ASP-THR-CYS-HIS-ASN-LEU-ILE-SER-LEU-ASP-LEU-SER-GLU-ASN-LEU-LEU-VAL-GLY-SER-ILE-PRO-LYS-SER-LEU-PRO-PHE-ASN-LEU-PRO-ASN-LEU-LYS-PHE-LEU-GLU-ILE-SER-GLY-ASN-ASN-LEU-SER-ASP-THR-ILE-PRO-SER-SER-PHE-GLY-GLU-PHE-ARG-LYS-LEU-GLU-SER-LEU-ASN-LEU-ALA-GLY-ASN-PHE-LEU-SER-GLY-THR-ILE-PRO-ALA-SER-LEU-GLY-ASN-VAL-THR-THR-LEU-LYS-GLU-LEU-LYS-LEU-ALA-TYR-ASN-LEU-PHE-SER-PRO-SER-GLN-ILE-PRO-SER-GLN-LEU-GLY-ASN-LEU-THR-GLU-LEU-GLN-VAL-LEU-TRP-LEU-ALA-GLY-CYS-ASN-LEU-VAL-GLY-PRO-ILE-PRO-PRO-SER-LEU-SER-ARG-LEU-THR-SER-LEU-VAL-ASN-LEU-ASP-LEU-THR-PHE-ASN-GLN-LEU-THR-GLY-SER-ILE-PRO-SER-TRP-ILE-THR-GLN-LEU-LYS-THR-VAL-GLU-GLN-ILE-GLU-LEU-PHE-ASN-ASN-SER-PHE-SER-GLY-GLU-LEU-PRO-GLU-SER-MET-GLY-ASN-MET-THR-THR-LEU-LYS-ARG-PHE-ASP-ALA-SER-MET-ASN-LYS-LEU-THR-GLY-LYS-ILE-PRO-ASP-ASN-LEU-ASN-LEU-LEU-ASN-LEU-GLU-SER-LEU-ASN-LEU-PHE-GLU-ASN-MET-LEU-GLU-GLY-PRO-LEU-PRO-GLU-SER-ILE-THR-ARG-SER-LYS-THR-LEU-SER-GLU-LEU-LYS-LEU-PHE-ASN-ASN-ARG-LEU-THR-GLY-VAL-LEU-PRO-SER-GLN-LEU-GLY-ALA-ASN-SER-PRO-LEU-GLN-TYR-VAL-ASP-LEU-SER-TYR-ASN-ARG-PHE-SER-GLY-GLU-ILE-PRO-ALA-ASN-VAL-CYS-GLY-GLU-GLY-LYS-LEU-GLU-TYR-LEU-ILE-LEU-ILE-ASP-ASN-SER-PHE-SER-GLY-GLU-ILE-SER-ASN-ASN-LEU-GLY-LYS-CYS-LYS-SER-LEU-THR-ARG-VAL-ARG-LEU-SER-ASN-ASN-LYS-LEU-SER-GLY-GLN-ILE-PRO-HIS-GLY-PHE-TRP-GLY-LEU-PRO-ARG-LEU-SER-LEU-LEU-GLU-LEU-SER-ASP-ASN-SER-PHE-THR-GLY-SER-ILE-PRO-LYS-THR-ILE-ILE-GLY-ALA-LYS-ASN-LEU-SER-ASN-LEU-ARG-ILE-SER-LYS-ASN-ARG-PHE-SER-GLY-SER-ILE-PRO-ASN-GLU-ILE-GLY-SER-LEU-ASN-GLY-ILE-ILE-GLU-ILE-SER-GLY-ALA-GLU-ASN-ASP-PHE-SER-GLY-GLU-ILE-PRO-GLU-SER-LEU-VAL-LYS-LEU-LYS-GLN-LEU-SER-ARG-LEU-ASP-LEU-SER-LYS-ASN-GLN-LEU-SER-GLY-GLU-ILE-PRO-ARG-GLU-LEU-ARG-GLY-TRP-LYS-ASN-LEU-ASN-GLU-LEU-ASN-LEU-ALA-ASN-ASN-HIS-LEU-SER-GLY-GLU-ILE-PRO-LYS-GLU-VAL-GLY-ILE-LEU-PRO-VAL-LEU-ASN-TYR-LEU-ASP-LEU-SER-SER-ASN-GLN-PHE-SER-GLY-GLU-ILE-PRO-LEU-GLU-LEU-GLN-ASN-LEU-LYS-LEU-ASN-VAL-LEU-ASN-LEU-SER-TYR-ASN-HIS-LEU-SER-GLY-LYS-ILE-PRO-PRO-LEU-TYR-ALA-ASN-LYS-ILE-TYR-ALA-HIS-ASP-PHE-ILE-GLY-ASN-PRO-GLY-LEU-CYS-VAL-ASP-LEU-ASP-GLY-LEU-CYS-ARG-LYS-ILE-THR-ARG-SER-LYS-LEU-GLU-GLY-SER-GLU-ASN-LEU-TYR-PHE-GLN,TYR-PRO-LYS-GLY-VAL-PRO-ILE-PRO-PRO-SER-ALA-HYP-SER-LYS-ARG-HIS-ASN,616,17,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1c[nH]cn1)CCC[NH+]=C(N)N)CCCC[NH3+])NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCC[NH2+]1)CO)C)O,Kd=25uM,4.60206,4.6,1,A,A,1,M,T,0,,B,A,,1,1,616,17,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.7814826965332031,0.714628279209137,79.08670043945312,79.82278442382812,0.480859100818634,0.8652816414833069,0.8459922671318054,0.8282099962234497,0.7357344627380371,0.6679697632789612,YPKGVPIPPSAPSKRHN,Low,"(4.456, 4.606]",train
5LGS,protein-peptide,Q9WVG6 P11940,GHMGHTLERSVFSERTEESSAVQYFQFYGYLSQQQNMMQDYVRTGTYQRAILQNHTDFKDKIVLDVGCGSGILSFFAAQAGARKIYAVEASTMAQHAEVLVKSNNLTDRIVVIPGKVEEVSLPEQVDIIISEPMGYMLFNERMLESYLHAKKYLKPSGNMFPTIGDVHLAPFTDEQLYMEQFTKANFWYQPSFHGVDLSALRGAAVDEYFRQPVVDTFDIRILMAKSVKYTVNFLEAKEGDLHRIEIPFKFHMLHSGLVHGLAFWFDVAFIGSIMTVWLSTAPTEPLTHWYQVRCLFQSPLFAKAGDTLSGTCLLIANKRQSYDISIVAQVDQTGSKSSNLLDLKNPFFRYTGTTPSPPPG,PAAPRPPFS,GLY-HIS-MET-GLY-HIS-THR-LEU-GLU-ARG-SER-VAL-PHE-SER-GLU-ARG-THR-GLU-GLU-SER-SER-ALA-VAL-GLN-TYR-PHE-GLN-PHE-TYR-GLY-TYR-LEU-SER-GLN-GLN-GLN-ASN-MET-MET-GLN-ASP-TYR-VAL-ARG-THR-GLY-THR-TYR-GLN-ARG-ALA-ILE-LEU-GLN-ASN-HIS-THR-ASP-PHE-LYS-ASP-LYS-ILE-VAL-LEU-ASP-VAL-GLY-CYS-GLY-SER-GLY-ILE-LEU-SER-PHE-PHE-ALA-ALA-GLN-ALA-GLY-ALA-ARG-LYS-ILE-TYR-ALA-VAL-GLU-ALA-SER-THR-MET-ALA-GLN-HIS-ALA-GLU-VAL-LEU-VAL-LYS-SER-ASN-ASN-LEU-THR-ASP-ARG-ILE-VAL-VAL-ILE-PRO-GLY-LYS-VAL-GLU-GLU-VAL-SER-LEU-PRO-GLU-GLN-VAL-ASP-ILE-ILE-ILE-SER-GLU-PRO-MET-GLY-TYR-MET-LEU-PHE-ASN-GLU-ARG-MET-LEU-GLU-SER-TYR-LEU-HIS-ALA-LYS-LYS-TYR-LEU-LYS-PRO-SER-GLY-ASN-MET-PHE-PRO-THR-ILE-GLY-ASP-VAL-HIS-LEU-ALA-PRO-PHE-THR-ASP-GLU-GLN-LEU-TYR-MET-GLU-GLN-PHE-THR-LYS-ALA-ASN-PHE-TRP-TYR-GLN-PRO-SER-PHE-HIS-GLY-VAL-ASP-LEU-SER-ALA-LEU-ARG-GLY-ALA-ALA-VAL-ASP-GLU-TYR-PHE-ARG-GLN-PRO-VAL-VAL-ASP-THR-PHE-ASP-ILE-ARG-ILE-LEU-MET-ALA-LYS-SER-VAL-LYS-TYR-THR-VAL-ASN-PHE-LEU-GLU-ALA-LYS-GLU-GLY-ASP-LEU-HIS-ARG-ILE-GLU-ILE-PRO-PHE-LYS-PHE-HIS-MET-LEU-HIS-SER-GLY-LEU-VAL-HIS-GLY-LEU-ALA-PHE-TRP-PHE-ASP-VAL-ALA-PHE-ILE-GLY-SER-ILE-MET-THR-VAL-TRP-LEU-SER-THR-ALA-PRO-THR-GLU-PRO-LEU-THR-HIS-TRP-TYR-GLN-VAL-ARG-CYS-LEU-PHE-GLN-SER-PRO-LEU-PHE-ALA-LYS-ALA-GLY-ASP-THR-LEU-SER-GLY-THR-CYS-LEU-LEU-ILE-ALA-ASN-LYS-ARG-GLN-SER-TYR-ASP-ILE-SER-ILE-VAL-ALA-GLN-VAL-ASP-GLN-THR-GLY-SER-LYS-SER-SER-ASN-LEU-LEU-ASP-LEU-LYS-ASN-PRO-PHE-PHE-ARG-TYR-THR-GLY-THR-THR-PRO-SER-PRO-PRO-PRO-GLY,PRO-ALA-ALA-PRO-ARG-PRO-PRO-PHE-SER,361,9,OC[C@@H](C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCC[NH+]=C(N)N,IC50=0.0876uM,7.057496,7.06,1,A,A,1,M,T,0,,E,A,,1,1,361,9,0,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,0.9119274020195008,0.8548246026039124,88.44402313232422,80.28184509277344,0.3784384429454803,0.6133610010147095,0.9191185235977172,0.8950089812278748,0.8662106394767761,0.8118836879730225,PAAPRPPFS,Moderate,"(7.049, 7.268]",train
1O9D,protein-peptide,Q40409 P93343,MAVAPTAREENVYMAKLAEQAERYEEMVEFMEKVSNSLGSEELTVEERNLLSVAYKNVIGARRASWRIISSIEQKEESRGNEEHVNSIREYRSKIENELSKICDGILKLLDAKLIPSAASGDSKVFYLKMKGDYHRYLAEFKTGAERKEAAESTLTAYKAAQDIATTELAPTHPIRLGLALNFSVFYYEILNSPDRACNLAKQAFDEAIAELDTLGEESYKDSTLIMQLLRDNLTLWTSDMQDDGADEIKEDPKPDEAKN,QSYTV,MET-ALA-VAL-ALA-PRO-THR-ALA-ARG-GLU-GLU-ASN-VAL-TYR-MET-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-GLU-MET-VAL-GLU-PHE-MET-GLU-LYS-VAL-SER-ASN-SER-LEU-GLY-SER-GLU-GLU-LEU-THR-VAL-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-ILE-GLY-ALA-ARG-ARG-ALA-SER-TRP-ARG-ILE-ILE-SER-SER-ILE-GLU-GLN-LYS-GLU-GLU-SER-ARG-GLY-ASN-GLU-GLU-HIS-VAL-ASN-SER-ILE-ARG-GLU-TYR-ARG-SER-LYS-ILE-GLU-ASN-GLU-LEU-SER-LYS-ILE-CYS-ASP-GLY-ILE-LEU-LYS-LEU-LEU-ASP-ALA-LYS-LEU-ILE-PRO-SER-ALA-ALA-SER-GLY-ASP-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-HIS-ARG-TYR-LEU-ALA-GLU-PHE-LYS-THR-GLY-ALA-GLU-ARG-LYS-GLU-ALA-ALA-GLU-SER-THR-LEU-THR-ALA-TYR-LYS-ALA-ALA-GLN-ASP-ILE-ALA-THR-THR-GLU-LEU-ALA-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-ASP-ARG-ALA-CYS-ASN-LEU-ALA-LYS-GLN-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-GLY-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-MET-GLN-ASP-ASP-GLY-ALA-ASP-GLU-ILE-LYS-GLU-ASP-PRO-LYS-PRO-ASP-GLU-ALA-LYS-ASN,GLN-SER-TYR-TPO-VAL,260,5,OC[C@@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)O)NC(=O)[C@H](CCC(=O)N)[NH3+],Kd=2.5uM,5.60206,5.6,1,M,S,1,A,A,0,,P,A,,1,1,260,5,0,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9634459614753724,0.9199798107147216,82.27880859375,81.56859588623047,0.3581920564174652,0.4880699515342712,0.902134656906128,0.883357584476471,0.9339624643325806,0.8930776715278625,QSYTV,Low,"(5.6, 5.699]",train
4IUT,protein-peptide,Q9XI47 P59226,SADLAFEAKSARDYAWYDVSSFLTYRVLRTGELEVRVRFSGFDNRHDEWVNVKTSVRERSIPVEPSECGRVNVGDLLLCFQEREDQALYCDGHVLNIKRGIHDHARCNCVFLVRYELDNTEESLGLERICRRPEE,ARTKQTARKSTGGKA,SER-ALA-ASP-LEU-ALA-PHE-GLU-ALA-LYS-SER-ALA-ARG-ASP-TYR-ALA-TRP-TYR-ASP-VAL-SER-SER-PHE-LEU-THR-TYR-ARG-VAL-LEU-ARG-THR-GLY-GLU-LEU-GLU-VAL-ARG-VAL-ARG-PHE-SER-GLY-PHE-ASP-ASN-ARG-HIS-ASP-GLU-TRP-VAL-ASN-VAL-LYS-THR-SER-VAL-ARG-GLU-ARG-SER-ILE-PRO-VAL-GLU-PRO-SER-GLU-CYS-GLY-ARG-VAL-ASN-VAL-GLY-ASP-LEU-LEU-LEU-CYS-PHE-GLN-GLU-ARG-GLU-ASP-GLN-ALA-LEU-TYR-CYS-ASP-GLY-HIS-VAL-LEU-ASN-ILE-LYS-ARG-GLY-ILE-HIS-ASP-HIS-ALA-ARG-CYS-ASN-CYS-VAL-PHE-LEU-VAL-ARG-TYR-GLU-LEU-ASP-ASN-THR-GLU-GLU-SER-LEU-GLY-LEU-GLU-ARG-ILE-CYS-ARG-ARG-PRO-GLU-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA,135,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH+](C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)[NH3+],Kd=1.9uM,5.721246,5.72,1,M,S,1,A,A,0,,C,A,,0,1,135,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.8907331228256226,0.7681495547294617,89.53740692138672,87.16230773925781,0.3593611121177673,0.7723798751831055,0.9073173999786376,0.847654402256012,0.8240870237350464,0.7482733726501465,ARTKQTARKSTGGKA,Low,"(5.699, 5.821]",train
4U0A,protein-peptide,Q16630 P12493,PIVQNLQGQMVHQCISPRTLNAWVKVVEEKAFSPEVIPMFSALSCGATPQDLNTMLNTVGGHQAAMQMLKETINEEAAEWDRLHPVHAGPIAPGQMREPRGSDIAGTTSTLQEQIGWMTHNPPIPVGEIYKRWIILGLNKIVRMYSPTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKNAATETLLVQNANPDCKTILKALGPGATLEEMMTACQGVGGPGHKARVL,PVLFPGQPFGQPPLG,PRO-ILE-VAL-GLN-ASN-LEU-GLN-GLY-GLN-MET-VAL-HIS-GLN-CYS-ILE-SER-PRO-ARG-THR-LEU-ASN-ALA-TRP-VAL-LYS-VAL-VAL-GLU-GLU-LYS-ALA-PHE-SER-PRO-GLU-VAL-ILE-PRO-MET-PHE-SER-ALA-LEU-SER-CYS-GLY-ALA-THR-PRO-GLN-ASP-LEU-ASN-THR-MET-LEU-ASN-THR-VAL-GLY-GLY-HIS-GLN-ALA-ALA-MET-GLN-MET-LEU-LYS-GLU-THR-ILE-ASN-GLU-GLU-ALA-ALA-GLU-TRP-ASP-ARG-LEU-HIS-PRO-VAL-HIS-ALA-GLY-PRO-ILE-ALA-PRO-GLY-GLN-MET-ARG-GLU-PRO-ARG-GLY-SER-ASP-ILE-ALA-GLY-THR-THR-SER-THR-LEU-GLN-GLU-GLN-ILE-GLY-TRP-MET-THR-HIS-ASN-PRO-PRO-ILE-PRO-VAL-GLY-GLU-ILE-TYR-LYS-ARG-TRP-ILE-ILE-LEU-GLY-LEU-ASN-LYS-ILE-VAL-ARG-MET-TYR-SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-ALA-ALA-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,PRO-VAL-LEU-PHE-PRO-GLY-GLN-PRO-PHE-GLY-GLN-PRO-PRO-LEU-GLY,231,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)CCC(=O)N)Cc1ccccc1)CCC(=O)N)Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCC[NH2+]1)C,Kd=50uM,4.30103,4.3,1,M,S,1,A,A,0,,B,A,,0,1,231,15,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O,0.8824394345283508,0.5315700769424438,71.27740478515625,69.86990356445312,0.5077956318855286,1.0955952405929563,0.7421602010726929,0.6575226783752441,0.8692367672920227,0.5000819563865662,PVLFPGQPFGQPPLG,Low,"(4.155, 4.319]",train
4Z0D,protein-peptide,Q8IKV6 A0A024UZE1,NYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSNTTFLKPVATGNQDLKDGGFAFPPTNPLISPMTLNGMRDFYKNNEYVKNLDELTLCSRHAGNMNPDNDKNSNYKYPAVYDYNDKKCHILYIAAQENNGPRYCNKDQSKRNSMFCFRPAKDKLFENYTYLSKNVVDNWEEVCPRKNLENAKFGLWVDGNCEDIPHVNEFSANDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNASMIKSAFLPTGAFKADRYKSHGKGYNWGNYNRETQKCEIFNVKPTCLINNSSYIATTALSHPIEVE,CWTTRMSPPQQIC,ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-ASN-THR-THR-PHE-LEU-LYS-PRO-VAL-ALA-THR-GLY-ASN-GLN-ASP-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-ASN-PRO-LEU-ILE-SER-PRO-MET-THR-LEU-ASN-GLY-MET-ARG-ASP-PHE-TYR-LYS-ASN-ASN-GLU-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ASN-PRO-ASP-ASN-ASP-LYS-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-TYR-ASN-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLN-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-LYS-LEU-PHE-GLU-ASN-TYR-THR-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-GLU-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLU-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-SER-ALA-ASN-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-SER-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-ARG-GLU-THR-GLN-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASN-SER-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU,CYS-TRP-THR-THR-ARG-MET-SER-PRO-PRO-GLN-GLN-ILE-CYS,335,13,CSCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@H]3N(C(=O)[C@@H](NC1=O)C)CCC3)CCC2)CCC(=O)N)C)[C@H](CC)C)C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](O)C)[C@H](O)C,Kd=5uM,5.30103,5.3,1,M,S,1,A,A,0,,C,A,,1,1,335,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,0.8223764300346375,0.7395501136779785,79.505615234375,76.89488983154297,0.5729942917823792,0.8915355801582336,0.871001660823822,0.8438320755958557,0.7868723273277283,0.7134795784950256,CWTTRMSPPQQIC,Low,"(5.222, 5.31]",val
6QTO,protein-peptide,O24646 P43254,GAMTFTRYSRLRVIAEIRHGDIFHSANIVSSIEFDRDDELFATAGVSRCIKVFDFSSVVNEPADMQCPIVEMSTRSKLSCLSWNKHEKNHIASSDYEGIVTVWDVTTRQSLMEYEEHEKRAWSVDFSRTEPSMLVSGSDDCKVKVWCTRQEASVINIDMKANICCVKYNPGSSNYIAVGSADHHIHYYDLRNISQPLHVFSGHKKAVSYVKFLSNNELASASTDSTLRLWDVKDNLPVRTFRGHTNEKNFVGLTVNSEYLACGSETNEVYVYHKEITRPVTSHRFGSPDMDDAEEEAGSYFISAVCWKSDSPTMLTANSQGTIKVLVLAA,EIRRVPEFGGY,GLY-ALA-MET-THR-PHE-THR-ARG-TYR-SER-ARG-LEU-ARG-VAL-ILE-ALA-GLU-ILE-ARG-HIS-GLY-ASP-ILE-PHE-HIS-SER-ALA-ASN-ILE-VAL-SER-SER-ILE-GLU-PHE-ASP-ARG-ASP-ASP-GLU-LEU-PHE-ALA-THR-ALA-GLY-VAL-SER-ARG-CSO-ILE-LYS-VAL-PHE-ASP-PHE-SER-SER-VAL-VAL-ASN-GLU-PRO-ALA-ASP-MET-GLN-CYS-PRO-ILE-VAL-GLU-MET-SER-THR-ARG-SER-LYS-LEU-SER-CSO-LEU-SER-TRP-ASN-LYS-HIS-GLU-LYS-ASN-HIS-ILE-ALA-SER-SER-ASP-TYR-GLU-GLY-ILE-VAL-THR-VAL-TRP-ASP-VAL-THR-THR-ARG-GLN-SER-LEU-MET-GLU-TYR-GLU-GLU-HIS-GLU-LYS-ARG-ALA-TRP-SER-VAL-ASP-PHE-SER-ARG-THR-GLU-PRO-SER-MET-LEU-VAL-SER-GLY-SER-ASP-ASP-CYS-LYS-VAL-LYS-VAL-TRP-CSO-THR-ARG-GLN-GLU-ALA-SER-VAL-ILE-ASN-ILE-ASP-MET-LYS-ALA-ASN-ILE-CYS-CSO-VAL-LYS-TYR-ASN-PRO-GLY-SER-SER-ASN-TYR-ILE-ALA-VAL-GLY-SER-ALA-ASP-HIS-HIS-ILE-HIS-TYR-TYR-ASP-LEU-ARG-ASN-ILE-SER-GLN-PRO-LEU-HIS-VAL-PHE-SER-GLY-HIS-LYS-LYS-ALA-VAL-SER-TYR-VAL-LYS-PHE-LEU-SER-ASN-ASN-GLU-LEU-ALA-SER-ALA-SER-THR-ASP-SER-THR-LEU-ARG-LEU-TRP-ASP-VAL-LYS-ASP-ASN-LEU-PRO-VAL-ARG-THR-PHE-ARG-GLY-HIS-THR-ASN-GLU-LYS-ASN-PHE-VAL-GLY-LEU-THR-VAL-ASN-SER-GLU-TYR-LEU-ALA-CYS-GLY-SER-GLU-THR-ASN-GLU-VAL-TYR-VAL-TYR-HIS-LYS-GLU-ILE-THR-ARG-PRO-VAL-THR-SER-HIS-ARG-PHE-GLY-SER-PRO-ASP-MET-ASP-ASP-ALA-GLU-GLU-GLU-ALA-GLY-SER-TYR-PHE-ILE-SER-ALA-VAL-CYS-TRP-LYS-SER-ASP-SER-PRO-THR-MET-LEU-THR-ALA-ASN-SER-GLN-GLY-THR-ILE-LYS-VAL-LEU-VAL-LEU-ALA-ALA,ACE-GLU-ILE-ARG-ARG-VAL-PRO-GLU-PHE-GLY-GLY-TYR,330,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCC(=O)O)C(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)C)CCC(=O)O)C,Kd=23uM,4.638272,4.64,1,M,S,1,A,A,0,,B,A,,1,1,330,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,0.8837817311286926,0.8469372987747192,92.03813934326172,91.18617248535156,0.3941772878170013,0.618653416633606,0.9190261960029602,0.8996762037277222,0.8548093438148499,0.8337525129318237,EIRRVPEFGGY,Low,"(4.606, 4.745]",train
6EM6,protein-peptide,P25321 G3HK48,GHMGNAAAAKKGSEQESVKEFLAKAKEEFLKKWESPSQNTAQLDHFDRIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGSRNAI,GLY-HIS-MET-GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SEP-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-GLU-PHE-LEU-LYS-LYS-TRP-GLU-SER-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-HIS-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-PRO-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SEP-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-SER-ARG-ASN-ALA-ILE,353,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)CC(=O)N)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC[NH+]=C(N)N)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O)C)CC(=O)O)Cc1ccccc1)C,Kd=100uM,4.0,4.0,1,M,S,1,A,A,0,,C,A,,0,1,353,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.8361055254936218,0.7422178983688354,84.40973663330078,82.27981567382812,0.4769335091114044,0.943723201751709,0.9033257365226746,0.8668211698532104,0.7704460620880127,0.691591203212738,TTYADFIASGRTGSRNAI,Low,"(3.924, 4.155]",train
5OUS,protein-peptide,P25321 G3HK48,GHMGNAAAAKKGSEQESVKEFLAKAKEEFLKKWESPSQNTAQLDHFDRIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGKRNAI,GLY-HIS-MET-GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SEP-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-GLU-PHE-LEU-LYS-LYS-TRP-GLU-SER-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-HIS-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-PRO-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SEP-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-LYS-ARG-ASN-ALA-ILE,353,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)CC(=O)N)CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O)C)CC(=O)O)Cc1ccccc1)C)CO)CCC[NH+]=C(N)N,Kd=100uM,4.0,4.0,1,M,T,1,A,A,0,,B,A,,1,1,353,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.9728771448135376,0.7421701550483704,87.23912811279297,82.08346557617188,0.3612066507339477,0.9206578731536864,0.932246208190918,0.8698111176490784,0.9324958324432372,0.6943250298500061,TTYADFIASGRTGKRNAI,Low,"(3.924, 4.155]",train
1T37,protein-peptide,P60045,NLYQFKNMIQCTVPSRSWADFADYGCYCGKGGSGTPVDDLDRCCQTHDNCYNEAENISGCRPYFKTYSYECTQGTLTCKGDNNACAASVCDCDRLAAICFAGAPYNDDNYNIDLKARCN,LAIYS,ASN-LEU-TYR-GLN-PHE-LYS-ASN-MET-ILE-GLN-CYS-THR-VAL-PRO-SER-ARG-SER-TRP-ALA-ASP-PHE-ALA-ASP-TYR-GLY-CYS-TYR-CYS-GLY-LYS-GLY-GLY-SER-GLY-THR-PRO-VAL-ASP-ASP-LEU-ASP-ARG-CYS-CYS-GLN-THR-HIS-ASP-ASN-CYS-TYR-ASN-GLU-ALA-GLU-ASN-ILE-SER-GLY-CYS-ARG-PRO-TYR-PHE-LYS-THR-TYR-SER-TYR-GLU-CYS-THR-GLN-GLY-THR-LEU-THR-CYS-LYS-GLY-ASP-ASN-ASN-ALA-CYS-ALA-ALA-SER-VAL-CYS-ASP-CYS-ASP-ARG-LEU-ALA-ALA-ILE-CYS-PHE-ALA-GLY-ALA-PRO-TYR-ASN-ASP-ASP-ASN-TYR-ASN-ILE-ASP-LEU-LYS-ALA-ARG-CYS-ASN,LEU-ALA-ILE-TYR-SER,119,5,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NC(CO)CO)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C)C,Kd=45uM,4.346787,4.35,1,M,S,1,A,A,0,,P,A,,1,1,119,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8639671206474304,0.8704848289489746,96.20684051513672,94.4637680053711,0.330165147781372,0.5035364627838135,0.9224483370780944,0.909790813922882,0.8241451978683472,0.8606582880020142,LAIYS,Low,"(4.319, 4.456]",train
3O1D,protein-peptide,Q9PTN2 Q15596,GSHMLSDEQMQIINSLVEAHHKTYDDSYSDFVRFRPPVREGPVTRSASRAASLHSLSDASSDSFNHSPESVDTKLNFSNLLMMYQDSGSPDSSEEDQQSRLSMLPHLADLVSYSIQKVIGFAKMIPGFRDLTAEDQIALLKSSAIEIIMLRSNQSFSLEDMSWSCGGPDFKYCINDVTKAGHTLELLEPLVKFQVGLKKLKLHEEEHVLLMAICLLSPDRPGVQDHVRIEALQDRLCDVLQAYIRIQHPGGRLLYAKMIQKLADLRSLNEEHSKQYRSLSFQPEHSMQLTPLVLEVFGSEVS,KHKILHRLLQDSS,GLY-SER-HIS-MET-LEU-SER-ASP-GLU-GLN-MET-GLN-ILE-ILE-ASN-SER-LEU-VAL-GLU-ALA-HIS-HIS-LYS-THR-TYR-ASP-ASP-SER-TYR-SER-ASP-PHE-VAL-ARG-PHE-ARG-PRO-PRO-VAL-ARG-GLU-GLY-PRO-VAL-THR-ARG-SER-ALA-SER-ARG-ALA-ALA-SER-LEU-HIS-SER-LEU-SER-ASP-ALA-SER-SER-ASP-SER-PHE-ASN-HIS-SER-PRO-GLU-SER-VAL-ASP-THR-LYS-LEU-ASN-PHE-SER-ASN-LEU-LEU-MET-MET-TYR-GLN-ASP-SER-GLY-SER-PRO-ASP-SER-SER-GLU-GLU-ASP-GLN-GLN-SER-ARG-LEU-SER-MET-LEU-PRO-HIS-LEU-ALA-ASP-LEU-VAL-SER-TYR-SER-ILE-GLN-LYS-VAL-ILE-GLY-PHE-ALA-LYS-MET-ILE-PRO-GLY-PHE-ARG-ASP-LEU-THR-ALA-GLU-ASP-GLN-ILE-ALA-LEU-LEU-LYS-SER-SER-ALA-ILE-GLU-ILE-ILE-MET-LEU-ARG-SER-ASN-GLN-SER-PHE-SER-LEU-GLU-ASP-MET-SER-TRP-SER-CYS-GLY-GLY-PRO-ASP-PHE-LYS-TYR-CYS-ILE-ASN-ASP-VAL-THR-LYS-ALA-GLY-HIS-THR-LEU-GLU-LEU-LEU-GLU-PRO-LEU-VAL-LYS-PHE-GLN-VAL-GLY-LEU-LYS-LYS-LEU-LYS-LEU-HIS-GLU-GLU-GLU-HIS-VAL-LEU-LEU-MET-ALA-ILE-CYS-LEU-LEU-SER-PRO-ASP-ARG-PRO-GLY-VAL-GLN-ASP-HIS-VAL-ARG-ILE-GLU-ALA-LEU-GLN-ASP-ARG-LEU-CYS-ASP-VAL-LEU-GLN-ALA-TYR-ILE-ARG-ILE-GLN-HIS-PRO-GLY-GLY-ARG-LEU-LEU-TYR-ALA-LYS-MET-ILE-GLN-LYS-LEU-ALA-ASP-LEU-ARG-SER-LEU-ASN-GLU-GLU-HIS-SER-LYS-GLN-TYR-ARG-SER-LEU-SER-PHE-GLN-PRO-GLU-HIS-SER-MET-GLN-LEU-THR-PRO-LEU-VAL-LEU-GLU-VAL-PHE-GLY-SER-GLU-VAL-SER,LYS-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-ASP-SER-SER,302,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]([NH3+])C)CCCC[NH3+])C,Kd=1.8uM,5.744727,5.74,1,M,S,1,A,A,0,,B,A,,1,1,302,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,0.9772968292236328,0.8569794297218323,81.94578552246094,76.35625457763672,0.5467575192451477,0.8836056590080261,0.8138085603713989,0.8066532611846924,0.9011052846908568,0.8012662529945374,KHKILHRLLQDSS,Low,"(5.699, 5.821]",train
4CC2,protein-peptide,O00401 Q6XZF7,GPEGNQVYFAVYTFKARNPNELSVSANQKLKILEFKDVTGNTEWWLAEVNGKKGYVPSNYIRKTEYT,PPPALPSSAPSG,GLY-PRO-GLU-GLY-ASN-GLN-VAL-TYR-PHE-ALA-VAL-TYR-THR-PHE-LYS-ALA-ARG-ASN-PRO-ASN-GLU-LEU-SER-VAL-SER-ALA-ASN-GLN-LYS-LEU-LYS-ILE-LEU-GLU-PHE-LYS-ASP-VAL-THR-GLY-ASN-THR-GLU-TRP-TRP-LEU-ALA-GLU-VAL-ASN-GLY-LYS-LYS-GLY-TYR-VAL-PRO-SER-ASN-TYR-ILE-ARG-LYS-THR-GLU-TYR-THR,PRO-PRO-PRO-ALA-LEU-PRO-SER-SER-ALA-PRO-SER-GLY,67,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)O)CO)C)CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]1[NH2+]CCC1)C)CC(C)C,Kd=46.5uM,4.332547,4.33,1,M,S,1,A,A,0,,B,A,dimer,1,1,67,12,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,0.9823418855667114,0.8074508309364319,91.32455444335938,91.29998016357422,0.3121817708015442,0.5046018362045288,0.9061219692230223,0.8517251014709473,0.9064601063728333,0.7963822484016418,PPPALPSSAPSG,Low,"(4.319, 4.456]",train
1AVP,protein-peptide,P03252 P03274,MGSSEQELKAIVKDLGCGPYFLGTYDKRFPGFVSPHKLACAIVNTAGRETGGVHWMAFAWNPRSKTCYLFEPFGFSDQRLKQVYQFEYESLLRRSAIASSPDRCITLEKSTQSVQGPNSAACGLFCCMFLHAFANWPQTPMDHNPTMNLITGVPNSMLNSPQVQPTLRRNQEQLYSFLERHSPYFRSHSAQIRSATSFCHLKNM,GVQSLKRRRCF,MET-GLY-SER-SER-GLU-GLN-GLU-LEU-LYS-ALA-ILE-VAL-LYS-ASP-LEU-GLY-CYS-GLY-PRO-TYR-PHE-LEU-GLY-THR-TYR-ASP-LYS-ARG-PHE-PRO-GLY-PHE-VAL-SER-PRO-HIS-LYS-LEU-ALA-CYS-ALA-ILE-VAL-ASN-THR-ALA-GLY-ARG-GLU-THR-GLY-GLY-VAL-HIS-TRP-MET-ALA-PHE-ALA-TRP-ASN-PRO-ARG-SER-LYS-THR-CYS-TYR-LEU-PHE-GLU-PRO-PHE-GLY-PHE-SER-ASP-GLN-ARG-LEU-LYS-GLN-VAL-TYR-GLN-PHE-GLU-TYR-GLU-SER-LEU-LEU-ARG-ARG-SER-ALA-ILE-ALA-SER-SER-PRO-ASP-ARG-CYS-ILE-THR-LEU-GLU-LYS-SER-THR-GLN-SER-VAL-GLN-GLY-PRO-ASN-SER-ALA-ALA-CYS-GLY-LEU-PHE-CYS-CYS-MET-PHE-LEU-HIS-ALA-PHE-ALA-ASN-TRP-PRO-GLN-THR-PRO-MET-ASP-HIS-ASN-PRO-THR-MET-ASN-LEU-ILE-THR-GLY-VAL-PRO-ASN-SER-MET-LEU-ASN-SER-PRO-GLN-VAL-GLN-PRO-THR-LEU-ARG-ARG-ASN-GLN-GLU-GLN-LEU-TYR-SER-PHE-LEU-GLU-ARG-HIS-SER-PRO-TYR-PHE-ARG-SER-HIS-SER-ALA-GLN-ILE-ARG-SER-ALA-THR-SER-PHE-CYS-HIS-LEU-LYS-ASN-MET,GLY-VAL-GLN-SER-LEU-LYS-ARG-ARG-ARG-CYS-PHE,204,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CS)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)C[NH3+])CCC(=O)N)CO)CC(C)C,Kd=12nM,7.920819,7.92,1,M,T,1,A,A,0,,B,A,,1,1,204,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,0.7720630764961243,0.7005162239074707,81.6197738647461,66.21527099609375,0.7471681237220764,0.9936647415161132,0.7809920310974121,0.7600201368331909,0.73785400390625,0.6856402158737183,GVQSLKRRRCF,Moderate,"(7.523, 7.921]",train
1CWC,protein-peptide,P62937,MVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE,ALLVTAGLVLA,MET-VAL-ASN-PRO-THR-VAL-PHE-PHE-ASP-ILE-ALA-VAL-ASP-GLY-GLU-PRO-LEU-GLY-ARG-VAL-SER-PHE-GLU-LEU-PHE-ALA-ASP-LYS-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-ALA-LEU-SER-THR-GLY-GLU-LYS-GLY-PHE-GLY-TYR-LYS-GLY-SER-CYS-PHE-HIS-ARG-ILE-ILE-PRO-GLY-PHE-MET-CYS-GLN-GLY-GLY-ASP-PHE-THR-ARG-HIS-ASN-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-GLU-LYS-PHE-GLU-ASP-GLU-ASN-PHE-ILE-LEU-LYS-HIS-THR-GLY-PRO-GLY-ILE-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-CYS-THR-ALA-LYS-THR-GLU-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-LYS-GLU-GLY-MET-ASN-ILE-VAL-GLU-ALA-MET-GLU-ARG-PHE-GLY-SER-ARG-ASN-GLY-LYS-THR-SER-LYS-LYS-ILE-THR-ILE-ALA-ASP-CYS-GLY-GLN-LEU-GLU,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MNL-VAL-MLE-ALA,165,11,C/C=C/C[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](C[C@@H](CC)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,IC50=16.0nM,7.79588,7.8,1,M,T,1,A,A,0,,C,A,,0,1,165,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.8887704610824585,0.8365381360054016,89.57877349853516,94.79664611816406,0.3685001134872436,0.564480721950531,0.9356136322021484,0.9085452556610109,0.8379970788955688,0.8185363411903381,ALLVTAGLVLA,Moderate,"(7.523, 7.921]",train
1D4T,protein-peptide,O60880 Q13291,MDAVAVYHGKISRETGEKLLLATGLDGSYLLRDSESVPGVYCLCVLYHGYIYTYRVSQTETGSWSAETAPGVHKRYFRKIKNLISAFQKPDQGIVIPLQYPVEK,KSLTIYAQVQK,MET-ASP-ALA-VAL-ALA-VAL-TYR-HIS-GLY-LYS-ILE-SER-ARG-GLU-THR-GLY-GLU-LYS-LEU-LEU-LEU-ALA-THR-GLY-LEU-ASP-GLY-SER-TYR-LEU-LEU-ARG-ASP-SER-GLU-SER-VAL-PRO-GLY-VAL-TYR-CYS-LEU-CYS-VAL-LEU-TYR-HIS-GLY-TYR-ILE-TYR-THR-TYR-ARG-VAL-SER-GLN-THR-GLU-THR-GLY-SER-TRP-SER-ALA-GLU-THR-ALA-PRO-GLY-VAL-HIS-LYS-ARG-TYR-PHE-ARG-LYS-ILE-LYS-ASN-LEU-ILE-SER-ALA-PHE-GLN-LYS-PRO-ASP-GLN-GLY-ILE-VAL-ILE-PRO-LEU-GLN-TYR-PRO-VAL-GLU-LYS,LYS-SER-LEU-THR-ILE-TYR-ALA-GLN-VAL-GLN-LYS,104,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC(=O)N)C(C)C)CCC(=O)N)C)Cc1ccc(cc1)O)[C@H](CC)C)[C@H](O)C)CC(C)C)CO)[NH3+],Kd=650nM,6.187087,6.19,1,M,T,1,A,A,0,,B,A,,1,1,104,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9192427396774292,0.8106632232666016,96.94196319580078,92.39411163330078,0.3280652463436126,0.6136508584022522,0.9234760999679564,0.869310200214386,0.8584017157554626,0.7960014939308167,KSLTIYAQVQK,Low,"(6.097, 6.26]",train
1J4Q,protein-peptide,P14737 P22216,ATQRFLIEKFSQEQIGENIVCRVICTTGQIPIRDLSADISQVLKEKRSIKKVWTFGRNPACDYHLGNISRLSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSNQLLSQGDEITVGVGVESDILSLVIFINDKFKQCLEQNKVDRIR,SLEVTEADATFVQ,ALA-THR-GLN-ARG-PHE-LEU-ILE-GLU-LYS-PHE-SER-GLN-GLU-GLN-ILE-GLY-GLU-ASN-ILE-VAL-CYS-ARG-VAL-ILE-CYS-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-LEU-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-SER-ARG-LEU-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-ASN-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-GLY-VAL-GLY-VAL-GLU-SER-ASP-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-CYS-LEU-GLU-GLN-ASN-LYS-VAL-ASP-ARG-ILE-ARG,SER-LEU-GLU-VAL-TPO-GLU-ALA-ASP-ALA-THR-PHE-VAL-GLN,151,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)C(C)C)CC(C)C)[C@H](O)C)C)CC(=O)O)C)CCC(=O)O)C(C)C)CCC(=O)O)CC(C)C)[NH3+],Kd=0.36uM,6.443697,6.44,1,M,T,1,A,A,0,,B,A,,1,1,151,13,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.9318345785140992,0.8133349418640137,78.6397476196289,82.20293426513672,0.4297426044940948,0.717418909072876,0.8817945122718811,0.8430486917495728,0.830015242099762,0.7396813631057739,SLEVTEADATFVQ,Low,"(6.398, 6.523]",train
1KNA,protein-peptide,P05205 P02299,MKKHHHHHHAEEEEEEYAVEKIIDRRVRKGMVEYYLKWKGYPETENTWEPENNLDCQDLIQQYEASRKD,ARTKQTARKSTGGKAY,MET-LYS-LYS-HIS-HIS-HIS-HIS-HIS-HIS-ALA-GLU-GLU-GLU-GLU-GLU-GLU-TYR-ALA-VAL-GLU-LYS-ILE-ILE-ASP-ARG-ARG-VAL-ARG-LYS-GLY-MET-VAL-GLU-TYR-TYR-LEU-LYS-TRP-LYS-GLY-TYR-PRO-GLU-THR-GLU-ASN-THR-TRP-GLU-PRO-GLU-ASN-ASN-LEU-ASP-CYS-GLN-ASP-LEU-ILE-GLN-GLN-TYR-GLU-ALA-SER-ARG-LYS-ASP,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA-TYR,69,16,OC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)C=O,Kd=7uM,5.154902,5.15,1,M,T,1,A,A,0,,P,A,,1,1,69,16,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.0077553987503052,0.8418238162994385,86.21882629394531,83.14514923095703,0.3867596983909607,0.7790873646736145,0.8027464151382446,0.7831321358680725,0.8016546368598938,0.7478010654449463,ARTKQTARKSTGGKAY,Low,"(5.105, 5.222]",train
1LF8,protein-peptide,Q9NZ52 P11717,GAMGSMAEAEGESLESWLNKATNPSNRQEDWEYIIGFCDQINKELEGPQIAVRLLAHKIQSPQEWEALQALTVLEACMKNCGRRFHNEVGKFRFLNELIKVVSPKYLGDRVSEKVKTKVIELLYSWTMALPEEAKIKDAYHMLKRQGIVQSDPPIPVDRTLIPSPPPRPKN,FHDDSDEDLLHI,GLY-ALA-MET-GLY-SER-MET-ALA-GLU-ALA-GLU-GLY-GLU-SER-LEU-GLU-SER-TRP-LEU-ASN-LYS-ALA-THR-ASN-PRO-SER-ASN-ARG-GLN-GLU-ASP-TRP-GLU-TYR-ILE-ILE-GLY-PHE-CYS-ASP-GLN-ILE-ASN-LYS-GLU-LEU-GLU-GLY-PRO-GLN-ILE-ALA-VAL-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-LEU-GLN-ALA-LEU-THR-VAL-LEU-GLU-ALA-CYS-MET-LYS-ASN-CYS-GLY-ARG-ARG-PHE-HIS-ASN-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-ASP-ARG-VAL-SER-GLU-LYS-VAL-LYS-THR-LYS-VAL-ILE-GLU-LEU-LEU-TYR-SER-TRP-THR-MET-ALA-LEU-PRO-GLU-GLU-ALA-LYS-ILE-LYS-ASP-ALA-TYR-HIS-MET-LEU-LYS-ARG-GLN-GLY-ILE-VAL-GLN-SER-ASP-PRO-PRO-ILE-PRO-VAL-ASP-ARG-THR-LEU-ILE-PRO-SER-PRO-PRO-PRO-ARG-PRO-LYS-ASN,PHE-HIS-ASP-ASP-SEP-ASP-GLU-ASP-LEU-LEU-HIS-ILE,171,12,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](COP(O)(O)O)[NH3+])CC(=O)O)CCC(=O)O)CC(=O)O)CC(C)C)CC(C)C)Cc1[nH]cnc1)C,Kd=3.5uM,5.455932,5.46,1,M,T,1,A,A,0,,E,A,,0,1,171,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9667763710021972,0.9504178166389464,91.08110809326172,85.53434753417969,0.3417639434337616,0.6060439348220825,0.9189946055412292,0.8851795792579651,0.8830934166908264,0.8643881678581238,FHDDSDEDLLHI,Low,"(5.31, 5.463]",train
4GNF,protein-peptide,Q9BZ95 P84243,SNARKIKTEPKQMHEDYCFQCGDGGELVMCDKKDCPKAYHLLCLNLTQPPYGKWECPWHQCDECSSAAVSFCEFCPHSFCKDHEKGALVPSALEGRLCCSEHDPMAP,ARTKQTARKSTGGKA,SER-ASN-ALA-ARG-LYS-ILE-LYS-THR-GLU-PRO-LYS-GLN-MET-HIS-GLU-ASP-TYR-CYS-PHE-GLN-CYS-GLY-ASP-GLY-GLY-GLU-LEU-VAL-MET-CYS-ASP-LYS-LYS-ASP-CYS-PRO-LYS-ALA-TYR-HIS-LEU-LEU-CYS-LEU-ASN-LEU-THR-GLN-PRO-PRO-TYR-GLY-LYS-TRP-GLU-CYS-PRO-TRP-HIS-GLN-CYS-ASP-GLU-CYS-SER-SER-ALA-ALA-VAL-SER-PHE-CYS-GLU-PHE-CYS-PRO-HIS-SER-PHE-CYS-LYS-ASP-HIS-GLU-LYS-GLY-ALA-LEU-VAL-PRO-SER-ALA-LEU-GLU-GLY-ARG-LEU-CYS-CYS-SER-GLU-HIS-ASP-PRO-MET-ALA-PRO,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,107,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=450uM,3.346787,3.35,1,M,T,1,A,A,0,,C,A,,1,1,107,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9124999046325684,0.8189297914505005,86.28518676757812,80.29602813720703,0.4290209114551544,0.7655553221702576,0.8089514970779419,0.8046160340309143,0.784698486328125,0.7582559585571289,ARTKQTARKSTGGKA,Low,"(2.044, 3.548]",train
4GVC,protein-peptide,P18827 Q13009,GAMGKVTHSIHIEKSDTAADTYGFSLSSVEEDGIRRLYVNSVKETGLASKKGLKAGDEILEINNRAADALNSSMLKDFLSQPSLGLLVRTYPEL,TKQEEFYA,GLY-ALA-MET-GLY-LYS-VAL-THR-HIS-SER-ILE-HIS-ILE-GLU-LYS-SER-ASP-THR-ALA-ALA-ASP-THR-TYR-GLY-PHE-SER-LEU-SER-SER-VAL-GLU-GLU-ASP-GLY-ILE-ARG-ARG-LEU-TYR-VAL-ASN-SER-VAL-LYS-GLU-THR-GLY-LEU-ALA-SER-LYS-LYS-GLY-LEU-LYS-ALA-GLY-ASP-GLU-ILE-LEU-GLU-ILE-ASN-ASN-ARG-ALA-ALA-ASP-ALA-LEU-ASN-SER-SER-MET-LEU-LYS-ASP-PHE-LEU-SER-GLN-PRO-SER-LEU-GLY-LEU-LEU-VAL-ARG-THR-TYR-PRO-GLU-LEU,THR-LYS-GLN-GLU-GLU-PHE-PTR-ALA,94,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)OP(O)(O)O)Cc1ccccc1)CCC(=O)O)CCC(=O)O)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)[NH3+],Kd=19.3uM,4.714443,4.71,1,M,T,1,A,A,0,,B,A,,1,1,94,8,0,C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,C[C@H](N)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,C[C@H](N)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.953486442565918,0.8832463622093201,97.2352523803711,94.79344177246094,0.3126607835292816,0.509334146976471,0.9205994606018066,0.9055020213127136,0.9126885533332824,0.8776823878288269,TKQEEFYA,Low,"(4.606, 4.745]",val
4NW2,protein-peptide,P03495 O14646,MHHHHHHSSGRENLYFQGEEEFETIERFMDCRIGRKGATGATTTIYAVEADGDPNAGFEKNKEPGEIQYLIKWKGWSHIHNTWETEETLKQQNVRGMKKLDNYKKKDQETKRWLKNASPEDVEYYNCQQELTDDLHKQYQIVERIIAHSNQKSAAGYPDYYCKWQGLPYSECSWEDGALISKKFQACIDEYFSR,PKQKRKMARTARSKV,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-GLU-GLU-GLU-PHE-GLU-THR-ILE-GLU-ARG-PHE-MET-ASP-CYS-ARG-ILE-GLY-ARG-LYS-GLY-ALA-THR-GLY-ALA-THR-THR-THR-ILE-TYR-ALA-VAL-GLU-ALA-ASP-GLY-ASP-PRO-ASN-ALA-GLY-PHE-GLU-LYS-ASN-LYS-GLU-PRO-GLY-GLU-ILE-GLN-TYR-LEU-ILE-LYS-TRP-LYS-GLY-TRP-SER-HIS-ILE-HIS-ASN-THR-TRP-GLU-THR-GLU-GLU-THR-LEU-LYS-GLN-GLN-ASN-VAL-ARG-GLY-MET-LYS-LYS-LEU-ASP-ASN-TYR-LYS-LYS-LYS-ASP-GLN-GLU-THR-LYS-ARG-TRP-LEU-LYS-ASN-ALA-SER-PRO-GLU-ASP-VAL-GLU-TYR-TYR-ASN-CYS-GLN-GLN-GLU-LEU-THR-ASP-ASP-LEU-HIS-LYS-GLN-TYR-GLN-ILE-VAL-GLU-ARG-ILE-ILE-ALA-HIS-SER-ASN-GLN-LYS-SER-ALA-ALA-GLY-TYR-PRO-ASP-TYR-TYR-CYS-LYS-TRP-GLN-GLY-LEU-PRO-TYR-SER-GLU-CYS-SER-TRP-GLU-ASP-GLY-ALA-LEU-ILE-SER-LYS-LYS-PHE-GLN-ALA-CYS-ILE-ASP-GLU-TYR-PHE-SER-ARG,PRO-LYS-GLN-LYS-ARG-LYS-MET-ALA-ARG-THR-ALA-ARG-SER-M3L-VAL,194,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCCC[N+](C)(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)C)CCC[NH+]=C(N)N.O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CC)C)CCC[NH+]=C(N)N,Kd=29uM,4.537602,4.54,1,M,T,1,A,A,0,,B,A,,1,1,194,15,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,0.8163570761680603,0.8081358075141907,80.13361358642578,81.95516204833984,0.4784063398838043,0.8764470815658569,0.8144881725311279,0.8099067807197571,0.7151496410369873,0.746481716632843,PKQKRKMARTARSKV,Low,"(4.456, 4.606]",train
4PIQ,protein-peptide,B9A5B9 B9A5C1,SGSSEQELAAIVRDLGCGPYFLGTHDKRFPGFLAGNKLACAIVNTAGRETGGVHWLAFGWNPRSRTCYMFDPFGFSDRRLKQIYSFEYEAMLRRSALALSPDRCLSLEQSTQTVQGPDSAACGLFCCMFLHAFVHWPDRPMDGNPTMNLLTGVPNGMLQSPQVLPTLRRNQEKLYRFLAHHSPYFRSHRAAIEHATAFDKMKQL,GVKSLKRRRCY,SER-GLY-SER-SER-GLU-GLN-GLU-LEU-ALA-ALA-ILE-VAL-ARG-ASP-LEU-GLY-CYS-GLY-PRO-TYR-PHE-LEU-GLY-THR-HIS-ASP-LYS-ARG-PHE-PRO-GLY-PHE-LEU-ALA-GLY-ASN-LYS-LEU-ALA-CYS-ALA-ILE-VAL-ASN-THR-ALA-GLY-ARG-GLU-THR-GLY-GLY-VAL-HIS-TRP-LEU-ALA-PHE-GLY-TRP-ASN-PRO-ARG-SER-ARG-THR-CYS-TYR-MET-PHE-ASP-PRO-PHE-GLY-PHE-SER-ASP-ARG-ARG-LEU-LYS-GLN-ILE-TYR-SER-PHE-GLU-TYR-GLU-ALA-MET-LEU-ARG-ARG-SER-ALA-LEU-ALA-LEU-SER-PRO-ASP-ARG-CYS-LEU-SER-LEU-GLU-GLN-SER-THR-GLN-THR-VAL-GLN-GLY-PRO-ASP-SER-ALA-ALA-CYS-GLY-LEU-PHE-CYS-CYS-MET-PHE-LEU-HIS-ALA-PHE-VAL-HIS-TRP-PRO-ASP-ARG-PRO-MET-ASP-GLY-ASN-PRO-THR-MET-ASN-LEU-LEU-THR-GLY-VAL-PRO-ASN-GLY-MET-LEU-GLN-SER-PRO-GLN-VAL-LEU-PRO-THR-LEU-ARG-ARG-ASN-GLN-GLU-LYS-LEU-TYR-ARG-PHE-LEU-ALA-HIS-HIS-SER-PRO-TYR-PHE-ARG-SER-HIS-ARG-ALA-ALA-ILE-GLU-HIS-ALA-THR-ALA-PHE-ASP-LYS-MET-LYS-GLN-LEU,GLY-VAL-LYS-SER-LEU-LYS-ARG-ARG-ARG-CYS-TYR,204,11,N=CCNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)Cc1cc(Cl)cc(c1)Cl,IC50=0.08uM,7.09691,7.1,1,M,T,1,A,A,0,,B,A,,1,1,204,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,0.7169576287269592,0.7082281112670898,58.32963180541992,50.11779022216797,1.035796046257019,1.0488083362579346,0.6624124646186829,0.726439356803894,0.698617160320282,0.7036752700805664,GVKSLKRRRCY,Moderate,"(7.049, 7.268]",train
5AJO,protein-peptide,P98088 Q10471,MRRRSRMLLCFAFLWVLGIAYYMYSGGGSALAGGAGGGAGRKEDWNEIDPIKKKDLHHSNGEEKAQSMETLPPGKVRWPDFNQEAYVGGTMVRSGQDPYARNKFNQVESDKLRMDRAIPDTRHDQCQRKQWRVDLPATSVVITFHNEARSALLRTVVSVLKKSPPHLIKEIILVDDYSNDPEDGALLGKIEKVRVLRNDRREGLMRSRVRGADAAQAKVLTFLDSHCECNEHWLEPLLERVAEDRTRVVSPIIDVINMDNFQYVGASADLKGGFDWNLVFKWDYMTPEQRRSRQGNPVAPIKTPMIAGGLFVMDKFYFEELGKYDMMMDVWGGENLEISFRVWQCGGSLEIIPCSRVGHVFRKQHPYTFPGGSGTVFARNTRRAAEVWMDEYKNFYYAAVPSARNVPYGNIQSRLELRKKLSCKPFKWYLENVYPELRVPDHQDIAFGALQQGTNCLDTLGHFADGVVGVYECHNAGGNQEWALTKEKSVKHMDLCLTVVDRAPGSLIKLQGCREDDSRQKWEQIEGNSKLRHVGSNLCLDSRTAKSGGLSVEVCGPALSQQWKFTLNLQQ,AGTTPSPVPTTSTTSAA,MET-ARG-ARG-ARG-SER-ARG-MET-LEU-LEU-CYS-PHE-ALA-PHE-LEU-TRP-VAL-LEU-GLY-ILE-ALA-TYR-TYR-MET-TYR-SER-GLY-GLY-GLY-SER-ALA-LEU-ALA-GLY-GLY-ALA-GLY-GLY-GLY-ALA-GLY-ARG-LYS-GLU-ASP-TRP-ASN-GLU-ILE-ASP-PRO-ILE-LYS-LYS-LYS-ASP-LEU-HIS-HIS-SER-ASN-GLY-GLU-GLU-LYS-ALA-GLN-SER-MET-GLU-THR-LEU-PRO-PRO-GLY-LYS-VAL-ARG-TRP-PRO-ASP-PHE-ASN-GLN-GLU-ALA-TYR-VAL-GLY-GLY-THR-MET-VAL-ARG-SER-GLY-GLN-ASP-PRO-TYR-ALA-ARG-ASN-LYS-PHE-ASN-GLN-VAL-GLU-SER-ASP-LYS-LEU-ARG-MET-ASP-ARG-ALA-ILE-PRO-ASP-THR-ARG-HIS-ASP-GLN-CYS-GLN-ARG-LYS-GLN-TRP-ARG-VAL-ASP-LEU-PRO-ALA-THR-SER-VAL-VAL-ILE-THR-PHE-HIS-ASN-GLU-ALA-ARG-SER-ALA-LEU-LEU-ARG-THR-VAL-VAL-SER-VAL-LEU-LYS-LYS-SER-PRO-PRO-HIS-LEU-ILE-LYS-GLU-ILE-ILE-LEU-VAL-ASP-ASP-TYR-SER-ASN-ASP-PRO-GLU-ASP-GLY-ALA-LEU-LEU-GLY-LYS-ILE-GLU-LYS-VAL-ARG-VAL-LEU-ARG-ASN-ASP-ARG-ARG-GLU-GLY-LEU-MET-ARG-SER-ARG-VAL-ARG-GLY-ALA-ASP-ALA-ALA-GLN-ALA-LYS-VAL-LEU-THR-PHE-LEU-ASP-SER-HIS-CYS-GLU-CYS-ASN-GLU-HIS-TRP-LEU-GLU-PRO-LEU-LEU-GLU-ARG-VAL-ALA-GLU-ASP-ARG-THR-ARG-VAL-VAL-SER-PRO-ILE-ILE-ASP-VAL-ILE-ASN-MET-ASP-ASN-PHE-GLN-TYR-VAL-GLY-ALA-SER-ALA-ASP-LEU-LYS-GLY-GLY-PHE-ASP-TRP-ASN-LEU-VAL-PHE-LYS-TRP-ASP-TYR-MET-THR-PRO-GLU-GLN-ARG-ARG-SER-ARG-GLN-GLY-ASN-PRO-VAL-ALA-PRO-ILE-LYS-THR-PRO-MET-ILE-ALA-GLY-GLY-LEU-PHE-VAL-MET-ASP-LYS-PHE-TYR-PHE-GLU-GLU-LEU-GLY-LYS-TYR-ASP-MET-MET-MET-ASP-VAL-TRP-GLY-GLY-GLU-ASN-LEU-GLU-ILE-SER-PHE-ARG-VAL-TRP-GLN-CYS-GLY-GLY-SER-LEU-GLU-ILE-ILE-PRO-CYS-SER-ARG-VAL-GLY-HIS-VAL-PHE-ARG-LYS-GLN-HIS-PRO-TYR-THR-PHE-PRO-GLY-GLY-SER-GLY-THR-VAL-PHE-ALA-ARG-ASN-THR-ARG-ARG-ALA-ALA-GLU-VAL-TRP-MET-ASP-GLU-TYR-LYS-ASN-PHE-TYR-TYR-ALA-ALA-VAL-PRO-SER-ALA-ARG-ASN-VAL-PRO-TYR-GLY-ASN-ILE-GLN-SER-ARG-LEU-GLU-LEU-ARG-LYS-LYS-LEU-SER-CYS-LYS-PRO-PHE-LYS-TRP-TYR-LEU-GLU-ASN-VAL-TYR-PRO-GLU-LEU-ARG-VAL-PRO-ASP-HIS-GLN-ASP-ILE-ALA-PHE-GLY-ALA-LEU-GLN-GLN-GLY-THR-ASN-CYS-LEU-ASP-THR-LEU-GLY-HIS-PHE-ALA-ASP-GLY-VAL-VAL-GLY-VAL-TYR-GLU-CYS-HIS-ASN-ALA-GLY-GLY-ASN-GLN-GLU-TRP-ALA-LEU-THR-LYS-GLU-LYS-SER-VAL-LYS-HIS-MET-ASP-LEU-CYS-LEU-THR-VAL-VAL-ASP-ARG-ALA-PRO-GLY-SER-LEU-ILE-LYS-LEU-GLN-GLY-CYS-ARG-GLU-ASP-ASP-SER-ARG-GLN-LYS-TRP-GLU-GLN-ILE-GLU-GLY-ASN-SER-LYS-LEU-ARG-HIS-VAL-GLY-SER-ASN-LEU-CYS-LEU-ASP-SER-ARG-THR-ALA-LYS-SER-GLY-GLY-LEU-SER-VAL-GLU-VAL-CYS-GLY-PRO-ALA-LEU-SER-GLN-GLN-TRP-LYS-PHE-THR-LEU-ASN-LEU-GLN-GLN,ALA-GLY-THR-THR-PRO-SER-PRO-VAL-PRO-THR-THR-SER-THR-THR-SER-ALA-ALA,571,17,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)CO)[C@H](O)C)[C@H](O)C)CO)[C@H](O)C)[C@H](O)C)C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)C,Kd=11uM,4.958607,4.96,1,M,T,1,A,A,0,,B,A,,1,1,571,17,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.710072934627533,0.8394122123718262,61.24771881103516,68.6043930053711,0.7518512606620789,0.9434190988540648,0.7385784387588501,0.7804527878761292,0.6062203645706177,0.7731537818908691,AGTTPSPVPTTSTTSAA,Low,"(4.866, 5.014]",val
5H1E,protein-peptide,P13053 Q15596,GSHMGSPNSPLKDSLRPKLSEEQQHIIAILLDAHHKTYDPTYADFRDFRPPVRMDGSTGSVTLDLSPLSMLPHLADLVSYSIQKVIGFAKMIPGFRDLTSDDQIVLLKSSAIEVIMLRSNQSFTMDDMSWDCGSQDYKYDVTDVSKAGHTLELIEPLIKFQVGLKKLNLHEEEHVLLMAICIVSPDRPGVQDAKLVEAIQDRLSNTLQTYIRCRHPPPGSHQLYAKMIQKLADLRSLNEEHSKQYRSLSFQPENSMKLTPLVLEVFGNEIS,KENALLRYLLDKD,GLY-SER-HIS-MET-GLY-SER-PRO-ASN-SER-PRO-LEU-LYS-ASP-SER-LEU-ARG-PRO-LYS-LEU-SER-GLU-GLU-GLN-GLN-HIS-ILE-ILE-ALA-ILE-LEU-LEU-ASP-ALA-HIS-HIS-LYS-THR-TYR-ASP-PRO-THR-TYR-ALA-ASP-PHE-ARG-ASP-PHE-ARG-PRO-PRO-VAL-ARG-MET-ASP-GLY-SER-THR-GLY-SER-VAL-THR-LEU-ASP-LEU-SER-PRO-LEU-SER-MET-LEU-PRO-HIS-LEU-ALA-ASP-LEU-VAL-SER-TYR-SER-ILE-GLN-LYS-VAL-ILE-GLY-PHE-ALA-LYS-MET-ILE-PRO-GLY-PHE-ARG-ASP-LEU-THR-SER-ASP-ASP-GLN-ILE-VAL-LEU-LEU-LYS-SER-SER-ALA-ILE-GLU-VAL-ILE-MET-LEU-ARG-SER-ASN-GLN-SER-PHE-THR-MET-ASP-ASP-MET-SER-TRP-ASP-CYS-GLY-SER-GLN-ASP-TYR-LYS-TYR-ASP-VAL-THR-ASP-VAL-SER-LYS-ALA-GLY-HIS-THR-LEU-GLU-LEU-ILE-GLU-PRO-LEU-ILE-LYS-PHE-GLN-VAL-GLY-LEU-LYS-LYS-LEU-ASN-LEU-HIS-GLU-GLU-GLU-HIS-VAL-LEU-LEU-MET-ALA-ILE-CYS-ILE-VAL-SER-PRO-ASP-ARG-PRO-GLY-VAL-GLN-ASP-ALA-LYS-LEU-VAL-GLU-ALA-ILE-GLN-ASP-ARG-LEU-SER-ASN-THR-LEU-GLN-THR-TYR-ILE-ARG-CYS-ARG-HIS-PRO-PRO-PRO-GLY-SER-HIS-GLN-LEU-TYR-ALA-LYS-MET-ILE-GLN-LYS-LEU-ALA-ASP-LEU-ARG-SER-LEU-ASN-GLU-GLU-HIS-SER-LYS-GLN-TYR-ARG-SER-LEU-SER-PHE-GLN-PRO-GLU-ASN-SER-MET-LYS-LEU-THR-PRO-LEU-VAL-LEU-GLU-VAL-PHE-GLY-ASN-GLU-ILE-SER,LYS-GLU-ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP-LYS-ASP,271,13,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(C)C)CC(C)C)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)CC(C)C)CC(C)C)C)CC(=O)N)[NH3+],Kd=0.029uM,7.537602,7.54,1,M,T,1,A,A,0,,C,A,,1,1,271,13,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9533122777938844,0.8272421360015869,88.64582061767578,82.56140899658203,0.4334616065025329,0.7967547178268433,0.8726129531860352,0.8564420342445374,0.911867380142212,0.7853480577468872,KENALLRYLLDKD,Moderate,"(7.523, 7.921]",val
5JEO,protein-peptide,Q99FX5 Q14653,SEFENPLKRLLVPGEEWEFEVTAFYRGRQVFQQTISCPEGLRLVGSEVGDRTLPGWPVTLPDPGMSLTDRGVMSYVRHVLSCLGGGLALWRAGQWLWAQRLGHCHTYWAVSEELLPNSGHGPDGEVPKDKEGGVFDLGPFIVDLITFTEGSGRSPRYALWFCVGESWPQDQPWTKRLVMVKVVPTCLRALVEMARVGGASSLENTVDLHISNSHPLSLTSDQYKAYLQDLVEGMDFQGPGES,STLTEEFELLISNSEDDWE,SER-GLU-PHE-GLU-ASN-PRO-LEU-LYS-ARG-LEU-LEU-VAL-PRO-GLY-GLU-GLU-TRP-GLU-PHE-GLU-VAL-THR-ALA-PHE-TYR-ARG-GLY-ARG-GLN-VAL-PHE-GLN-GLN-THR-ILE-SER-CYS-PRO-GLU-GLY-LEU-ARG-LEU-VAL-GLY-SER-GLU-VAL-GLY-ASP-ARG-THR-LEU-PRO-GLY-TRP-PRO-VAL-THR-LEU-PRO-ASP-PRO-GLY-MET-SER-LEU-THR-ASP-ARG-GLY-VAL-MET-SER-TYR-VAL-ARG-HIS-VAL-LEU-SER-CYS-LEU-GLY-GLY-GLY-LEU-ALA-LEU-TRP-ARG-ALA-GLY-GLN-TRP-LEU-TRP-ALA-GLN-ARG-LEU-GLY-HIS-CYS-HIS-THR-TYR-TRP-ALA-VAL-SER-GLU-GLU-LEU-LEU-PRO-ASN-SER-GLY-HIS-GLY-PRO-ASP-GLY-GLU-VAL-PRO-LYS-ASP-LYS-GLU-GLY-GLY-VAL-PHE-ASP-LEU-GLY-PRO-PHE-ILE-VAL-ASP-LEU-ILE-THR-PHE-THR-GLU-GLY-SER-GLY-ARG-SER-PRO-ARG-TYR-ALA-LEU-TRP-PHE-CYS-VAL-GLY-GLU-SER-TRP-PRO-GLN-ASP-GLN-PRO-TRP-THR-LYS-ARG-LEU-VAL-MET-VAL-LYS-VAL-VAL-PRO-THR-CYS-LEU-ARG-ALA-LEU-VAL-GLU-MET-ALA-ARG-VAL-GLY-GLY-ALA-SER-SER-LEU-GLU-ASN-THR-VAL-ASP-LEU-HIS-ILE-SER-ASN-SER-HIS-PRO-LEU-SER-LEU-THR-SER-ASP-GLN-TYR-LYS-ALA-TYR-LEU-GLN-ASP-LEU-VAL-GLU-GLY-MET-ASP-PHE-GLN-GLY-PRO-GLY-GLU-SER,SER-THR-LEU-THR-GLU-GLU-PHE-GLU-LEU-LEU-ILE-SEP-ASN-SER-GLU-ASP-ASP-TRP-GLU,242,19,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)N)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)Cc1ccccc1)CCC(=O)O)CC(C)C)CC(C)C)C,Kd=15.8uM,4.801343,4.8,1,M,T,1,A,A,0,,B,A,,1,1,242,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,0.8778676390647888,0.731024980545044,86.01667785644531,77.02481079101562,0.4482465982437134,1.0089131593704224,0.9067641496658324,0.8182216882705688,0.8251453638076782,0.7066431045532227,STLTEEFELLISNSEDDWE,Low,"(4.745, 4.866]",train
5WXG,protein-peptide,Q5VWG9 P68431,SMYVIRDEWGNQIWICPGCNKPDDGSPMIGCDDCDDWYHWPCVGIMTAPPEEMQWFCPKCANK,ARTKQTA,SER-MET-TYR-VAL-ILE-ARG-ASP-GLU-TRP-GLY-ASN-GLN-ILE-TRP-ILE-CYS-PRO-GLY-CYS-ASN-LYS-PRO-ASP-ASP-GLY-SER-PRO-MET-ILE-GLY-CYS-ASP-ASP-CYS-ASP-ASP-TRP-TYR-HIS-TRP-PRO-CYS-VAL-GLY-ILE-MET-THR-ALA-PRO-PRO-GLU-GLU-MET-GLN-TRP-PHE-CYS-PRO-LYS-CYS-ALA-ASN-LYS,ALA-ARG-THR-ALY-GLN-THR-ALA,63,7,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCCNC(=O)C,Kd=137uM,3.863279,3.86,1,M,T,1,A,A,0,,P,A,,1,1,63,7,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.9278132915496826,0.8902291059494019,96.18639373779295,94.71878814697266,0.3356180787086487,0.4362387061119079,0.8755623698234558,0.9022545218467712,0.8783760070800781,0.8872227072715759,ARTKQTA,Low,"(3.548, 3.924]",train
5XO2,protein-peptide,P06437 Q9UKJ1,MLYGVTQPKHLSASMGGSVEIPFSFYYPWELATAPDVRISWRRGHFHGQSFYSTRPPSIHKDYVNRLFLNWTEGQKSGFLRISNLQKQDQSVYFCRVELDTRSSGRQQWQSIEGTKLSIT,GPATPAP,MET-LEU-TYR-GLY-VAL-THR-GLN-PRO-LYS-HIS-LEU-SER-ALA-SER-MET-GLY-GLY-SER-VAL-GLU-ILE-PRO-PHE-SER-PHE-TYR-TYR-PRO-TRP-GLU-LEU-ALA-THR-ALA-PRO-ASP-VAL-ARG-ILE-SER-TRP-ARG-ARG-GLY-HIS-PHE-HIS-GLY-GLN-SER-PHE-TYR-SER-THR-ARG-PRO-PRO-SER-ILE-HIS-LYS-ASP-TYR-VAL-ASN-ARG-LEU-PHE-LEU-ASN-TRP-THR-GLU-GLY-GLN-LYS-SER-GLY-PHE-LEU-ARG-ILE-SER-ASN-LEU-GLN-LYS-GLN-ASP-GLN-SER-VAL-TYR-PHE-CYS-ARG-VAL-GLU-LEU-ASP-THR-ARG-SER-SER-GLY-ARG-GLN-GLN-TRP-GLN-SER-ILE-GLU-GLY-THR-LYS-LEU-SER-ILE-THR,GLY-PRO-ALA-THR-PRO-ALA-PRO,120,7,OC[C@H]([C@H]([C@@H]1O[C@](OC[C@H]2O[C@H](O[C@@H]([C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)C[NH3+])C)C)[C@@H]([C@H](C2)O)NC(=O)C)(C[C@@H]([C@H]1NC(=O)C)O)C(=O)O)O)O,Kd=94uM,4.026872,4.03,1,M,T,1,A,A,0,,X,A,dimer,0,1,120,7,0,C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.8833014965057373,0.8038546442985535,91.99974060058594,95.94075775146484,0.3023872971534729,0.4990928769111633,0.9432806968688964,0.8911857604980469,0.8338578343391418,0.7820218801498413,GPATPAP,Low,"(3.924, 4.155]",train
5YC3,protein-peptide,Q9M2B4 P59226,GPLGSDHGETLCGACGDSDGADEFWICCDLCEKWFHGKCVKITPARAEHIKQYKCPSCSN,ARTKQTARK,GLY-PRO-LEU-GLY-SER-ASP-HIS-GLY-GLU-THR-LEU-CYS-GLY-ALA-CYS-GLY-ASP-SER-ASP-GLY-ALA-ASP-GLU-PHE-TRP-ILE-CYS-CYS-ASP-LEU-CYS-GLU-LYS-TRP-PHE-HIS-GLY-LYS-CYS-VAL-LYS-ILE-THR-PRO-ALA-ARG-ALA-GLU-HIS-ILE-LYS-GLN-TYR-LYS-CYS-PRO-SER-CYS-SER-ASN,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-LYS,60,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=14.2uM,4.847712,4.85,1,M,T,1,A,A,0,,P,A,,1,1,60,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.0155810117721558,0.9754963517189026,89.82408142089844,86.78860473632812,0.3804508745670318,0.5505744218826294,0.8247753381729126,0.8785218000411987,0.8549490571022034,0.8643232583999634,ARTKQTARK,Low,"(4.745, 4.866]",train
6BHD,protein-peptide,Q15047 P68431,MHHHHHHSSGRENLYFQGGELSKDGDLIVSMRILGKKRTKTWHKGTLIAIQTVGPGKKYKVKFDNKGKSLLSGNHIAYDYHPPADKLYVGSRVVAKYKDGNQVWLYAGIVAETPNVKNKLRFLIFFDDGYASYVTQSELYPICRPLKKTWEDIEDISCRDFIEEYVTAYPNRPMVLLKSGQLIKTEWEGTWWKSRVEEVDGSLVRILFLDDKRCEWIYRGSTRLEPMFSMKTSSASALE,KQTARKSTGGKAPRKQ,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-GLY-GLU-LEU-SER-LYS-ASP-GLY-ASP-LEU-ILE-VAL-SER-MET-ARG-ILE-LEU-GLY-LYS-LYS-ARG-THR-LYS-THR-TRP-HIS-LYS-GLY-THR-LEU-ILE-ALA-ILE-GLN-THR-VAL-GLY-PRO-GLY-LYS-LYS-TYR-LYS-VAL-LYS-PHE-ASP-ASN-LYS-GLY-LYS-SER-LEU-LEU-SER-GLY-ASN-HIS-ILE-ALA-TYR-ASP-TYR-HIS-PRO-PRO-ALA-ASP-LYS-LEU-TYR-VAL-GLY-SER-ARG-VAL-VAL-ALA-LYS-TYR-LYS-ASP-GLY-ASN-GLN-VAL-TRP-LEU-TYR-ALA-GLY-ILE-VAL-ALA-GLU-THR-PRO-ASN-VAL-LYS-ASN-LYS-LEU-ARG-PHE-LEU-ILE-PHE-PHE-ASP-ASP-GLY-TYR-ALA-SER-TYR-VAL-THR-GLN-SER-GLU-LEU-TYR-PRO-ILE-CYS-ARG-PRO-LEU-LYS-LYS-THR-TRP-GLU-ASP-ILE-GLU-ASP-ILE-SER-CYS-ARG-ASP-PHE-ILE-GLU-GLU-TYR-VAL-THR-ALA-TYR-PRO-ASN-ARG-PRO-MET-VAL-LEU-LEU-LYS-SER-GLY-GLN-LEU-ILE-LYS-THR-GLU-TRP-GLU-GLY-THR-TRP-TRP-LYS-SER-ARG-VAL-GLU-GLU-VAL-ASP-GLY-SER-LEU-VAL-ARG-ILE-LEU-PHE-LEU-ASP-ASP-LYS-ARG-CYS-GLU-TRP-ILE-TYR-ARG-GLY-SER-THR-ARG-LEU-GLU-PRO-MET-PHE-SER-MET-LYS-THR-SER-SER-ALA-SER-ALA-LEU-GLU,ACE-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN-NH2,239,18,CCC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CO)CCCCNC(=O)C)C,Kd=9.3uM,5.031517,5.03,1,M,T,1,A,A,0,,B,A,,1,1,239,18,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.8512845039367676,0.7249001264572144,80.23624420166016,79.13163757324219,0.4672684073448181,1.00308358669281,0.851500391960144,0.797302782535553,0.7654461860656738,0.657113254070282,KQTARKSTGGKAPRKQ,Low,"(5.014, 5.105]",val
6MTV,protein-peptide,P23508 Q14160,GSAPSVKGVSFDQANNLLIEPARIEEEELTLTILRQTGGLGISIAGGKGSTPYKGDDEGIFISRVSEEGPAARAGVRVGDKLLEVNGVALQGAEHHEAVEALRGAGTAVQMRVWRERM,PHTNETSL,GLY-SER-ALA-PRO-SER-VAL-LYS-GLY-VAL-SER-PHE-ASP-GLN-ALA-ASN-ASN-LEU-LEU-ILE-GLU-PRO-ALA-ARG-ILE-GLU-GLU-GLU-GLU-LEU-THR-LEU-THR-ILE-LEU-ARG-GLN-THR-GLY-GLY-LEU-GLY-ILE-SER-ILE-ALA-GLY-GLY-LYS-GLY-SER-THR-PRO-TYR-LYS-GLY-ASP-ASP-GLU-GLY-ILE-PHE-ILE-SER-ARG-VAL-SER-GLU-GLU-GLY-PRO-ALA-ALA-ARG-ALA-GLY-VAL-ARG-VAL-GLY-ASP-LYS-LEU-LEU-GLU-VAL-ASN-GLY-VAL-ALA-LEU-GLN-GLY-ALA-GLU-HIS-HIS-GLU-ALA-VAL-GLU-ALA-LEU-ARG-GLY-ALA-GLY-THR-ALA-VAL-GLN-MET-ARG-VAL-TRP-ARG-GLU-ARG-MET,PRO-HIS-THR-ASN-GLU-THR-SER-LEU,118,8,OC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CC(=O)N)CCC(=O)O,Kd=7715nM,5.112664,5.11,1,M,T,1,A,A,0,,D,A,,0,1,118,8,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.0459388494491575,0.9703655242919922,86.3357162475586,81.63919067382812,0.3572236895561218,0.5127565860748291,0.8791033625602722,0.8477699756622314,0.9239572286605836,0.8685991764068604,PHTNETSL,Low,"(5.105, 5.222]",train
5SZC,protein-peptide,Q92784 P68431,GTVIPNNYCDFCLGGSNMNKKSGRPEELVSCADCGRSGHPTCLQFTLNMTEAVKTYKWQCIECKSCILCGTSENDDQLLFCDDCDRGYHMYCLNPPVAEPPEGSWSCHLCWELLK,ARTKQTARKSTGGKAPRK,GLY-THR-VAL-ILE-PRO-ASN-ASN-TYR-CYS-ASP-PHE-CYS-LEU-GLY-GLY-SER-ASN-MET-ASN-LYS-LYS-SER-GLY-ARG-PRO-GLU-GLU-LEU-VAL-SER-CYS-ALA-ASP-CYS-GLY-ARG-SER-GLY-HIS-PRO-THR-CYS-LEU-GLN-PHE-THR-LEU-ASN-MET-THR-GLU-ALA-VAL-LYS-THR-TYR-LYS-TRP-GLN-CYS-ILE-GLU-CYS-LYS-SER-CYS-ILE-LEU-CYS-GLY-THR-SER-GLU-ASN-ASP-ASP-GLN-LEU-LEU-PHE-CYS-ASP-ASP-CYS-ASP-ARG-GLY-TYR-HIS-MET-TYR-CYS-LEU-ASN-PRO-PRO-VAL-ALA-GLU-PRO-PRO-GLU-GLY-SER-TRP-SER-CYS-HIS-LEU-CYS-TRP-GLU-LEU-LEU-LYS,ALA-ARG-THR-MLZ-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS,115,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCCNC(=O)C)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH2+]C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=20.4uM,4.69037,4.69,1,M,T,1,A,A,0,,H,A,,0,1,115,18,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9637168049812316,0.6904151439666748,87.19773864746094,87.6109619140625,0.3395191431045532,0.9520083069801332,0.9073349833488464,0.7838417887687683,0.8791280388832092,0.6561888456344604,ARTKQTARKSTGGKAPRK,Low,"(4.606, 4.745]",train
6UYY,protein-peptide,P63165,GSKEGEYIKLKVIGQDSSEIHFKVKMTTHLKKLKESYAQRQGVPMNSLRFLFEGQRIADNHTPKELGMEEEDVIEVYQEQTGG,GSGEAEERIIVLSDSDY,GLY-SER-LYS-GLU-GLY-GLU-TYR-ILE-LYS-LEU-LYS-VAL-ILE-GLY-GLN-ASP-SER-SER-GLU-ILE-HIS-PHE-LYS-VAL-ALY-MET-THR-THR-HIS-LEU-LYS-LYS-LEU-LYS-GLU-SER-TYR-ALA-GLN-ARG-GLN-GLY-VAL-PRO-MET-ASN-SER-LEU-ARG-PHE-LEU-PHE-GLU-GLY-GLN-ARG-ILE-ALA-ASP-ASN-HIS-THR-PRO-LYS-GLU-LEU-GLY-MET-GLU-GLU-GLU-ASP-VAL-ILE-GLU-VAL-TYR-GLN-GLU-GLN-THR-GLY-GLY,GLY-SER-GLY-GLU-ALA-GLU-GLU-ARG-ILE-ILE-VAL-LEU-SEP-ASP-SEP-ASP-TYR,83,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)COP(O)(O)O)CC(C)C)C(C)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])C)CCC(=O)O)CCC(=O)O)CCC[NH+]=C(N)N)C,Kd=1.9uM,5.721246,5.72,1,M,T,1,A,A,0,,B,A,,0,1,83,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,0.9044060707092284,0.7870136499404907,92.56614685058594,88.99986267089844,0.3630390167236328,0.6499363780021667,0.8731346130371094,0.8370510935783386,0.8059739470481873,0.7745043039321899,GSGEAEERIIVLSDSDY,Low,"(5.699, 5.821]",train
1UJJ,protein-peptide,Q9UJY5 P56817,MEPAMEPETLEARINRATNPLNKELDWASINGFCEQLNEDFEGPPLATRLLAHKIQSPQEWEAIQALTVLETCMKSCGKRFHDEVGKFRFLNELIKVVSPKYLGSRTSEKVKNKILELLYSWTVGLPEEVKIAEAYQMLKKQGIVKS,HDDFADDISLLK,MET-GLU-PRO-ALA-MET-GLU-PRO-GLU-THR-LEU-GLU-ALA-ARG-ILE-ASN-ARG-ALA-THR-ASN-PRO-LEU-ASN-LYS-GLU-LEU-ASP-TRP-ALA-SER-ILE-ASN-GLY-PHE-CYS-GLU-GLN-LEU-ASN-GLU-ASP-PHE-GLU-GLY-PRO-PRO-LEU-ALA-THR-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-ILE-GLN-ALA-LEU-THR-VAL-LEU-GLU-THR-CYS-MET-LYS-SER-CYS-GLY-LYS-ARG-PHE-HIS-ASP-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-SER-ARG-THR-SER-GLU-LYS-VAL-LYS-ASN-LYS-ILE-LEU-GLU-LEU-LEU-TYR-SER-TRP-THR-VAL-GLY-LEU-PRO-GLU-GLU-VAL-LYS-ILE-ALA-GLU-ALA-TYR-GLN-MET-LEU-LYS-LYS-GLN-GLY-ILE-VAL-LYS-SER,HIS-ASP-ASP-PHE-ALA-ASP-ASP-ILE-SER-LEU-LEU-LYS,147,12,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)CO)CC(C)C)CC(C)C,Kd=0.8uM,6.09691,6.1,1,M,T,1,A,A,0,,C,A,,1,1,147,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9010831117630004,0.8157554268836975,94.1288833618164,92.7484359741211,0.3269452154636383,0.6902573704719543,0.9309942722320556,0.8734760880470276,0.8464354872703552,0.780066728591919,HDDFADDISLLK,Low,"(5.959, 6.097]",train
1UKH,protein-peptide,Q9WVI9 P45983,MSRSKRDNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGLLNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMIKGGVLFPGTDHIDQWNKVIEQLGTPCPEFMKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKLKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSEAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLHHHHHH,RPKRPTTLNLF,MET-SER-ARG-SER-LYS-ARG-ASP-ASN-ASN-PHE-TYR-SER-VAL-GLU-ILE-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-ILE-LEU-GLU-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-GLY-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-SER-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-ILE-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-ILE-LYS-GLY-GLY-VAL-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-THR-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-TYR-SER-PHE-GLU-LYS-LEU-PHE-PRO-ASP-VAL-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-ALA-SER-LYS-ARG-ILE-SER-VAL-ASP-GLU-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-SER-GLU-ALA-GLU-ALA-PRO-PRO-PRO-LYS-ILE-PRO-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASP-LEU-HIS-HIS-HIS-HIS-HIS-HIS,ARG-PRO-LYS-ARG-PRO-THR-THR-LEU-ASN-LEU-PHE,369,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(C)C)CC(=O)N)CC(C)C)[C@H](O)C)[C@H](O)C)CCC[NH+]=C(N)N)NC(=O)[C@H]1[NH2+]CCC1,Kd=0.42uM,6.376751,6.38,1,M,T,1,A,A,0,,B,A,,1,1,369,11,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.8850729465484619,0.7358744740486145,77.36687469482422,75.76182556152344,0.5611477494239807,0.9536913633346558,0.8646473288536072,0.8255389928817749,0.8720872402191162,0.706683337688446,RPKRPTTLNLF,Low,"(6.26, 6.398]",train
2F6J,protein-peptide,Q12830,GPLGSDTKLYCICKTPYDESKFYIGCDRCQNWYHGRCVGILQSEAELIDEYVCPQCQSTEDAMTVLTPLTEKDYEGLKRVLRSLQAHKMAWPFLEPVDPNDAPDYYGVIKEPMDLATMEERVQRRYYEKLTEFVADMTKIFDNCRYYNPSDSPFYQCAEVLESFFVQKLKGFKA,ARTKQTARKSTGGKA,GLY-PRO-LEU-GLY-SER-ASP-THR-LYS-LEU-TYR-CYS-ILE-CYS-LYS-THR-PRO-TYR-ASP-GLU-SER-LYS-PHE-TYR-ILE-GLY-CYS-ASP-ARG-CYS-GLN-ASN-TRP-TYR-HIS-GLY-ARG-CYS-VAL-GLY-ILE-LEU-GLN-SER-GLU-ALA-GLU-LEU-ILE-ASP-GLU-TYR-VAL-CYS-PRO-GLN-CYS-GLN-SER-THR-GLU-ASP-ALA-MSE-THR-VAL-LEU-THR-PRO-LEU-THR-GLU-LYS-ASP-TYR-GLU-GLY-LEU-LYS-ARG-VAL-LEU-ARG-SER-LEU-GLN-ALA-HIS-LYS-MSE-ALA-TRP-PRO-PHE-LEU-GLU-PRO-VAL-ASP-PRO-ASN-ASP-ALA-PRO-ASP-TYR-TYR-GLY-VAL-ILE-LYS-GLU-PRO-MSE-ASP-LEU-ALA-THR-MSE-GLU-GLU-ARG-VAL-GLN-ARG-ARG-TYR-TYR-GLU-LYS-LEU-THR-GLU-PHE-VAL-ALA-ASP-MSE-THR-LYS-ILE-PHE-ASP-ASN-CYS-ARG-TYR-TYR-ASN-PRO-SER-ASP-SER-PRO-PHE-TYR-GLN-CYS-ALA-GLU-VAL-LEU-GLU-SER-PHE-PHE-VAL-GLN-LYS-LEU-LYS-GLY-PHE-LYS-ALA,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,174,15,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=2.7uM,5.568636,5.57,1,M,T,1,A,A,0,,P,A,,1,1,174,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.6670673489570618,0.6264958381652832,63.840553283691406,70.14643096923828,0.676974892616272,1.6092636585235596,0.6712217330932617,0.6925069093704224,0.5767430067062378,0.609993040561676,ARTKQTARKSTGGKA,Low,"(5.463, 5.6]",train
2H2D,protein-peptide,Q9WYW0 P04637,MKMKEFLDLLNESRLTVTLTGAGISTPSGIPDFRGPNGIYKKYSQNVFDIDFFYSHPEEFYRFAKEGIFPMLQAKPNLAHVLLAKLEEKGLIEAVITQNIDRLHQRAGSKKVIELHGNVEEYYCVRCEKKYTVEDVIKKLESSDVPLCDDCNSLIRPNIVFFGENLPQDALREAIGLSSRASLMIVLGSSLVVYPAAELPLITVRSGGKLVIVNLGETPFDDIATLKYNMDVVEFARRVMEEGGIS,KKGQSTSRHKKLMFKTEG,MET-LYS-MET-LYS-GLU-PHE-LEU-ASP-LEU-LEU-ASN-GLU-SER-ARG-LEU-THR-VAL-THR-LEU-THR-GLY-ALA-GLY-ILE-SER-THR-PRO-SER-GLY-ILE-PRO-ASP-PHE-ARG-GLY-PRO-ASN-GLY-ILE-TYR-LYS-LYS-TYR-SER-GLN-ASN-VAL-PHE-ASP-ILE-ASP-PHE-PHE-TYR-SER-HIS-PRO-GLU-GLU-PHE-TYR-ARG-PHE-ALA-LYS-GLU-GLY-ILE-PHE-PRO-MET-LEU-GLN-ALA-LYS-PRO-ASN-LEU-ALA-HIS-VAL-LEU-LEU-ALA-LYS-LEU-GLU-GLU-LYS-GLY-LEU-ILE-GLU-ALA-VAL-ILE-THR-GLN-ASN-ILE-ASP-ARG-LEU-HIS-GLN-ARG-ALA-GLY-SER-LYS-LYS-VAL-ILE-GLU-LEU-HIS-GLY-ASN-VAL-GLU-GLU-TYR-TYR-CYS-VAL-ARG-CYS-GLU-LYS-LYS-TYR-THR-VAL-GLU-ASP-VAL-ILE-LYS-LYS-LEU-GLU-SER-SER-ASP-VAL-PRO-LEU-CYS-ASP-ASP-CYS-ASN-SER-LEU-ILE-ARG-PRO-ASN-ILE-VAL-PHE-PHE-GLY-GLU-ASN-LEU-PRO-GLN-ASP-ALA-LEU-ARG-GLU-ALA-ILE-GLY-LEU-SER-SER-ARG-ALA-SER-LEU-MET-ILE-VAL-LEU-GLY-SER-SER-LEU-VAL-VAL-TYR-PRO-ALA-ALA-GLU-LEU-PRO-LEU-ILE-THR-VAL-ARG-SER-GLY-GLY-LYS-LEU-VAL-ILE-VAL-ASN-LEU-GLY-GLU-THR-PRO-PHE-ASP-ASP-ILE-ALA-THR-LEU-LYS-TYR-ASN-MET-ASP-VAL-VAL-GLU-PHE-ALA-ARG-ARG-VAL-MET-GLU-GLU-GLY-GLY-ILE-SER,LYS-LYS-GLY-GLN-SER-THR-SER-ARG-HIS-LYS-ALY-LEU-MET-PHE-LYS-THR-GLU-GLY,246,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C=O)CCSC)CC(C)C)CCCCNC(=O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)N)CO)CO)CCC[NH+]=C(N)N)Cc1[nH]cnc1,Kd=4.3uM,5.366532,5.37,1,M,T,1,A,A,0,,B,A,,0,1,246,18,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.7612828612327576,0.7106418609619141,89.58049774169922,87.77396392822266,0.4613707959651947,0.9579122066497804,0.8924950957298279,0.8386328816413879,0.6858660578727722,0.6786441206932068,KKGQSTSRHKKLMFKTEG,Low,"(5.31, 5.463]",train
2H6K,protein-peptide,P61964,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,ARTKQTARK,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ALA-ARG-THR-MLZ-GLN-THR-ALA-ARG-LYS,312,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH2+]C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=8.7uM,5.060481,5.06,1,M,T,1,A,A,0,,C,A,,1,1,312,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.918578326702118,0.7451587915420532,95.755615234375,93.67021942138672,0.3211289644241333,0.7350755333900452,0.9435771107673644,0.8898631930351257,0.8733877539634705,0.6869474053382874,ARTKQTARK,Low,"(5.014, 5.105]",train
2KGI,protein-peptide,P29375,SVCAAQNCQRPCKDKVDWVQCDGGCDEWFHQVCVGVSPEMAENEDYICINCA,ARTKQTARK,SER-VAL-CYS-ALA-ALA-GLN-ASN-CYS-GLN-ARG-PRO-CYS-LYS-ASP-LYS-VAL-ASP-TRP-VAL-GLN-CYS-ASP-GLY-GLY-CYS-ASP-GLU-TRP-PHE-HIS-GLN-VAL-CYS-VAL-GLY-VAL-SER-PRO-GLU-MET-ALA-GLU-ASN-GLU-ASP-TYR-ILE-CYS-ILE-ASN-CYS-ALA,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS,52,9,[NH3+]CCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N)C,Kd=0.75uM,6.124939,6.12,1,M,T,1,A,A,0,,B,A,,1,1,52,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9243366718292236,0.8225640654563904,93.23260498046876,87.4389877319336,0.414676159620285,0.6359550952911377,0.815117359161377,0.8260906338691711,0.7979528903961182,0.773605465888977,ARTKQTARK,Low,"(6.097, 6.26]",train
2LCT,protein-peptide,P15498 P48025,GHMQDLSVHLWYAGPMERAGAESILANRSDGTFLVRQRVKDAAEFAISIKYNVEVKHIKIMTAEGLYRITEKKAFRGLTELVEFYQQNSLKDCFKSLDTTLQFPFKE,DTEVYESPYADPE,GLY-HIS-MET-GLN-ASP-LEU-SER-VAL-HIS-LEU-TRP-TYR-ALA-GLY-PRO-MET-GLU-ARG-ALA-GLY-ALA-GLU-SER-ILE-LEU-ALA-ASN-ARG-SER-ASP-GLY-THR-PHE-LEU-VAL-ARG-GLN-ARG-VAL-LYS-ASP-ALA-ALA-GLU-PHE-ALA-ILE-SER-ILE-LYS-TYR-ASN-VAL-GLU-VAL-LYS-HIS-ILE-LYS-ILE-MET-THR-ALA-GLU-GLY-LEU-TYR-ARG-ILE-THR-GLU-LYS-LYS-ALA-PHE-ARG-GLY-LEU-THR-GLU-LEU-VAL-GLU-PHE-TYR-GLN-GLN-ASN-SER-LEU-LYS-ASP-CYS-PHE-LYS-SER-LEU-ASP-THR-THR-LEU-GLN-PHE-PRO-PHE-LYS-GLU,ASP-THR-GLU-VAL-PTR-GLU-SER-PRO-PTR-ALA-ASP-PRO-GLU,107,13,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O)CCC(=O)O,Kd=7.27uM,5.138466,5.14,1,M,T,1,A,A,0,,B,A,,1,1,107,13,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,0.9038740396499634,0.759678065776825,94.71680450439452,88.72640228271484,0.3525729775428772,0.6894025206565857,0.9158923625946044,0.843166172504425,0.8331611156463623,0.7388060092926025,DTEVYESPYADPE,Low,"(5.105, 5.222]",train
2O9K,protein-peptide,P61964,GSTQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,ARTKQTARKST,GLY-SER-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-LYS-SER-THR,313,11,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C,Kd=77uM,4.113509,4.11,1,M,T,1,A,A,0,,B,A,,0,1,313,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8923684358596802,0.7633121609687805,95.89729309082033,94.70401763916016,0.3352916538715362,0.733487069606781,0.936777114868164,0.8902813196182251,0.8368989825248718,0.711601734161377,ARTKQTARKST,Low,"(3.924, 4.155]",train
3D9M,protein-peptide,Q9UPN6 P24928,MEAVKTFNSELYSLNDYKPPISKAKMTQITKAAIKAIKFYKHVVQSVEKFIQKCKPEYKVPGLYVIDSIVRQSRHQFGQEKDVFAPRFSNNIISTFQNLYRCPGDDKSKIVRVLNLWQKNNVFKSEIIQPLLDMAAALEHHHHHH,YSPTSPSYSPTSPS,MET-GLU-ALA-VAL-LYS-THR-PHE-ASN-SER-GLU-LEU-TYR-SER-LEU-ASN-ASP-TYR-LYS-PRO-PRO-ILE-SER-LYS-ALA-LYS-MET-THR-GLN-ILE-THR-LYS-ALA-ALA-ILE-LYS-ALA-ILE-LYS-PHE-TYR-LYS-HIS-VAL-VAL-GLN-SER-VAL-GLU-LYS-PHE-ILE-GLN-LYS-CYS-LYS-PRO-GLU-TYR-LYS-VAL-PRO-GLY-LEU-TYR-VAL-ILE-ASP-SER-ILE-VAL-ARG-GLN-SER-ARG-HIS-GLN-PHE-GLY-GLN-GLU-LYS-ASP-VAL-PHE-ALA-PRO-ARG-PHE-SER-ASN-ASN-ILE-ILE-SER-THR-PHE-GLN-ASN-LEU-TYR-ARG-CYS-PRO-GLY-ASP-ASP-LYS-SER-LYS-ILE-VAL-ARG-VAL-LEU-ASN-LEU-TRP-GLN-LYS-ASN-ASN-VAL-PHE-LYS-SER-GLU-ILE-ILE-GLN-PRO-LEU-LEU-ASP-MET-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,TYR-SER-PRO-THR-SEP-PRO-SER-TYR-SER-PRO-THR-SEP-PRO-SER,145,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)COP(O)(O)O)[C@H](O)C)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+],Kd=330uM,3.481486,3.48,1,M,T,1,A,A,0,,Y,A,,0,1,145,14,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9125443696975708,0.6711467504501343,92.8516616821289,90.56159210205078,0.3255723416805267,0.8420663475990295,0.934573769569397,0.8128760457038879,0.8520055413246155,0.6357143521308899,YSPTSPSYSPTSPS,Low,"(2.044, 3.548]",train
3G2S,protein-peptide,Q92673 Q9UJY5,GSMEPAMEPETLEARINRATNPLNKELDWASINGFCEQLNEDFEGPPLATRLLAHKIQSPQEWEAIQALTVLETCMKSCGKRFHDEVGKFRFLNELIKVVSPKYLGSRTSEKVKNKILELLYSWTVGLPEEVKIAEAYQMLKKQGIVKS,ITGFSDDVPMVIA,GLY-SER-MET-GLU-PRO-ALA-MET-GLU-PRO-GLU-THR-LEU-GLU-ALA-ARG-ILE-ASN-ARG-ALA-THR-ASN-PRO-LEU-ASN-LYS-GLU-LEU-ASP-TRP-ALA-SER-ILE-ASN-GLY-PHE-CYS-GLU-GLN-LEU-ASN-GLU-ASP-PHE-GLU-GLY-PRO-PRO-LEU-ALA-THR-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-ILE-GLN-ALA-LEU-THR-VAL-LEU-GLU-THR-CYS-MET-LYS-SER-CYS-GLY-LYS-ARG-PHE-HIS-ASP-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-SER-ARG-THR-SER-GLU-LYS-VAL-LYS-ASN-LYS-ILE-LEU-GLU-LEU-LEU-TYR-SER-TRP-THR-VAL-GLY-LEU-PRO-GLU-GLU-VAL-LYS-ILE-ALA-GLU-ALA-TYR-GLN-MET-LEU-LYS-LYS-GLN-GLY-ILE-VAL-LYS-SER,ILE-THR-GLY-PHE-SER-ASP-ASP-VAL-PRO-MET-VAL-ILE-ALA,149,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])Cc1ccccc1)CO)CC(=O)O)CC(=O)O,Kd=0.6uM,6.221849,6.22,1,M,T,1,A,A,0,,C,A,,1,1,149,13,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.9269137978553772,0.87511146068573,92.10125732421876,93.3434600830078,0.3295333683490753,0.5313252210617065,0.927731990814209,0.9070907831192015,0.84183269739151,0.862921953201294,ITGFSDDVPMVIA,Low,"(6.097, 6.26]",train
3G2U,protein-peptide,Q99523 Q9UJY5,GSMEPAMEPETLEARINRATNPLNKELDWASINGFCEQLNEDFEGPPLATRLLAHKIQSPQEWEAIQALTVLETCMKSCGKRFHDEVGKFRFLNELIKVVSPKYLGSRTSEKVKNKILELLYSWTVGLPEEVKIAEAYQMLKKQGIVKS,SGYHDDSDEDLLE,GLY-SER-MET-GLU-PRO-ALA-MET-GLU-PRO-GLU-THR-LEU-GLU-ALA-ARG-ILE-ASN-ARG-ALA-THR-ASN-PRO-LEU-ASN-LYS-GLU-LEU-ASP-TRP-ALA-SER-ILE-ASN-GLY-PHE-CYS-GLU-GLN-LEU-ASN-GLU-ASP-PHE-GLU-GLY-PRO-PRO-LEU-ALA-THR-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-ILE-GLN-ALA-LEU-THR-VAL-LEU-GLU-THR-CYS-MET-LYS-SER-CYS-GLY-LYS-ARG-PHE-HIS-ASP-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-SER-ARG-THR-SER-GLU-LYS-VAL-LYS-ASN-LYS-ILE-LEU-GLU-LEU-LEU-TYR-SER-TRP-THR-VAL-GLY-LEU-PRO-GLU-GLU-VAL-LYS-ILE-ALA-GLU-ALA-TYR-GLN-MET-LEU-LYS-LYS-GLN-GLY-ILE-VAL-LYS-SER,SER-GLY-TYR-HIS-ASP-ASP-SER-ASP-GLU-ASP-LEU-LEU-GLU,149,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CCC(=O)O)CC(=O)O)[NH3+],Kd=5.4uM,5.267606,5.27,1,M,T,1,A,A,0,,C,A,,1,1,149,13,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.963663637638092,0.8088371753692627,94.2476806640625,92.55500793457033,0.3037402331829071,0.6993138790130615,0.9383426308631896,0.8746127486228943,0.892833411693573,0.7923933267593384,SGYHDDSDEDLLE,Low,"(5.222, 5.31]",train
3LQJ,protein-peptide,P68431 Q03164,SGNFCPLCDKCYDDDDYESKMMQCGKCDRWVHSKCENLSDEMYEILSNLPESVAYTCVNCTERHPAEWRLALEKELQISLKQVLTALLNSRTTSHLLRYRQQQPLDLEGVKRKMDQGNYTSVLEFSDDIVKIIQAAINSDGGQPEIKKANSMVKSFFIRQMERVFPWFSVKKSRFWEPNKVSS,ARTKQTARK,SER-GLY-ASN-PHE-CYS-PRO-LEU-CYS-ASP-LYS-CYS-TYR-ASP-ASP-ASP-ASP-TYR-GLU-SER-LYS-MET-MET-GLN-CYS-GLY-LYS-CYS-ASP-ARG-TRP-VAL-HIS-SER-LYS-CYS-GLU-ASN-LEU-SER-ASP-GLU-MET-TYR-GLU-ILE-LEU-SER-ASN-LEU-PRO-GLU-SER-VAL-ALA-TYR-THR-CYS-VAL-ASN-CYS-THR-GLU-ARG-HIS-PRO-ALA-GLU-TRP-ARG-LEU-ALA-LEU-GLU-LYS-GLU-LEU-GLN-ILE-SER-LEU-LYS-GLN-VAL-LEU-THR-ALA-LEU-LEU-ASN-SER-ARG-THR-THR-SER-HIS-LEU-LEU-ARG-TYR-ARG-GLN-GLN-GLN-PRO-LEU-ASP-LEU-GLU-GLY-VAL-LYS-ARG-LYS-MET-ASP-GLN-GLY-ASN-TYR-THR-SER-VAL-LEU-GLU-PHE-SER-ASP-ASP-ILE-VAL-LYS-ILE-ILE-GLN-ALA-ALA-ILE-ASN-SER-ASP-GLY-GLY-GLN-PRO-GLU-ILE-LYS-LYS-ALA-ASN-SER-MET-VAL-LYS-SER-PHE-PHE-ILE-ARG-GLN-MET-GLU-ARG-VAL-PHE-PRO-TRP-PHE-SER-VAL-LYS-LYS-SER-ARG-PHE-TRP-GLU-PRO-ASN-LYS-VAL-SER-SER,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS,183,9,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=4.3uM,5.366532,5.37,1,M,T,1,A,A,0,,Q,A,,0,1,183,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9491530656814576,0.8307580351829529,90.74528503417967,85.63796997070312,0.3745743036270141,0.6196880340576172,0.8967916369438171,0.8780019879341125,0.923180878162384,0.8189470171928406,ARTKQTARK,Low,"(5.31, 5.463]",train
3M54,protein-peptide,Q12962 Q8WTS6,GAMGYKDNIRHGVCWIYYPDGGSLVGEVNEDGEMTGEKIAYVYPDERTALYGKFIDGEMIEGKLATLMSTEEGRPHFELMPGNSVYHFDKSTSSCISTNALLPDPYESERVYVAESLISSAGEGLFSKVAVGPNTVMSFYNGVRITHQEVDSRDWALNGNTLSLDEETVIDVPEPYNHVSKYCASLGHKANHSFTPNCIFDMFVHPRFGPIKCIRTLRAVEADEELTVAYGYDHSPPGKSGPEAPEWYQVELKAFQATQQK,SKSKDRKYTL,GLY-ALA-MET-GLY-TYR-LYS-ASP-ASN-ILE-ARG-HIS-GLY-VAL-CYS-TRP-ILE-TYR-TYR-PRO-ASP-GLY-GLY-SER-LEU-VAL-GLY-GLU-VAL-ASN-GLU-ASP-GLY-GLU-MET-THR-GLY-GLU-LYS-ILE-ALA-TYR-VAL-TYR-PRO-ASP-GLU-ARG-THR-ALA-LEU-TYR-GLY-LYS-PHE-ILE-ASP-GLY-GLU-MET-ILE-GLU-GLY-LYS-LEU-ALA-THR-LEU-MET-SER-THR-GLU-GLU-GLY-ARG-PRO-HIS-PHE-GLU-LEU-MET-PRO-GLY-ASN-SER-VAL-TYR-HIS-PHE-ASP-LYS-SER-THR-SER-SER-CYS-ILE-SER-THR-ASN-ALA-LEU-LEU-PRO-ASP-PRO-TYR-GLU-SER-GLU-ARG-VAL-TYR-VAL-ALA-GLU-SER-LEU-ILE-SER-SER-ALA-GLY-GLU-GLY-LEU-PHE-SER-LYS-VAL-ALA-VAL-GLY-PRO-ASN-THR-VAL-MET-SER-PHE-TYR-ASN-GLY-VAL-ARG-ILE-THR-HIS-GLN-GLU-VAL-ASP-SER-ARG-ASP-TRP-ALA-LEU-ASN-GLY-ASN-THR-LEU-SER-LEU-ASP-GLU-GLU-THR-VAL-ILE-ASP-VAL-PRO-GLU-PRO-TYR-ASN-HIS-VAL-SER-LYS-TYR-CYS-ALA-SER-LEU-GLY-HIS-LYS-ALA-ASN-HIS-SER-PHE-THR-PRO-ASN-CYS-ILE-PHE-ASP-MET-PHE-VAL-HIS-PRO-ARG-PHE-GLY-PRO-ILE-LYS-CYS-ILE-ARG-THR-LEU-ARG-ALA-VAL-GLU-ALA-ASP-GLU-GLU-LEU-THR-VAL-ALA-TYR-GLY-TYR-ASP-HIS-SER-PRO-PRO-GLY-LYS-SER-GLY-PRO-GLU-ALA-PRO-GLU-TRP-TYR-GLN-VAL-GLU-LEU-LYS-ALA-PHE-GLN-ALA-THR-GLN-GLN-LYS,ACE-SER-LYS-SER-LYS-ASP-ARG-LYS-TYR-THR-LEU,261,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCCC[NH3+])CCC[NH+]=C(N)N)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)CCCC[NH3+])CO,Kd=1.3uM,5.886057,5.89,1,M,T,1,A,A,0,,B,A,,1,1,261,11,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,0.9431779980659484,0.8493440747261047,92.12068939208984,87.79190826416016,0.3761826455593109,0.695302426815033,0.9271421432495116,0.8979973196983337,0.8987551927566528,0.818023681640625,SKSKDRKYTL,Low,"(5.821, 5.959]",train
3M57,protein-peptide,Q12962 Q8WTS6,GAMGYKDNIRHGVCWIYYPDGGSLVGEVNEDGEMTGEKIAYVYPDERTALYGKFIDGEMIEGKLATLMSTEEGRPHFELMPGNSVYHFDKSTSSCISTNALLPDPYESERVYVAESLISSAGEGLFSKVAVGPNTVMSFANGVRITHQEVDSRDWALNGNTLSLDEETVIDVPEPYNHVSKYCASLGHKANHSFTPNCIYDMFVHPRFGPIKCIRTLRAVEADEELTVAYGYDHSPPGKSGPEAPEWYQVELKAFQATQQK,SKSKDRKYTL,GLY-ALA-MET-GLY-TYR-LYS-ASP-ASN-ILE-ARG-HIS-GLY-VAL-CYS-TRP-ILE-TYR-TYR-PRO-ASP-GLY-GLY-SER-LEU-VAL-GLY-GLU-VAL-ASN-GLU-ASP-GLY-GLU-MET-THR-GLY-GLU-LYS-ILE-ALA-TYR-VAL-TYR-PRO-ASP-GLU-ARG-THR-ALA-LEU-TYR-GLY-LYS-PHE-ILE-ASP-GLY-GLU-MET-ILE-GLU-GLY-LYS-LEU-ALA-THR-LEU-MET-SER-THR-GLU-GLU-GLY-ARG-PRO-HIS-PHE-GLU-LEU-MET-PRO-GLY-ASN-SER-VAL-TYR-HIS-PHE-ASP-LYS-SER-THR-SER-SER-CYS-ILE-SER-THR-ASN-ALA-LEU-LEU-PRO-ASP-PRO-TYR-GLU-SER-GLU-ARG-VAL-TYR-VAL-ALA-GLU-SER-LEU-ILE-SER-SER-ALA-GLY-GLU-GLY-LEU-PHE-SER-LYS-VAL-ALA-VAL-GLY-PRO-ASN-THR-VAL-MET-SER-PHE-ALA-ASN-GLY-VAL-ARG-ILE-THR-HIS-GLN-GLU-VAL-ASP-SER-ARG-ASP-TRP-ALA-LEU-ASN-GLY-ASN-THR-LEU-SER-LEU-ASP-GLU-GLU-THR-VAL-ILE-ASP-VAL-PRO-GLU-PRO-TYR-ASN-HIS-VAL-SER-LYS-TYR-CYS-ALA-SER-LEU-GLY-HIS-LYS-ALA-ASN-HIS-SER-PHE-THR-PRO-ASN-CYS-ILE-TYR-ASP-MET-PHE-VAL-HIS-PRO-ARG-PHE-GLY-PRO-ILE-LYS-CYS-ILE-ARG-THR-LEU-ARG-ALA-VAL-GLU-ALA-ASP-GLU-GLU-LEU-THR-VAL-ALA-TYR-GLY-TYR-ASP-HIS-SER-PRO-PRO-GLY-LYS-SER-GLY-PRO-GLU-ALA-PRO-GLU-TRP-TYR-GLN-VAL-GLU-LEU-LYS-ALA-PHE-GLN-ALA-THR-GLN-GLN-LYS,ACE-SER-LYS-SER-LYS-ASP-ARG-LYS-TYR-THR-LEU,261,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCCC[NH3+])CCC[NH+]=C(N)N)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)CCCC[NH3+])CO,Kd=4.0uM,5.39794,5.4,1,M,T,1,A,A,0,,B,A,,1,1,261,11,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,0.9638399481773376,0.842124342918396,92.2153549194336,87.38981628417969,0.3624166250228882,0.6742433309555054,0.9316514134407043,0.905264139175415,0.9257616996765136,0.8263393640518188,SKSKDRKYTL,Low,"(5.31, 5.463]",val
3ME9,protein-peptide,Q92133 Q96ES7,GRRGVLMTLLQQSAMTLPLWIGKPGDKPPPLCGAIPASGDYVARPGDKVAARVKAVDGDEQWILAEVVSYSHATNKYEVDDIDEEGKERHTLSRRRVIPLPQWKANPETDPEALFQKEQLVLALYPQTTCFYRALIHAPPQRPQDDYSVLFEDTSYADGYSPPLNVAQRYVVACKEPKKK,ARTKQTARKST,GLY-ARG-ARG-GLY-VAL-LEU-MSE-THR-LEU-LEU-GLN-GLN-SER-ALA-MSE-THR-LEU-PRO-LEU-TRP-ILE-GLY-LYS-PRO-GLY-ASP-LYS-PRO-PRO-PRO-LEU-CYS-GLY-ALA-ILE-PRO-ALA-SER-GLY-ASP-TYR-VAL-ALA-ARG-PRO-GLY-ASP-LYS-VAL-ALA-ALA-ARG-VAL-LYS-ALA-VAL-ASP-GLY-ASP-GLU-GLN-TRP-ILE-LEU-ALA-GLU-VAL-VAL-SER-TYR-SER-HIS-ALA-THR-ASN-LYS-TYR-GLU-VAL-ASP-ASP-ILE-ASP-GLU-GLU-GLY-LYS-GLU-ARG-HIS-THR-LEU-SER-ARG-ARG-ARG-VAL-ILE-PRO-LEU-PRO-GLN-TRP-LYS-ALA-ASN-PRO-GLU-THR-ASP-PRO-GLU-ALA-LEU-PHE-GLN-LYS-GLU-GLN-LEU-VAL-LEU-ALA-LEU-TYR-PRO-GLN-THR-THR-CYS-PHE-TYR-ARG-ALA-LEU-ILE-HIS-ALA-PRO-PRO-GLN-ARG-PRO-GLN-ASP-ASP-TYR-SER-VAL-LEU-PHE-GLU-ASP-THR-SER-TYR-ALA-ASP-GLY-TYR-SER-PRO-PRO-LEU-ASN-VAL-ALA-GLN-ARG-TYR-VAL-VAL-ALA-CYS-LYS-GLU-PRO-LYS-LYS-LYS,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR,180,11,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[N+](C)(C)C)[C@H](O)C)NC(=O)[C@@H]([NH3+])C)N,Kd=0.5uM,6.30103,6.3,1,M,T,1,A,A,0,,C,A,,1,1,180,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9103119373321532,0.8618309497833252,93.7641143798828,92.02896881103516,0.3414123058319092,0.5941391587257385,0.9331209659576416,0.9129984378814696,0.8686147928237915,0.8490390181541443,ARTKQTARKST,Low,"(6.26, 6.398]",train
3OAP,protein-peptide,P19793 Q15596,EDMPVERILEAELAVEPKTETYVEANMGLNPSSPNDPVTNICQAADKQLFTLVEWAKRIPHFSELPLDDQVILLRAGWNELLIASFSHRSIAVKDGILLATGLHVHRNSAHSAGVGAIFDRVLTELVSKMRDMQMDKTELGCLRAIVLFNPDSKGLSNPAEVEALREKVYASLEAYCKHKYPEQPGRFAKLLLRLPALRSIGLKCLEHLFFFKLIGDTPIDTFLMEMLEAP,KHKILHRLLQD,GLU-ASP-MET-PRO-VAL-GLU-ARG-ILE-LEU-GLU-ALA-GLU-LEU-ALA-VAL-GLU-PRO-LYS-THR-GLU-THR-TYR-VAL-GLU-ALA-ASN-MET-GLY-LEU-ASN-PRO-SER-SER-PRO-ASN-ASP-PRO-VAL-THR-ASN-ILE-CYS-GLN-ALA-ALA-ASP-LYS-GLN-LEU-PHE-THR-LEU-VAL-GLU-TRP-ALA-LYS-ARG-ILE-PRO-HIS-PHE-SER-GLU-LEU-PRO-LEU-ASP-ASP-GLN-VAL-ILE-LEU-LEU-ARG-ALA-GLY-TRP-ASN-GLU-LEU-LEU-ILE-ALA-SER-PHE-SER-HIS-ARG-SER-ILE-ALA-VAL-LYS-ASP-GLY-ILE-LEU-LEU-ALA-THR-GLY-LEU-HIS-VAL-HIS-ARG-ASN-SER-ALA-HIS-SER-ALA-GLY-VAL-GLY-ALA-ILE-PHE-ASP-ARG-VAL-LEU-THR-GLU-LEU-VAL-SER-LYS-MET-ARG-ASP-MET-GLN-MET-ASP-LYS-THR-GLU-LEU-GLY-CYS-LEU-ARG-ALA-ILE-VAL-LEU-PHE-ASN-PRO-ASP-SER-LYS-GLY-LEU-SER-ASN-PRO-ALA-GLU-VAL-GLU-ALA-LEU-ARG-GLU-LYS-VAL-TYR-ALA-SER-LEU-GLU-ALA-TYR-CYS-LYS-HIS-LYS-TYR-PRO-GLU-GLN-PRO-GLY-ARG-PHE-ALA-LYS-LEU-LEU-LEU-ARG-LEU-PRO-ALA-LEU-ARG-SER-ILE-GLY-LEU-LYS-CYS-LEU-GLU-HIS-LEU-PHE-PHE-PHE-LYS-LEU-ILE-GLY-ASP-THR-PRO-ILE-ASP-THR-PHE-LEU-MET-GLU-MET-LEU-GLU-ALA-PRO,LYS-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-ASP,231,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+])C,Kd=0.55uM,6.259637,6.26,1,M,T,1,A,A,0,,B,A,,1,1,231,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,0.7957990169525146,0.7352935671806335,85.5038070678711,77.96083068847656,0.6698818206787109,0.9396213889122008,0.830390453338623,0.8399632573127747,0.758742094039917,0.7091261148452759,KHKILHRLLQD,Low,"(6.097, 6.26]",train
3QL9,protein-peptide,P46100 P84243,GPLGSMGIVSCTACGQQVNHFQKDSIYRHPSLQVLICKNCFKYYMSDDISRDSDGMDEQCRWCAEGGNLICCDFCHNAFCKKCILRNLGRRELSTIMDENNQWYCYICHPEPLLDLVTACNSVYENLEQ,ARTKQTARKSTGGKA,GLY-PRO-LEU-GLY-SER-MET-GLY-ILE-VAL-SER-CYS-THR-ALA-CYS-GLY-GLN-GLN-VAL-ASN-HIS-PHE-GLN-LYS-ASP-SER-ILE-TYR-ARG-HIS-PRO-SER-LEU-GLN-VAL-LEU-ILE-CYS-LYS-ASN-CYS-PHE-LYS-TYR-TYR-MET-SER-ASP-ASP-ILE-SER-ARG-ASP-SER-ASP-GLY-MET-ASP-GLU-GLN-CYS-ARG-TRP-CYS-ALA-GLU-GLY-GLY-ASN-LEU-ILE-CYS-CYS-ASP-PHE-CYS-HIS-ASN-ALA-PHE-CYS-LYS-LYS-CYS-ILE-LEU-ARG-ASN-LEU-GLY-ARG-ARG-GLU-LEU-SER-THR-ILE-MET-ASP-GLU-ASN-ASN-GLN-TRP-TYR-CYS-TYR-ILE-CYS-HIS-PRO-GLU-PRO-LEU-LEU-ASP-LEU-VAL-THR-ALA-CYS-ASN-SER-VAL-TYR-GLU-ASN-LEU-GLU-GLN,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,129,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.5uM,6.30103,6.3,1,M,T,1,A,A,0,,C,A,,1,1,129,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.889326274394989,0.8188018202781677,90.97703552246094,91.52912902832033,0.387624979019165,0.6186637282371521,0.9009809494018556,0.8773225545883179,0.8213083744049072,0.804171621799469,ARTKQTARKSTGGKA,Low,"(6.26, 6.398]",train
3Q4K,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QADLF,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-ALC-ASP-LEU-200,366,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)Cl)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC1CCCCC1)CC(=O)O)C,Kd=89nM,7.05061,7.05,1,M,T,1,A,A,0,,C,A,,1,1,366,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.914036989212036,0.904456913471222,90.08345794677734,87.99652099609375,0.3723908960819244,0.4716564416885376,0.9092705249786376,0.9011656641960144,0.9068053960800172,0.9052796959877014,QADLF,Moderate,"(7.049, 7.268]",train
3SOU,protein-peptide,Q96T88 P68431,SGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRNDA,ARTKQTARK,SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS,70,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=2.1uM,5.677781,5.68,1,M,T,1,A,A,0,,D,A,,1,1,70,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8808314800262451,0.8276785016059875,90.92446899414062,86.47159576416016,0.4094164073467254,0.5896096229553223,0.8195777535438538,0.8664693832397461,0.7853853702545166,0.8179807662963867,ARTKQTARK,Low,"(5.6, 5.699]",train
3UED,protein-peptide,O15392,GSHEMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFKELEGWEPDDDPIEEHKKHSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,ARTKQTARKSTG,GLY-SER-HIS-GLU-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-LYS-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-HIS-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-ARG-TPO-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,146,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=29.6uM,4.528708,4.53,1,M,T,1,A,A,0,,B,A,,1,1,146,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.9087821841239928,0.8772098422050476,83.94732666015625,85.05660247802734,0.3798596262931824,0.7048521637916565,0.8538646697998047,0.8392764329910278,0.8236191272735596,0.7839534878730774,ARTKQTARKSTG,Low,"(4.456, 4.606]",train
1ABT,protein-peptide,P02710 P60615,IVCHTTATSPISAVTCPPGENLCYRKMWCDAFCSSRGKVVELGCAATCPSKKPYEEVTCCSTDKCNPHPKQRPG,KHWVYYTCCPDT,ILE-VAL-CYS-HIS-THR-THR-ALA-THR-SER-PRO-ILE-SER-ALA-VAL-THR-CYS-PRO-PRO-GLY-GLU-ASN-LEU-CYS-TYR-ARG-LYS-MET-TRP-CYS-ASP-ALA-PHE-CYS-SER-SER-ARG-GLY-LYS-VAL-VAL-GLU-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-SER-LYS-LYS-PRO-TYR-GLU-GLU-VAL-THR-CYS-CYS-SER-THR-ASP-LYS-CYS-ASN-PRO-HIS-PRO-LYS-GLN-ARG-PRO-GLY,LYS-HIS-TRP-VAL-TYR-TYR-THR-CYS-CYS-PRO-ASP-THR,74,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C(C)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]cn1)[NH3+],Kd=1.4uM,5.853872,5.85,1,A,A,1,A,A,0,,B,A,,1,1,74,12,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.892373263835907,0.5785744190216064,60.0419921875,56.34781265258789,0.490989476442337,0.9355007410049438,0.782983124256134,0.6369526982307434,0.7889068722724915,0.5048581957817078,KHWVYYTCCPDT,Low,"(5.821, 5.959]",val
1AQC,protein-peptide,Q02410,MEDLIDGIIFAANYLGSTQLLSDKTPSKNVRMMQAQEAVSRIKMAQKLAKSRKKAPEGESQPMTEVDLFILTQRIKVLNADTQETMMDHPLRTISYIADIGNIVVLMARRRIPRSNSQENVEASHPSQDGKRQYKMICHVFESEDAQLIAQSIGQAFSVAYQEFLRANGINP,GYENPTYKFF,MSE-GLU-ASP-LEU-ILE-ASP-GLY-ILE-ILE-PHE-ALA-ALA-ASN-TYR-LEU-GLY-SER-THR-GLN-LEU-LEU-SER-ASP-LYS-THR-PRO-SER-LYS-ASN-VAL-ARG-MSE-MSE-GLN-ALA-GLN-GLU-ALA-VAL-SER-ARG-ILE-LYS-MSE-ALA-GLN-LYS-LEU-ALA-LYS-SER-ARG-LYS-LYS-ALA-PRO-GLU-GLY-GLU-SER-GLN-PRO-MSE-THR-GLU-VAL-ASP-LEU-PHE-ILE-LEU-THR-GLN-ARG-ILE-LYS-VAL-LEU-ASN-ALA-ASP-THR-GLN-GLU-THR-MSE-MSE-ASP-HIS-PRO-LEU-ARG-THR-ILE-SER-TYR-ILE-ALA-ASP-ILE-GLY-ASN-ILE-VAL-VAL-LEU-MSE-ALA-ARG-ARG-ARG-ILE-PRO-ARG-SER-ASN-SER-GLN-GLU-ASN-VAL-GLU-ALA-SER-HIS-PRO-SER-GLN-ASP-GLY-LYS-ARG-GLN-TYR-LYS-MSE-ILE-CYS-HIS-VAL-PHE-GLU-SER-GLU-ASP-ALA-GLN-LEU-ILE-ALA-GLN-SER-ILE-GLY-GLN-ALA-PHE-SER-VAL-ALA-TYR-GLN-GLU-PHE-LEU-ARG-ALA-ASN-GLY-ILE-ASN-PRO,GLY-TYR-GLU-ASN-PRO-THR-TYR-LYS-PHE-PHE,172,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])Cc1ccc(cc1)O)CCC(=O)O)CC(=O)N)Cc1ccc(cc1)O,Kd=4.56uM,5.341035,5.34,1,A,A,1,A,A,0,,C,A,,1,1,172,10,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.8447383642196655,0.9490304589271544,72.47483825683594,77.6996078491211,0.5126702189445496,0.5616459846496582,0.8252937197685242,0.8704105615615845,0.7637478709220886,0.8960109949111938,GYENPTYKFF,Low,"(5.31, 5.463]",train
1AZE,protein-peptide,P26675 P62993,MEAIAKVDFKATADDELSFKRGDILKVLNEESDQNWYKAELNGKDGFIPKNYIEMK,VPPPVPPRRR,MET-GLU-ALA-ILE-ALA-LYS-VAL-ASP-PHE-LYS-ALA-THR-ALA-ASP-ASP-GLU-LEU-SER-PHE-LYS-ARG-GLY-ASP-ILE-LEU-LYS-VAL-LEU-ASN-GLU-GLU-SER-ASP-GLN-ASN-TRP-TYR-LYS-ALA-GLU-LEU-ASN-GLY-LYS-ASP-GLY-PHE-ILE-PRO-LYS-ASN-TYR-ILE-GLU-MET-LYS,VAL-PRO-PRO-PRO-VAL-PRO-PRO-ARG-ARG-ARG,56,10,CC([C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)[NH3+])C,Kd=60uM,4.221849,4.22,1,A,A,1,A,A,0,,B,A,,1,1,56,10,0,CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.8762829303741455,0.8146904706954956,95.7658920288086,91.02291107177734,0.352696418762207,0.5274487733840942,0.8534123301506042,0.8516349196434021,0.7873035669326782,0.8054543137550354,VPPPVPPRRR,Low,"(4.155, 4.319]",train
1AZG,protein-peptide,P27986 P06241,TGVTLFVALYDYEARTEDDLSFHKGEKFQILNSSEGDWWEARSLTTGETGYIPSNYVAPVDSIQAEE,PPRPLPVAPGSSKT,THR-GLY-VAL-THR-LEU-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-ALA-ARG-THR-GLU-ASP-ASP-LEU-SER-PHE-HIS-LYS-GLY-GLU-LYS-PHE-GLN-ILE-LEU-ASN-SER-SER-GLU-GLY-ASP-TRP-TRP-GLU-ALA-ARG-SER-LEU-THR-THR-GLY-GLU-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-VAL-ASP-SER-ILE-GLN-ALA-GLU-GLU,PRO-PRO-ARG-PRO-LEU-PRO-VAL-ALA-PRO-GLY-SER-SER-LYS-THR,67,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCC[NH3+])CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N)CC(C)C)C,Kd=16uM,4.79588,4.8,1,A,A,1,A,A,0,,A,B,,1,1,67,14,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,0.904686450958252,0.8630301356315613,91.63424682617188,90.64706420898438,0.3315536975860595,0.4863403737545013,0.8780539035797119,0.8884569406509399,0.8033198714256287,0.8566734194755554,PPRPLPVAPGSSKT,Low,"(4.745, 4.866]",train
1BJR,protein-peptide,P06873,AAQTNAPWGLARISSTSPGTSTYYYDESAGQGSCVYVIDTGIEASHPEFEGRAQMVKTYYYSSRDGNGHGTHCAGTVGSRTYGVAKKTQLFGVKVLDDNGSGQYSTIIAGMDFVASDKNNRNCPKGVVASLSLGGGYSSSVNSAAARLQSSGVMVAVAAGNNNADARNYSPASEPSVCTVGASDRYDRRSSFSNYGSVLDIFGPGTSILSTWIGGSTRSISGTSMATPHVAGLAAYLMTLGKTTAASACRYIADTANKGDLSNIPFGTVNLLAYNNYQA,VAQGGAAGLA,ALA-ALA-GLN-THR-ASN-ALA-PRO-TRP-GLY-LEU-ALA-ARG-ILE-SER-SER-THR-SER-PRO-GLY-THR-SER-THR-TYR-TYR-TYR-ASP-GLU-SER-ALA-GLY-GLN-GLY-SER-CYS-VAL-TYR-VAL-ILE-ASP-THR-GLY-ILE-GLU-ALA-SER-HIS-PRO-GLU-PHE-GLU-GLY-ARG-ALA-GLN-MET-VAL-LYS-THR-TYR-TYR-TYR-SER-SER-ARG-ASP-GLY-ASN-GLY-HIS-GLY-THR-HIS-CYS-ALA-GLY-THR-VAL-GLY-SER-ARG-THR-TYR-GLY-VAL-ALA-LYS-LYS-THR-GLN-LEU-PHE-GLY-VAL-LYS-VAL-LEU-ASP-ASP-ASN-GLY-SER-GLY-GLN-TYR-SER-THR-ILE-ILE-ALA-GLY-MET-ASP-PHE-VAL-ALA-SER-ASP-LYS-ASN-ASN-ARG-ASN-CYS-PRO-LYS-GLY-VAL-VAL-ALA-SER-LEU-SER-LEU-GLY-GLY-GLY-TYR-SER-SER-SER-VAL-ASN-SER-ALA-ALA-ALA-ARG-LEU-GLN-SER-SER-GLY-VAL-MET-VAL-ALA-VAL-ALA-ALA-GLY-ASN-ASN-ASN-ALA-ASP-ALA-ARG-ASN-TYR-SER-PRO-ALA-SER-GLU-PRO-SER-VAL-CYS-THR-VAL-GLY-ALA-SER-ASP-ARG-TYR-ASP-ARG-ARG-SER-SER-PHE-SER-ASN-TYR-GLY-SER-VAL-LEU-ASP-ILE-PHE-GLY-PRO-GLY-THR-SER-ILE-LEU-SER-THR-TRP-ILE-GLY-GLY-SER-THR-ARG-SER-ILE-SER-GLY-THR-SER-MET-ALA-THR-PRO-HIS-VAL-ALA-GLY-LEU-ALA-ALA-TYR-LEU-MET-THR-LEU-GLY-LYS-THR-THR-ALA-ALA-SER-ALA-CYS-ARG-TYR-ILE-ALA-ASP-THR-ALA-ASN-LYS-GLY-ASP-LEU-SER-ASN-ILE-PRO-PHE-GLY-THR-VAL-ASN-LEU-LEU-ALA-TYR-ASN-ASN-TYR-GLN-ALA,VAL-ALA-GLN-GLY-GLY-ALA-ALA-GLY-LEU-ALA,279,10,O=C[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])C)CCC(=O)N)C)C)CC(C)C)C,Ki=21nM,7.677781,7.68,1,A,A,1,A,A,0,,I,E,,1,1,279,10,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C,0.9042397141456604,0.824224054813385,96.01698303222656,97.08306884765624,0.3198671638965606,0.4914217293262481,0.9690448045730592,0.9392720460891724,0.8664121627807617,0.7954620122909546,VAQGGAAGLA,Moderate,"(7.523, 7.921]",train
1BM2,protein-peptide,P62993,GSPKNYIEMKPHPWFFGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVVKFNSLNELVDYHRSTSVSRNQQIFLRDIEQVPQQPTYVQA,KYVNVP,GLY-SER-PRO-LYS-ASN-TYR-ILE-GLU-MET-LYS-PRO-HIS-PRO-TRP-PHE-PHE-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLU-GLN-VAL-PRO-GLN-GLN-PRO-THR-TYR-VAL-GLN-ALA,ACE-SLZ-PTR-VAL-ASN-VAL-PRO,117,7,O=C[C@@H](NC(=O)C)CSCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)[NH3+])CC(=O)N,IC50=0.11uM,6.958607,6.96,1,A,A,1,A,A,0,,L,A,,1,1,117,7,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C,,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C,1.0252431631088257,0.991184651851654,89.44557189941406,92.51829528808594,0.3328477144241333,0.4833962619304657,0.8996348977088928,0.8870188593864441,0.9143688678741456,0.8943628072738647,KYVNVP,Low,"(6.824, 7.049]",train
1BMB,protein-peptide,P62993,MGSPKNYIEMKPHPWFFGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVVKFNSLNELVDYHRSTSVSRNQQIFLRDIEQVPQQPTYVQALFDFD,KPFYVNVEF,MET-GLY-SER-PRO-LYS-ASN-TYR-ILE-GLU-MET-LYS-PRO-HIS-PRO-TRP-PHE-PHE-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLU-GLN-VAL-PRO-GLN-GLN-PRO-THR-TYR-VAL-GLN-ALA-LEU-PHE-ASP-PHE-ASP,LYS-PRO-PHE-PTR-VAL-ASN-VAL-GLU-PHE,123,9,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCC(=O)O)C(C)C)CC(=O)N)C(C)C)Cc1ccc(cc1)OP(O)(O)O)Cc1ccccc1)[NH3+],IC50=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,I,A,,1,1,123,9,0,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.8884291648864746,0.8474813103675842,88.55763244628906,88.78993225097656,0.3880224525928497,0.6394453644752502,0.8735995888710022,0.8314923644065857,0.8116440773010254,0.8006654977798462,KPFYVNVEF,Low,"(6.097, 6.26]",val
1BR8,protein-peptide,P01008,HGSPVDICTAKPRDIPMNPMCIYRSPEKKATEDEGSEQKIPEATNRRVWELSKANSRFATTFYQHLADSKNDNDNIFLSPLSISTAFAMTKLGACNDTLQQLMEVFKFDTISEKTSDQIHFFFAKLNCRLYRKANKSSKLVSANRLFGDKSLTFNETYQDISELVYGAKLQPLDFKENAEQSRAAINKWVSNKTEGRITDVIPSEAINELTVLVLVNTIYFKGLWKSKFSPENTRKELFYKADGESCSASMMYQEGKFRYRRVAEGTQVLELPFKGDDITMVLILPKPEKSLAKVEKELTPEVLQEWLDELEEMMLVVHMPRFRIEDGFSLKEQLQDMGLVDLFSPEKSKLPGIVAEGRDDLYVSDAFHKAFLEVNEEGSEAAASTAVVIAGRSLNPNRVTFKANRPFLVFIREVPLNTIIFMGRVANPCVK,SEAAASTAVVIA,HIS-GLY-SER-PRO-VAL-ASP-ILE-CYS-THR-ALA-LYS-PRO-ARG-ASP-ILE-PRO-MET-ASN-PRO-MET-CYS-ILE-TYR-ARG-SER-PRO-GLU-LYS-LYS-ALA-THR-GLU-ASP-GLU-GLY-SER-GLU-GLN-LYS-ILE-PRO-GLU-ALA-THR-ASN-ARG-ARG-VAL-TRP-GLU-LEU-SER-LYS-ALA-ASN-SER-ARG-PHE-ALA-THR-THR-PHE-TYR-GLN-HIS-LEU-ALA-ASP-SER-LYS-ASN-ASP-ASN-ASP-ASN-ILE-PHE-LEU-SER-PRO-LEU-SER-ILE-SER-THR-ALA-PHE-ALA-MET-THR-LYS-LEU-GLY-ALA-CYS-ASN-ASP-THR-LEU-GLN-GLN-LEU-MET-GLU-VAL-PHE-LYS-PHE-ASP-THR-ILE-SER-GLU-LYS-THR-SER-ASP-GLN-ILE-HIS-PHE-PHE-PHE-ALA-LYS-LEU-ASN-CYS-ARG-LEU-TYR-ARG-LYS-ALA-ASN-LYS-SER-SER-LYS-LEU-VAL-SER-ALA-ASN-ARG-LEU-PHE-GLY-ASP-LYS-SER-LEU-THR-PHE-ASN-GLU-THR-TYR-GLN-ASP-ILE-SER-GLU-LEU-VAL-TYR-GLY-ALA-LYS-LEU-GLN-PRO-LEU-ASP-PHE-LYS-GLU-ASN-ALA-GLU-GLN-SER-ARG-ALA-ALA-ILE-ASN-LYS-TRP-VAL-SER-ASN-LYS-THR-GLU-GLY-ARG-ILE-THR-ASP-VAL-ILE-PRO-SER-GLU-ALA-ILE-ASN-GLU-LEU-THR-VAL-LEU-VAL-LEU-VAL-ASN-THR-ILE-TYR-PHE-LYS-GLY-LEU-TRP-LYS-SER-LYS-PHE-SER-PRO-GLU-ASN-THR-ARG-LYS-GLU-LEU-PHE-TYR-LYS-ALA-ASP-GLY-GLU-SER-CYS-SER-ALA-SER-MET-MET-TYR-GLN-GLU-GLY-LYS-PHE-ARG-TYR-ARG-ARG-VAL-ALA-GLU-GLY-THR-GLN-VAL-LEU-GLU-LEU-PRO-PHE-LYS-GLY-ASP-ASP-ILE-THR-MET-VAL-LEU-ILE-LEU-PRO-LYS-PRO-GLU-LYS-SER-LEU-ALA-LYS-VAL-GLU-LYS-GLU-LEU-THR-PRO-GLU-VAL-LEU-GLN-GLU-TRP-LEU-ASP-GLU-LEU-GLU-GLU-MET-MET-LEU-VAL-VAL-HIS-MET-PRO-ARG-PHE-ARG-ILE-GLU-ASP-GLY-PHE-SER-LEU-LYS-GLU-GLN-LEU-GLN-ASP-MET-GLY-LEU-VAL-ASP-LEU-PHE-SER-PRO-GLU-LYS-SER-LYS-LEU-PRO-GLY-ILE-VAL-ALA-GLU-GLY-ARG-ASP-ASP-LEU-TYR-VAL-SER-ASP-ALA-PHE-HIS-LYS-ALA-PHE-LEU-GLU-VAL-ASN-GLU-GLU-GLY-SER-GLU-ALA-ALA-ALA-SER-THR-ALA-VAL-VAL-ILE-ALA-GLY-ARG-SER-LEU-ASN-PRO-ASN-ARG-VAL-THR-PHE-LYS-ALA-ASN-ARG-PRO-PHE-LEU-VAL-PHE-ILE-ARG-GLU-VAL-PRO-LEU-ASN-THR-ILE-ILE-PHE-MET-GLY-ARG-VAL-ALA-ASN-PRO-CYS-VAL-LYS,SER-GLU-ALA-ALA-ALA-SER-THR-ALA-VAL-VAL-ILE-ALA,432,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)O)C)C)C)CO)C)C,Kd=18uM,4.744727,4.74,1,A,A,1,A,A,0,,P,I,,1,1,432,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C)C(C)C,0.9911407232284546,0.9462138414382936,81.23125457763672,78.94193267822266,0.4726108014583587,0.5361295938491821,0.9076968431472778,0.8988199234008789,0.9613260626792908,0.9392544627189636,SEAAASTAVVIA,Low,"(4.606, 4.745]",train
1BT6,protein-peptide,P17785 P60903,PSQMEHAMETMMFTFHKFAGDKGYLTKEDLRVLMEKEFPGFLENQKDPLAVDKIMKDLDQCRDGKVGFQSFFSLIAGLTIACNDYFVVHMKQKGKK,STVHEILSKLSLE,PRO-SER-GLN-MET-GLU-HIS-ALA-MET-GLU-THR-MET-MET-PHE-THR-PHE-HIS-LYS-PHE-ALA-GLY-ASP-LYS-GLY-TYR-LEU-THR-LYS-GLU-ASP-LEU-ARG-VAL-LEU-MET-GLU-LYS-GLU-PHE-PRO-GLY-PHE-LEU-GLU-ASN-GLN-LYS-ASP-PRO-LEU-ALA-VAL-ASP-LYS-ILE-MET-LYS-ASP-LEU-ASP-GLN-CYS-ARG-ASP-GLY-LYS-VAL-GLY-PHE-GLN-SER-PHE-PHE-SER-LEU-ILE-ALA-GLY-LEU-THR-ILE-ALA-CYS-ASN-ASP-TYR-PHE-VAL-VAL-HIS-MET-LYS-GLN-LYS-GLY-LYS-LYS,ACE-SER-THR-VAL-HIS-GLU-ILE-LEU-SER-LYS-LEU-SER-LEU-GLU,96,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)C)CO)Cc1[nH]cnc1)CCC(=O)O)CC(C)C)CO,Kd=2uM,5.69897,5.7,1,A,A,1,A,A,0,,C,A,dimer,1,1,96,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8757755756378174,0.7323328256607056,88.60177612304688,81.90336608886719,0.4299829006195068,0.884297251701355,0.8268316388130188,0.7593029141426086,0.7561308145523071,0.6669965386390686,STVHEILSKLSLE,Low,"(5.6, 5.699]",train
1BXL,protein-peptide,Q16611 Q07817,MSMAMSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEMETPSAINGNPSWHLADSPAVNGATGHSSSLDAREVIPMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQERLEHHHHHH,GQVGRQLAIIGDDINR,MET-SER-MET-ALA-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-MET-GLU-THR-PRO-SER-ALA-ILE-ASN-GLY-ASN-PRO-SER-TRP-HIS-LEU-ALA-ASP-SER-PRO-ALA-VAL-ASN-GLY-ALA-THR-GLY-HIS-SER-SER-SER-LEU-ASP-ALA-ARG-GLU-VAL-ILE-PRO-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-GLN-VAL-GLY-ARG-GLN-LEU-ALA-ILE-ILE-GLY-ASP-ASP-ILE-ASN-ARG,221,16,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(=O)N)[C@H](CC)C)CC(=O)O)CC(=O)O)[C@H](CC)C)[C@H](CC)C)C)CC(C)C)CCC(=O)N)CCC[NH+]=C(N)N)C(C)C)CCC(=O)N,Kd=0.34uM,6.468521,6.47,1,A,A,1,A,A,0,,B,A,,1,1,221,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)C(C)C)[C@@H](C)CC,1.0223408937454224,0.9477676749229432,68.81834411621094,66.36255645751953,0.6356784701347351,0.762532114982605,0.6945213675498962,0.7658213376998901,0.903873860836029,0.8179149031639099,GQVGRQLAIIGDDINR,Low,"(6.398, 6.523]",train
1BZH,protein-peptide,P18031,MEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHCSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLDMRKFRMGLIQTAEQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHED,DADEYLC,MET-GLU-MET-GLU-LYS-GLU-PHE-GLU-GLN-ILE-ASP-LYS-SER-GLY-SER-TRP-ALA-ALA-ILE-TYR-GLN-ASP-ILE-ARG-HIS-GLU-ALA-SER-ASP-PHE-PRO-CYS-ARG-VAL-ALA-LYS-LEU-PRO-LYS-ASN-LYS-ASN-ARG-ASN-ARG-TYR-ARG-ASP-VAL-SER-PRO-PHE-ASP-HIS-SER-ARG-ILE-LYS-LEU-HIS-GLN-GLU-ASP-ASN-ASP-TYR-ILE-ASN-ALA-SER-LEU-ILE-LYS-MET-GLU-GLU-ALA-GLN-ARG-SER-TYR-ILE-LEU-THR-GLN-GLY-PRO-LEU-PRO-ASN-THR-CYS-GLY-HIS-PHE-TRP-GLU-MET-VAL-TRP-GLU-GLN-LYS-SER-ARG-GLY-VAL-VAL-MET-LEU-ASN-ARG-VAL-MET-GLU-LYS-GLY-SER-LEU-LYS-CYS-ALA-GLN-TYR-TRP-PRO-GLN-LYS-GLU-GLU-LYS-GLU-MET-ILE-PHE-GLU-ASP-THR-ASN-LEU-LYS-LEU-THR-LEU-ILE-SER-GLU-ASP-ILE-LYS-SER-TYR-TYR-THR-VAL-ARG-GLN-LEU-GLU-LEU-GLU-ASN-LEU-THR-THR-GLN-GLU-THR-ARG-GLU-ILE-LEU-HIS-PHE-HIS-TYR-THR-THR-TRP-PRO-ASP-PHE-GLY-VAL-PRO-GLU-SER-PRO-ALA-SER-PHE-LEU-ASN-PHE-LEU-PHE-LYS-VAL-ARG-GLU-SER-GLY-SER-LEU-SER-PRO-GLU-HIS-GLY-PRO-VAL-VAL-VAL-HIS-CYS-SER-ALA-GLY-ILE-GLY-ARG-SER-GLY-THR-PHE-CYS-LEU-ALA-ASP-THR-CYS-LEU-LEU-LEU-MET-ASP-LYS-ARG-LYS-ASP-PRO-SER-SER-VAL-ASP-ILE-LYS-LYS-VAL-LEU-LEU-ASP-MET-ARG-LYS-PHE-ARG-MET-GLY-LEU-ILE-GLN-THR-ALA-GLU-GLN-LEU-ARG-PHE-SER-TYR-LEU-ALA-VAL-ILE-GLU-GLY-ALA-LYS-PHE-ILE-MET-GLY-ASP-SER-SER-VAL-GLN-ASP-GLN-TRP-LYS-GLU-LEU-SER-HIS-GLU-ASP,ASP-ALA-ASP-GLU-FLT-LEU-AEA,298,7,OC(=O)CC[C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CSC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1ccc(cc1)OC(C(=O)O)(C(=O)O)F)CC(C)C)C(=O)N)CC(=O)O,Ki=0.17uM,6.769551,6.77,1,A,A,1,A,A,0,,I,A,,1,1,298,7,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CSCC(N)C(N)=O)C(=O)NC(Cc1ccc(OC(F)(C(=O)O)C(=O)O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CSCC(N)C(N)=O)C(=O)NC(Cc1ccc(OC(F)(C(=O)O)C(=O)O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8836166858673096,0.851777970790863,93.1678695678711,94.82343292236328,0.3333136439323425,0.5648351311683655,0.9552868604660034,0.9363436102867126,0.8513548970222473,0.8306365609169006,DADEYLC,Low,"(6.696, 6.824]",train
1CKA,protein-peptide,Q64010,AEYVRALFDFNGNDEEDLPFKKGDILRIRDKPEEQWWNAEDSEGKRGMIPVPYVEKY,PPPALPPKKR,ALA-GLU-TYR-VAL-ARG-ALA-LEU-PHE-ASP-PHE-ASN-GLY-ASN-ASP-GLU-GLU-ASP-LEU-PRO-PHE-LYS-LYS-GLY-ASP-ILE-LEU-ARG-ILE-ARG-ASP-LYS-PRO-GLU-GLU-GLN-TRP-TRP-ASN-ALA-GLU-ASP-SER-GLU-GLY-LYS-ARG-GLY-MET-ILE-PRO-VAL-PRO-TYR-VAL-GLU-LYS-TYR,PRO-PRO-PRO-ALA-LEU-PRO-PRO-LYS-LYS-ARG,57,10,[NH3+]CCCC[C@@H](C(=O)N[C@@H](CCCC[NH3+])C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)C)CC(C)C,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,B,A,,1,1,57,10,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9702709317207336,0.8217698335647583,98.01617431640624,96.4853286743164,0.28132164478302,0.5191856622695923,0.92147558927536,0.8650184273719788,0.8891862034797668,0.810957670211792,PPPALPPKKR,Low,"(5.699, 5.821]",train
1CKB,protein-peptide,Q64010,AEYVRALFDFNGNDEEDLPFKKGDILRIRDKPEEQWWNAEDSEGKRGMIPVPYVEKY,PPPVPPRRRR,ALA-GLU-TYR-VAL-ARG-ALA-LEU-PHE-ASP-PHE-ASN-GLY-ASN-ASP-GLU-GLU-ASP-LEU-PRO-PHE-LYS-LYS-GLY-ASP-ILE-LEU-ARG-ILE-ARG-ASP-LYS-PRO-GLU-GLU-GLN-TRP-TRP-ASN-ALA-GLU-ASP-SER-GLU-GLY-LYS-ARG-GLY-MET-ILE-PRO-VAL-PRO-TYR-VAL-GLU-LYS-TYR,PRO-PRO-PRO-VAL-PRO-PRO-ARG-ARG-ARG-ARG,57,10,CC(NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N)C,Kd=5.2uM,5.283997,5.28,1,A,A,1,A,A,0,,B,A,,1,1,57,10,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9607859253883362,0.8197022676467896,97.28214263916016,96.0810317993164,0.2844876646995544,0.5829175114631653,0.9199773073196412,0.8650526404380798,0.8777044415473938,0.8083646893501282,PPPVPPRRRR,Low,"(5.222, 5.31]",train
1CYN,protein-peptide,P23284,GPKVTVKVYFDLRIGDEDVGRVIFGLFGKTVPKTVDNFVALATGEKGFGYKNSKFHRVIKDFMIQGGDFTRGDGTGGKSIYGERFPDENFKLKHYGPGWVSMANAGKDTNGSQFFITTVKTAWLDGKHVVFGKVLEGMEVVRKVESTKTDSRDKPLKDVIIADCGKIEVEKPFAIAKE,SLLVTAGLVLA,GLY-PRO-LYS-VAL-THR-VAL-LYS-VAL-TYR-PHE-ASP-LEU-ARG-ILE-GLY-ASP-GLU-ASP-VAL-GLY-ARG-VAL-ILE-PHE-GLY-LEU-PHE-GLY-LYS-THR-VAL-PRO-LYS-THR-VAL-ASP-ASN-PHE-VAL-ALA-LEU-ALA-THR-GLY-GLU-LYS-GLY-PHE-GLY-TYR-LYS-ASN-SER-LYS-PHE-HIS-ARG-VAL-ILE-LYS-ASP-PHE-MET-ILE-GLN-GLY-GLY-ASP-PHE-THR-ARG-GLY-ASP-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-GLU-ARG-PHE-PRO-ASP-GLU-ASN-PHE-LYS-LEU-LYS-HIS-TYR-GLY-PRO-GLY-TRP-VAL-SER-MET-ALA-ASN-ALA-GLY-LYS-ASP-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-THR-THR-VAL-LYS-THR-ALA-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-LEU-GLU-GLY-MET-GLU-VAL-VAL-ARG-LYS-VAL-GLU-SER-THR-LYS-THR-ASP-SER-ARG-ASP-LYS-PRO-LEU-LYS-ASP-VAL-ILE-ILE-ALA-ASP-CYS-GLY-LYS-ILE-GLU-VAL-GLU-LYS-PRO-PHE-ALA-ILE-ALA-LYS-GLU,DSN-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,178,11,C/C=C/C[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,Ki<21nM,7.68,7.68,1,A,A,1,A,A,0,,C,A,,1,1,178,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(CO)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(CO)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.8971232175827026,0.8016952276229858,94.57501983642578,92.24351501464844,0.3257902562618255,0.6215183138847351,0.952642858028412,0.8996386528015137,0.8468676209449768,0.7772092819213867,SLLVTAGLVLA,Moderate,"(7.523, 7.921]",train
1DDM,protein-peptide,P16554,HQWQADEEAVRSATCSFSVKYLGCVEVFESRGMQVCEEALKVLRQSRRRPVRGLLHVSGDGLRVVDDETKGLIVDQTIEKVSFCAPDRNHERGFSYICRDGTTRRWMCHGFLACKDSGERLSHAVGCAFAVCLER,GFSNMSFEDFP,HIS-GLN-TRP-GLN-ALA-ASP-GLU-GLU-ALA-VAL-ARG-SER-ALA-THR-CYS-SER-PHE-SER-VAL-LYS-TYR-LEU-GLY-CYS-VAL-GLU-VAL-PHE-GLU-SER-ARG-GLY-MET-GLN-VAL-CYS-GLU-GLU-ALA-LEU-LYS-VAL-LEU-ARG-GLN-SER-ARG-ARG-ARG-PRO-VAL-ARG-GLY-LEU-LEU-HIS-VAL-SER-GLY-ASP-GLY-LEU-ARG-VAL-VAL-ASP-ASP-GLU-THR-LYS-GLY-LEU-ILE-VAL-ASP-GLN-THR-ILE-GLU-LYS-VAL-SER-PHE-CYS-ALA-PRO-ASP-ARG-ASN-HIS-GLU-ARG-GLY-PHE-SER-TYR-ILE-CYS-ARG-ASP-GLY-THR-THR-ARG-ARG-TRP-MET-CYS-HIS-GLY-PHE-LEU-ALA-CYS-LYS-ASP-SER-GLY-GLU-ARG-LEU-SER-HIS-ALA-VAL-GLY-CYS-ALA-PHE-ALA-VAL-CYS-LEU-GLU-ARG,GLY-PHE-SER-ASN-MET-SER-PHE-GLU-ASP-PHE-PRO,135,11,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1)CC(=O)O)CCC(=O)O)Cc1ccccc1)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])Cc1ccccc1)CO)CC(=O)N,Kd=1.7uM,5.769551,5.77,1,A,A,1,A,A,0,,B,A,,1,1,135,11,0,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,0.8160433173179626,0.8092466592788696,90.00749206542969,88.66950225830078,0.4545296728610992,0.643312931060791,0.8338708281517029,0.8838165998458862,0.7644973993301392,0.7906041741371155,GFSNMSFEDFP,Low,"(5.699, 5.821]",val
1DPU,protein-peptide,P15927 P13051,ANSQPSAGRAPISNPGMSEAGNFGGNSFMPANGLTVAQNQVLNLIKACPRPEGLNFQDLKNQLKHMSVSSIKQAVDFLSNEGHIYSTVDDDHFKSTDAE,RIQRNKAAALLRLAAR,ALA-ASN-SER-GLN-PRO-SER-ALA-GLY-ARG-ALA-PRO-ILE-SER-ASN-PRO-GLY-MET-SER-GLU-ALA-GLY-ASN-PHE-GLY-GLY-ASN-SER-PHE-MET-PRO-ALA-ASN-GLY-LEU-THR-VAL-ALA-GLN-ASN-GLN-VAL-LEU-ASN-LEU-ILE-LYS-ALA-CYS-PRO-ARG-PRO-GLU-GLY-LEU-ASN-PHE-GLN-ASP-LEU-LYS-ASN-GLN-LEU-LYS-HIS-MET-SER-VAL-SER-SER-ILE-LYS-GLN-ALA-VAL-ASP-PHE-LEU-SER-ASN-GLU-GLY-HIS-ILE-TYR-SER-THR-VAL-ASP-ASP-ASP-HIS-PHE-LYS-SER-THR-ASP-ALA-GLU,ARG-ILE-GLN-ARG-ASN-LYS-ALA-ALA-ALA-LEU-LEU-ARG-LEU-ALA-ALA-ARG,99,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)C)CC(C)C)CCC[NH+]=C(N)N)CC(C)C)CC(C)C)C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC(=O)N)CCC[NH+]=C(N)N)CC(=O)N,Kd=1uM,6.0,6.0,1,A,A,1,A,A,0,,B,A,,1,1,99,16,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,1.0410510301589966,0.7725144624710083,80.41389465332031,70.64620971679688,0.3928509354591369,1.0013941526412964,0.7702244520187378,0.6738523244857788,0.864192545413971,0.6140992045402527,RIQRNKAAALLRLAAR,Low,"(5.959, 6.097]",train
1DXP,protein-peptide,P26662,APITAYSQQTRGLLGCIITSLTGRDKNQVDGEVQVLSTATQSFLATCVNGVCWTVYHGAGSKTLAGPKGPITQMYTNVDQDLVGWPAPPGARSMTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPVSYLKGSSGGPLLCPSGHVVGIFRAAVCTRGVAKAVDFIPVESMETTMRSPVFTDN,KGSVVIVGRIILSGRK,ALA-PRO-ILE-THR-ALA-TYR-SER-GLN-GLN-THR-ARG-GLY-LEU-LEU-GLY-CYS-ILE-ILE-THR-SER-LEU-THR-GLY-ARG-ASP-LYS-ASN-GLN-VAL-ASP-GLY-GLU-VAL-GLN-VAL-LEU-SER-THR-ALA-THR-GLN-SER-PHE-LEU-ALA-THR-CYS-VAL-ASN-GLY-VAL-CYS-TRP-THR-VAL-TYR-HIS-GLY-ALA-GLY-SER-LYS-THR-LEU-ALA-GLY-PRO-LYS-GLY-PRO-ILE-THR-GLN-MET-TYR-THR-ASN-VAL-ASP-GLN-ASP-LEU-VAL-GLY-TRP-PRO-ALA-PRO-PRO-GLY-ALA-ARG-SER-MET-THR-PRO-CYS-THR-CYS-GLY-SER-SER-ASP-LEU-TYR-LEU-VAL-THR-ARG-HIS-ALA-ASP-VAL-ILE-PRO-VAL-ARG-ARG-ARG-GLY-ASP-SER-ARG-GLY-SER-LEU-LEU-SER-PRO-ARG-PRO-VAL-SER-TYR-LEU-LYS-GLY-SER-SER-GLY-GLY-PRO-LEU-LEU-CYS-PRO-SER-GLY-HIS-VAL-VAL-GLY-ILE-PHE-ARG-ALA-ALA-VAL-CYS-THR-ARG-GLY-VAL-ALA-LYS-ALA-VAL-ASP-PHE-ILE-PRO-VAL-GLU-SER-MET-GLU-THR-THR-MET-ARG-SER-PRO-VAL-PHE-THR-ASP-ASN,LYS-GLY-SER-VAL-VAL-ILE-VAL-GLY-ARG-ILE-ILE-LEU-SER-GLY-ARG-LYS,187,16,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)C[NH3+])CO)C,Ki=27nM,7.568636,7.57,1,A,A,1,A,A,0,,C,A,,1,1,187,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,0.9486621618270874,0.8635388612747192,88.1926498413086,81.58255767822266,0.4151403307914734,0.5174906849861145,0.9219069480895996,0.90291827917099,0.8937745094299316,0.853693962097168,KGSVVIVGRIILSGRK,Moderate,"(7.523, 7.921]",train
1EJ4,protein-peptide,P63073 Q13541,VANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENRDAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,RIIYDRKFLMECRN,VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-ASP-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ARG-ILE-ILE-TYR-ASP-ARG-LYS-PHE-LEU-MET-GLU-CYS-ARG-ASN,190,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC[NH+]=C(N)N)CS)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1ccc(cc1)O)CC(=O)O)CCC[NH+]=C(N)N)C)Cc1ccccc1)CC(C)C,Kd=50nM,7.30103,7.3,1,A,A,1,A,A,0,,B,A,,1,1,190,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,0.9817274808883668,0.6811627149581909,94.6697006225586,90.78221130371094,0.3295579552650451,1.034409999847412,0.933935046195984,0.819013237953186,0.9507834315299988,0.6467000246047974,RIIYDRKFLMECRN,Moderate,"(7.268, 7.523]",train
1ELR,protein-peptide,P31948 Q9H2A1,GKQALKEKELGNDAYKKKDFDTALKHYDKAKELDPTNMTYITNQAAVYFEKGDYNKCRELCEKAIEVGRENREDYRQIAKAYARIGNSYFKEEKYKDAIHFYNKSLAEHRTPDVLKKCQQAEKILKEQERL,MEEVD,GLY-LYS-GLN-ALA-LEU-LYS-GLU-LYS-GLU-LEU-GLY-ASN-ASP-ALA-TYR-LYS-LYS-LYS-ASP-PHE-ASP-THR-ALA-LEU-LYS-HIS-TYR-ASP-LYS-ALA-LYS-GLU-LEU-ASP-PRO-THR-ASN-MET-THR-TYR-ILE-THR-ASN-GLN-ALA-ALA-VAL-TYR-PHE-GLU-LYS-GLY-ASP-TYR-ASN-LYS-CYS-ARG-GLU-LEU-CYS-GLU-LYS-ALA-ILE-GLU-VAL-GLY-ARG-GLU-ASN-ARG-GLU-ASP-TYR-ARG-GLN-ILE-ALA-LYS-ALA-TYR-ALA-ARG-ILE-GLY-ASN-SER-TYR-PHE-LYS-GLU-GLU-LYS-TYR-LYS-ASP-ALA-ILE-HIS-PHE-TYR-ASN-LYS-SER-LEU-ALA-GLU-HIS-ARG-THR-PRO-ASP-VAL-LEU-LYS-LYS-CYS-GLN-GLN-ALA-GLU-LYS-ILE-LEU-LYS-GLU-GLN-GLU-ARG-LEU,ACE-MET-GLU-GLU-VAL-ASP,131,6,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)C,Kd=11uM,4.958607,4.96,1,A,A,1,A,A,0,,B,A,,1,1,131,6,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,0.9739271402359008,0.9092043042182922,94.90766143798828,96.4737319946289,0.2740719616413116,0.4232061803340912,0.9507039189338684,0.9354456067085266,0.956754982471466,0.9026439189910888,MEEVD,Low,"(4.866, 5.014]",train
1EVH,protein-peptide,Q03173,MSEQSICQARAAVMVYDDANKKWVPAGGSTGFSRVHIYHHTGNNTFRVVGRKIQDHQVVINCAIPKGLKYNQATQTFHQWRDARQVYGLNFGSKEDANVFASAMMHALEVLN,FPPPPT,MET-SER-GLU-GLN-SER-ILE-CYS-GLN-ALA-ARG-ALA-ALA-VAL-MET-VAL-TYR-ASP-ASP-ALA-ASN-LYS-LYS-TRP-VAL-PRO-ALA-GLY-GLY-SER-THR-GLY-PHE-SER-ARG-VAL-HIS-ILE-TYR-HIS-HIS-THR-GLY-ASN-ASN-THR-PHE-ARG-VAL-VAL-GLY-ARG-LYS-ILE-GLN-ASP-HIS-GLN-VAL-VAL-ILE-ASN-CYS-ALA-ILE-PRO-LYS-GLY-LEU-LYS-TYR-ASN-GLN-ALA-THR-GLN-THR-PHE-HIS-GLN-TRP-ARG-ASP-ALA-ARG-GLN-VAL-TYR-GLY-LEU-ASN-PHE-GLY-SER-LYS-GLU-ASP-ALA-ASN-VAL-PHE-ALA-SER-ALA-MET-MET-HIS-ALA-LEU-GLU-VAL-LEU-ASN,ACE-PHE-PRO-PRO-PRO-PRO-THR,112,7,CC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1,Kd=602uM,3.220404,3.22,1,A,A,1,A,A,0,,B,A,,1,1,112,7,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccccc1)C(=O)O,,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccccc1)C(=O)O,0.9564353227615356,0.9138453602790833,95.76517486572266,93.24250030517578,0.2996604144573211,0.3808253705501556,0.9369195103645324,0.9318053126335144,0.9295346140861512,0.9093553423881532,FPPPPT,Low,"(2.044, 3.548]",train
1F47,protein-peptide,P0A9A6 P77173,MDKPKRKEAVIIMNVAAHHGSELNGELLLNSIQQAGFIFGDMNIYHRHLSPDGSGPALFSLANMVKPGTFDPEMKDFTTPGVTIFMQVPSYGDELQLFKLMLQSAQHIADEVGGVVLDDQRRMMTPQKLREYQDIIREVKDANA,KEPDYLDIPAFLRKQAD,MET-ASP-LYS-PRO-LYS-ARG-LYS-GLU-ALA-VAL-ILE-ILE-MET-ASN-VAL-ALA-ALA-HIS-HIS-GLY-SER-GLU-LEU-ASN-GLY-GLU-LEU-LEU-LEU-ASN-SER-ILE-GLN-GLN-ALA-GLY-PHE-ILE-PHE-GLY-ASP-MET-ASN-ILE-TYR-HIS-ARG-HIS-LEU-SER-PRO-ASP-GLY-SER-GLY-PRO-ALA-LEU-PHE-SER-LEU-ALA-ASN-MET-VAL-LYS-PRO-GLY-THR-PHE-ASP-PRO-GLU-MET-LYS-ASP-PHE-THR-THR-PRO-GLY-VAL-THR-ILE-PHE-MET-GLN-VAL-PRO-SER-TYR-GLY-ASP-GLU-LEU-GLN-LEU-PHE-LYS-LEU-MET-LEU-GLN-SER-ALA-GLN-HIS-ILE-ALA-ASP-GLU-VAL-GLY-GLY-VAL-VAL-LEU-ASP-ASP-GLN-ARG-ARG-MET-MET-THR-PRO-GLN-LYS-LEU-ARG-GLU-TYR-GLN-ASP-ILE-ILE-ARG-GLU-VAL-LYS-ASP-ALA-ASN-ALA,LYS-GLU-PRO-ASP-TYR-LEU-ASP-ILE-PRO-ALA-PHE-LEU-ARG-LYS-GLN-ALA-ASP,144,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CC(=O)O)Cc1ccc(cc1)O)CC(C)C)CC(=O)O)C)Cc1ccccc1)CC(C)C)CCC[NH+]=C(N)N,Kd=21.6uM,4.665546,4.67,1,A,A,1,A,A,0,,A,B,,1,1,144,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9616449475288392,0.7485907077789307,94.4257354736328,88.75214385986328,0.3392679989337921,0.7960811853408813,0.9260978698730468,0.8335615396499634,0.9006559252738953,0.7273479700088501,KEPDYLDIPAFLRKQAD,Low,"(4.606, 4.745]",train
1F8A,protein-peptide,Q13526,GSHGMADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE,YSPTSPS,GLY-SER-HIS-GLY-MET-ALA-ASP-GLU-GLU-LYS-LEU-PRO-PRO-GLY-TRP-GLU-LYS-ARG-MET-SER-ARG-SER-SER-GLY-ARG-VAL-TYR-TYR-PHE-ASN-HIS-ILE-THR-ASN-ALA-SER-GLN-TRP-GLU-ARG-PRO-SER-GLY-ASN-SER-SER-SER-GLY-GLY-LYS-ASN-GLY-GLN-GLY-GLU-PRO-ALA-ARG-VAL-ARG-CYS-SER-HIS-LEU-LEU-VAL-LYS-HIS-SER-GLN-SER-ARG-ARG-PRO-SER-SER-TRP-ARG-GLN-GLU-LYS-ILE-THR-ARG-THR-LYS-GLU-GLU-ALA-LEU-GLU-LEU-ILE-ASN-GLY-TYR-ILE-GLN-LYS-ILE-LYS-SER-GLY-GLU-GLU-ASP-PHE-GLU-SER-LEU-ALA-SER-GLN-PHE-SER-ASP-CYS-SER-SER-ALA-LYS-ALA-ARG-GLY-ASP-LEU-GLY-ALA-PHE-SER-ARG-GLY-GLN-MET-GLN-LYS-PRO-PHE-GLU-ASP-ALA-SER-PHE-ALA-LEU-ARG-THR-GLY-GLU-MET-SER-GLY-PRO-VAL-PHE-THR-ASP-SER-GLY-ILE-HIS-ILE-ILE-LEU-ARG-THR-GLU,TYR-SEP-PRO-THR-SEP-PRO-SER,167,7,OC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])COP(O)(O)O)COP(O)(O)O,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,C,B,,1,1,167,7,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,0.8698347806930542,0.8741862177848816,85.4991683959961,90.00292205810547,0.4019652307033539,0.6193283796310425,0.8956055641174316,0.8515806198120117,0.7987368702888489,0.8274424076080322,YSPTSPS,Low,"(4.866, 5.014]",train
1FF1,protein-peptide,P42566,PWAVKPEDKAKYDAIFDSLSPVNGFLSGDKVKPVLLNSKLPVDILGRVWELSDIDHDGMLDRDEFAVAMFLVYCALEKEPVPMSLPPALVPPSKR,PTGSSSTNPFL,PRO-TRP-ALA-VAL-LYS-PRO-GLU-ASP-LYS-ALA-LYS-TYR-ASP-ALA-ILE-PHE-ASP-SER-LEU-SER-PRO-VAL-ASN-GLY-PHE-LEU-SER-GLY-ASP-LYS-VAL-LYS-PRO-VAL-LEU-LEU-ASN-SER-LYS-LEU-PRO-VAL-ASP-ILE-LEU-GLY-ARG-VAL-TRP-GLU-LEU-SER-ASP-ILE-ASP-HIS-ASP-GLY-MET-LEU-ASP-ARG-ASP-GLU-PHE-ALA-VAL-ALA-MET-PHE-LEU-VAL-TYR-CYS-ALA-LEU-GLU-LYS-GLU-PRO-VAL-PRO-MET-SER-LEU-PRO-PRO-ALA-LEU-VAL-PRO-PRO-SER-LYS-ARG,PRO-THR-GLY-SER-SER-SER-THR-ASN-PRO-PHE-LEU,95,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)CC(=O)N)[C@H](O)C)[NH3+],Kd=12uM,4.920819,4.92,1,A,A,1,A,A,0,,B,A,,1,1,95,11,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.872067928314209,0.716752827167511,93.02261352539062,91.1248779296875,0.3550115525722503,0.6801420450210571,0.8924351930618286,0.8267638087272644,0.8021175861358643,0.6892500519752502,PTGSSSTNPFL,Low,"(4.866, 5.014]",train
1G3F,protein-peptide,Q9NR28 P98170,MSDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVKCFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTT,AVPIAQKSE,MET-SER-ASP-ALA-VAL-SER-SER-ASP-ARG-ASN-PHE-PRO-ASN-SER-THR-ASN-LEU-PRO-ARG-ASN-PRO-SER-MET-ALA-ASP-TYR-GLU-ALA-ARG-ILE-PHE-THR-PHE-GLY-THR-TRP-ILE-TYR-SER-VAL-ASN-LYS-GLU-GLN-LEU-ALA-ARG-ALA-GLY-PHE-TYR-ALA-LEU-GLY-GLU-GLY-ASP-LYS-VAL-LYS-CYS-PHE-HIS-CYS-GLY-GLY-GLY-LEU-THR-ASP-TRP-LYS-PRO-SER-GLU-ASP-PRO-TRP-GLU-GLN-HIS-ALA-LYS-TRP-TYR-PRO-GLY-CYS-LYS-TYR-LEU-LEU-GLU-GLN-LYS-GLY-GLN-GLU-TYR-ILE-ASN-ASN-ILE-HIS-LEU-THR-HIS-SER-LEU-GLU-GLU-CYS-LEU-VAL-ARG-THR-THR,ALA-VAL-PRO-ILE-ALA-GLN-LYS-SER-GLU,117,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CO)CCCC[NH3+])CCC(=O)N)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)C,Kd=0.43uM,6.366532,6.37,1,A,A,1,A,A,0,,B,A,,1,1,117,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8732562065124512,0.860817551612854,71.42277526855469,67.9457015991211,0.473458856344223,0.7370485067367554,0.7741177082061768,0.7152195572853088,0.793874204158783,0.7209349274635315,AVPIAQKSE,Low,"(6.26, 6.398]",train
1G6G,protein-peptide,P22216,GENIVCRVICTTGQIPIRDLSADISQVLKEKRSIKKVWTFGRNPACDYHLGNISRLSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSNQLLSQGDEITVGVGVESDILSLVIFINDKFKQCL,SLEVTEADATFAK,GLY-GLU-ASN-ILE-VAL-CYS-ARG-VAL-ILE-CYS-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-LEU-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-SER-ARG-LEU-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-ASN-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-GLY-VAL-GLY-VAL-GLU-SER-ASP-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-CYS-LEU,SER-LEU-GLU-VAL-TPO-GLU-ALA-ASP-ALA-THR-PHE-ALA-LYS,127,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)CCC(=O)O)C(C)C)CCC(=O)O)CC(C)C)[NH3+],Kd=530nM,6.275724,6.28,1,A,A,1,A,A,0,,E,A,,1,1,127,13,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.8447043895721436,0.765365719795227,89.9413070678711,92.57245635986328,0.3593364059925079,0.6847062706947327,0.9247231483459472,0.8520861268043518,0.7666639685630798,0.7436855435371399,SLEVTEADATFAK,Low,"(6.26, 6.398]",train
1GAG,protein-peptide,P06213,VFPSSVFVPDEWEVSREKITLLRELGQGSFGMVYEGNARDIIKGEAETRVAVKTVNESASLRERIEFLNEASVMKGFTCHHVVRLLGVVSKGQPTLVVMELMAHGDLKSYLRSLRPEAENNPGRPPPTLQEMIQMAAEIADGMAYLNAKKFVHRDLAARNCMVAHDFTVKIGDFGMTRDIYETDYYRKGGKGLLPVRWMAPESLKDGVFTTSSDMWSFGVVLWEITSLAEQPYQGLSNEQVLKFVMDGGYLDQPDNCPERVTDLMRMCWQFNPKMRPTFLEIVNLLKDDLHPSFPEVSFFHSEENK,PATGDFMNMSPVG,VAL-PHE-PRO-SER-SER-VAL-PHE-VAL-PRO-ASP-GLU-TRP-GLU-VAL-SER-ARG-GLU-LYS-ILE-THR-LEU-LEU-ARG-GLU-LEU-GLY-GLN-GLY-SER-PHE-GLY-MET-VAL-TYR-GLU-GLY-ASN-ALA-ARG-ASP-ILE-ILE-LYS-GLY-GLU-ALA-GLU-THR-ARG-VAL-ALA-VAL-LYS-THR-VAL-ASN-GLU-SER-ALA-SER-LEU-ARG-GLU-ARG-ILE-GLU-PHE-LEU-ASN-GLU-ALA-SER-VAL-MET-LYS-GLY-PHE-THR-CYS-HIS-HIS-VAL-VAL-ARG-LEU-LEU-GLY-VAL-VAL-SER-LYS-GLY-GLN-PRO-THR-LEU-VAL-VAL-MET-GLU-LEU-MET-ALA-HIS-GLY-ASP-LEU-LYS-SER-TYR-LEU-ARG-SER-LEU-ARG-PRO-GLU-ALA-GLU-ASN-ASN-PRO-GLY-ARG-PRO-PRO-PRO-THR-LEU-GLN-GLU-MET-ILE-GLN-MET-ALA-ALA-GLU-ILE-ALA-ASP-GLY-MET-ALA-TYR-LEU-ASN-ALA-LYS-LYS-PHE-VAL-HIS-ARG-ASP-LEU-ALA-ALA-ARG-ASN-CYS-MET-VAL-ALA-HIS-ASP-PHE-THR-VAL-LYS-ILE-GLY-ASP-PHE-GLY-MET-THR-ARG-ASP-ILE-PTR-GLU-THR-ASP-PTR-PTR-ARG-LYS-GLY-GLY-LYS-GLY-LEU-LEU-PRO-VAL-ARG-TRP-MET-ALA-PRO-GLU-SER-LEU-LYS-ASP-GLY-VAL-PHE-THR-THR-SER-SER-ASP-MET-TRP-SER-PHE-GLY-VAL-VAL-LEU-TRP-GLU-ILE-THR-SER-LEU-ALA-GLU-GLN-PRO-TYR-GLN-GLY-LEU-SER-ASN-GLU-GLN-VAL-LEU-LYS-PHE-VAL-MET-ASP-GLY-GLY-TYR-LEU-ASP-GLN-PRO-ASP-ASN-CYS-PRO-GLU-ARG-VAL-THR-ASP-LEU-MET-ARG-MET-CYS-TRP-GLN-PHE-ASN-PRO-LYS-MET-ARG-PRO-THR-PHE-LEU-GLU-ILE-VAL-ASN-LEU-LEU-LYS-ASP-ASP-LEU-HIS-PRO-SER-PHE-PRO-GLU-VAL-SER-PHE-PHE-HIS-SER-GLU-GLU-ASN-LYS,PRO-ALA-THR-GLY-ASP-PHE-MET-ASN-MET-SER-PRO-VAL-GLY,306,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC=O)C(C)C)CO)CCSC)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)C)CC(=O)O)Cc1ccccc1,Ki=750nM,6.124939,6.12,1,A,A,1,A,A,0,,B,A,,1,1,306,13,0,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,0.8545156717300415,0.8200026154518127,80.28308868408203,82.62980651855469,0.4861920773983001,0.7701674103736877,0.8997222185134888,0.8857472538948059,0.8177438378334045,0.7872265577316284,PATGDFMNMSPVG,Low,"(6.097, 6.26]",val
1GUW,protein-peptide,P83917 P68433,HMVEEVLEEEEEEYVVEKVLDRRVVKGKVEYLLKWKGFSDEDNTWEPEENLDCPDLIAEFLQSQKTAHETDKS,ARTKQTARKSTGGKAPGG,HIS-MET-VAL-GLU-GLU-VAL-LEU-GLU-GLU-GLU-GLU-GLU-GLU-TYR-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-VAL-VAL-LYS-GLY-LYS-VAL-GLU-TYR-LEU-LEU-LYS-TRP-LYS-GLY-PHE-SER-ASP-GLU-ASP-ASN-THR-TRP-GLU-PRO-GLU-GLU-ASN-LEU-ASP-CYS-PRO-ASP-LEU-ILE-ALA-GLU-PHE-LEU-GLN-SER-GLN-LYS-THR-ALA-HIS-GLU-THR-ASP-LYS-SER,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA-PRO-GLY-GLY,73,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)O)C)NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CCC(=O)N)C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CO,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,B,A,,1,1,73,18,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCCN(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCCN(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,1.0593479871749878,1.0208889245986938,87.55123138427734,85.26580810546875,0.3519100844860077,0.650538980960846,0.8548390865325928,0.8228034973144531,0.8563543558120728,0.8049992918968201,ARTKQTARKSTGGKAPGG,Low,"(5.699, 5.821]",train
1GWQ,protein-peptide,P03372 Q15596,SKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLLLEMLDAHR,KILHRLLQD,SER-LYS-LYS-ASN-SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-CYS-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-CYS-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-CYS-LYS-ASN-VAL-VAL-PRO-LEU-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS-ARG,LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-ASP,248,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1[nH]cnc1)CC(C)C)NC(=O)[C@@H]([NH3+])C)C,Kd=76nM,7.119186,7.12,1,A,A,1,A,A,0,,C,A,,1,1,248,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.9548455476760864,0.8460566997528076,88.1520004272461,87.64872741699219,0.3922584056854248,0.6355504393577576,0.923355996608734,0.91071617603302,0.9408307671546936,0.8298918008804321,KILHRLLQD,Moderate,"(7.049, 7.268]",train
1GWR,protein-peptide,P03372 Q15596,SLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLLLEMLDAHRL,NALLRYLLD,SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-CYS-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-CYS-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-CYS-LYS-ASN-VAL-VAL-PRO-LEU-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS-ARG-LEU,ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP,245,9,OC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])C)CC(C)C)CC(C)C)C)Cc1ccc(cc1)O)CC(C)C)CC(C)C)CC(=O)O,Kd=250nM,6.60206,6.6,1,A,A,1,A,A,0,,C,A,,1,1,245,9,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9509247541427612,0.8383281230926514,89.31228637695312,86.55452728271484,0.3761036992073059,0.6390494704246521,0.9322811365127563,0.9034446477890016,0.9334399104118348,0.8220490217208862,NALLRYLLD,Low,"(6.523, 6.696]",train
1H3H,protein-peptide,Q13094 O89100,GRVRWARALYDFEALEEDELGFRSGEVVEVLDSSNPSWWTGRLHNKLGLFPANYVAPMMR,APSIDRSTKPA,GLY-ARG-VAL-ARG-TRP-ALA-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-LEU-GLU-GLU-ASP-GLU-LEU-GLY-PHE-ARG-SER-GLY-GLU-VAL-VAL-GLU-VAL-LEU-ASP-SER-SER-ASN-PRO-SER-TRP-TRP-THR-GLY-ARG-LEU-HIS-ASN-LYS-LEU-GLY-LEU-PHE-PRO-ALA-ASN-TYR-VAL-ALA-PRO-MET-MET-ARG,ALA-PRO-SER-ILE-ASP-ARG-SER-THR-LYS-PRO-ALA,60,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CO)CC(=O)O)CCC[NH+]=C(N)N)CO,Kd=220nM,6.657577,6.66,1,A,A,1,A,A,0,,B,A,,1,1,60,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.950169801712036,0.8413788676261902,94.67671966552734,93.76451873779295,0.3020073473453522,0.520819365978241,0.9086530208587646,0.8770445585250854,0.8637180328369141,0.8324624300003052,APSIDRSTKPA,Low,"(6.523, 6.696]",train
1H6E,protein-peptide,Q96CW1 P16410,HHHHHHEQKLISEEDLEGIKYRRNELFLDVLESVNLLMSPQGQVLSAHVSGRVVMKSYLSGMPECKFGMNDKIVIEKQGKGTADETSKSGKQSIAIDDCTFHQCVRLSKFDSERSISFIPPDGEFELMRYRTTKDIILPFRVIPLVREVGRTKLEVKVVIKSNFKPSLLAQKIEVRIPTPLNTSGVQVICMKGKAKYKASENAIVWKIKRMAGMKESQISAEIELLPTNDKKKWARPPISMNFEVPFAPSGLKVRYLKVFEPKLNYSDHDVIKWVRYIGRSGIYETRC,TTGVYVKMPPT,HIS-HIS-HIS-HIS-HIS-HIS-GLU-GLN-LYS-LEU-ILE-SER-GLU-GLU-ASP-LEU-GLU-GLY-ILE-LYS-TYR-ARG-ARG-ASN-GLU-LEU-PHE-LEU-ASP-VAL-LEU-GLU-SER-VAL-ASN-LEU-LEU-MET-SER-PRO-GLN-GLY-GLN-VAL-LEU-SER-ALA-HIS-VAL-SER-GLY-ARG-VAL-VAL-MET-LYS-SER-TYR-LEU-SER-GLY-MET-PRO-GLU-CYS-LYS-PHE-GLY-MET-ASN-ASP-LYS-ILE-VAL-ILE-GLU-LYS-GLN-GLY-LYS-GLY-THR-ALA-ASP-GLU-THR-SER-LYS-SER-GLY-LYS-GLN-SER-ILE-ALA-ILE-ASP-ASP-CYS-THR-PHE-HIS-GLN-CYS-VAL-ARG-LEU-SER-LYS-PHE-ASP-SER-GLU-ARG-SER-ILE-SER-PHE-ILE-PRO-PRO-ASP-GLY-GLU-PHE-GLU-LEU-MET-ARG-TYR-ARG-THR-THR-LYS-ASP-ILE-ILE-LEU-PRO-PHE-ARG-VAL-ILE-PRO-LEU-VAL-ARG-GLU-VAL-GLY-ARG-THR-LYS-LEU-GLU-VAL-LYS-VAL-VAL-ILE-LYS-SER-ASN-PHE-LYS-PRO-SER-LEU-LEU-ALA-GLN-LYS-ILE-GLU-VAL-ARG-ILE-PRO-THR-PRO-LEU-ASN-THR-SER-GLY-VAL-GLN-VAL-ILE-CYS-MET-LYS-GLY-LYS-ALA-LYS-TYR-LYS-ALA-SER-GLU-ASN-ALA-ILE-VAL-TRP-LYS-ILE-LYS-ARG-MET-ALA-GLY-MET-LYS-GLU-SER-GLN-ILE-SER-ALA-GLU-ILE-GLU-LEU-LEU-PRO-THR-ASN-ASP-LYS-LYS-LYS-TRP-ALA-ARG-PRO-PRO-ILE-SER-MET-ASN-PHE-GLU-VAL-PRO-PHE-ALA-PRO-SER-GLY-LEU-LYS-VAL-ARG-TYR-LEU-LYS-VAL-PHE-GLU-PRO-LYS-LEU-ASN-TYR-SER-ASP-HIS-ASP-VAL-ILE-LYS-TRP-VAL-ARG-TYR-ILE-GLY-ARG-SER-GLY-ILE-TYR-GLU-THR-ARG-CYS,THR-THR-GLY-VAL-TYR-VAL-LYS-MET-PRO-PRO-THR,288,11,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[NH3+],Kd=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,P,A,,1,1,288,11,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(C)C,0.7645728588104248,0.8717889189720154,78.09078216552734,78.81007385253906,0.6624792814254761,0.6656902432441711,0.790142834186554,0.8237955570220947,0.6766586899757385,0.8295337557792664,TTGVYVKMPPT,Low,"(6.097, 6.26]",train
1HAA,protein-peptide,P60615,IVCHTTATSPISAVTCPPGENLCYRKMWCDAFCSSRGKVVELGCAATCPSKKPYEEVTCCSTDKCNPHPKQRPG,WRYYESSLEPYPD,ILE-VAL-CYS-HIS-THR-THR-ALA-THR-SER-PRO-ILE-SER-ALA-VAL-THR-CYS-PRO-PRO-GLY-GLU-ASN-LEU-CYS-TYR-ARG-LYS-MET-TRP-CYS-ASP-ALA-PHE-CYS-SER-SER-ARG-GLY-LYS-VAL-VAL-GLU-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-SER-LYS-LYS-PRO-TYR-GLU-GLU-VAL-THR-CYS-CYS-SER-THR-ASP-LYS-CYS-ASN-PRO-HIS-PRO-LYS-GLN-ARG-PRO-GLY,TRP-ARG-TYR-TYR-GLU-SER-SER-LEU-GLU-PRO-TYR-PRO-ASP,74,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccc(cc1)O)CCC(=O)O)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)[NH3+])CCC[NH+]=C(N)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCC(=O)O,IC50=2nM,8.69897,8.7,1,A,A,1,A,A,0,,B,A,,1,1,74,13,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9603028893470764,0.6736329197883606,59.77392578125,62.813453674316406,0.5579420328140259,0.9074435234069824,0.7327251434326172,0.7087997794151306,0.7944961190223694,0.6395033001899719,WRYYESSLEPYPD,Moderate,"(8.383, 8.824]",train
1I3Z,protein-peptide,O35324 Q13291,MDLPYYHGCLTKRECEALLLKGGVDGNFLIRDSESVPGALCLCVSFKKLVYSYRIFREKHGYYRIETDAHTPRTIFPNLQELVSKYGKPGQGLVVHLSNPIMR,VEKKSLTIYAQVQK,MET-ASP-LEU-PRO-TYR-TYR-HIS-GLY-CYS-LEU-THR-LYS-ARG-GLU-CYS-GLU-ALA-LEU-LEU-LEU-LYS-GLY-GLY-VAL-ASP-GLY-ASN-PHE-LEU-ILE-ARG-ASP-SER-GLU-SER-VAL-PRO-GLY-ALA-LEU-CYS-LEU-CYS-VAL-SER-PHE-LYS-LYS-LEU-VAL-TYR-SER-TYR-ARG-ILE-PHE-ARG-GLU-LYS-HIS-GLY-TYR-TYR-ARG-ILE-GLU-THR-ASP-ALA-HIS-THR-PRO-ARG-THR-ILE-PHE-PRO-ASN-LEU-GLN-GLU-LEU-VAL-SER-LYS-TYR-GLY-LYS-PRO-GLY-GLN-GLY-LEU-VAL-VAL-HIS-LEU-SER-ASN-PRO-ILE-MET-ARG,VAL-GLU-LYS-LYS-SER-LEU-THR-ILE-PTR-ALA-GLN-VAL-GLN-LYS,103,14,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)Cc1ccc(cc1)OP(O)(O)O)C)CCC(=O)N)CCC(=O)N,Kd=131nM,6.882729,6.88,1,A,A,1,A,A,0,,B,A,,1,1,103,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O,0.8195081949234009,0.7357652187347412,92.49796295166016,91.13186645507812,0.4061756730079651,0.7863729596138,0.8872420191764832,0.8213474154472351,0.7277884483337402,0.7143696546554565,VEKKSLTIYAQVQK,Low,"(6.824, 7.049]",train
1IDG,protein-peptide,P02710 P60615,IVCHTTATSPISAVTCPPGENLCYRKMWCDAFCSSRGKVVELGCAATCPSKKPYEEVTCCSTDKCNPHPKQRPG,YRGWKHWVYYTCCPDTPYS,ILE-VAL-CYS-HIS-THR-THR-ALA-THR-SER-PRO-ILE-SER-ALA-VAL-THR-CYS-PRO-PRO-GLY-GLU-ASN-LEU-CYS-TYR-ARG-LYS-MET-TRP-CYS-ASP-ALA-PHE-CYS-SER-SER-ARG-GLY-LYS-VAL-VAL-GLU-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-SER-LYS-LYS-PRO-TYR-GLU-GLU-VAL-THR-CYS-CYS-SER-THR-ASP-LYS-CYS-ASN-PRO-HIS-PRO-LYS-GLN-ARG-PRO-GLY,TYR-ARG-GLY-TRP-LYS-HIS-TRP-VAL-TYR-TYR-THR-CYS-CYS-PRO-ASP-THR-PRO-TYR-HSL,74,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]1CSSC[C@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)[C@@H](O)C)CC(=O)O)[C@H](O)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C(C)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCC[NH+]=C(N)N,Kd=65nM,7.187087,7.19,1,A,A,1,A,A,0,,B,A,,1,1,74,19,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9289687275886536,0.6022768020629883,54.26493835449219,55.44067001342773,0.510936439037323,1.0378055572509766,0.7757806181907654,0.6365603804588318,0.7320506572723389,0.5514761805534363,YRGWKHWVYYTCCPDTPYS,Moderate,"(7.049, 7.268]",val
1IRS,protein-peptide,P35568 P24394,MGPAFKEVWQVILKPKGLGQTKNLIGIYRLCLTSKTISFVKLNSEAAAVVLQLMNIRRCGHSENFFFIEVGRSAVTGPGEFWMQVDDSVVAQNMHETILEAMRAMSDEFRPR,LVIAGNPAYRS,MET-GLY-PRO-ALA-PHE-LYS-GLU-VAL-TRP-GLN-VAL-ILE-LEU-LYS-PRO-LYS-GLY-LEU-GLY-GLN-THR-LYS-ASN-LEU-ILE-GLY-ILE-TYR-ARG-LEU-CYS-LEU-THR-SER-LYS-THR-ILE-SER-PHE-VAL-LYS-LEU-ASN-SER-GLU-ALA-ALA-ALA-VAL-VAL-LEU-GLN-LEU-MET-ASN-ILE-ARG-ARG-CYS-GLY-HIS-SER-GLU-ASN-PHE-PHE-PHE-ILE-GLU-VAL-GLY-ARG-SER-ALA-VAL-THR-GLY-PRO-GLY-GLU-PHE-TRP-MET-GLN-VAL-ASP-ASP-SER-VAL-VAL-ALA-GLN-ASN-MET-HIS-GLU-THR-ILE-LEU-GLU-ALA-MET-ARG-ALA-MET-SER-ASP-GLU-PHE-ARG-PRO-ARG,LEU-VAL-ILE-ALA-GLY-ASN-PRO-ALA-PTR-ARG-SER,112,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCC[NH+]=C(N)N)Cc1ccc(cc1)OP(O)(O)O)C)CC(=O)N)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)[NH3+])C,Kd=6uM,5.221849,5.22,1,A,A,1,A,A,0,,B,A,,1,1,112,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.973476767539978,0.8995078802108765,96.13172912597656,93.8121566772461,0.3240164816379547,0.475297749042511,0.9249432682991028,0.9181602597236632,0.9297157526016236,0.8948447108268738,LVIAGNPAYRS,Low,"(5.105, 5.222]",val
1IWQ,protein-peptide,P26645 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,KKRFSFKKSFKLSGFSFKK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,LYS-LYS-ARG-PHE-SER-PHE-LYS-LYS-SER-PHE-LYS-LEU-SER-GLY-PHE-SER-PHE-LYS-LYS,148,19,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])Cc1ccccc1)CO)Cc1ccccc1)CO)CC(C)C)CCCC[NH3+])Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)C)CO)CCCC[NH3+])CCCC[NH3+],Kd=8.8nM,8.055517,8.06,1,A,A,1,A,A,0,,B,A,,1,1,148,19,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,0.8100976943969727,0.677489697933197,59.7338981628418,49.91521835327149,0.509705126285553,1.1156610250473022,0.7680146098136902,0.7106073498725891,0.749510645866394,0.6692102551460266,KKRFSFKKSFKLSGFSFKK,Moderate,"(7.921, 8.383]",val
1J19,protein-peptide,P35330 P26043,MPKPINVRVTTMDAELEFAIQPNTTGKQLFDQVVKTVGLREVWFFGLQYVDSKGYSTWLKLNKKVTQQDVKKENPLQFKFRAKFFPEDVSEELIQEITQRLFFLQVKEAILNDEIYCPPETAVLLASYAVQAKYGDYNKEIHKPGYLANDRLLPQRVLEQHKLTKEQWEERIQNWHEEHRGMLREDSMMEYLKIAQDLEMYGVNYFEIKNKKGTELWLGVDALGLNIYEHDDKLTPKIGFPWSEIRNISFNDKKFVIKPIDKKAPDFVFYAPRLRINKRILALCMGNHELYMRRRKPDTIEVQQMKAQARVDSSGAA,RRRTGTYGVLAAWRRL,MET-PRO-LYS-PRO-ILE-ASN-VAL-ARG-VAL-THR-THR-MET-ASP-ALA-GLU-LEU-GLU-PHE-ALA-ILE-GLN-PRO-ASN-THR-THR-GLY-LYS-GLN-LEU-PHE-ASP-GLN-VAL-VAL-LYS-THR-VAL-GLY-LEU-ARG-GLU-VAL-TRP-PHE-PHE-GLY-LEU-GLN-TYR-VAL-ASP-SER-LYS-GLY-TYR-SER-THR-TRP-LEU-LYS-LEU-ASN-LYS-LYS-VAL-THR-GLN-GLN-ASP-VAL-LYS-LYS-GLU-ASN-PRO-LEU-GLN-PHE-LYS-PHE-ARG-ALA-LYS-PHE-PHE-PRO-GLU-ASP-VAL-SER-GLU-GLU-LEU-ILE-GLN-GLU-ILE-THR-GLN-ARG-LEU-PHE-PHE-LEU-GLN-VAL-LYS-GLU-ALA-ILE-LEU-ASN-ASP-GLU-ILE-TYR-CYS-PRO-PRO-GLU-THR-ALA-VAL-LEU-LEU-ALA-SER-TYR-ALA-VAL-GLN-ALA-LYS-TYR-GLY-ASP-TYR-ASN-LYS-GLU-ILE-HIS-LYS-PRO-GLY-TYR-LEU-ALA-ASN-ASP-ARG-LEU-LEU-PRO-GLN-ARG-VAL-LEU-GLU-GLN-HIS-LYS-LEU-THR-LYS-GLU-GLN-TRP-GLU-GLU-ARG-ILE-GLN-ASN-TRP-HIS-GLU-GLU-HIS-ARG-GLY-MET-LEU-ARG-GLU-ASP-SER-MET-MET-GLU-TYR-LEU-LYS-ILE-ALA-GLN-ASP-LEU-GLU-MET-TYR-GLY-VAL-ASN-TYR-PHE-GLU-ILE-LYS-ASN-LYS-LYS-GLY-THR-GLU-LEU-TRP-LEU-GLY-VAL-ASP-ALA-LEU-GLY-LEU-ASN-ILE-TYR-GLU-HIS-ASP-ASP-LYS-LEU-THR-PRO-LYS-ILE-GLY-PHE-PRO-TRP-SER-GLU-ILE-ARG-ASN-ILE-SER-PHE-ASN-ASP-LYS-LYS-PHE-VAL-ILE-LYS-PRO-ILE-ASP-LYS-LYS-ALA-PRO-ASP-PHE-VAL-PHE-TYR-ALA-PRO-ARG-LEU-ARG-ILE-ASN-LYS-ARG-ILE-LEU-ALA-LEU-CYS-MET-GLY-ASN-HIS-GLU-LEU-TYR-MET-ARG-ARG-ARG-LYS-PRO-ASP-THR-ILE-GLU-VAL-GLN-GLN-MET-LYS-ALA-GLN-ALA-ARG-VAL-ASP-SER-SER-GLY-ALA-ALA,ARG-ARG-ARG-THR-GLY-THR-TYR-GLY-VAL-LEU-ALA-ALA-TRP-ARG-ARG-LEU,317,16,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)C)Cc1c[nH]c2c1cccc2)C)C)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)C,Kd=16.4nM,7.785156,7.79,1,A,A,1,A,A,0,,B,A,,1,1,317,16,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,0.7721556425094604,0.6005880236625671,84.79839324951172,81.2786865234375,0.469589501619339,1.1841012239456177,0.8901384472846985,0.8071414232254028,0.7069993019104004,0.548949658870697,RRRTGTYGVLAAWRRL,Moderate,"(7.523, 7.921]",train
1JBD,protein-peptide,P60615,IVCHTTATSPISAVTCPPGENLCYRKMWCDAFCSSRGKVVELGCAATCPSKKPYEEVTCCSTDKCNPHPKQRPG,HRYYESSLEPWYPD,ILE-VAL-CYS-HIS-THR-THR-ALA-THR-SER-PRO-ILE-SER-ALA-VAL-THR-CYS-PRO-PRO-GLY-GLU-ASN-LEU-CYS-TYR-ARG-LYS-MET-TRP-CYS-ASP-ALA-PHE-CYS-SER-SER-ARG-GLY-LYS-VAL-VAL-GLU-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-SER-LYS-LYS-PRO-TYR-GLU-GLU-VAL-THR-CYS-CYS-SER-THR-ASP-LYS-CYS-ASN-PRO-HIS-PRO-LYS-GLN-ARG-PRO-GLY,HIS-ARG-TYR-TYR-GLU-SER-SER-LEU-GLU-PRO-TRP-TYR-PRO-ASP,74,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2)CCC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC[NH+]=C(N)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCC(=O)O)CO,IC50=0.12uM,6.920819,6.92,1,A,A,1,A,A,0,,B,A,,0,1,74,14,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.7253839373588562,0.4974916577339172,56.34342193603516,59.72867584228516,0.5946471095085144,1.1347990036010742,0.7251924872398376,0.5655941963195801,0.6259999871253967,0.4382362961769104,HRYYESSLEPWYPD,Low,"(6.824, 7.049]",train
1JD5,protein-peptide,Q24570 Q24306,DVQPETCRPSAASGNYFPQYPEYAIETARLRTFEAWPRNLKQKPHQLAEAGFFYTGVGDRVRCFSCGGGLMDWNDNDEPWEQHALWLSQCRFVKLMKGQLYIDTVAAKPVLAEEKEESTSIGGD,AIAYFIPDQA,ASP-VAL-GLN-PRO-GLU-THR-CYS-ARG-PRO-SER-ALA-ALA-SER-GLY-ASN-TYR-PHE-PRO-GLN-TYR-PRO-GLU-TYR-ALA-ILE-GLU-THR-ALA-ARG-LEU-ARG-THR-PHE-GLU-ALA-TRP-PRO-ARG-ASN-LEU-LYS-GLN-LYS-PRO-HIS-GLN-LEU-ALA-GLU-ALA-GLY-PHE-PHE-TYR-THR-GLY-VAL-GLY-ASP-ARG-VAL-ARG-CYS-PHE-SER-CYS-GLY-GLY-GLY-LEU-MET-ASP-TRP-ASN-ASP-ASN-ASP-GLU-PRO-TRP-GLU-GLN-HIS-ALA-LEU-TRP-LEU-SER-GLN-CYS-ARG-PHE-VAL-LYS-LEU-MET-LYS-GLY-GLN-LEU-TYR-ILE-ASP-THR-VAL-ALA-ALA-LYS-PRO-VAL-LEU-ALA-GLU-GLU-LYS-GLU-GLU-SER-THR-SER-ILE-GLY-GLY-ASP,ALA-ILE-ALA-TYR-PHE-ILE-PRO-ASP-GLN-ALA,124,10,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]([NH3+])C)C)Cc1ccc(cc1)O)Cc1ccccc1)C,Kd=0.24uM,6.619789,6.62,1,A,A,1,A,A,0,,B,A,,1,1,124,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,1.017817139625549,1.0143823623657229,86.05903625488281,80.74159240722656,0.381963312625885,0.5008650422096252,0.8405306935310364,0.8782461285591125,0.8895641565322876,0.9022470712661744,AIAYFIPDQA,Low,"(6.523, 6.696]",val
1JD6,protein-peptide,Q24106 Q24306,DVQPETCRPSAASGNYFPQYPEYAIETARLRTFEAWPRNLKQKPHQLAEAGFFYTGVGDRVRCFSCGGGLMDWNDNDEPWEQHALWLSQCRFVKLMKGQLYIDTVAAKPVLAEEKEESTSIGGD,AVPFYLPEGG,ASP-VAL-GLN-PRO-GLU-THR-CYS-ARG-PRO-SER-ALA-ALA-SER-GLY-ASN-TYR-PHE-PRO-GLN-TYR-PRO-GLU-TYR-ALA-ILE-GLU-THR-ALA-ARG-LEU-ARG-THR-PHE-GLU-ALA-TRP-PRO-ARG-ASN-LEU-LYS-GLN-LYS-PRO-HIS-GLN-LEU-ALA-GLU-ALA-GLY-PHE-PHE-TYR-THR-GLY-VAL-GLY-ASP-ARG-VAL-ARG-CYS-PHE-SER-CYS-GLY-GLY-GLY-LEU-MET-ASP-TRP-ASN-ASP-ASN-ASP-GLU-PRO-TRP-GLU-GLN-HIS-ALA-LEU-TRP-LEU-SER-GLN-CYS-ARG-PHE-VAL-LYS-LEU-MET-LYS-GLY-GLN-LEU-TYR-ILE-ASP-THR-VAL-ALA-ALA-LYS-PRO-VAL-LEU-ALA-GLU-GLU-LYS-GLU-GLU-SER-THR-SER-ILE-GLY-GLY-ASP,ALA-VAL-PRO-PHE-TYR-LEU-PRO-GLU-GLY-GLY,124,10,O=C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)CC(C)C)CCC(=O)O,Kd=0.041uM,7.387216,7.39,1,A,A,1,A,A,0,,B,A,,1,1,124,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)NCC(=O)O,1.010666012763977,0.9789481163024902,84.05088806152344,79.75882720947266,0.3889365196228027,0.5552276968955994,0.8375330567359924,0.8479418754577637,0.8767104148864746,0.8655303120613098,AVPFYLPEGG,Moderate,"(7.268, 7.523]",train
1JM4,protein-peptide,P04610 Q92831,GSHMSKEPRDPDQLYSTLKSILQQVKSHQSAWPFMEPVKRTEAPGYYEVIRFPMDLKTMSERLKNRYYVSKKLFMADLQRVFTNCKEYNPPESEYYKCANILEKFFFSKIKEAGLIDK,SYGRKKRRQRC,GLY-SER-HIS-MET-SER-LYS-GLU-PRO-ARG-ASP-PRO-ASP-GLN-LEU-TYR-SER-THR-LEU-LYS-SER-ILE-LEU-GLN-GLN-VAL-LYS-SER-HIS-GLN-SER-ALA-TRP-PRO-PHE-MET-GLU-PRO-VAL-LYS-ARG-THR-GLU-ALA-PRO-GLY-TYR-TYR-GLU-VAL-ILE-ARG-PHE-PRO-MET-ASP-LEU-LYS-THR-MET-SER-GLU-ARG-LEU-LYS-ASN-ARG-TYR-TYR-VAL-SER-LYS-LYS-LEU-PHE-MET-ALA-ASP-LEU-GLN-ARG-VAL-PHE-THR-ASN-CYS-LYS-GLU-TYR-ASN-PRO-PRO-GLU-SER-GLU-TYR-TYR-LYS-CYS-ALA-ASN-ILE-LEU-GLU-LYS-PHE-PHE-PHE-SER-LYS-ILE-LYS-GLU-ALA-GLY-LEU-ILE-ASP-LYS,SER-TYR-GLY-ARG-ALY-LYS-ARG-ARG-GLN-ARG-CYS,118,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1ccc(cc1)O)CCC[NH+]=C(N)N)CCCCNC(=O)C,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,A,B,,1,1,118,11,0,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,0.8912279009819031,0.732718825340271,89.19261169433594,87.98137664794922,0.3566697537899017,0.7687774300575256,0.9012308716773988,0.8224753737449646,0.8160526752471924,0.710279643535614,SYGRKKRRQRC,Low,"(4.866, 5.014]",train
1JP5,protein-peptide,,DILMTQTPLYLPVSLGDQASISCRSSQTIVHNNGNTYLEWYLQKPGQSPQLLIYKVSNRFSGVPDRFSGSGSGTDFTLKISRVEAEDLGIYYCFQGSHFPPTFGGGTKLEIKGGGGSGGGGSGGGGSEVQLQQSGPELKKPGETVKISCKATNYAFTDYSMHWVKQAPGGDLKYVGWINTETDEPTFADDFKGRFAFSLDTSTSTAFLQINNLKNEDTATYFCVRDRHDYGEIFTYWGQGTTVTVSS,PQITLWQRR,ASP-ILE-LEU-MET-THR-GLN-THR-PRO-LEU-TYR-LEU-PRO-VAL-SER-LEU-GLY-ASP-GLN-ALA-SER-ILE-SER-CYS-ARG-SER-SER-GLN-THR-ILE-VAL-HIS-ASN-ASN-GLY-ASN-THR-TYR-LEU-GLU-TRP-TYR-LEU-GLN-LYS-PRO-GLY-GLN-SER-PRO-GLN-LEU-LEU-ILE-TYR-LYS-VAL-SER-ASN-ARG-PHE-SER-GLY-VAL-PRO-ASP-ARG-PHE-SER-GLY-SER-GLY-SER-GLY-THR-ASP-PHE-THR-LEU-LYS-ILE-SER-ARG-VAL-GLU-ALA-GLU-ASP-LEU-GLY-ILE-TYR-TYR-CYS-PHE-GLN-GLY-SER-HIS-PHE-PRO-PRO-THR-PHE-GLY-GLY-GLY-THR-LYS-LEU-GLU-ILE-LYS-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLU-VAL-GLN-LEU-GLN-GLN-SER-GLY-PRO-GLU-LEU-LYS-LYS-PRO-GLY-GLU-THR-VAL-LYS-ILE-SER-CYS-LYS-ALA-THR-ASN-TYR-ALA-PHE-THR-ASP-TYR-SER-MET-HIS-TRP-VAL-LYS-GLN-ALA-PRO-GLY-GLY-ASP-LEU-LYS-TYR-VAL-GLY-TRP-ILE-ASN-THR-GLU-THR-ASP-GLU-PRO-THR-PHE-ALA-ASP-ASP-PHE-LYS-GLY-ARG-PHE-ALA-PHE-SER-LEU-ASP-THR-SER-THR-SER-THR-ALA-PHE-LEU-GLN-ILE-ASN-ASN-LEU-LYS-ASN-GLU-ASP-THR-ALA-THR-TYR-PHE-CYS-VAL-ARG-ASP-ARG-HIS-ASP-TYR-GLY-GLU-ILE-PHE-THR-TYR-TRP-GLY-GLN-GLY-THR-THR-VAL-THR-VAL-SER-SER,PRO-GLN-ILE-THR-LEU-TRP-GLN-ARG-ARG,247,9,O=C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC(=O)N)CC(C)C,Ki=0.6nM,9.221849,9.22,1,A,A,1,A,A,0,,C,A,,1,1,247,9,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.9370203018188475,0.8372777104377747,93.26300811767578,88.6862564086914,0.349696546792984,0.6366991996765137,0.9315804243087769,0.9061493277549744,0.901759147644043,0.8048775792121887,PQITLWQRR,High,"(8.824, 12.12]",val
1JQ8,protein-peptide,P59071,SLLEFGKMILEETGKLAIPSYSSYGCYCGWGGKGTPKDATDRCCFVHDCCYGNLPDCNPKSDRYKYKRVNGAIVCEKGTSCENRICECDKAAAICFRQNLNTYSKKYMLYPDFLCKGELKC,LAIYS,SER-LEU-LEU-GLU-PHE-GLY-LYS-MET-ILE-LEU-GLU-GLU-THR-GLY-LYS-LEU-ALA-ILE-PRO-SER-TYR-SER-SER-TYR-GLY-CYS-TYR-CYS-GLY-TRP-GLY-GLY-LYS-GLY-THR-PRO-LYS-ASP-ALA-THR-ASP-ARG-CYS-CYS-PHE-VAL-HIS-ASP-CYS-CYS-TYR-GLY-ASN-LEU-PRO-ASP-CYS-ASN-PRO-LYS-SER-ASP-ARG-TYR-LYS-TYR-LYS-ARG-VAL-ASN-GLY-ALA-ILE-VAL-CYS-GLU-LYS-GLY-THR-SER-CYS-GLU-ASN-ARG-ILE-CYS-GLU-CYS-ASP-LYS-ALA-ALA-ALA-ILE-CYS-PHE-ARG-GLN-ASN-LEU-ASN-THR-TYR-SER-LYS-LYS-TYR-MET-LEU-TYR-PRO-ASP-PHE-LEU-CYS-LYS-GLY-GLU-LEU-LYS-CYS,LEU-ALA-ILE-TYR-SER,121,5,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C)C,Ki=1.01uM,5.995679,6.0,1,A,A,1,A,A,0,,P,A,dimer,1,1,121,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.86712247133255,0.777965247631073,95.9048843383789,94.72566223144533,0.3232716619968414,0.6694226264953613,0.9376211762428284,0.8848763108253479,0.8246961832046509,0.7512374520301819,LAIYS,Low,"(5.959, 6.097]",val
1JQ9,protein-peptide,P59071,SLLEFGKMILEETGKLAIPSYSSYGCYCGWGGKGTPKDATDRCCFVHDCCYGNLPDCNPKSDRYKYKRVNGAIVCEKGTSCENRICECDKAAAICFRQNLNTYSKKYMLYPDFLCKGELKC,FLSYK,SER-LEU-LEU-GLU-PHE-GLY-LYS-MET-ILE-LEU-GLU-GLU-THR-GLY-LYS-LEU-ALA-ILE-PRO-SER-TYR-SER-SER-TYR-GLY-CYS-TYR-CYS-GLY-TRP-GLY-GLY-LYS-GLY-THR-PRO-LYS-ASP-ALA-THR-ASP-ARG-CYS-CYS-PHE-VAL-HIS-ASP-CYS-CYS-TYR-GLY-ASN-LEU-PRO-ASP-CYS-ASN-PRO-LYS-SER-ASP-ARG-TYR-LYS-TYR-LYS-ARG-VAL-ASN-GLY-ALA-ILE-VAL-CYS-GLU-LYS-GLY-THR-SER-CYS-GLU-ASN-ARG-ILE-CYS-GLU-CYS-ASP-LYS-ALA-ALA-ALA-ILE-CYS-PHE-ARG-GLN-ASN-LEU-ASN-THR-TYR-SER-LYS-LYS-TYR-MET-LEU-TYR-PRO-ASP-PHE-LEU-CYS-LYS-GLY-GLU-LEU-LYS-CYS,PHE-LEU-SER-TYR-LYS,121,5,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(C)C,Kd=3.57nM,8.447332,8.45,1,A,A,1,A,A,0,,P,A,dimer,0,1,121,5,0,CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9132559895515442,0.8058422207832336,94.44446563720705,93.7128448486328,0.3068872094154358,0.6010532975196838,0.9410769939422609,0.8889644145965576,0.8814991116523743,0.7850615978240967,FLSYK,Moderate,"(8.383, 8.824]",train
1JUQ,protein-peptide,P20645 Q9NZ52,GAMGSMAEAEGESLESWLNKATNPSNRQEDWEYIIGFCDQINKELEGPQIAVRLLAHKIQSPQEWEALQALTVLEACMKNCGRRFHNEVGKFRFLNELIKVVSPKYLGDRVSEKVKTKVIELLYSWTMALPEEAKIKDAYHMLKRQGIVQSDPPIPVDRTLIPSPPPRPKN,EESEERDDHLLPM,GLY-ALA-MSE-GLY-SER-MSE-ALA-GLU-ALA-GLU-GLY-GLU-SER-LEU-GLU-SER-TRP-LEU-ASN-LYS-ALA-THR-ASN-PRO-SER-ASN-ARG-GLN-GLU-ASP-TRP-GLU-TYR-ILE-ILE-GLY-PHE-CYS-ASP-GLN-ILE-ASN-LYS-GLU-LEU-GLU-GLY-PRO-GLN-ILE-ALA-VAL-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-LEU-GLN-ALA-LEU-THR-VAL-LEU-GLU-ALA-CYS-MSE-LYS-ASN-CYS-GLY-ARG-ARG-PHE-HIS-ASN-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-ASP-ARG-VAL-SER-GLU-LYS-VAL-LYS-THR-LYS-VAL-ILE-GLU-LEU-LEU-TYR-SER-TRP-THR-MSE-ALA-LEU-PRO-GLU-GLU-ALA-LYS-ILE-LYS-ASP-ALA-TYR-HIS-MSE-LEU-LYS-ARG-GLN-GLY-ILE-VAL-GLN-SER-ASP-PRO-PRO-ILE-PRO-VAL-ASP-ARG-THR-LEU-ILE-PRO-SER-PRO-PRO-PRO-ARG-PRO-LYS-ASN,GLU-GLU-SER-GLU-GLU-ARG-ASP-ASP-HIS-LEU-LEU-PRO-MET,171,13,O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)Cc1[nH]cnc1)CC(C)C)CC(C)C,Kd=56uM,4.251812,4.25,1,A,A,1,A,A,0,,E,A,,1,1,171,13,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9557285904884338,0.922757089138031,90.87730407714844,84.43627166748047,0.3608892560005188,0.6361187100410461,0.9051197171211244,0.8792935609817505,0.8698753118515015,0.8422486186027527,EESEERDDHLLPM,Low,"(4.155, 4.319]",train
1JYC,protein-peptide,P02866,ADTIVAVELDTYPNTDIGDPSYPHIGIDIKSVRSKKTAKWNMQNGKVGTAHIIYNSVDKRLSAVVSYPNADSATVSYDVDLDNVLPEWVRVGLSASTGLYKETNTILSWSFTSKLKSNSTHETNALHFMFNQFSKDQKDLILQGDATTGTDGNLELTRVSSNGSPQGSSVGRALFYAPVHIWESSAVVASFEATFTFLIKSPDSHPADGIAFFISNIDSSIPSGSTGRLLGLFPDAN,RVWYPYGSYLTASGS,ALA-ASP-THR-ILE-VAL-ALA-VAL-GLU-LEU-ASP-THR-TYR-PRO-ASN-THR-ASP-ILE-GLY-ASP-PRO-SER-TYR-PRO-HIS-ILE-GLY-ILE-ASP-ILE-LYS-SER-VAL-ARG-SER-LYS-LYS-THR-ALA-LYS-TRP-ASN-MET-GLN-ASN-GLY-LYS-VAL-GLY-THR-ALA-HIS-ILE-ILE-TYR-ASN-SER-VAL-ASP-LYS-ARG-LEU-SER-ALA-VAL-VAL-SER-TYR-PRO-ASN-ALA-ASP-SER-ALA-THR-VAL-SER-TYR-ASP-VAL-ASP-LEU-ASP-ASN-VAL-LEU-PRO-GLU-TRP-VAL-ARG-VAL-GLY-LEU-SER-ALA-SER-THR-GLY-LEU-TYR-LYS-GLU-THR-ASN-THR-ILE-LEU-SER-TRP-SER-PHE-THR-SER-LYS-LEU-LYS-SER-ASN-SER-THR-HIS-GLU-THR-ASN-ALA-LEU-HIS-PHE-MET-PHE-ASN-GLN-PHE-SER-LYS-ASP-GLN-LYS-ASP-LEU-ILE-LEU-GLN-GLY-ASP-ALA-THR-THR-GLY-THR-ASP-GLY-ASN-LEU-GLU-LEU-THR-ARG-VAL-SER-SER-ASN-GLY-SER-PRO-GLN-GLY-SER-SER-VAL-GLY-ARG-ALA-LEU-PHE-TYR-ALA-PRO-VAL-HIS-ILE-TRP-GLU-SER-SER-ALA-VAL-VAL-ALA-SER-PHE-GLU-ALA-THR-PHE-THR-PHE-LEU-ILE-LYS-SER-PRO-ASP-SER-HIS-PRO-ALA-ASP-GLY-ILE-ALA-PHE-PHE-ILE-SER-ASN-ILE-ASP-SER-SER-ILE-PRO-SER-GLY-SER-THR-GLY-ARG-LEU-LEU-GLY-LEU-PHE-PRO-ASP-ALA-ASN,ARG-VAL-TRP-TYR-PRO-TYR-GLY-SER-TYR-LEU-THR-ALA-SER-GLY-SER,237,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CO)CO)C)[C@H](O)C)CC(C)C)Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1ccc(cc1)O)Cc1ccc(cc1)O,Kd=0.046mM,4.337242,4.34,1,A,A,1,A,A,0,,P,A,,1,1,237,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.8866709470748901,0.8331620097160339,87.45246887207031,88.1091537475586,0.4015271961688995,0.6731748580932617,0.9359886050224304,0.903950572013855,0.8371391296386719,0.8154648542404175,RVWYPYGSYLTASGS,Low,"(4.319, 4.456]",train
1JYI,protein-peptide,P02866,ADTIVAVELDTYPNTDIGDPSYPHIGIDIKSVRSKKTAKWNMQNGKVGTAHIIYNSVDKRLSAVVSYPNADSATVSYDVDLDNVLPEWVRVGLSASTGLYKETNTILSWSFTSKLKSNSTHETNALHFMFNQFSKDQKDLILQGDATTGTDGNLELTRVSSNGSPQGSSVGRALFYAPVHIWESSAVVASFEATFTFLIKSPDSHPADGIAFFISNIDSSIPSGSTGRLLGLFPDAN,DVFYPYPYASGS,ALA-ASP-THR-ILE-VAL-ALA-VAL-GLU-LEU-ASP-THR-TYR-PRO-ASN-THR-ASP-ILE-GLY-ASP-PRO-SER-TYR-PRO-HIS-ILE-GLY-ILE-ASP-ILE-LYS-SER-VAL-ARG-SER-LYS-LYS-THR-ALA-LYS-TRP-ASN-MET-GLN-ASN-GLY-LYS-VAL-GLY-THR-ALA-HIS-ILE-ILE-TYR-ASN-SER-VAL-ASP-LYS-ARG-LEU-SER-ALA-VAL-VAL-SER-TYR-PRO-ASN-ALA-ASP-SER-ALA-THR-VAL-SER-TYR-ASP-VAL-ASP-LEU-ASP-ASN-VAL-LEU-PRO-GLU-TRP-VAL-ARG-VAL-GLY-LEU-SER-ALA-SER-THR-GLY-LEU-TYR-LYS-GLU-THR-ASN-THR-ILE-LEU-SER-TRP-SER-PHE-THR-SER-LYS-LEU-LYS-SER-ASN-SER-THR-HIS-GLU-THR-ASN-ALA-LEU-HIS-PHE-MET-PHE-ASN-GLN-PHE-SER-LYS-ASP-GLN-LYS-ASP-LEU-ILE-LEU-GLN-GLY-ASP-ALA-THR-THR-GLY-THR-ASP-GLY-ASN-LEU-GLU-LEU-THR-ARG-VAL-SER-SER-ASN-GLY-SER-PRO-GLN-GLY-SER-SER-VAL-GLY-ARG-ALA-LEU-PHE-TYR-ALA-PRO-VAL-HIS-ILE-TRP-GLU-SER-SER-ALA-VAL-VAL-ALA-SER-PHE-GLU-ALA-THR-PHE-THR-PHE-LEU-ILE-LYS-SER-PRO-ASP-SER-HIS-PRO-ALA-ASP-GLY-ILE-ALA-PHE-PHE-ILE-SER-ASN-ILE-ASP-SER-SER-ILE-PRO-SER-GLY-SER-THR-GLY-ARG-LEU-LEU-GLY-LEU-PHE-PRO-ASP-ALA-ASN,ASP-VAL-PHE-TYR-PRO-TYR-PRO-TYR-ALA-SER-GLY-SER,237,12,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)[NH3+])Cc1ccccc1)Cc1ccc(cc1)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C,IC50=100uM,4.0,4.0,1,A,A,1,A,A,0,,P,A,,1,1,237,12,0,CC(C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NCC(=O)O,0.8968448638916016,0.7417139410972595,90.2047882080078,86.15323638916016,0.3729119002819061,0.7911168932914734,0.9442052841186525,0.8654526472091675,0.8548843264579773,0.7107792496681213,DVFYPYPYASGS,Low,"(3.924, 4.155]",train
1KA7,protein-peptide,O60880 Q13291,MDAVAVYHGKISRETGEKLLLATGLDGSYLLRDSESVPGVYCLCVLYHGYIYTYRVSQTETGSWSAETAPGVHKRYFRKIKNLISAFQKPDQGIVIPLQYPVEKKSSARSTQGTTGIREDPDVCLKAP,RKSLTIYAQVQK,MET-ASP-ALA-VAL-ALA-VAL-TYR-HIS-GLY-LYS-ILE-SER-ARG-GLU-THR-GLY-GLU-LYS-LEU-LEU-LEU-ALA-THR-GLY-LEU-ASP-GLY-SER-TYR-LEU-LEU-ARG-ASP-SER-GLU-SER-VAL-PRO-GLY-VAL-TYR-CYS-LEU-CYS-VAL-LEU-TYR-HIS-GLY-TYR-ILE-TYR-THR-TYR-ARG-VAL-SER-GLN-THR-GLU-THR-GLY-SER-TRP-SER-ALA-GLU-THR-ALA-PRO-GLY-VAL-HIS-LYS-ARG-TYR-PHE-ARG-LYS-ILE-LYS-ASN-LEU-ILE-SER-ALA-PHE-GLN-LYS-PRO-ASP-GLN-GLY-ILE-VAL-ILE-PRO-LEU-GLN-TYR-PRO-VAL-GLU-LYS-LYS-SER-SER-ALA-ARG-SER-THR-GLN-GLY-THR-THR-GLY-ILE-ARG-GLU-ASP-PRO-ASP-VAL-CYS-LEU-LYS-ALA-PRO,ARG-LYS-SER-LEU-THR-ILE-TYR-ALA-GLN-VAL-GLN-LYS,128,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC(=O)N)C(C)C)CCC(=O)N)C)Cc1ccc(cc1)O)[C@H](CC)C)[C@H](O)C)CC(C)C)CO)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=0.60uM,6.221849,6.22,1,A,A,1,A,A,0,,B,A,,1,1,128,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.9403305053710938,0.8711667060852051,86.44542694091797,70.61744689941406,0.4102621674537658,0.7043850421905518,0.8550796508789062,0.8109555840492249,0.8366432189941406,0.7739147543907166,RKSLTIYAQVQK,Low,"(6.097, 6.26]",train
1KAT,protein-peptide,P15692,HHEVVKFMDVYQRSYCHPIETLVDIFQEYPDEIEYIFKPSCVPLMRCGGCCNDEGLECVPTEESNITMQIMRIKPHQGQHIGEMSFLQHNKCECRPKKD,GGNECDIARMWEWECFERL,HIS-HIS-GLU-VAL-VAL-LYS-PHE-MET-ASP-VAL-TYR-GLN-ARG-SER-TYR-CYS-HIS-PRO-ILE-GLU-THR-LEU-VAL-ASP-ILE-PHE-GLN-GLU-TYR-PRO-ASP-GLU-ILE-GLU-TYR-ILE-PHE-LYS-PRO-SER-CYS-VAL-PRO-LEU-MET-ARG-CYS-GLY-GLY-CYS-CYS-ASN-ASP-GLU-GLY-LEU-GLU-CYS-VAL-PRO-THR-GLU-GLU-SER-ASN-ILE-THR-MET-GLN-ILE-MET-ARG-ILE-LYS-PRO-HIS-GLN-GLY-GLN-HIS-ILE-GLY-GLU-MET-SER-PHE-LEU-GLN-HIS-ASN-LYS-CYS-GLU-CYS-ARG-PRO-LYS-LYS-ASP,GLY-GLY-ASN-GLU-CYS-ASP-ILE-ALA-ARG-MET-TRP-GLU-TRP-GLU-CYS-PHE-GLU-ARG-LEU,99,19,CSCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c2c1cccc2)CCC(=O)O)Cc1c[nH]c2c1cccc2)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CC(=O)N)CCC(=O)O)[C@H](CC)C,IC50=1.0uM,6.0,6.0,1,A,A,1,A,A,0,,X,V,dimer,1,1,99,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)O)C(=O)O)C(=O)O,0.8430135250091553,0.4887409806251526,80.16741943359375,78.64734649658203,0.4157848060131073,1.2521917819976809,0.7978327870368958,0.5781694054603577,0.700706958770752,0.4095656871795654,GGNECDIARMWEWECFERL,Low,"(5.959, 6.097]",train
1KL3,protein-peptide,P22629,MEAGITGTWYNQLGSTFIVTAGADGALTGTYVTARGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAAS,NWSHPQFEK,MET-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-VAL-THR-ALA-ARG-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER,ASN-TRP-SER-HIS-PRO-GLN-PHE-GLU-LYS,127,9,O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1[nH]cnc1)CCC(=O)N)Cc1ccccc1)CCC(=O)O,Kd=1.37uM,5.863279,5.86,1,A,A,1,A,A,0,,E,A,dimer,1,1,127,9,0,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(N)=O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8935788869857788,0.8853020668029785,92.60142517089844,90.56346893310548,0.4108381271362304,0.6123175024986267,0.8905606865882874,0.8804157972335815,0.8437819480895996,0.8471535444259644,NWSHPQFEK,Low,"(5.821, 5.959]",val
1KL5,protein-peptide,P22629,MEAGITGTWYNQLGSTFIVTAGADGALTGTYIGARGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAAS,NWSHPQFEK,MET-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-ILE-GLY-ALA-ARG-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER,ASN-TRP-SER-HIS-PRO-GLN-PHE-GLU-LYS,127,9,O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1[nH]cnc1)CCC(=O)N)Cc1ccccc1,Kd=1.02uM,5.9914,5.99,1,A,A,1,A,A,0,,E,A,dimer,1,1,127,9,0,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(N)=O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9203073382377625,0.8251031041145325,91.43704223632812,88.70709991455078,0.4242335259914398,0.6765706539154053,0.8863353133201599,0.8627563118934631,0.8460797071456909,0.8156898021697998,NWSHPQFEK,Low,"(5.959, 6.097]",val
1L0A,protein-peptide,Q13114 Q92844,NTGLLESQLSRHDQMLSVHDIRLADMDLRFQVLETASYNGVLIWKIRDYKRRKQEAVMGKTLSLYSQPFYTGYFGYKMCARVYLNGDGMGKGTHLSLFFVIMRGEYDALLPWPFKQKVTLMLMDQGSSRRHLGDAFKPDPNSSSFKKPTGEMNIASGCPVFVAQTVLENGTYIKDDTIFIKVIVDTSDLPDP,SVPIQCTDKTDKQEALFK,ASN-THR-GLY-LEU-LEU-GLU-SER-GLN-LEU-SER-ARG-HIS-ASP-GLN-MET-LEU-SER-VAL-HIS-ASP-ILE-ARG-LEU-ALA-ASP-MET-ASP-LEU-ARG-PHE-GLN-VAL-LEU-GLU-THR-ALA-SER-TYR-ASN-GLY-VAL-LEU-ILE-TRP-LYS-ILE-ARG-ASP-TYR-LYS-ARG-ARG-LYS-GLN-GLU-ALA-VAL-MET-GLY-LYS-THR-LEU-SER-LEU-TYR-SER-GLN-PRO-PHE-TYR-THR-GLY-TYR-PHE-GLY-TYR-LYS-MET-CYS-ALA-ARG-VAL-TYR-LEU-ASN-GLY-ASP-GLY-MET-GLY-LYS-GLY-THR-HIS-LEU-SER-LEU-PHE-PHE-VAL-ILE-MET-ARG-GLY-GLU-TYR-ASP-ALA-LEU-LEU-PRO-TRP-PRO-PHE-LYS-GLN-LYS-VAL-THR-LEU-MET-LEU-MET-ASP-GLN-GLY-SER-SER-ARG-ARG-HIS-LEU-GLY-ASP-ALA-PHE-LYS-PRO-ASP-PRO-ASN-SER-SER-SER-PHE-LYS-LYS-PRO-THR-GLY-GLU-MET-ASN-ILE-ALA-SER-GLY-CYS-PRO-VAL-PHE-VAL-ALA-GLN-THR-VAL-LEU-GLU-ASN-GLY-THR-TYR-ILE-LYS-ASP-ASP-THR-ILE-PHE-ILE-LYS-VAL-ILE-VAL-ASP-THR-SER-ASP-LEU-PRO-ASP-PRO,SER-VAL-PRO-ILE-GLN-CYS-THR-ASP-LYS-THR-ASP-LYS-GLN-GLU-ALA-LEU-PHE-LYS,192,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])Cc1ccccc1)CC(C)C)C)CCC(=O)O)CCC(=O)N)CCCC[NH3+])CC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@H](CO)[NH3+])CCC(=O)N)CS)CC(=O)O,Kd=23.9uM,4.621602,4.62,1,A,A,1,A,A,0,,B,A,,1,1,192,18,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.7799394130706787,0.8829547762870789,84.46299743652344,87.99068450927734,0.4594186246395111,0.6527231335639954,0.837321400642395,0.8752432465553284,0.7120223641395569,0.8425649404525757,SVPIQCTDKTDKQEALFK,Low,"(4.606, 4.745]",val
1L2Z,protein-peptide,O95400 P06729,DVMWEYKWENTGDAELYGPFTSAQMQTWVSEGYFPDGVYCRKLDPPGGQFYNSKRIDFDLYT,SHRPPPPGHRV,ASP-VAL-MET-TRP-GLU-TYR-LYS-TRP-GLU-ASN-THR-GLY-ASP-ALA-GLU-LEU-TYR-GLY-PRO-PHE-THR-SER-ALA-GLN-MET-GLN-THR-TRP-VAL-SER-GLU-GLY-TYR-PHE-PRO-ASP-GLY-VAL-TYR-CYS-ARG-LYS-LEU-ASP-PRO-PRO-GLY-GLY-GLN-PHE-TYR-ASN-SER-LYS-ARG-ILE-ASP-PHE-ASP-LEU-TYR-THR,SER-HIS-ARG-PRO-PRO-PRO-PRO-GLY-HIS-ARG-VAL,62,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CCC[NH+]=C(N)N)Cc1c[nH]cn1)[NH3+],Kd=203uM,3.692504,3.69,1,A,A,1,A,A,0,,B,A,,1,1,62,11,0,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8260485529899597,0.703689455986023,96.89265441894533,93.47517395019533,0.3490316569805145,0.6475362777709961,0.8638177514076233,0.7837942242622375,0.7224280834197998,0.6836632490158081,SHRPPPPGHRV,Low,"(3.548, 3.924]",train
1LB6,protein-peptide,Q9Y4K3 P25942,QQCNGIYIWKIGNFGMHLKCQEEEKPVVIHSPGFYTGKPGYKLCMRLHLQLPTAQRCANYISLFVHTMQGEYDSHLPWPFQGTIRLTILDQSEAPVRQNHEEIMDAKPELLAFQRPTIPRNPKGFGYVTFMHLEALRQRTFIKDDTLLVRCEVSTRFDLE,KQEPQEIDF,GLN-GLN-CYS-ASN-GLY-ILE-TYR-ILE-TRP-LYS-ILE-GLY-ASN-PHE-GLY-MET-HIS-LEU-LYS-CYS-GLN-GLU-GLU-GLU-LYS-PRO-VAL-VAL-ILE-HIS-SER-PRO-GLY-PHE-TYR-THR-GLY-LYS-PRO-GLY-TYR-LYS-LEU-CYS-MET-ARG-LEU-HIS-LEU-GLN-LEU-PRO-THR-ALA-GLN-ARG-CYS-ALA-ASN-TYR-ILE-SER-LEU-PHE-VAL-HIS-THR-MET-GLN-GLY-GLU-TYR-ASP-SER-HIS-LEU-PRO-TRP-PRO-PHE-GLN-GLY-THR-ILE-ARG-LEU-THR-ILE-LEU-ASP-GLN-SER-GLU-ALA-PRO-VAL-ARG-GLN-ASN-HIS-GLU-GLU-ILE-MET-ASP-ALA-LYS-PRO-GLU-LEU-LEU-ALA-PHE-GLN-ARG-PRO-THR-ILE-PRO-ARG-ASN-PRO-LYS-GLY-PHE-GLY-TYR-VAL-THR-PHE-MET-HIS-LEU-GLU-ALA-LEU-ARG-GLN-ARG-THR-PHE-ILE-LYS-ASP-ASP-THR-LEU-LEU-VAL-ARG-CYS-GLU-VAL-SER-THR-ARG-PHE-ASP-LEU-GLU,LYS-GLN-GLU-PRO-GLN-GLU-ILE-ASP-PHE,160,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(=O)O)[C@H](CC)C)CCC(=O)O)CCC(=O)N)CCC(=O)O)CCC(=O)N)[NH3+],Kd=84uM,4.075721,4.08,1,A,A,1,A,A,0,,B,A,,1,1,160,9,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9549102187156676,0.9208617806434632,96.0677490234375,91.6750259399414,0.3257984519004822,0.4721265435218811,0.9347169399261476,0.9301183223724364,0.9266744256019592,0.9185476303100586,KQEPQEIDF,Low,"(3.924, 4.155]",train
1LCJ,protein-peptide,P03079 P06239,MANSLEPEPWFFKNLSRKDAERQLLAPGNTHGSFLIRESESTAGSFSLSVRDFDQNQGEVVKHYKIRNLDNGGFYISPRITFPGLHELVRHYTNASDGLCTRLSRPCQT,EPQYEEIPIYL,MET-ALA-ASN-SER-LEU-GLU-PRO-GLU-PRO-TRP-PHE-PHE-LYS-ASN-LEU-SER-ARG-LYS-ASP-ALA-GLU-ARG-GLN-LEU-LEU-ALA-PRO-GLY-ASN-THR-HIS-GLY-SER-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-THR-ALA-GLY-SER-PHE-SER-LEU-SER-VAL-ARG-ASP-PHE-ASP-GLN-ASN-GLN-GLY-GLU-VAL-VAL-LYS-HIS-TYR-LYS-ILE-ARG-ASN-LEU-ASP-ASN-GLY-GLY-PHE-TYR-ILE-SER-PRO-ARG-ILE-THR-PHE-PRO-GLY-LEU-HIS-GLU-LEU-VAL-ARG-HIS-TYR-THR-ASN-ALA-SER-ASP-GLY-LEU-CYS-THR-ARG-LEU-SER-ARG-PRO-CYS-GLN-THR,GLU-PRO-GLN-PTR-GLU-GLU-ILE-PRO-ILE-TYR-LEU,109,11,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccc(cc1)O)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)N)Cc1ccc(cc1)O)CCC(=O)O)CCC(=O)O)C,Kd=1nM,9.0,9.0,1,A,A,1,A,A,0,,B,A,,1,1,109,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9488551020622252,0.818178117275238,95.40239715576172,92.1090850830078,0.3276954293251037,0.6040409207344055,0.92699134349823,0.8724855184555054,0.8866126537322998,0.80460125207901,EPQYEEIPIYL,High,"(8.824, 12.12]",train
1LXH,protein-peptide,P01391 P02710,IRCFITPDITSKDCPNGHVCYTKTWCDAFCSIRGKRVDLGCAATCPTVKTGVDIQCCSTDNCNPFPTRKRP,YRGWKHWVYYTCCPDTPYS,ILE-ARG-CYS-PHE-ILE-THR-PRO-ASP-ILE-THR-SER-LYS-ASP-CYS-PRO-ASN-GLY-HIS-VAL-CYS-TYR-THR-LYS-THR-TRP-CYS-ASP-ALA-PHE-CYS-SER-ILE-ARG-GLY-LYS-ARG-VAL-ASP-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-THR-VAL-LYS-THR-GLY-VAL-ASP-ILE-GLN-CYS-CYS-SER-THR-ASP-ASN-CYS-ASN-PRO-PHE-PRO-THR-ARG-LYS-ARG-PRO,TYR-ARG-GLY-TRP-LYS-HIS-TRP-VAL-TYR-TYR-THR-CYS-CYS-PRO-ASP-THR-PRO-TYR-HSL,71,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]1CSSC[C@H](NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)[C@H](O)C)CC(=O)O)[C@H](O)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C(C)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCC[NH+]=C(N)N,Kd=65nM,7.187087,7.19,1,A,A,1,A,A,0,,B,A,,0,1,71,19,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(C)C)[C@@H](C)CC)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.7324091792106628,0.4560763835906982,55.265262603759766,46.036231994628906,0.722745954990387,1.3150367736816406,0.6836721897125244,0.4956706464290619,0.577926754951477,0.4461778104305267,YRGWKHWVYYTCCPDTPYS,Moderate,"(7.049, 7.268]",train
1MF4,protein-peptide,P60045,NLYQFKNMIQCTVPSRSWADFADYGCYCGKGGSGTPVDDLDRCCQTHDNCYNEAENISGCRPYFKTYSYECTQGTLTCKGDNNACAASVCDCDRLAAICFAGAPYNDANYNIDLKARCN,VAFRS,ASN-LEU-TYR-GLN-PHE-LYS-ASN-MET-ILE-GLN-CYS-THR-VAL-PRO-SER-ARG-SER-TRP-ALA-ASP-PHE-ALA-ASP-TYR-GLY-CYS-TYR-CYS-GLY-LYS-GLY-GLY-SER-GLY-THR-PRO-VAL-ASP-ASP-LEU-ASP-ARG-CYS-CYS-GLN-THR-HIS-ASP-ASN-CYS-TYR-ASN-GLU-ALA-GLU-ASN-ILE-SER-GLY-CYS-ARG-PRO-TYR-PHE-LYS-THR-TYR-SER-TYR-GLU-CYS-THR-GLN-GLY-THR-LEU-THR-CYS-LYS-GLY-ASP-ASN-ASN-ALA-CYS-ALA-ALA-SER-VAL-CYS-ASP-CYS-ASP-ARG-LEU-ALA-ALA-ILE-CYS-PHE-ALA-GLY-ALA-PRO-TYR-ASN-ASP-ALA-ASN-TYR-ASN-ILE-ASP-LEU-LYS-ALA-ARG-CYS-ASN,VAL-ALA-PHE-ARG-SER,119,5,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])C)CCC[NH+]=C(N)N,Ki=10.2nM,7.9914,7.99,1,A,A,1,A,A,0,,B,A,,1,1,119,5,0,CC(C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)O,0.8885219097137451,0.8349562287330627,97.4158706665039,94.45492553710938,0.3177769482135772,0.5342462658882141,0.9287554621696472,0.9016268849372864,0.8532619476318359,0.8182885050773621,VAFRS,Moderate,"(7.921, 8.383]",train
1MFG,protein-peptide,Q96RT1 P04626,GSMEIRVRVEKDPELGFSISGGVGGRGNPFRPDDDGIFVTRVQPEGPASKLLQPGDKIIQANGYSFINIEHGQAVSLLKTFQNTVELIIVREVSS,EYLGLDVPV,GLY-SER-MET-GLU-ILE-ARG-VAL-ARG-VAL-GLU-LYS-ASP-PRO-GLU-LEU-GLY-PHE-SER-ILE-SER-GLY-GLY-VAL-GLY-GLY-ARG-GLY-ASN-PRO-PHE-ARG-PRO-ASP-ASP-ASP-GLY-ILE-PHE-VAL-THR-ARG-VAL-GLN-PRO-GLU-GLY-PRO-ALA-SER-LYS-LEU-LEU-GLN-PRO-GLY-ASP-LYS-ILE-ILE-GLN-ALA-ASN-GLY-TYR-SER-PHE-ILE-ASN-ILE-GLU-HIS-GLY-GLN-ALA-VAL-SER-LEU-LEU-LYS-THR-PHE-GLN-ASN-THR-VAL-GLU-LEU-ILE-ILE-VAL-ARG-GLU-VAL-SER-SER,GLU-TYR-LEU-GLY-LEU-ASP-VAL-PRO-VAL,95,9,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccc(cc1)O)CC(C)C)C,Kd=50uM,4.30103,4.3,1,A,A,1,A,A,0,,B,A,,1,1,95,9,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.948574960231781,0.7699967622756958,97.37864685058594,93.1582260131836,0.3109679818153381,0.6439279317855835,0.9328169226646424,0.8516533374786377,0.8984279632568359,0.7495825886726379,EYLGLDVPV,Low,"(4.155, 4.319]",train
1MQ1,protein-peptide,P52907 P04271,SELEKAMVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDNDGDGECDFQEFMAFVAMVTTACHEFFEHE,TRTKIDWNKILS,SER-GLU-LEU-GLU-LYS-ALA-MET-VAL-ALA-LEU-ILE-ASP-VAL-PHE-HIS-GLN-TYR-SER-GLY-ARG-GLU-GLY-ASP-LYS-HIS-LYS-LEU-LYS-LYS-SER-GLU-LEU-LYS-GLU-LEU-ILE-ASN-ASN-GLU-LEU-SER-HIS-PHE-LEU-GLU-GLU-ILE-LYS-GLU-GLN-GLU-VAL-VAL-ASP-LYS-VAL-MET-GLU-THR-LEU-ASP-ASN-ASP-GLY-ASP-GLY-GLU-CYS-ASP-PHE-GLN-GLU-PHE-MET-ALA-PHE-VAL-ALA-MET-VAL-THR-THR-ALA-CYS-HIS-GLU-PHE-PHE-GLU-HIS-GLU,THR-ARG-THR-LYS-ILE-ASP-TRP-ASN-LYS-ILE-LEU-SER,91,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)CCCC[NH3+])CC(=O)N)Cc1c[nH]c2c1cccc2)CC(=O)O)[C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCC[NH+]=C(N)N,Kd=260nM,6.585027,6.59,1,A,A,1,A,A,0,,C,A,dimer,1,1,91,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8678675889968872,0.7470155358314514,72.73886108398438,78.81652069091797,0.379686951637268,0.7746779918670654,0.8681530952453613,0.8167387843132019,0.7949805855751038,0.7295846939086914,TRTKIDWNKILS,Low,"(6.523, 6.696]",train
1MV0,protein-peptide,O00499 P01106,GRLDLPPGFMFKVQAQHDYTATDTDELQLKAGDVVLVIPFQNPEEQDEGWLMGVKESDWNQHKKLEKCRGVFPENFTERVP,LLPTPPLSPSRRSG,GLY-ARG-LEU-ASP-LEU-PRO-PRO-GLY-PHE-MET-PHE-LYS-VAL-GLN-ALA-GLN-HIS-ASP-TYR-THR-ALA-THR-ASP-THR-ASP-GLU-LEU-GLN-LEU-LYS-ALA-GLY-ASP-VAL-VAL-LEU-VAL-ILE-PRO-PHE-GLN-ASN-PRO-GLU-GLU-GLN-ASP-GLU-GLY-TRP-LEU-MET-GLY-VAL-LYS-GLU-SER-ASP-TRP-ASN-GLN-HIS-LYS-LYS-LEU-GLU-LYS-CYS-ARG-GLY-VAL-PHE-PRO-GLU-ASN-PHE-THR-GLU-ARG-VAL-PRO,LEU-LEU-PRO-THR-PRO-PRO-LEU-SER-PRO-SER-ARG-ARG-SER-GLY,81,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CO)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CC(C)C,Kd=0.0933mM,4.030118,4.03,1,A,A,1,A,A,0,,A,B,,1,1,81,14,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O,0.8533409833908081,0.8527212142944336,91.73922729492188,86.38392639160156,0.388565182685852,0.5396304130554199,0.8651950359344482,0.8772017359733582,0.7582721710205078,0.8466010689735413,LLPTPPLSPSRRSG,Low,"(3.924, 4.155]",train
1MWN,protein-peptide,P04631 P52907,MSELEKAMVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDEDGDGECDFQEFMAFVSMVTTACHEFFEHE,TRTKIDWNKILS,MET-SER-GLU-LEU-GLU-LYS-ALA-MET-VAL-ALA-LEU-ILE-ASP-VAL-PHE-HIS-GLN-TYR-SER-GLY-ARG-GLU-GLY-ASP-LYS-HIS-LYS-LEU-LYS-LYS-SER-GLU-LEU-LYS-GLU-LEU-ILE-ASN-ASN-GLU-LEU-SER-HIS-PHE-LEU-GLU-GLU-ILE-LYS-GLU-GLN-GLU-VAL-VAL-ASP-LYS-VAL-MET-GLU-THR-LEU-ASP-GLU-ASP-GLY-ASP-GLY-GLU-CYS-ASP-PHE-GLN-GLU-PHE-MET-ALA-PHE-VAL-SER-MET-VAL-THR-THR-ALA-CYS-HIS-GLU-PHE-PHE-GLU-HIS-GLU,THR-ARG-THR-LYS-ILE-ASP-TRP-ASN-LYS-ILE-LEU-SER,92,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)CCCC[NH3+])CC(=O)N)Cc1c[nH]c2c1cccc2)CC(=O)O)[C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCC[NH+]=C(N)N,Kd=200nM,6.69897,6.7,1,A,A,1,A,A,0,,X,A,,1,1,92,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.888827919960022,0.6897249221801758,74.21057891845703,79.91529083251953,0.3752447366714477,0.8589406609535217,0.8715066909790039,0.7848701477050781,0.8150331974029541,0.6659386157989502,TRTKIDWNKILS,Low,"(6.696, 6.824]",train
1N5Z,protein-peptide,P53112 P80667,ISEFGSEPIDPSKLEFARALYDFVPENPEMEVALKKGDLMAILSKKDPLGRDSDWWKVRTKNGNIGYIPYNYIEIIKRRKKIEHVDDETRTH,EAMPPTLPHRDWKD,ILE-SER-GLU-PHE-GLY-SER-GLU-PRO-ILE-ASP-PRO-SER-LYS-LEU-GLU-PHE-ALA-ARG-ALA-LEU-TYR-ASP-PHE-VAL-PRO-GLU-ASN-PRO-GLU-MET-GLU-VAL-ALA-LEU-LYS-LYS-GLY-ASP-LEU-MET-ALA-ILE-LEU-SER-LYS-LYS-ASP-PRO-LEU-GLY-ARG-ASP-SER-ASP-TRP-TRP-LYS-VAL-ARG-THR-LYS-ASN-GLY-ASN-ILE-GLY-TYR-ILE-PRO-TYR-ASN-TYR-ILE-GLU-ILE-ILE-LYS-ARG-ARG-LYS-LYS-ILE-GLU-HIS-VAL-ASP-ASP-GLU-THR-ARG-THR-HIS,GLU-ALA-MET-PRO-PRO-THR-LEU-PRO-HIS-ARG-ASP-TRP-LYS-ASP,92,14,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CC(=O)O)CCC[NH+]=C(N)N)Cc1[nH]cnc1)CC(C)C)[C@H](O)C)[NH3+],Kd=44uM,4.356547,4.36,1,A,A,1,A,A,0,,P,A,,1,1,92,14,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,1.001462459564209,0.856751561164856,81.01791381835938,77.37891387939453,0.4087681174278259,0.8303210735321045,0.8016915321350098,0.7602398991584778,0.8273486495018005,0.7042490243911743,EAMPPTLPHRDWKD,Low,"(4.319, 4.456]",val
1N7T,protein-peptide,Q96RT1,GSHMGHELAKQEIRVRVEKDPELGFSISGGVGGRGNPFRPDDDGIFVTRVQPEGPASKLLQPGDKIIQANGYSFINIEHGQAVSLLKTFQNTVELIIVREVSS,TGWETWV,GLY-SER-HIS-MET-GLY-HIS-GLU-LEU-ALA-LYS-GLN-GLU-ILE-ARG-VAL-ARG-VAL-GLU-LYS-ASP-PRO-GLU-LEU-GLY-PHE-SER-ILE-SER-GLY-GLY-VAL-GLY-GLY-ARG-GLY-ASN-PRO-PHE-ARG-PRO-ASP-ASP-ASP-GLY-ILE-PHE-VAL-THR-ARG-VAL-GLN-PRO-GLU-GLY-PRO-ALA-SER-LYS-LEU-LEU-GLN-PRO-GLY-ASP-LYS-ILE-ILE-GLN-ALA-ASN-GLY-TYR-SER-PHE-ILE-ASN-ILE-GLU-HIS-GLY-GLN-ALA-VAL-SER-LEU-LEU-LYS-THR-PHE-GLN-ASN-THR-VAL-GLU-LEU-ILE-ILE-VAL-ARG-GLU-VAL-SER-SER,THR-GLY-TRP-GLU-THR-TRP-VAL,103,7,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1c[nH]c2c1cccc2)[C@H](O)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@H]([C@H](O)C)[NH3+],IC50=0.15uM,6.823909,6.82,1,A,A,1,A,A,0,,B,A,,1,1,103,7,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.9793047904968262,0.904423177242279,94.34302520751952,91.18522644042967,0.3474036157131195,0.4577681422233581,0.900677502155304,0.9154070019721984,0.9023707509040833,0.8956092596054077,TGWETWV,Low,"(6.696, 6.824]",val
1NLT,protein-peptide,P25491,GAQRPRGPQRGKDIKHEISASLEELYKGRTAKLALNKQILCKECEGRGGKKGAVKKCTSCNGQGIKFVTRQMGPMIQRFQTECDVCHGTGDIIDPKDRCKSCNGKKVENERKILEVHVEPGMKDGQRIVFKGEADQAPDVIPGDVVFIVSERPHKSFKRDGDDLVYEAEIDLLTAIAGGEFALEHVSGDWLKVGIVPGEVIAPGMRKVIEGKGMPIPKYGGYGNLIIKFTIKDPENHFTSEENLKKLE,GWLYEIS,GLY-ALA-GLN-ARG-PRO-ARG-GLY-PRO-GLN-ARG-GLY-LYS-ASP-ILE-LYS-HIS-GLU-ILE-SER-ALA-SER-LEU-GLU-GLU-LEU-TYR-LYS-GLY-ARG-THR-ALA-LYS-LEU-ALA-LEU-ASN-LYS-GLN-ILE-LEU-CYS-LYS-GLU-CYS-GLU-GLY-ARG-GLY-GLY-LYS-LYS-GLY-ALA-VAL-LYS-LYS-CYS-THR-SER-CYS-ASN-GLY-GLN-GLY-ILE-LYS-PHE-VAL-THR-ARG-GLN-MET-GLY-PRO-MET-ILE-GLN-ARG-PHE-GLN-THR-GLU-CYS-ASP-VAL-CYS-HIS-GLY-THR-GLY-ASP-ILE-ILE-ASP-PRO-LYS-ASP-ARG-CYS-LYS-SER-CYS-ASN-GLY-LYS-LYS-VAL-GLU-ASN-GLU-ARG-LYS-ILE-LEU-GLU-VAL-HIS-VAL-GLU-PRO-GLY-MET-LYS-ASP-GLY-GLN-ARG-ILE-VAL-PHE-LYS-GLY-GLU-ALA-ASP-GLN-ALA-PRO-ASP-VAL-ILE-PRO-GLY-ASP-VAL-VAL-PHE-ILE-VAL-SER-GLU-ARG-PRO-HIS-LYS-SER-PHE-LYS-ARG-ASP-GLY-ASP-ASP-LEU-VAL-TYR-GLU-ALA-GLU-ILE-ASP-LEU-LEU-THR-ALA-ILE-ALA-GLY-GLY-GLU-PHE-ALA-LEU-GLU-HIS-VAL-SER-GLY-ASP-TRP-LEU-LYS-VAL-GLY-ILE-VAL-PRO-GLY-GLU-VAL-ILE-ALA-PRO-GLY-MET-ARG-LYS-VAL-ILE-GLU-GLY-LYS-GLY-MET-PRO-ILE-PRO-LYS-TYR-GLY-GLY-TYR-GLY-ASN-LEU-ILE-ILE-LYS-PHE-THR-ILE-LYS-ASP-PRO-GLU-ASN-HIS-PHE-THR-SER-GLU-GLU-ASN-LEU-LYS-LYS-LEU-GLU,GLY-TRP-LEU-TYR-GLU-ILE-SER,248,7,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C=O)CO)[C@H](CC)C)CCC(=O)O)Cc1ccc(cc1)O)CC(C)C)Cc1c[nH]c2c1cccc2,Kd=12uM,4.920819,4.92,1,A,A,1,A,A,0,,B,A,,1,1,248,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O)C(=O)O,0.9107252955436708,0.9113069772720336,71.9524154663086,67.58370208740234,0.5134134888648987,0.5326032042503357,0.7421828508377075,0.8076038956642151,0.8817824125289917,0.8943899869918823,GWLYEIS,Low,"(4.866, 5.014]",train
1NTV,protein-peptide,P97318,GQDRSEATLIKRFKGEGVRYKAKLIGIDEVSAARGDKLCQDSMMKLKGVVAGARSKGEHKQKIFLTISFGGIKIFDEKTGALQHHHAVHEISYIAKDITDHRAFGYVCGKEGNHRFVAIKTAQAAEPVILDLRDLFQLIYELKQREELEKKA,NFDNPVYRKT,GLY-GLN-ASP-ARG-SER-GLU-ALA-THR-LEU-ILE-LYS-ARG-PHE-LYS-GLY-GLU-GLY-VAL-ARG-TYR-LYS-ALA-LYS-LEU-ILE-GLY-ILE-ASP-GLU-VAL-SER-ALA-ALA-ARG-GLY-ASP-LYS-LEU-CYS-GLN-ASP-SER-MET-MET-LYS-LEU-LYS-GLY-VAL-VAL-ALA-GLY-ALA-ARG-SER-LYS-GLY-GLU-HIS-LYS-GLN-LYS-ILE-PHE-LEU-THR-ILE-SER-PHE-GLY-GLY-ILE-LYS-ILE-PHE-ASP-GLU-LYS-THR-GLY-ALA-LEU-GLN-HIS-HIS-HIS-ALA-VAL-HIS-GLU-ILE-SER-TYR-ILE-ALA-LYS-ASP-ILE-THR-ASP-HIS-ARG-ALA-PHE-GLY-TYR-VAL-CYS-GLY-LYS-GLU-GLY-ASN-HIS-ARG-PHE-VAL-ALA-ILE-LYS-THR-ALA-GLN-ALA-ALA-GLU-PRO-VAL-ILE-LEU-ASP-LEU-ARG-ASP-LEU-PHE-GLN-LEU-ILE-TYR-GLU-LEU-LYS-GLN-ARG-GLU-GLU-LEU-GLU-LYS-LYS-ALA,ASN-PHE-ASP-ASN-PRO-VAL-TYR-ARG-LYS-THR,152,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1ccccc1)CC(=O)O)CC(=O)N)Cc1ccc(cc1)O)CCC[NH+]=C(N)N,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,B,A,,1,1,152,10,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9731481671333312,0.8634892702102661,94.57199096679688,91.15250396728516,0.3095189332962036,0.5789299607276917,0.9386391639709472,0.9084754586219788,0.9431951642036438,0.8522427082061768,NFDNPVYRKT,Low,"(5.821, 5.959]",train
1NZL,protein-peptide,P00524,AEEWYFGKITRRESERLLLNPENPRGTFLVRESETTKGAYCLSVSDFDNAKGLNVKHYKIRKLDSGGFYITSRTQFSSLQQLVAYYSKHADGLCHRLTNVCPT,PQYEYIPA,ALA-GLU-GLU-TRP-TYR-PHE-GLY-LYS-ILE-THR-ARG-ARG-GLU-SER-GLU-ARG-LEU-LEU-LEU-ASN-PRO-GLU-ASN-PRO-ARG-GLY-THR-PHE-LEU-VAL-ARG-GLU-SER-GLU-THR-THR-LYS-GLY-ALA-TYR-CYS-LEU-SER-VAL-SER-ASP-PHE-ASP-ASN-ALA-LYS-GLY-LEU-ASN-VAL-LYS-HIS-TYR-LYS-ILE-ARG-LYS-LEU-ASP-SER-GLY-GLY-PHE-TYR-ILE-THR-SER-ARG-THR-GLN-PHE-SER-SER-LEU-GLN-GLN-LEU-VAL-ALA-TYR-TYR-SER-LYS-HIS-ALA-ASP-GLY-LEU-CYS-HIS-ARG-LEU-THR-ASN-VAL-CYS-PRO-THR,PRO-GLN-PTR-GLU-PTR-ILE-PRO-ALA,103,8,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CCC(=O)N)CCC(=O)O)C,Kd=0.07uM,7.154902,7.15,1,A,A,1,A,A,0,,C,A,,0,1,103,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.898777425289154,0.8339611291885376,97.33869171142578,95.4609603881836,0.321892112493515,0.5603224635124207,0.9279270768165588,0.884636402130127,0.8464449644088745,0.8212922811508179,PQYEYIPA,Moderate,"(7.049, 7.268]",train
1NZV,protein-peptide,P00524,AEEWYFGKITRRESERLLLNPENPRGTFLVRESETTKGAYCLSVSDFDNAKGLNVKHYKIRKLDSGGFYITSRTQFSSLQQLVAYYSKHADGLCHRLTNVCPT,PQYIYVPA,ALA-GLU-GLU-TRP-TYR-PHE-GLY-LYS-ILE-THR-ARG-ARG-GLU-SER-GLU-ARG-LEU-LEU-LEU-ASN-PRO-GLU-ASN-PRO-ARG-GLY-THR-PHE-LEU-VAL-ARG-GLU-SER-GLU-THR-THR-LYS-GLY-ALA-TYR-CYS-LEU-SER-VAL-SER-ASP-PHE-ASP-ASN-ALA-LYS-GLY-LEU-ASN-VAL-LYS-HIS-TYR-LYS-ILE-ARG-LYS-LEU-ASP-SER-GLY-GLY-PHE-TYR-ILE-THR-SER-ARG-THR-GLN-PHE-SER-SER-LEU-GLN-GLN-LEU-VAL-ALA-TYR-TYR-SER-LYS-HIS-ALA-ASP-GLY-LEU-CYS-HIS-ARG-LEU-THR-ASN-VAL-CYS-PRO-THR,PRO-GLN-PTR-ILE-PTR-VAL-PRO-ALA,103,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)C(C)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CCC(=O)N)C,Kd=0.40uM,6.39794,6.4,1,A,A,1,A,A,0,,C,A,,0,1,103,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.8902161121368408,0.8515276908874512,97.18010711669922,96.11881256103516,0.326637864112854,0.530559778213501,0.925659716129303,0.897392749786377,0.8363101482391357,0.8400614261627197,PQYIYVPA,Low,"(6.26, 6.398]",train
1OAI,protein-peptide,Q9UBU9,PTLSPEQQEMLQAFSTQSGMNLEWSQKCLQDNNWDYTRSAQAFTHLKAKGEIPEVAFMK,DSGFSFGSK,PRO-THR-LEU-SER-PRO-GLU-GLN-GLN-GLU-MET-LEU-GLN-ALA-PHE-SER-THR-GLN-SER-GLY-MET-ASN-LEU-GLU-TRP-SER-GLN-LYS-CYS-LEU-GLN-ASP-ASN-ASN-TRP-ASP-TYR-THR-ARG-SER-ALA-GLN-ALA-PHE-THR-HIS-LEU-LYS-ALA-LYS-GLY-GLU-ILE-PRO-GLU-VAL-ALA-PHE-MET-LYS,ASP-SER-GLY-PHE-SER-PHE-GLY-SER-LYS,59,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CO)CO)Cc1ccccc1)CO,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,B,A,,1,1,59,9,0,NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9267539978027344,0.79742032289505,97.9323501586914,92.57967376708984,0.2875193953514099,0.5816267132759094,0.9090632796287536,0.8491308093070984,0.848456084728241,0.7844926714897156,DSGFSFGSK,Low,"(4.866, 5.014]",train
1OBX,protein-peptide,O00560 Q01344,GAMDPRTITMHKDSTGHVGFIFKNGKITSIVKDSSAARNGLLTEHNICEINGQNVIGLKDSQIADILSTSGTVVTITIM,ETLEDSVF,GLY-ALA-MET-ASP-PRO-ARG-THR-ILE-THR-MET-HIS-LYS-ASP-SER-THR-GLY-HIS-VAL-GLY-PHE-ILE-PHE-LYS-ASN-GLY-LYS-ILE-THR-SER-ILE-VAL-LYS-ASP-SER-SER-ALA-ALA-ARG-ASN-GLY-LEU-LEU-THR-GLU-HIS-ASN-ILE-CYS-GLU-ILE-ASN-GLY-GLN-ASN-VAL-ILE-GLY-LEU-LYS-ASP-SER-GLN-ILE-ALA-ASP-ILE-LEU-SER-THR-SER-GLY-THR-VAL-VAL-THR-ILE-THR-ILE-MET,GLU-THR-LEU-GLU-ASP-SER-VAL-PHE,79,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)C(C)C)NC(=O)[C@H](CC(=O)O)[NH3+],Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,B,A,,1,1,79,8,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,0.939189076423645,0.8605518937110901,97.44304656982422,96.35084533691406,0.2879085838794708,0.4908992052078247,0.9225342869758606,0.893290102481842,0.8858814835548401,0.8523673415184021,ETLEDSVF,Low,"(5.699, 5.821]",val
1OEB,protein-peptide,Q60787 O89100,PLGSVRWARALYDFEALEEDELGFRSGEVVEVLDSSNPSWWTGRLHNKLGLFPANYVAPMMR,PAPSIDRSTKPPL,PRO-LEU-GLY-SER-VAL-ARG-TRP-ALA-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-LEU-GLU-GLU-ASP-GLU-LEU-GLY-PHE-ARG-SER-GLY-GLU-VAL-VAL-GLU-VAL-LEU-ASP-SER-SER-ASN-PRO-SER-TRP-TRP-THR-GLY-ARG-LEU-HIS-ASN-LYS-LEU-GLY-LEU-PHE-PRO-ALA-ASN-TYR-VAL-ALA-PRO-MET-MET-ARG,PRO-ALA-PRO-SER-ILE-ASP-ARG-SER-THR-LYS-PRO-PRO-LEU,62,13,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CO)CC(=O)O)CCC[NH+]=C(N)N)CO,Kd=0.118uM,6.928118,6.93,1,A,A,1,A,A,0,,C,A,,0,1,62,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.9912961721420288,0.8285993337631226,97.14289093017578,94.40573120117188,0.2930914461612701,0.5327692031860352,0.9178481101989746,0.8659402132034302,0.9013248682022096,0.8192641139030457,PAPSIDRSTKPPL,Low,"(6.824, 7.049]",val
1OJ5,protein-peptide,P70365 P42226,GHMTGVESFMTKQDTTGKIISIDTSSLRAAGRTGWEDLVRKCIYAFFQPQGREPSYARQLFQEVMTRGTASSPSYRFILNDGTMLSAHTRCKLCYPQSPDMQPFIMGIHIIDREHSGLSPQDDTNSGMSIPR,LPPTEQDLTKLLLE,GLY-HIS-MET-THR-GLY-VAL-GLU-SER-PHE-MET-THR-LYS-GLN-ASP-THR-THR-GLY-LYS-ILE-ILE-SER-ILE-ASP-THR-SER-SER-LEU-ARG-ALA-ALA-GLY-ARG-THR-GLY-TRP-GLU-ASP-LEU-VAL-ARG-LYS-CYS-ILE-TYR-ALA-PHE-PHE-GLN-PRO-GLN-GLY-ARG-GLU-PRO-SER-TYR-ALA-ARG-GLN-LEU-PHE-GLN-GLU-VAL-MET-THR-ARG-GLY-THR-ALA-SER-SER-PRO-SER-TYR-ARG-PHE-ILE-LEU-ASN-ASP-GLY-THR-MET-LEU-SER-ALA-HIS-THR-ARG-CYS-LYS-LEU-CYS-TYR-PRO-GLN-SER-PRO-ASP-MET-GLN-PRO-PHE-ILE-MET-GLY-ILE-HIS-ILE-ILE-ASP-ARG-GLU-HIS-SER-GLY-LEU-SER-PRO-GLN-ASP-ASP-THR-ASN-SER-GLY-MET-SER-ILE-PRO-ARG,LEU-PRO-PRO-THR-GLU-GLN-ASP-LEU-THR-LYS-LEU-LEU-LEU-GLU,132,14,CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)C)CC(C)C)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)[NH3+])CCC(=O)O)CCC(=O)N)CC(=O)O)CC(C)C,Kd=0.8uM,6.09691,6.1,1,A,A,1,A,A,0,,B,A,,1,1,132,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9503626823425292,0.8775240182876587,85.86302185058594,82.1333999633789,0.409392774105072,0.6411415934562683,0.8508790731430054,0.8361343145370483,0.8510897755622864,0.8168486952781677,LPPTEQDLTKLLLE,Low,"(5.959, 6.097]",train
1OK7,protein-peptide,Q47155 P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,VTLLDPQMERQLVLGL,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,VAL-THR-LEU-LEU-ASP-PRO-GLN-MET-GLU-ARG-GLN-LEU-VAL-LEU-GLY-LEU,366,16,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC(=O)N)C,Kd=1.2uM,5.920819,5.92,1,A,A,1,A,A,0,,C,A,,0,1,366,16,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8574575781822205,0.8505637645721436,89.27796936035156,86.95063781738281,0.4275592267513275,0.6093531847000122,0.883481502532959,0.8855463266372681,0.8247736096382141,0.8418181538581848,VTLLDPQMERQLVLGL,Low,"(5.821, 5.959]",val
1OM2,protein-peptide,P11884 Q62760,RAGLSKLPDLKDAEAVQKFFLEEIQLGEELLAQGDYEKGVDHLTNAIAVCGQPQQLLQVLQQTLPPPVFQMLLTKLPTISQRIVSAQSLGEDDVE,GPRLSRLLSYA,ARG-ALA-GLY-LEU-SER-LYS-LEU-PRO-ASP-LEU-LYS-ASP-ALA-GLU-ALA-VAL-GLN-LYS-PHE-PHE-LEU-GLU-GLU-ILE-GLN-LEU-GLY-GLU-GLU-LEU-LEU-ALA-GLN-GLY-ASP-TYR-GLU-LYS-GLY-VAL-ASP-HIS-LEU-THR-ASN-ALA-ILE-ALA-VAL-CYS-GLY-GLN-PRO-GLN-GLN-LEU-LEU-GLN-VAL-LEU-GLN-GLN-THR-LEU-PRO-PRO-PRO-VAL-PHE-GLN-MET-LEU-LEU-THR-LYS-LEU-PRO-THR-ILE-SER-GLN-ARG-ILE-VAL-SER-ALA-GLN-SER-LEU-GLY-GLU-ASP-ASP-VAL-GLU,GLY-PRO-ARG-LEU-SER-ARG-LEU-LEU-SER-TYR-ALA,95,11,[NH3+]CC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)CO)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CO)CC(C)C)CCC[NH+]=C(N)N,Kd=20uM,4.69897,4.7,1,A,A,1,A,A,0,,B,A,,1,1,95,11,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,0.999720573425293,0.900273859500885,87.63239288330078,73.57279205322266,0.4252634942531585,0.5925204753875732,0.7974597811698914,0.8610617518424988,0.8498139977455139,0.8442873954772949,GPRLSRLLSYA,Low,"(4.606, 4.745]",train
1OM9,protein-peptide,Q7Z6B0 Q9UJY5,MHHHHHHMELSLASITVPLESIKPSNILPVTVYDQHGFRILFHFARDPLPGRSDVLVVVVSMLSTAPQPIRNIVFQSAVPKVMKVKLQPPSGTELPAFNPIVHPSAITQVLLLANPQKEKVRLRYKLTFTMGDQTYNEMGDVDQFPPPETWGSL,DDDDFGGFEAAETFD,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-GLU-LEU-SER-LEU-ALA-SER-ILE-THR-VAL-PRO-LEU-GLU-SER-ILE-LYS-PRO-SER-ASN-ILE-LEU-PRO-VAL-THR-VAL-TYR-ASP-GLN-HIS-GLY-PHE-ARG-ILE-LEU-PHE-HIS-PHE-ALA-ARG-ASP-PRO-LEU-PRO-GLY-ARG-SER-ASP-VAL-LEU-VAL-VAL-VAL-VAL-SER-MET-LEU-SER-THR-ALA-PRO-GLN-PRO-ILE-ARG-ASN-ILE-VAL-PHE-GLN-SER-ALA-VAL-PRO-LYS-VAL-MET-LYS-VAL-LYS-LEU-GLN-PRO-PRO-SER-GLY-THR-GLU-LEU-PRO-ALA-PHE-ASN-PRO-ILE-VAL-HIS-PRO-SER-ALA-ILE-THR-GLN-VAL-LEU-LEU-LEU-ALA-ASN-PRO-GLN-LYS-GLU-LYS-VAL-ARG-LEU-ARG-TYR-LYS-LEU-THR-PHE-THR-MET-GLY-ASP-GLN-THR-TYR-ASN-GLU-MET-GLY-ASP-VAL-ASP-GLN-PHE-PRO-PRO-PRO-GLU-THR-TRP-GLY-SER-LEU,ASP-ASP-ASP-ASP-PHE-GLY-GLY-PHE-GLU-ALA-ALA-GLU-THR-PHE-ASP,154,15,O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCC(=O)O)C)C)CCC(=O)O)Cc1ccccc1)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)Cc1ccccc1,Kd=70uM,4.154902,4.15,1,A,A,1,A,A,0,,P,A,,1,1,154,15,0,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9499132633209229,0.8945754170417786,93.34823608398438,90.35143280029295,0.3512443900108337,0.6706454157829285,0.9248355627059937,0.8934699892997742,0.8822181820869446,0.8461504578590393,DDDDFGGFEAAETFD,Low,"(3.924, 4.155]",train
1OPI,protein-peptide,Q15637 P26368,GHPTEVLCLMNMVLPEELLDDEEYEEIVEDVRDECSKYGLVKSIEIPRPVDGVEVPGCGKIFVEFTSVFDCQKAMQGLTGRKFANRVVVTKYCDPDSYHRRDFW,PSKKRKRSRWNQD,GLY-HIS-PRO-THR-GLU-VAL-LEU-CYS-LEU-MET-ASN-MET-VAL-LEU-PRO-GLU-GLU-LEU-LEU-ASP-ASP-GLU-GLU-TYR-GLU-GLU-ILE-VAL-GLU-ASP-VAL-ARG-ASP-GLU-CYS-SER-LYS-TYR-GLY-LEU-VAL-LYS-SER-ILE-GLU-ILE-PRO-ARG-PRO-VAL-ASP-GLY-VAL-GLU-VAL-PRO-GLY-CYS-GLY-LYS-ILE-PHE-VAL-GLU-PHE-THR-SER-VAL-PHE-ASP-CYS-GLN-LYS-ALA-MET-GLN-GLY-LEU-THR-GLY-ARG-LYS-PHE-ALA-ASN-ARG-VAL-VAL-VAL-THR-LYS-TYR-CYS-ASP-PRO-ASP-SER-TYR-HIS-ARG-ARG-ASP-PHE-TRP,PRO-SER-LYS-LYS-ARG-LYS-ARG-SER-ARG-TRP-ASN-GLN-ASP,104,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)N)CC(=O)N)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)CO)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CO)CCCC[NH3+])CCCC[NH3+])CCC[NH+]=C(N)N,Kd=50nM,7.30103,7.3,1,A,A,1,A,A,0,,B,A,,0,1,104,13,0,N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8808032274246216,0.8165880441665649,91.19841766357422,88.36592864990234,0.394150048494339,0.6652121543884277,0.8635961413383484,0.8717769980430603,0.8156604766845703,0.8027908205986023,PSKKRKRSRWNQD,Moderate,"(7.268, 7.523]",val
1OQP,protein-peptide,P05434 P11927,GSGERDSREEILKAFRLFDDDNSGTITIKDLRRVAKELGENLTEEELQEMIAEADRNDDNEIDEDEFIRIMKKTSLF,KKRELIESKWHRLLFHDKK,GLY-SER-GLY-GLU-ARG-ASP-SER-ARG-GLU-GLU-ILE-LEU-LYS-ALA-PHE-ARG-LEU-PHE-ASP-ASP-ASP-ASN-SER-GLY-THR-ILE-THR-ILE-LYS-ASP-LEU-ARG-ARG-VAL-ALA-LYS-GLU-LEU-GLY-GLU-ASN-LEU-THR-GLU-GLU-GLU-LEU-GLN-GLU-MET-ILE-ALA-GLU-ALA-ASP-ARG-ASN-ASP-ASP-ASN-GLU-ILE-ASP-GLU-ASP-GLU-PHE-ILE-ARG-ILE-MET-LYS-LYS-THR-SER-LEU-PHE,LYS-LYS-ARG-GLU-LEU-ILE-GLU-SER-LYS-TRP-HIS-ARG-LEU-LEU-PHE-HIS-ASP-LYS-LYS,77,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCCC[NH3+])CC(=O)O)Cc1[nH]cnc1)Cc1ccccc1)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1[nH]cnc1)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+])CCC[NH+]=C(N)N)CCC(=O)O)CC(C)C)CCC(=O)O)CO,Kd=50nM,7.30103,7.3,1,A,A,1,A,A,0,,B,A,,1,1,77,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9172015190124512,0.6964083909988403,92.02155303955078,85.08341217041016,0.3810435235500335,0.961540162563324,0.8429284691810608,0.7500859498977661,0.8120718598365784,0.6829889416694641,KKRELIESKWHRLLFHDKK,Moderate,"(7.268, 7.523]",train
1OV3,protein-peptide,P14598,GPLGSPEFIILQTYRAIADYEKTSGSEMALSTGDVVEVVEKSESGWWFCQMKAKRGWIPASFLEPLDSPDETEDPEPNYAGEPYVAIKAYTAVEGDEVSLLEGEAVEVIHKLLDGWWVIRKDDVTGYFPSMYLQKSGQ,KQPPSNPPPRPPAEARKK,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-ILE-ILE-LEU-GLN-THR-TYR-ARG-ALA-ILE-ALA-ASP-TYR-GLU-LYS-THR-SER-GLY-SER-GLU-MET-ALA-LEU-SER-THR-GLY-ASP-VAL-VAL-GLU-VAL-VAL-GLU-LYS-SER-GLU-SER-GLY-TRP-TRP-PHE-CYS-GLN-MET-LYS-ALA-LYS-ARG-GLY-TRP-ILE-PRO-ALA-SER-PHE-LEU-GLU-PRO-LEU-ASP-SER-PRO-ASP-GLU-THR-GLU-ASP-PRO-GLU-PRO-ASN-TYR-ALA-GLY-GLU-PRO-TYR-VAL-ALA-ILE-LYS-ALA-TYR-THR-ALA-VAL-GLU-GLY-ASP-GLU-VAL-SER-LEU-LEU-GLU-GLY-GLU-ALA-VAL-GLU-VAL-ILE-HIS-LYS-LEU-LEU-ASP-GLY-TRP-TRP-VAL-ILE-ARG-LYS-ASP-ASP-VAL-THR-GLY-TYR-PHE-PRO-SER-MET-TYR-LEU-GLN-LYS-SER-GLY-GLN,LYS-GLN-PRO-PRO-SER-ASN-PRO-PRO-PRO-ARG-PRO-PRO-ALA-GLU-ALA-ARG-LYS-LYS,138,18,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C)CCC[NH+]=C(N)N)CC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C,Kd=0.19uM,6.721246,6.72,1,A,A,1,A,A,0,,C,A,dimer,1,1,138,18,0,C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,1.0083577632904053,0.8376233577728271,88.4454574584961,84.1058578491211,0.3446889519691467,0.7075961232185364,0.888452410697937,0.8202362656593323,0.9141353964805604,0.787622332572937,KQPPSNPPPRPPAEARKK,Low,"(6.696, 6.824]",train
1OW8,protein-peptide,Q05397 P49023,SSPADSYNEGVKLQPQEISPPPTANLDRSNDKVYENVTGLVKAVIEMSSKIQPAPPEEYVPMVKEVGLALRTLLATVDETIPLLPASTHREIEMAQKLLNSDLGELINKMKLAQQYVMTSLQQEYKKQMLTAAHALAVDAKNLLDVIDQARLKMLGQTRPH,NLSELDRLLLELN,SER-SER-PRO-ALA-ASP-SER-TYR-ASN-GLU-GLY-VAL-LYS-LEU-GLN-PRO-GLN-GLU-ILE-SER-PRO-PRO-PRO-THR-ALA-ASN-LEU-ASP-ARG-SER-ASN-ASP-LYS-VAL-TYR-GLU-ASN-VAL-THR-GLY-LEU-VAL-LYS-ALA-VAL-ILE-GLU-MET-SER-SER-LYS-ILE-GLN-PRO-ALA-PRO-PRO-GLU-GLU-TYR-VAL-PRO-MET-VAL-LYS-GLU-VAL-GLY-LEU-ALA-LEU-ARG-THR-LEU-LEU-ALA-THR-VAL-ASP-GLU-THR-ILE-PRO-LEU-LEU-PRO-ALA-SER-THR-HIS-ARG-GLU-ILE-GLU-MET-ALA-GLN-LYS-LEU-LEU-ASN-SER-ASP-LEU-GLY-GLU-LEU-ILE-ASN-LYS-MET-LYS-LEU-ALA-GLN-GLN-TYR-VAL-MET-THR-SER-LEU-GLN-GLN-GLU-TYR-LYS-LYS-GLN-MET-LEU-THR-ALA-ALA-HIS-ALA-LEU-ALA-VAL-ASP-ALA-LYS-ASN-LEU-LEU-ASP-VAL-ILE-ASP-GLN-ALA-ARG-LEU-LYS-MET-LEU-GLY-GLN-THR-ARG-PRO-HIS,ASN-LEU-SER-GLU-LEU-ASP-ARG-LEU-LEU-LEU-GLU-LEU-ASN,161,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(C)C)CCC(=O)O)CC(C)C)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CC(=O)O)CC(C)C)CCC(=O)O)NC(=O)[C@H](CC(C)C)[NH3+],Kd=4uM,5.39794,5.4,1,A,A,1,A,A,0,,D,A,,1,1,161,13,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.9931951761245728,0.7505883574485779,83.83451080322266,82.61884307861328,0.3969200253486633,0.7622256875038147,0.8498367071151733,0.8300899267196655,0.8997244238853455,0.7268309593200684,NLSELDRLLLELN,Low,"(5.31, 5.463]",train
1OXG,protein-peptide,P00766,CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN,IVNGEEAVPGSWPW,CYS-GLY-VAL-PRO-ALA-ILE-GLN-PRO-VAL-LEU-SER-GLY-LEU-SER-ARG-ILE-VAL-ASN-GLY-GLU-GLU-ALA-VAL-PRO-GLY-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-GLN-ASP-LYS-THR-GLY-PHE-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-GLU-ASN-TRP-VAL-VAL-THR-ALA-ALA-HIS-CYS-GLY-VAL-THR-THR-SER-ASP-VAL-VAL-VAL-ALA-GLY-GLU-PHE-ASP-GLN-GLY-SER-SER-SER-GLU-LYS-ILE-GLN-LYS-LEU-LYS-ILE-ALA-LYS-VAL-PHE-LYS-ASN-SER-LYS-TYR-ASN-SER-LEU-THR-ILE-ASN-ASN-ASP-ILE-THR-LEU-LEU-LYS-LEU-SER-THR-ALA-ALA-SER-PHE-SER-GLN-THR-VAL-SER-ALA-VAL-CYS-LEU-PRO-SER-ALA-SER-ASP-ASP-PHE-ALA-ALA-GLY-THR-THR-CYS-VAL-THR-THR-GLY-TRP-GLY-LEU-THR-ARG-TYR-THR-ASN-ALA-ASN-THR-PRO-ASP-ARG-LEU-GLN-GLN-ALA-SER-LEU-PRO-LEU-LEU-SER-ASN-THR-ASN-CYS-LYS-LYS-TYR-TRP-GLY-THR-LYS-ILE-LYS-ASP-ALA-MET-ILE-CYS-ALA-GLY-ALA-SER-GLY-VAL-SER-SER-CYS-MET-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-LYS-LYS-ASN-GLY-ALA-TRP-THR-LEU-VAL-GLY-ILE-VAL-SER-TRP-GLY-SER-SER-THR-CYS-SER-THR-SER-THR-PRO-GLY-VAL-TYR-ALA-ARG-VAL-THR-ALA-LEU-VAL-ASN-TRP-VAL-GLN-GLN-THR-LEU-ALA-ALA-ASN,ILE-VAL-ASN-GLY-GLU-GLU-ALA-VAL-PRO-GLY-SER-TRP-PRO-TRP,245,14,[NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)CO)C(C)C)C,Ki=0.027nM,10.568636,10.57,1,A,A,1,A,A,0,,B,A,,1,1,245,14,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)O,0.8230324983596802,0.738359808921814,94.06291198730467,92.49991607666016,0.4611333012580871,0.8085765242576599,0.9422926902770996,0.8701794147491455,0.7594336271286011,0.7054048776626587,IVNGEEAVPGSWPW,High,"(8.824, 12.12]",train
1OXN,protein-peptide,Q96CA5,MGSSHHHHHHSSGLVPRGSHMLETEEEEEEGAGATLSRGPAFPGMGSEELRLASFYDWPLTAEVPPELLAAAGFFHTGHQDKVRCFFCYGGLQSWKRGDDPWTEHAKWFPSCQFLLRSKGRDFVHSVQETHSQLLGSWDP,AEAVPWKSE,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-LEU-GLU-THR-GLU-GLU-GLU-GLU-GLU-GLU-GLY-ALA-GLY-ALA-THR-LEU-SER-ARG-GLY-PRO-ALA-PHE-PRO-GLY-MET-GLY-SER-GLU-GLU-LEU-ARG-LEU-ALA-SER-PHE-TYR-ASP-TRP-PRO-LEU-THR-ALA-GLU-VAL-PRO-PRO-GLU-LEU-LEU-ALA-ALA-ALA-GLY-PHE-PHE-HIS-THR-GLY-HIS-GLN-ASP-LYS-VAL-ARG-CYS-PHE-PHE-CYS-TYR-GLY-GLY-LEU-GLN-SER-TRP-LYS-ARG-GLY-ASP-ASP-PRO-TRP-THR-GLU-HIS-ALA-LYS-TRP-PHE-PRO-SER-CYS-GLN-PHE-LEU-LEU-ARG-SER-LYS-GLY-ARG-ASP-PHE-VAL-HIS-SER-VAL-GLN-GLU-THR-HIS-SER-GLN-LEU-LEU-GLY-SER-TRP-ASP-PRO,ALA-GLU-ALA-VAL-PRO-TRP-LYS-SER-GLU,140,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)NC(=O)[C@@H]([NH3+])C,Ki=2.1uM,5.677781,5.68,1,A,A,1,A,A,0,,F,A,,0,1,140,9,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)O,1.0312206745147705,1.014477014541626,74.23272705078125,74.90874481201172,0.4362149834632873,0.5876690149307251,0.7370105981826782,0.7783770561218262,0.8614845275878906,0.8547520041465759,AEAVPWKSE,Low,"(5.6, 5.699]",train
1OXQ,protein-peptide,Q9NR28 Q96CA5,MGSSHHHHHHSSGLVPRGSHMLETEEEEEEGAGATLSRGPAFPGMGSEELRLASFYDWPLTAEVPPELLAAAGFFHTGHQDKVRCFFCYGGLQSWKRGDDPWTEHAKWFPSCQFLLRSKGRDFVHSVQETHSQLLGSWDP,AVPIAQKSE,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-LEU-GLU-THR-GLU-GLU-GLU-GLU-GLU-GLU-GLY-ALA-GLY-ALA-THR-LEU-SER-ARG-GLY-PRO-ALA-PHE-PRO-GLY-MET-GLY-SER-GLU-GLU-LEU-ARG-LEU-ALA-SER-PHE-TYR-ASP-TRP-PRO-LEU-THR-ALA-GLU-VAL-PRO-PRO-GLU-LEU-LEU-ALA-ALA-ALA-GLY-PHE-PHE-HIS-THR-GLY-HIS-GLN-ASP-LYS-VAL-ARG-CYS-PHE-PHE-CYS-TYR-GLY-GLY-LEU-GLN-SER-TRP-LYS-ARG-GLY-ASP-ASP-PRO-TRP-THR-GLU-HIS-ALA-LYS-TRP-PHE-PRO-SER-CYS-GLN-PHE-LEU-LEU-ARG-SER-LYS-GLY-ARG-ASP-PHE-VAL-HIS-SER-VAL-GLN-GLU-THR-HIS-SER-GLN-LEU-LEU-GLY-SER-TRP-ASP-PRO,ALA-VAL-PRO-ILE-ALA-GLN-LYS-SER-GLU,140,9,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)C,Ki=0.5uM,6.30103,6.3,1,A,A,1,A,A,0,,F,A,,0,1,140,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9373376369476318,0.9837055802345276,74.34254455566406,74.7993392944336,0.5056920051574707,0.6214087009429932,0.6894640326499939,0.7626984119415283,0.7560174465179443,0.8202073574066162,AVPIAQKSE,Low,"(6.26, 6.398]",train
1OY7,protein-peptide,Q96CA5,MGSSHHHHHHSSGLVPRGSHMLETEEEEEEGAGATLSRGPAFPGMGSEELRLASFYDWPLTAEVPPELLAAAGFFHTGHQDKVRCFFCYGGLQSWKRGDDPWTEHAKWFPSCQFLLRSKGRDFVHSVQETHSQLLGSWDP,AEVVAVKSE,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-LEU-GLU-THR-GLU-GLU-GLU-GLU-GLU-GLU-GLY-ALA-GLY-ALA-THR-LEU-SER-ARG-GLY-PRO-ALA-PHE-PRO-GLY-MET-GLY-SER-GLU-GLU-LEU-ARG-LEU-ALA-SER-PHE-TYR-ASP-TRP-PRO-LEU-THR-ALA-GLU-VAL-PRO-PRO-GLU-LEU-LEU-ALA-ALA-ALA-GLY-PHE-PHE-HIS-THR-GLY-HIS-GLN-ASP-LYS-VAL-ARG-CYS-PHE-PHE-CYS-TYR-GLY-GLY-LEU-GLN-SER-TRP-LYS-ARG-GLY-ASP-ASP-PRO-TRP-THR-GLU-HIS-ALA-LYS-TRP-PHE-PRO-SER-CYS-GLN-PHE-LEU-LEU-ARG-SER-LYS-GLY-ARG-ASP-PHE-VAL-HIS-SER-VAL-GLN-GLU-THR-HIS-SER-GLN-LEU-LEU-GLY-SER-TRP-ASP-PRO,ALA-GLU-VAL-VAL-ALA-VAL-LYS-SER-GLU,140,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)NC(=O)[C@@H]([NH3+])C,Ki=4.4uM,5.356547,5.36,1,A,A,1,A,A,0,,F,A,,0,1,140,9,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,0.956236720085144,0.991108238697052,73.88009643554688,74.35985565185547,0.4912317395210266,0.6052215695381165,0.7026160359382629,0.7623390555381775,0.784742534160614,0.8295505046844482,AEVVAVKSE,Low,"(5.31, 5.463]",train
1P4U,protein-peptide,Q15276 Q9NZ52,GSPPKGPELSLASIHVPLESIKPSSALPVTAYDKNGFRILFHFAKECPPGRPDVLVVVVSMLNMAPLPVKSIVLQAAAPKSMKVKLQPPSGTELSPFSPIQPPAAITQVMLLANPLKEKVRLRYKLTFALGEQLSTEVGEVDQFPPVEQWGNL,DESDFGPLVGADS,GLY-SER-PRO-PRO-LYS-GLY-PRO-GLU-LEU-SER-LEU-ALA-SER-ILE-HIS-VAL-PRO-LEU-GLU-SER-ILE-LYS-PRO-SER-SER-ALA-LEU-PRO-VAL-THR-ALA-TYR-ASP-LYS-ASN-GLY-PHE-ARG-ILE-LEU-PHE-HIS-PHE-ALA-LYS-GLU-CYS-PRO-PRO-GLY-ARG-PRO-ASP-VAL-LEU-VAL-VAL-VAL-VAL-SER-MET-LEU-ASN-MET-ALA-PRO-LEU-PRO-VAL-LYS-SER-ILE-VAL-LEU-GLN-ALA-ALA-ALA-PRO-LYS-SER-MET-LYS-VAL-LYS-LEU-GLN-PRO-PRO-SER-GLY-THR-GLU-LEU-SER-PRO-PHE-SER-PRO-ILE-GLN-PRO-PRO-ALA-ALA-ILE-THR-GLN-VAL-MET-LEU-LEU-ALA-ASN-PRO-LEU-LYS-GLU-LYS-VAL-ARG-LEU-ARG-TYR-LYS-LEU-THR-PHE-ALA-LEU-GLY-GLU-GLN-LEU-SER-THR-GLU-VAL-GLY-GLU-VAL-ASP-GLN-PHE-PRO-PRO-VAL-GLU-GLN-TRP-GLY-ASN-LEU,ASP-GLU-SER-ASP-PHE-GLY-PRO-LEU-VAL-GLY-ALA-ASP-SER,153,13,CC(C[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)C(C)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1ccccc1)C,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,153,13,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O,0.993586540222168,0.7889490723609924,95.42520141601562,91.29876708984376,0.3336964845657348,0.6695993542671204,0.9303910732269288,0.8690956830978394,0.9114938974380492,0.7689124345779419,DESDFGPLVGADS,Low,"(5.222, 5.31]",train
1PCG,protein-peptide,P03372,NSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLESAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKSVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKSKNVVPLYDLLLEMLDAH,KCILCRLLQ,ASN-SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-SER-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-SER-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-SER-LYS-ASN-VAL-VAL-PRO-LEU-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS,LYS-DCY-ILE-LEU-CYS-ARG-LEU-LEU-GLN,244,9,[NH3+]CCCC[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CS)CC(C)C)[C@H](CC)C)CS)[NH3+],Ki=25nM,7.60206,7.6,1,A,A,1,A,A,0,,E,A,,1,1,244,9,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NC(CS)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NC(CS)C(=O)N[C@@H](CCCCN)C(=O)O,0.945956289768219,0.83295738697052,90.33971405029295,90.04367065429688,0.3857384026050567,0.6623643636703491,0.92702978849411,0.9007401466369628,0.9284546971321106,0.8160117268562317,KCILCRLLQ,Moderate,"(7.523, 7.921]",train
1PDQ,protein-peptide,P26017 P84247,MKKHHHHHHDNATDDPVDLVYAAEKIIQKRVKKGVVEYRVKWKGWNQRYNTWEPEVNILDRRLIDIYEQTNK,APRKQLATKAARKSAPST,MET-LYS-LYS-HIS-HIS-HIS-HIS-HIS-HIS-ASP-ASN-ALA-THR-ASP-ASP-PRO-VAL-ASP-LEU-VAL-TYR-ALA-ALA-GLU-LYS-ILE-ILE-GLN-LYS-ARG-VAL-LYS-LYS-GLY-VAL-VAL-GLU-TYR-ARG-VAL-LYS-TRP-LYS-GLY-TRP-ASN-GLN-ARG-TYR-ASN-THR-TRP-GLU-PRO-GLU-VAL-ASN-ILE-LEU-ASP-ARG-ARG-LEU-ILE-ASP-ILE-TYR-GLU-GLN-THR-ASN-LYS,ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-M3L-SER-ALA-PRO-SER-THR,72,18,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C)CCCC[NH3+])C)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,72,18,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,1.021346926689148,0.9059916138648988,83.85821533203125,80.46159362792969,0.3712924122810364,0.8029712438583374,0.7952755689620972,0.7618902325630188,0.786198079586029,0.7336836457252502,APRKQLATKAARKSAPST,Low,"(5.222, 5.31]",train
1PMX,protein-peptide,P05019,GPETLCGAELVDALQFVCGDRGFYFNKPTGYGSSSRRAPQTGIVDECCFRSCDLRRLEMYCAPLKPAKSA,RNCFESVAALRRCMYG,GLY-PRO-GLU-THR-LEU-CYS-GLY-ALA-GLU-LEU-VAL-ASP-ALA-LEU-GLN-PHE-VAL-CYS-GLY-ASP-ARG-GLY-PHE-TYR-PHE-ASN-LYS-PRO-THR-GLY-TYR-GLY-SER-SER-SER-ARG-ARG-ALA-PRO-GLN-THR-GLY-ILE-VAL-ASP-GLU-CYS-CYS-PHE-ARG-SER-CYS-ASP-LEU-ARG-ARG-LEU-GLU-MET-TYR-CYS-ALA-PRO-LEU-LYS-PRO-ALA-LYS-SER-ALA,ARG-ASN-CYS-PHE-GLU-SER-VAL-ALA-ALA-LEU-ARG-ARG-CYS-MET-TYR-GLY,70,16,CSCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(=O)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CC(C)C)C)C)C(C)C,IC50=7.2uM,5.142668,5.14,1,A,A,1,A,A,0,,B,A,,1,1,70,16,0,CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(C)C,0.9133960604667664,0.7543795108795166,88.77725219726562,80.73014831542969,0.4732863903045654,0.8816843628883362,0.762932538986206,0.7260313034057617,0.7620583772659302,0.6632522344589233,RNCFESVAALRRCMYG,Low,"(5.105, 5.222]",train
1PY1,protein-peptide,Q9UJY5 P56817,GSEPAMEPETLEARINRATNPLNKELDWASINGFCEQLNEDFEGPPLATRLLAHKIQSPQEWEAIQALTVLETCMKSCGKRFHDEVGKFRFLNELIKVVSPKYLGSRTSEKVKNKILELLYSWTVGLPEEVKIAEAYQMLKKQGIVKSDPKLPDDTTF,ADDISLLK,GLY-SER-GLU-PRO-ALA-MET-GLU-PRO-GLU-THR-LEU-GLU-ALA-ARG-ILE-ASN-ARG-ALA-THR-ASN-PRO-LEU-ASN-LYS-GLU-LEU-ASP-TRP-ALA-SER-ILE-ASN-GLY-PHE-CYS-GLU-GLN-LEU-ASN-GLU-ASP-PHE-GLU-GLY-PRO-PRO-LEU-ALA-THR-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-ILE-GLN-ALA-LEU-THR-VAL-LEU-GLU-THR-CYS-MET-LYS-SER-CYS-GLY-LYS-ARG-PHE-HIS-ASP-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-SER-ARG-THR-SER-GLU-LYS-VAL-LYS-ASN-LYS-ILE-LEU-GLU-LEU-LEU-TYR-SER-TRP-THR-VAL-GLY-LEU-PRO-GLU-GLU-VAL-LYS-ILE-ALA-GLU-ALA-TYR-GLN-MET-LEU-LYS-LYS-GLN-GLY-ILE-VAL-LYS-SER-ASP-PRO-LYS-LEU-PRO-ASP-ASP-THR-THR-PHE,ALA-ASP-ASP-ILE-SEP-LEU-LEU-LYS,158,8,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)COP(O)(O)O)CC(C)C)CC(C)C,Kd=40uM,4.39794,4.4,1,A,A,1,A,A,0,,E,A,,1,1,158,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O,0.9776584506034852,0.8923120498657227,92.81148529052734,93.25983428955078,0.3033415973186493,0.4686087965965271,0.9388448596000672,0.9191515445709229,0.9308858513832092,0.8856021165847778,ADDISLLK,Low,"(4.319, 4.456]",val
1Q4K,protein-peptide,P53350,KGLENPLPERPREKEEPVVRETGEVVDCHLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSRSASNRLKAS,MQSTPL,LYS-GLY-LEU-GLU-ASN-PRO-LEU-PRO-GLU-ARG-PRO-ARG-GLU-LYS-GLU-GLU-PRO-VAL-VAL-ARG-GLU-THR-GLY-GLU-VAL-VAL-ASP-CYS-HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG-SER-ALA-SER-ASN-ARG-LEU-LYS-ALA-SER,MET-GLN-SER-TPO-PRO-LEU,259,6,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](OP(O)(O)O)C)CO)CCC(=O)N)[NH3+],Kd=280nM,6.552842,6.55,1,A,A,1,A,A,0,,D,A,,1,1,259,6,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8021875619888306,0.7863286733627319,78.61815643310547,81.23426818847656,0.5030893087387085,0.7217751741409302,0.8529088497161865,0.8189224600791931,0.7305449843406677,0.7323307991027832,MQSTPL,Low,"(6.523, 6.696]",train
1Q5L,protein-peptide,P0A6Y8,MGSSHHHHHHGLVPRGSHMVDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGL,NRLLLTG,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-VAL-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU,ASN-ARG-LEU-LEU-LEU-THR-GLY,135,7,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N)CC(C)C)C,Kd=600uM,3.221849,3.22,1,A,A,1,A,A,0,,B,A,,1,1,135,7,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9320565462112428,0.9127799272537231,80.0976791381836,80.20157623291016,0.4433333873748779,0.4656006395816803,0.8245236873626709,0.8991718292236328,0.8357003331184387,0.8930338025093079,NRLLLTG,Low,"(2.044, 3.548]",train
1QJA,protein-peptide,P63104,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,RLYHSLPA,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,ARG-LEU-TYR-HIS-SEP-LEU-PRO-ALA,245,8,OC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(C)C)Cc1ccc(cc1)O)Cc1[nH]cnc1)COP(O)(O)O)CC(C)C)C,Kd=416nM,6.380907,6.38,1,A,A,1,A,A,0,,Q,A,,0,1,245,8,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.9407799243927002,0.9028229117393494,87.23198699951172,86.26815032958984,0.3549088835716247,0.5183339715003967,0.9126431941986084,0.908251702785492,0.903347671031952,0.8759555220603943,RLYHSLPA,Low,"(6.26, 6.398]",train
1QJB,protein-peptide,P0DOJ7 P63104,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,ARSHSYPA,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,ALA-ARG-SER-HIS-SEP-TYR-PRO-ALA,245,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)COP(O)(O)O)Cc1[nH]cnc1)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Ki=416nM,6.380907,6.38,1,A,A,1,A,A,0,,Q,A,,1,1,245,8,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9502791166305542,0.8781371116638184,87.19944763183594,85.97976684570312,0.3449412584304809,0.5645896792411804,0.9177533388137816,0.9002033472061157,0.913944125175476,0.847110390663147,ARSHSYPA,Low,"(6.26, 6.398]",train
1QNG,protein-peptide,Q25756,SKRSKVFFDISIDNSNAGRIIFELFSDITPRTCENFRALCTGEKIGSRGKNLHYKNSIFHRIIPQFMCQGGDITNGNGSGGESIYGRSFTDENFNMKHDQPGLLSMANAGPNTNSSQFFITLVPCPWLDGKHVVFGKVIEGMNVVREMEKEGAKSGYVKRSVVITDCGEL,ALLVTAGLVLA,SER-LYS-ARG-SER-LYS-VAL-PHE-PHE-ASP-ILE-SER-ILE-ASP-ASN-SER-ASN-ALA-GLY-ARG-ILE-ILE-PHE-GLU-LEU-PHE-SER-ASP-ILE-THR-PRO-ARG-THR-CYS-GLU-ASN-PHE-ARG-ALA-LEU-CYS-THR-GLY-GLU-LYS-ILE-GLY-SER-ARG-GLY-LYS-ASN-LEU-HIS-TYR-LYS-ASN-SER-ILE-PHE-HIS-ARG-ILE-ILE-PRO-GLN-PHE-MET-CYS-GLN-GLY-GLY-ASP-ILE-THR-ASN-GLY-ASN-GLY-SER-GLY-GLY-GLU-SER-ILE-TYR-GLY-ARG-SER-PHE-THR-ASP-GLU-ASN-PHE-ASN-MET-LYS-HIS-ASP-GLN-PRO-GLY-LEU-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-SER-SER-GLN-PHE-PHE-ILE-THR-LEU-VAL-PRO-CYS-PRO-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-ILE-GLU-GLY-MET-ASN-VAL-VAL-ARG-GLU-MET-GLU-LYS-GLU-GLY-ALA-LYS-SER-GLY-TYR-VAL-LYS-ARG-SER-VAL-VAL-ILE-THR-ASP-CYS-GLY-GLU-LEU,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,170,11,C/C=C/C[C@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)[C@@H](CC(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C)CC)[N@@H+](OO)C)O)C,Kd=13nM,7.886057,7.89,1,A,A,1,A,A,0,,D,A,,1,1,170,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9060912728309632,0.7812615633010864,94.27892303466795,92.05081939697266,0.3537508547306061,0.6334853768348694,0.9403557777404784,0.8867306709289551,0.859541654586792,0.7548941969871521,ALLVTAGLVLA,Moderate,"(7.523, 7.921]",train
1QNH,protein-peptide,Q25756,SKRSKVFFDISIDNSNAGRIIFELFSDITPRTCENFRALCTGEKIGSRGKNLHYKNSIFHRIIPQFMCQGGDITNGNGSGGESIYGRSFTDENFNMKHDQPGLLSMANAGPNTNSSQFLITLVPCPWLDGKHVVFGKVIEGMNVVREMEKEGAKSGYVKRSVVITDCGEW,ALLVTAGLVLA,SER-LYS-ARG-SER-LYS-VAL-PHE-PHE-ASP-ILE-SER-ILE-ASP-ASN-SER-ASN-ALA-GLY-ARG-ILE-ILE-PHE-GLU-LEU-PHE-SER-ASP-ILE-THR-PRO-ARG-THR-CYS-GLU-ASN-PHE-ARG-ALA-LEU-CYS-THR-GLY-GLU-LYS-ILE-GLY-SER-ARG-GLY-LYS-ASN-LEU-HIS-TYR-LYS-ASN-SER-ILE-PHE-HIS-ARG-ILE-ILE-PRO-GLN-PHE-MET-CYS-GLN-GLY-GLY-ASP-ILE-THR-ASN-GLY-ASN-GLY-SER-GLY-GLY-GLU-SER-ILE-TYR-GLY-ARG-SER-PHE-THR-ASP-GLU-ASN-PHE-ASN-MET-LYS-HIS-ASP-GLN-PRO-GLY-LEU-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-SER-SER-GLN-PHE-LEU-ILE-THR-LEU-VAL-PRO-CYS-PRO-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-ILE-GLU-GLY-MET-ASN-VAL-VAL-ARG-GLU-MET-GLU-LYS-GLU-GLY-ALA-LYS-SER-GLY-TYR-VAL-LYS-ARG-SER-VAL-VAL-ILE-THR-ASP-CYS-GLY-GLU-TRP,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,170,11,C/C=C/C[C@H]([C@H]([C@@H](C(=O)N[C@H](C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)C(=C)CC(C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C)CC)[N@@H+](OO)C)O)C,Kd=872nM,6.059484,6.06,1,A,A,1,A,A,0,,C,A,,1,1,170,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9205857515335084,0.7986587285995483,93.90409088134766,91.2171630859375,0.3415359556674957,0.6138641238212585,0.9455891847610474,0.8917883038520813,0.8763514161109924,0.7753763198852539,ALLVTAGLVLA,Low,"(5.959, 6.097]",train
1QSC,protein-peptide,Q12933,QDKIEALSSKVQQLERSIGLKDLAMADLEQKVLEMEASTYDGVFIWKISDFARKRQEAVAGRIPAIFSPAFYTSRYGYKMCLRIYLNGDGTGRGTHLSLFFVVMKGPNDALLRWPFNQKVTLMLLDQNNREHVIDAFRPDVTSSSFQRPVNDMNIASGCPLFCPVSKMEAKNSYVRDDAIFIKAIVDLTGL,YPIQET,GLN-ASP-LYS-ILE-GLU-ALA-LEU-SER-SER-LYS-VAL-GLN-GLN-LEU-GLU-ARG-SER-ILE-GLY-LEU-LYS-ASP-LEU-ALA-MSE-ALA-ASP-LEU-GLU-GLN-LYS-VAL-LEU-GLU-MSE-GLU-ALA-SER-THR-TYR-ASP-GLY-VAL-PHE-ILE-TRP-LYS-ILE-SER-ASP-PHE-ALA-ARG-LYS-ARG-GLN-GLU-ALA-VAL-ALA-GLY-ARG-ILE-PRO-ALA-ILE-PHE-SER-PRO-ALA-PHE-TYR-THR-SER-ARG-TYR-GLY-TYR-LYS-MSE-CYS-LEU-ARG-ILE-TYR-LEU-ASN-GLY-ASP-GLY-THR-GLY-ARG-GLY-THR-HIS-LEU-SER-LEU-PHE-PHE-VAL-VAL-MSE-LYS-GLY-PRO-ASN-ASP-ALA-LEU-LEU-ARG-TRP-PRO-PHE-ASN-GLN-LYS-VAL-THR-LEU-MSE-LEU-LEU-ASP-GLN-ASN-ASN-ARG-GLU-HIS-VAL-ILE-ASP-ALA-PHE-ARG-PRO-ASP-VAL-THR-SER-SER-SER-PHE-GLN-ARG-PRO-VAL-ASN-ASP-MSE-ASN-ILE-ALA-SER-GLY-CYS-PRO-LEU-PHE-CYS-PRO-VAL-SER-LYS-MSE-GLU-ALA-LYS-ASN-SER-TYR-VAL-ARG-ASP-ASP-ALA-ILE-PHE-ILE-LYS-ALA-ILE-VAL-ASP-LEU-THR-GLY-LEU,ACE-TYR-PRO-ILE-GLN-GLU-THR,191,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCC(=O)O)CCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C)C,Kd=210uM,3.677781,3.68,1,A,A,1,A,A,0,,D,A,,1,1,191,7,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9765552878379822,0.925537884235382,90.79009246826172,85.79273986816406,0.3476105630397796,0.4752967953681946,0.8646647930145264,0.8730741143226624,0.9410760998725892,0.8895699977874756,YPIQET,Low,"(3.548, 3.924]",val
1QWE,protein-peptide,P00525,GSHMGGVTTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS,APPLPPRNRPRL,GLY-SER-HIS-MET-GLY-GLY-VAL-THR-THR-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-SER-ARG-THR-GLU-THR-ASP-LEU-SER-PHE-LYS-LYS-GLY-GLU-ARG-LEU-GLN-ILE-VAL-ASN-ASN-THR-GLU-GLY-ASP-TRP-TRP-LEU-ALA-HIS-SER-LEU-THR-THR-GLY-GLN-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-SER,ALA-PRO-PRO-LEU-PRO-PRO-ARG-ASN-ARG-PRO-ARG-LEU,64,12,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CC(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)C,Kd=1.2uM,5.920819,5.92,1,A,A,1,A,A,0,,B,A,,1,1,64,12,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,1.016132116317749,0.8869872689247131,88.63389587402344,82.9689712524414,0.3257925510406494,0.5505018830299377,0.8800506591796875,0.8605343103408813,0.8527839779853821,0.8252411484718323,APPLPPRNRPRL,Low,"(5.821, 5.959]",train
1QWF,protein-peptide,P00525,GSHMGGVTTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS,VSLARRPLPPLP,GLY-SER-HIS-MET-GLY-GLY-VAL-THR-THR-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-SER-ARG-THR-GLU-THR-ASP-LEU-SER-PHE-LYS-LYS-GLY-GLU-ARG-LEU-GLN-ILE-VAL-ASN-ASN-THR-GLU-GLY-ASP-TRP-TRP-LEU-ALA-HIS-SER-LEU-THR-THR-GLY-GLN-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-SER,VAL-SER-LEU-ALA-ARG-ARG-PRO-LEU-PRO-PRO-LEU-PRO,64,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)CC(C)C)NC(=O)[C@H](C(C)C)[NH3+],Kd=0.45uM,6.346787,6.35,1,A,A,1,A,A,0,,B,A,,1,1,64,12,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,1.0316983461380005,0.9379220604896544,91.02328491210938,83.76066589355469,0.3258820176124573,0.5118759274482727,0.8823474049568176,0.8762123584747314,0.8798913359642029,0.8459275960922241,VSLARRPLPPLP,Low,"(6.26, 6.398]",train
1R2B,protein-peptide,Q9Y618 P41182,GSADSQIQFTRHASDVLLNLNRLRSRDILTDVVIVVSREQFRAHKTVLMACSGLFYSIFTDQLKRNLSVINLDPEINPEGFNILLDFMYTSRLNLREGNIMAVMATAMYLQMEHVVDTCRKFIKASE,GSLVATVKEAGRSIHEIPR,GLY-SER-ALA-ASP-SER-GLN-ILE-GLN-PHE-THR-ARG-HIS-ALA-SER-ASP-VAL-LEU-LEU-ASN-LEU-ASN-ARG-LEU-ARG-SER-ARG-ASP-ILE-LEU-THR-ASP-VAL-VAL-ILE-VAL-VAL-SER-ARG-GLU-GLN-PHE-ARG-ALA-HIS-LYS-THR-VAL-LEU-MET-ALA-CYS-SER-GLY-LEU-PHE-TYR-SER-ILE-PHE-THR-ASP-GLN-LEU-LYS-ARG-ASN-LEU-SER-VAL-ILE-ASN-LEU-ASP-PRO-GLU-ILE-ASN-PRO-GLU-GLY-PHE-ASN-ILE-LEU-LEU-ASP-PHE-MET-TYR-THR-SER-ARG-LEU-ASN-LEU-ARG-GLU-GLY-ASN-ILE-MET-ALA-VAL-MET-ALA-THR-ALA-MET-TYR-LEU-GLN-MET-GLU-HIS-VAL-VAL-ASP-THR-CYS-ARG-LYS-PHE-ILE-LYS-ALA-SER-GLU,GLY-SER-LEU-VAL-ALA-THR-VAL-LYS-GLU-ALA-GLY-ARG-SER-ILE-HIS-GLU-ILE-PRO-ARG,127,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)[C@H](CC)C)CCC(=O)O)Cc1nc[nH]c1)[C@H](CC)C)CO)CCC[NH+]=C(N)N)C)CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CO)CC(C)C)C,Kd=11.4uM,4.943095,4.94,1,A,A,1,A,A,0,,C,A,dimer,1,1,127,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9353484511375428,0.6632500886917114,87.78359985351562,88.86715698242188,0.3872783780097961,0.938600480556488,0.8749495148658752,0.7308151125907898,0.8091810345649719,0.5725399851799011,GSLVATVKEAGRSIHEIPR,Low,"(4.866, 5.014]",train
1RGJ,protein-peptide,P60615,IVCHTTATSPISAVTCPPGENLCYRKMWCDAFCSSRGKVVELGCAATCPSKKPYEEVTCCSTDKCNPHPKQRPG,FRYYESSLEPWDD,ILE-VAL-CYS-HIS-THR-THR-ALA-THR-SER-PRO-ILE-SER-ALA-VAL-THR-CYS-PRO-PRO-GLY-GLU-ASN-LEU-CYS-TYR-ARG-LYS-MET-TRP-CYS-ASP-ALA-PHE-CYS-SER-SER-ARG-GLY-LYS-VAL-VAL-GLU-LEU-GLY-CYS-ALA-ALA-THR-CYS-PRO-SER-LYS-LYS-PRO-TYR-GLU-GLU-VAL-THR-CYS-CYS-SER-THR-ASP-LYS-CYS-ASN-PRO-HIS-PRO-LYS-GLN-ARG-PRO-GLY,PHE-ARG-TYR-TYR-GLU-SER-SER-LEU-GLU-PRO-TRP-ASP-ASP,74,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)CCC(=O)O)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CCC[NH+]=C(N)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCC(=O)O,IC50=4.9nM,8.309804,8.31,1,A,A,1,A,A,0,,B,A,,1,1,74,13,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8774131536483765,0.7730218172073364,64.11616516113281,63.403297424316406,0.6498535871505737,0.809019923210144,0.6835437417030334,0.76764976978302,0.7175471782684326,0.7236891984939575,FRYYESSLEPWDD,Moderate,"(7.921, 8.383]",train
1RST,protein-peptide,P22629,MEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAAS,AWRHPQFGG,MET-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER,ALA-TRP-ARG-HIS-PRO-GLN-PHE-GLY-GLY,127,9,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)Cc1nc[nH]c1,Kd=37uM,4.431798,4.43,1,A,A,1,A,A,0,,P,B,,1,1,127,9,0,C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)O,0.8918875455856323,0.7833777666091919,90.75366973876952,89.33356475830078,0.4212127923965454,0.7435155510902405,0.8860874176025391,0.8505712151527405,0.8152125477790833,0.7665794491767883,AWRHPQFGG,Low,"(4.319, 4.456]",train
1RZX,protein-peptide,O97111,ETHRRVRLLKHGSDKPLGFYIRDGTSVRVTASGLEKQPGIFISRLVPGGLAESTGLLAVNDEVIEVNGIEVAGKTLDQVTDMMVANSSNLIITVKPAN,VKESLV,GLU-THR-HIS-ARG-ARG-VAL-ARG-LEU-LEU-LYS-HIS-GLY-SER-ASP-LYS-PRO-LEU-GLY-PHE-TYR-ILE-ARG-ASP-GLY-THR-SER-VAL-ARG-VAL-THR-ALA-SER-GLY-LEU-GLU-LYS-GLN-PRO-GLY-ILE-PHE-ILE-SER-ARG-LEU-VAL-PRO-GLY-GLY-LEU-ALA-GLU-SER-THR-GLY-LEU-LEU-ALA-VAL-ASN-ASP-GLU-VAL-ILE-GLU-VAL-ASN-GLY-ILE-GLU-VAL-ALA-GLY-LYS-THR-LEU-ASP-GLN-VAL-THR-ASP-MET-MET-VAL-ALA-ASN-SER-SER-ASN-LEU-ILE-ILE-THR-VAL-LYS-PRO-ALA-ASN,ACE-VAL-LYS-GLU-SER-LEU-VAL,98,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)CO)CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)C,Kd=80uM,4.09691,4.1,1,A,A,1,A,A,0,,B,A,,1,1,98,7,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,0.9627161026000975,0.8871763944625854,97.9257354736328,93.74312591552734,0.3025125861167907,0.4427562654018402,0.9244905114173888,0.9067869186401368,0.9362147450447084,0.8822737336158752,VKESLV,Low,"(3.924, 4.155]",train
1SFI,protein-peptide,Q4GWU5 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,GRCTKSIPPICFPD,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLY-ARG-CYS-THR-LYS-SER-ILE-PRO-PRO-ILE-CYS-PHE-PRO-ASP,223,14,[NH3+]CCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)[C@H](CC)C)CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N2)CCC[NH+]=C(N)N)CC(=O)O)[C@H](O)C,Ki=0.1nM,10.0,10.0,1,A,A,1,A,A,0,,I,A,,1,1,223,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9767051339149476,0.6975048780441284,96.28035736083984,93.10861206054688,0.3047817051410675,0.7564408779144287,0.9610544443130492,0.8625046014785767,0.9436978697776794,0.6562549471855164,GRCTKSIPPICFPD,High,"(8.824, 12.12]",train
1SHC,protein-peptide,P29353 P04629,GSHMGQLGGEEWTRHGSFVNKPTRGWLHPNDKVMGPGVSYLVRYMGCVEVLQSMRALDFNTRTQVTREAISLVCEAVPGAKGATRRRKPCSRPLSSILGRSNLKFAGMPITLTVSTSSLNLMAADCKQIIANHHMQSISFASGGDPDTAEYVAYVAKDPVNQRACHILECPEGLAQDVISTIGQAFELRFKQYLR,HIIENPQYFSDA,GLY-SER-HIS-MET-GLY-GLN-LEU-GLY-GLY-GLU-GLU-TRP-THR-ARG-HIS-GLY-SER-PHE-VAL-ASN-LYS-PRO-THR-ARG-GLY-TRP-LEU-HIS-PRO-ASN-ASP-LYS-VAL-MET-GLY-PRO-GLY-VAL-SER-TYR-LEU-VAL-ARG-TYR-MET-GLY-CYS-VAL-GLU-VAL-LEU-GLN-SER-MET-ARG-ALA-LEU-ASP-PHE-ASN-THR-ARG-THR-GLN-VAL-THR-ARG-GLU-ALA-ILE-SER-LEU-VAL-CYS-GLU-ALA-VAL-PRO-GLY-ALA-LYS-GLY-ALA-THR-ARG-ARG-ARG-LYS-PRO-CYS-SER-ARG-PRO-LEU-SER-SER-ILE-LEU-GLY-ARG-SER-ASN-LEU-LYS-PHE-ALA-GLY-MET-PRO-ILE-THR-LEU-THR-VAL-SER-THR-SER-SER-LEU-ASN-LEU-MET-ALA-ALA-ASP-CYS-LYS-GLN-ILE-ILE-ALA-ASN-HIS-HIS-MET-GLN-SER-ILE-SER-PHE-ALA-SER-GLY-GLY-ASP-PRO-ASP-THR-ALA-GLU-TYR-VAL-ALA-TYR-VAL-ALA-LYS-ASP-PRO-VAL-ASN-GLN-ARG-ALA-CYS-HIS-ILE-LEU-GLU-CYS-PRO-GLU-GLY-LEU-ALA-GLN-ASP-VAL-ILE-SER-THR-ILE-GLY-GLN-ALA-PHE-GLU-LEU-ARG-PHE-LYS-GLN-TYR-LEU-ARG,HIS-ILE-ILE-GLU-ASN-PRO-GLN-PTR-PHE-SER-ASP-ALA,195,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1cnc[nH]1)[NH3+])CCC(=O)O)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)OP(O)(O)O)Cc1ccccc1,Kd=53nM,7.275724,7.28,1,A,A,1,A,A,0,,B,A,,1,1,195,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,1.0009595155715942,0.9162354469299316,75.98979949951172,80.47520446777344,0.4717139303684234,0.5708722472190857,0.862023115158081,0.912422776222229,0.9269978404045104,0.9171885848045348,HIIENPQYFSDA,Moderate,"(7.268, 7.523]",train
1SLE,protein-peptide,P22629,DPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKP,CHPQGPPC,ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO,ACE-CYS-HIS-PRO-GLN-GLY-PRO-PRO-CYS-NH2,135,10,CC(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC1=O)Cc1[nH]cnc1)CCC2)CCC(=O)N)C(=O)N,Kd=670nM,6.173925,6.17,1,A,A,1,A,A,0,,M,B,,1,1,135,10,0,NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O,,NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O,0.8483173251152039,0.8589826226234436,87.88373565673828,89.81239318847656,0.4115121066570282,0.6201930046081543,0.8988362550735474,0.8634333610534668,0.7963519096374512,0.8162031769752502,CHPQGPPC,Low,"(6.097, 6.26]",val
1SLG,protein-peptide,P22629,DPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKP,FSHPQNT,ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO,PHE-SER-HIS-PRO-GLN-ASN-THR,135,7,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(=O)N)CCC(=O)N)Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)[NH3+],Kd=125uM,3.90309,3.9,1,A,A,1,A,A,0,,M,B,,1,1,135,7,0,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.92976576089859,0.876198410987854,89.15982055664062,89.9321517944336,0.3833661079406738,0.5829961895942688,0.9018846154212952,0.8712305426597595,0.8707148432731628,0.8357736468315125,FSHPQNT,Low,"(3.548, 3.924]",val
1STS,protein-peptide,P22629,AEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKP,FCHPQNT,ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO,PHE-CYS-HIS-PRO-GLN-ASN-THR-NH2,123,8,SC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)[C@H](O)C)CC(=O)N)CCC(=O)N)Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)[NH3+],Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,M,B,,1,1,123,8,0,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8934293985366821,0.8214017152786255,92.93634796142578,89.53942108154297,0.4294197559356689,0.6584689617156982,0.8937786817550659,0.8672471642494202,0.8596882224082947,0.8099403381347656,FCHPQNT,Low,"(4.866, 5.014]",train
4GLY,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,CCLGRGCENHRCL,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,CYS-CYS-LEU-GLY-ARG-GLY-CYS-GLU-ASN-HIS-ARG-CYS-LEU-NH2,245,14,OC(=O)CC[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)N)Cc1c[nH]cn1)CCC[NH+]=C(N)N)C(=O)N[C@H](C(=O)N)CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N2)CCC[NH+]=C(N)N,Ki=7.7uM,5.113509,5.11,1,A,A,1,A,A,0,,B,A,,1,1,245,14,0,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CS)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)O,0.919768452644348,0.7892522811889648,96.10051727294922,94.9889907836914,0.320932000875473,0.6814340353012085,0.9595087170600892,0.903488039970398,0.8783411383628845,0.7606933116912842,CCLGRGCENHRCL,Low,"(5.105, 5.222]",train
4GNE,protein-peptide,Q9BZ95 P84243,SNARKIKTEPKQMHEDYCFQCGDGGELVMCDKKDCPKAYHLLCLNLTQPPYGKWECPWHQCDECSSAAVSFCEFCPHSFCKDHEKGALVPSALEGRLCCSEHDPMAP,ARTKQTA,SER-ASN-ALA-ARG-LYS-ILE-LYS-THR-GLU-PRO-LYS-GLN-MET-HIS-GLU-ASP-TYR-CYS-PHE-GLN-CYS-GLY-ASP-GLY-GLY-GLU-LEU-VAL-MET-CYS-ASP-LYS-LYS-ASP-CYS-PRO-LYS-ALA-TYR-HIS-LEU-LEU-CYS-LEU-ASN-LEU-THR-GLN-PRO-PRO-TYR-GLY-LYS-TRP-GLU-CYS-PRO-TRP-HIS-GLN-CYS-ASP-GLU-CYS-SER-SER-ALA-ALA-VAL-SER-PHE-CYS-GLU-PHE-CYS-PRO-HIS-SER-PHE-CYS-LYS-ASP-HIS-GLU-LYS-GLY-ALA-LEU-VAL-PRO-SER-ALA-LEU-GLU-GLY-ARG-LEU-CYS-CYS-SER-GLU-HIS-ASP-PRO-MET-ALA-PRO,ALA-ARG-THR-LYS-GLN-THR-ALA,107,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=3.4mM,2.468521,2.47,1,A,A,1,A,A,0,,B,A,,1,1,107,7,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.969858944416046,0.8563004732131958,89.92327880859375,82.36009216308594,0.4180097281932831,0.6438653469085693,0.8105770349502563,0.8224567174911499,0.8890653848648071,0.7829856872558594,ARTKQTA,Low,"(2.044, 3.548]",train
4GPK,protein-peptide,G5DDY8,MAVTDLRDVEEDVKGKLDEWLNALVHLDKQQVERIYEELQGEMKHVLDFEIINYYKLLYTRYLIMKRDISALEEELDKLKKVYKKYSPFQKLLYMYGRGLLCCLQYRWKDGLDYLLKTEVMAKEQGYHETGLYYNIALAYTHLDIHHLAIHFVNMALEGFRSEYKFRNIINCQILIAVSYTEKGQYEEALKMYESILREATSFADKDVLLAITLSNMGSIYYKKGKYQQAKKYYLDSLQLQKQIDLNYLDTIYEMALVCIKLEELEEARTLIDKGIDAAKQEERFNAKLYLLLMLRYKYFEEAKDYKAFLENEAIPLYKSAGNKIELKKVYVELAEHFSSLSRFEESNRYYRLVIDLMNDNKEERSHHHHHH,SSKPDIVG,MET-ALA-VAL-THR-ASP-LEU-ARG-ASP-VAL-GLU-GLU-ASP-VAL-LYS-GLY-LYS-LEU-ASP-GLU-TRP-LEU-ASN-ALA-LEU-VAL-HIS-LEU-ASP-LYS-GLN-GLN-VAL-GLU-ARG-ILE-TYR-GLU-GLU-LEU-GLN-GLY-GLU-MET-LYS-HIS-VAL-LEU-ASP-PHE-GLU-ILE-ILE-ASN-TYR-TYR-LYS-LEU-LEU-TYR-THR-ARG-TYR-LEU-ILE-MET-LYS-ARG-ASP-ILE-SER-ALA-LEU-GLU-GLU-GLU-LEU-ASP-LYS-LEU-LYS-LYS-VAL-TYR-LYS-LYS-TYR-SER-PRO-PHE-GLN-LYS-LEU-LEU-TYR-MET-TYR-GLY-ARG-GLY-LEU-LEU-CYS-CYS-LEU-GLN-TYR-ARG-TRP-LYS-ASP-GLY-LEU-ASP-TYR-LEU-LEU-LYS-THR-GLU-VAL-MET-ALA-LYS-GLU-GLN-GLY-TYR-HIS-GLU-THR-GLY-LEU-TYR-TYR-ASN-ILE-ALA-LEU-ALA-TYR-THR-HIS-LEU-ASP-ILE-HIS-HIS-LEU-ALA-ILE-HIS-PHE-VAL-ASN-MET-ALA-LEU-GLU-GLY-PHE-ARG-SER-GLU-TYR-LYS-PHE-ARG-ASN-ILE-ILE-ASN-CYS-GLN-ILE-LEU-ILE-ALA-VAL-SER-TYR-THR-GLU-LYS-GLY-GLN-TYR-GLU-GLU-ALA-LEU-LYS-MET-TYR-GLU-SER-ILE-LEU-ARG-GLU-ALA-THR-SER-PHE-ALA-ASP-LYS-ASP-VAL-LEU-LEU-ALA-ILE-THR-LEU-SER-ASN-MET-GLY-SER-ILE-TYR-TYR-LYS-LYS-GLY-LYS-TYR-GLN-GLN-ALA-LYS-LYS-TYR-TYR-LEU-ASP-SER-LEU-GLN-LEU-GLN-LYS-GLN-ILE-ASP-LEU-ASN-TYR-LEU-ASP-THR-ILE-TYR-GLU-MET-ALA-LEU-VAL-CYS-ILE-LYS-LEU-GLU-GLU-LEU-GLU-GLU-ALA-ARG-THR-LEU-ILE-ASP-LYS-GLY-ILE-ASP-ALA-ALA-LYS-GLN-GLU-GLU-ARG-PHE-ASN-ALA-LYS-LEU-TYR-LEU-LEU-LEU-MET-LEU-ARG-TYR-LYS-TYR-PHE-GLU-GLU-ALA-LYS-ASP-TYR-LYS-ALA-PHE-LEU-GLU-ASN-GLU-ALA-ILE-PRO-LEU-TYR-LYS-SER-ALA-GLY-ASN-LYS-ILE-GLU-LEU-LYS-LYS-VAL-TYR-VAL-GLU-LEU-ALA-GLU-HIS-PHE-SER-SER-LEU-SER-ARG-PHE-GLU-GLU-SER-ASN-ARG-TYR-TYR-ARG-LEU-VAL-ILE-ASP-LEU-MET-ASN-ASP-ASN-LYS-GLU-GLU-ARG-SER-HIS-HIS-HIS-HIS-HIS-HIS,SER-SER-LYS-PRO-ASP-ILE-VAL-GLY,372,8,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)[C@H](CC)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CO,Kd=0.03uM,7.522879,7.52,1,A,A,1,A,A,0,,M,A,,1,1,372,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,0.9243769645690918,0.9166048765182496,71.71441650390625,74.36429595947266,0.4241470396518707,0.4739587903022766,0.8422527313232422,0.8770509362220764,0.9317501783370972,0.9264933466911316,SSKPDIVG,Moderate,"(7.268, 7.523]",train
4GQ6,protein-peptide,O00255 Q03164,GGSSSMGLKAAQKTLFPLRSIDDVVRLFAAELGREEPDLVLLSLVLGFVEHFLAVNRVGLTYFPVADLSIIAALYARFTAQIRGAVDLSLYPREGGVSSRELVKKVSDVIWNSLSRSYFKDRAHIQSLFSFITGTKLDSSGVAFAVVGACQALGLRDVHLALSEDHAWVVFGPNGEQTAEVTWHGKGNEDRRGQTVNAGVAERSWLYLKGSYMRCDRKMEVAFMVCAINPSIDLHTDSLELLQLQQKLLWLLYDLGHLERYPMALGNLADLEELEPTPGRPDPLTLYHKGIASAKTYYRDEHIYPYMYLAGYHCRNRNVREALQAWADTATVIQDYNYCREDEEIYKEFFEVANDVIPNLLKEAASLLEAGSQGSALQDPECFAHLLRFYDGICKWEEGSPTPVLHVGWATFLVQSLGRFEGQVRQKVRIVSVPAPAASPPPEGPVLTFQSEKMKGMKELLVATKINSSAIKLQLTAQSQVQMKKQKVS,SARWRFPARPGT,GLY-GLY-SER-SER-SER-MET-GLY-LEU-LYS-ALA-ALA-GLN-LYS-THR-LEU-PHE-PRO-LEU-ARG-SER-ILE-ASP-ASP-VAL-VAL-ARG-LEU-PHE-ALA-ALA-GLU-LEU-GLY-ARG-GLU-GLU-PRO-ASP-LEU-VAL-LEU-LEU-SER-LEU-VAL-LEU-GLY-PHE-VAL-GLU-HIS-PHE-LEU-ALA-VAL-ASN-ARG-VAL-GLY-LEU-THR-TYR-PHE-PRO-VAL-ALA-ASP-LEU-SER-ILE-ILE-ALA-ALA-LEU-TYR-ALA-ARG-PHE-THR-ALA-GLN-ILE-ARG-GLY-ALA-VAL-ASP-LEU-SER-LEU-TYR-PRO-ARG-GLU-GLY-GLY-VAL-SER-SER-ARG-GLU-LEU-VAL-LYS-LYS-VAL-SER-ASP-VAL-ILE-TRP-ASN-SER-LEU-SER-ARG-SER-TYR-PHE-LYS-ASP-ARG-ALA-HIS-ILE-GLN-SER-LEU-PHE-SER-PHE-ILE-THR-GLY-THR-LYS-LEU-ASP-SER-SER-GLY-VAL-ALA-PHE-ALA-VAL-VAL-GLY-ALA-CYS-GLN-ALA-LEU-GLY-LEU-ARG-ASP-VAL-HIS-LEU-ALA-LEU-SER-GLU-ASP-HIS-ALA-TRP-VAL-VAL-PHE-GLY-PRO-ASN-GLY-GLU-GLN-THR-ALA-GLU-VAL-THR-TRP-HIS-GLY-LYS-GLY-ASN-GLU-ASP-ARG-ARG-GLY-GLN-THR-VAL-ASN-ALA-GLY-VAL-ALA-GLU-ARG-SER-TRP-LEU-TYR-LEU-LYS-GLY-SER-TYR-MET-ARG-CYS-ASP-ARG-LYS-MET-GLU-VAL-ALA-PHE-MET-VAL-CYS-ALA-ILE-ASN-PRO-SER-ILE-ASP-LEU-HIS-THR-ASP-SER-LEU-GLU-LEU-LEU-GLN-LEU-GLN-GLN-LYS-LEU-LEU-TRP-LEU-LEU-TYR-ASP-LEU-GLY-HIS-LEU-GLU-ARG-TYR-PRO-MET-ALA-LEU-GLY-ASN-LEU-ALA-ASP-LEU-GLU-GLU-LEU-GLU-PRO-THR-PRO-GLY-ARG-PRO-ASP-PRO-LEU-THR-LEU-TYR-HIS-LYS-GLY-ILE-ALA-SER-ALA-LYS-THR-TYR-TYR-ARG-ASP-GLU-HIS-ILE-TYR-PRO-TYR-MET-TYR-LEU-ALA-GLY-TYR-HIS-CYS-ARG-ASN-ARG-ASN-VAL-ARG-GLU-ALA-LEU-GLN-ALA-TRP-ALA-ASP-THR-ALA-THR-VAL-ILE-GLN-ASP-TYR-ASN-TYR-CYS-ARG-GLU-ASP-GLU-GLU-ILE-TYR-LYS-GLU-PHE-PHE-GLU-VAL-ALA-ASN-ASP-VAL-ILE-PRO-ASN-LEU-LEU-LYS-GLU-ALA-ALA-SER-LEU-LEU-GLU-ALA-GLY-SER-GLN-GLY-SER-ALA-LEU-GLN-ASP-PRO-GLU-CYS-PHE-ALA-HIS-LEU-LEU-ARG-PHE-TYR-ASP-GLY-ILE-CYS-LYS-TRP-GLU-GLU-GLY-SER-PRO-THR-PRO-VAL-LEU-HIS-VAL-GLY-TRP-ALA-THR-PHE-LEU-VAL-GLN-SER-LEU-GLY-ARG-PHE-GLU-GLY-GLN-VAL-ARG-GLN-LYS-VAL-ARG-ILE-VAL-SER-VAL-PRO-ALA-PRO-ALA-ALA-SER-PRO-PRO-PRO-GLU-GLY-PRO-VAL-LEU-THR-PHE-GLN-SER-GLU-LYS-MET-LYS-GLY-MET-LYS-GLU-LEU-LEU-VAL-ALA-THR-LYS-ILE-ASN-SER-SER-ALA-ILE-LYS-LEU-GLN-LEU-THR-ALA-GLN-SER-GLN-VAL-GLN-MET-LYS-LYS-GLN-LYS-VAL-SER,SER-ALA-ARG-TRP-ARG-PHE-PRO-ALA-ARG-PRO-GLY-THR,489,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)O)[C@H](O)C)CCC[NH+]=C(N)N)C)Cc1ccccc1)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)C)[NH3+],Kd=53nM,7.275724,7.28,1,A,A,1,A,A,0,,B,A,,1,1,489,12,0,C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8539884686470032,0.8714850544929504,88.36676025390625,90.07567596435548,0.4882600903511047,0.6677120327949524,0.8904926776885986,0.8954386115074158,0.8111796975135803,0.850159227848053,SARWRFPARPGT,Moderate,"(7.268, 7.523]",train
4GXL,protein-peptide,O00214 Q13137,MGSSHHHHHHSSGENLYFQHMPFAARLNTPMGPGRTVVVKGEVNANAKSFNVDLLAGKSKDIALHLNPRLNIKAFVRNSFLQESWGEEERNITSFPFSPGMYFEMIIYCDVREFKVAVNGVHSLEYKHRFKELSSIDTLEINGDIHLLEVRSW,ARQNPGLAYGNPYS,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-GLU-ASN-LEU-TYR-PHE-GLN-HIS-MET-PRO-PHE-ALA-ALA-ARG-LEU-ASN-THR-PRO-MET-GLY-PRO-GLY-ARG-THR-VAL-VAL-VAL-LYS-GLY-GLU-VAL-ASN-ALA-ASN-ALA-LYS-SER-PHE-ASN-VAL-ASP-LEU-LEU-ALA-GLY-LYS-SER-LYS-ASP-ILE-ALA-LEU-HIS-LEU-ASN-PRO-ARG-LEU-ASN-ILE-LYS-ALA-PHE-VAL-ARG-ASN-SER-PHE-LEU-GLN-GLU-SER-TRP-GLY-GLU-GLU-GLU-ARG-ASN-ILE-THR-SER-PHE-PRO-PHE-SER-PRO-GLY-MET-TYR-PHE-GLU-MET-ILE-ILE-TYR-CYS-ASP-VAL-ARG-GLU-PHE-LYS-VAL-ALA-VAL-ASN-GLY-VAL-HIS-SER-LEU-GLU-TYR-LYS-HIS-ARG-PHE-LYS-GLU-LEU-SER-SER-ILE-ASP-THR-LEU-GLU-ILE-ASN-GLY-ASP-ILE-HIS-LEU-LEU-GLU-VAL-ARG-SER-TRP,ALA-ARG-GLN-ASN-PRO-GLY-LEU-ALA-TYR-GLY-ASN-PRO-TYR-SER,153,14,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)[NH3+])CC(C)C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O,Kd=5.2uM,5.283997,5.28,1,A,A,1,A,A,0,,B,A,,1,1,153,14,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,0.8810898661613464,0.6413168907165527,87.99439239501953,84.21356964111328,0.42082080245018,1.038179636001587,0.8869927525520325,0.7419811487197876,0.7748237252235413,0.5589612722396851,ARQNPGLAYGNPYS,Low,"(5.222, 5.31]",train
4GY5,protein-peptide,Q96T88 P84243,GPLGSPEFLYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRDEPCSSTSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGEGSPMVDNPMRRKSGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRND,ARTKQTARKSTGGKAPR,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-LEU-TYR-LYS-VAL-ASN-GLU-TYR-VAL-ASP-ALA-ARG-ASP-THR-ASN-MET-GLY-ALA-TRP-PHE-GLU-ALA-GLN-VAL-VAL-ARG-VAL-THR-ARG-LYS-ALA-PRO-SER-ARG-ASP-GLU-PRO-CYS-SER-SER-THR-SER-ARG-PRO-ALA-LEU-GLU-GLU-ASP-VAL-ILE-TYR-HIS-VAL-LYS-TYR-ASP-ASP-TYR-PRO-GLU-ASN-GLY-VAL-VAL-GLN-MET-ASN-SER-ARG-ASP-VAL-ARG-ALA-ARG-ALA-ARG-THR-ILE-ILE-LYS-TRP-GLN-ASP-LEU-GLU-VAL-GLY-GLN-VAL-VAL-MET-LEU-ASN-TYR-ASN-PRO-ASP-ASN-PRO-LYS-GLU-ARG-GLY-PHE-TRP-TYR-ASP-ALA-GLU-ILE-SER-ARG-LYS-ARG-GLU-THR-ARG-THR-ALA-ARG-GLU-LEU-TYR-ALA-ASN-VAL-VAL-LEU-GLY-ASP-ASP-SER-LEU-ASN-ASP-CYS-ARG-ILE-ILE-PHE-VAL-ASP-GLU-VAL-PHE-LYS-ILE-GLU-ARG-PRO-GLY-GLU-GLY-SER-PRO-MET-VAL-ASP-ASN-PRO-MET-ARG-ARG-LYS-SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA-PRO-ARG,241,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.15uM,6.823909,6.82,1,A,A,1,A,A,0,,E,A,,1,1,241,17,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.8374305367469788,0.7122836112976074,60.38130187988281,63.580963134765625,0.5666907429695129,0.998676061630249,0.7622053027153015,0.7579541206359863,0.7908297777175903,0.6775256991386414,ARTKQTARKSTGGKAPR,Low,"(6.696, 6.824]",val
4H36,protein-peptide,P15336 P53779,DNQFYSVEVGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAVLDRNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIISLLNVFTPQKTLEEFQDVYLVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMVRHKILFPGRDYIDQWNKVIEQLGTPCPEFMKKLQPTVRNYVENRPKYAGLTFPKLFPDSLFPADSEHNKLKASQARDLLSKMLVIDPAKRISVDDALQHPYINVWYDPAEVEAPPPQIYDKQLDEREHTIEEWKELIYKEVMN,KHEMTLKF,ASP-ASN-GLN-PHE-TYR-SER-VAL-GLU-VAL-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-VAL-LEU-ASP-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-SER-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-THR-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-LEU-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-VAL-ARG-HIS-LYS-ILE-LEU-PHE-PRO-GLY-ARG-ASP-TYR-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-ASN-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-LEU-THR-PHE-PRO-LYS-LEU-PHE-PRO-ASP-SER-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-PRO-ALA-LYS-ARG-ILE-SER-VAL-ASP-ASP-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-ALA-GLU-VAL-GLU-ALA-PRO-PRO-PRO-GLN-ILE-TYR-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASN,LYS-HIS-GLU-MET-THR-LEU-LYS-PHE,356,8,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)C)CC(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)O,IC50=53.4uM,4.272459,4.27,1,A,A,1,A,A,0,,B,A,,1,1,356,8,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9121829271316528,0.8164269924163818,83.02976989746094,86.70166778564453,0.4258545637130737,0.706453800201416,0.9104626178741456,0.8887222409248352,0.8988767266273499,0.7983531355857849,KHEMTLKF,Low,"(4.155, 4.319]",val
4H39,protein-peptide,P53779 Q9UQF2,DNQFYSVEVGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAVLDRNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIISLLNVFTPQKTLEEFQDVYLVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMVRHKILFPGRDYIDQWNKVIEQLGTPCPEFMKKLQPTVRNYVENRPKYAGLTFPKLFPDSLFPADSEHNKLKASQARDLLSKMLVIDPAKRISVDDALQHPYINVWYDPAEVEAPPPQIYDKQLDEREHTIEEWKELIYKEVMN,PKRPTTLNLF,ASP-ASN-GLN-PHE-TYR-SER-VAL-GLU-VAL-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-VAL-LEU-ASP-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-SER-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-THR-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-LEU-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-VAL-ARG-HIS-LYS-ILE-LEU-PHE-PRO-GLY-ARG-ASP-TYR-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-ASN-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-LEU-THR-PHE-PRO-LYS-LEU-PHE-PRO-ASP-SER-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-PRO-ALA-LYS-ARG-ILE-SER-VAL-ASP-ASP-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-ALA-GLU-VAL-GLU-ALA-PRO-PRO-PRO-GLN-ILE-TYR-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASN,PRO-LYS-ARG-PRO-THR-THR-LEU-ASN-LEU-PHE,356,10,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CCC[NH+]=C(N)N)C,IC50=0.21uM,6.677781,6.68,1,A,A,1,A,A,0,,B,A,,1,1,356,10,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9276722073554992,0.8100821375846863,84.04430389404297,85.39291381835938,0.4400260150432586,0.7143279910087585,0.907884955406189,0.8816846013069153,0.9155424237251282,0.7921814918518066,PKRPTTLNLF,Low,"(6.523, 6.696]",train
4H3B,protein-peptide,O60239 P53779,DNQFYSVEVGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAVLDRNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIISLLNVFTPQKTLEEFQDVYLVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMVRHKILFPGRDYIDQWNKVIEQLGTPCPEFMKKLQPTVRNYVENRPKYAGLTFPKLFPDSLFPADSEHNKLKASQARDLLSKMLVIDPAKRISVDDALQHPYINVWYDPAEVEAPPPQIYDKQLDEREHTIEEWKELIYKEVMN,VVRPGSLDLP,ASP-ASN-GLN-PHE-TYR-SER-VAL-GLU-VAL-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-VAL-LEU-ASP-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-SER-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-THR-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-LEU-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-VAL-ARG-HIS-LYS-ILE-LEU-PHE-PRO-GLY-ARG-ASP-TYR-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-ASN-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-LEU-THR-PHE-PRO-LYS-LEU-PHE-PRO-ASP-SER-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-PRO-ALA-LYS-ARG-ILE-SER-VAL-ASP-ASP-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-ALA-GLU-VAL-GLU-ALA-PRO-PRO-PRO-GLN-ILE-TYR-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASN,VAL-VAL-ARG-PRO-GLY-SER-LEU-ASP-LEU-PRO,356,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(=O)O)CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)[NH3+])CCC[NH+]=C(N)N,IC50=6.76uM,5.170053,5.17,1,A,A,1,A,A,0,,B,A,,1,1,356,10,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,0.9389491081237792,0.8142677545547485,83.67499542236328,85.91475677490234,0.413208395242691,0.691458523273468,0.9179806113243104,0.890754222869873,0.9271146655082704,0.795146107673645,VVRPGSLDLP,Low,"(5.105, 5.222]",train
4H3Q,protein-peptide,P36507 P28482,GSMAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVRVAIKKISPFEHQTYCQRTLREIKILLAFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTSDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCGINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLAQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,RRKPVLPALTINP,GLY-SER-MET-ALA-ALA-ALA-ALA-ALA-ALA-GLY-ALA-GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-VAL-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ALA-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-THR-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-SER-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-THR-GLU-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-GLY-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-ALA-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,ARG-ARG-LYS-PRO-VAL-LEU-PRO-ALA-LEU-THR-ILE-ASN-PRO,362,13,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)[C@H](O)C)CC(C)C)C)CC(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=8uM,5.09691,5.1,1,A,A,1,A,A,0,,B,A,,1,1,362,13,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8546745777130127,0.7914443612098694,76.98809051513672,79.94071960449219,0.5437589883804321,0.8286247849464417,0.8692893981933594,0.8573281168937683,0.8060208559036255,0.7508021593093872,RRKPVLPALTINP,Low,"(5.014, 5.105]",train
4H75,protein-peptide,Q5TEC6 Q9Y657,GSMKKRTSHKKHRSSVGPSKPVSQPRRNIVGCRIQHGWKEGNGPVTQWKGTVLDQVPVNPSLYLIKYDGFDCVYGLELNKDERVSALEVLPDRVATSRISDAHLADTMIGKAVEHMFETEDGSKDEWRGMVLARAPVMNTWFYITYEKDPVLYMYQLLDDYKEGDLRIMPDSNDSPPAEREPGEVVDSLVGKQVEYAKEDGSKRTGMVIHQVEAKPSVYFIKFDDDFHIYVYDLVKTS,ARTKQTAR,GLY-SER-MET-LYS-LYS-ARG-THR-SER-HIS-LYS-LYS-HIS-ARG-SER-SER-VAL-GLY-PRO-SER-LYS-PRO-VAL-SER-GLN-PRO-ARG-ARG-ASN-ILE-VAL-GLY-CYS-ARG-ILE-GLN-HIS-GLY-TRP-LYS-GLU-GLY-ASN-GLY-PRO-VAL-THR-GLN-TRP-LYS-GLY-THR-VAL-LEU-ASP-GLN-VAL-PRO-VAL-ASN-PRO-SER-LEU-TYR-LEU-ILE-LYS-TYR-ASP-GLY-PHE-ASP-CYS-VAL-TYR-GLY-LEU-GLU-LEU-ASN-LYS-ASP-GLU-ARG-VAL-SER-ALA-LEU-GLU-VAL-LEU-PRO-ASP-ARG-VAL-ALA-THR-SER-ARG-ILE-SER-ASP-ALA-HIS-LEU-ALA-ASP-THR-MET-ILE-GLY-LYS-ALA-VAL-GLU-HIS-MET-PHE-GLU-THR-GLU-ASP-GLY-SER-LYS-ASP-GLU-TRP-ARG-GLY-MET-VAL-LEU-ALA-ARG-ALA-PRO-VAL-MET-ASN-THR-TRP-PHE-TYR-ILE-THR-TYR-GLU-LYS-ASP-PRO-VAL-LEU-TYR-MET-TYR-GLN-LEU-LEU-ASP-ASP-TYR-LYS-GLU-GLY-ASP-LEU-ARG-ILE-MET-PRO-ASP-SER-ASN-ASP-SER-PRO-PRO-ALA-GLU-ARG-GLU-PRO-GLY-GLU-VAL-VAL-ASP-SER-LEU-VAL-GLY-LYS-GLN-VAL-GLU-TYR-ALA-LYS-GLU-ASP-GLY-SER-LYS-ARG-THR-GLY-MET-VAL-ILE-HIS-GLN-VAL-GLU-ALA-LYS-PRO-SER-VAL-TYR-PHE-ILE-LYS-PHE-ASP-ASP-ASP-PHE-HIS-ILE-TYR-VAL-TYR-ASP-LEU-VAL-LYS-THR-SER,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG,238,8,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=0.25uM,6.60206,6.6,1,A,A,1,A,A,0,,B,A,,1,1,238,8,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8711767196655273,0.9104838371276855,76.86627197265625,76.26921081542969,0.572742760181427,0.7204349040985107,0.77692049741745,0.7881202697753906,0.7778708338737488,0.8386587500572205,ARTKQTAR,Low,"(6.523, 6.696]",train
4HCZ,protein-peptide,Q6TXQ4 O43189,RPRLWEGQDVLARWTDGLLYLGTIKKVDSAREVCLVQFEDDSQFLVLWKDISPAALPG,STGGVKKPHR,ARG-PRO-ARG-LEU-TRP-GLU-GLY-GLN-ASP-VAL-LEU-ALA-ARG-TRP-THR-ASP-GLY-LEU-LEU-TYR-LEU-GLY-THR-ILE-LYS-LYS-VAL-ASP-SER-ALA-ARG-GLU-VAL-CYS-LEU-VAL-GLN-PHE-GLU-ASP-ASP-SER-GLN-PHE-LEU-VAL-LEU-TRP-LYS-ASP-ILE-SER-PRO-ALA-ALA-LEU-PRO-GLY,SER-THR-GLY-GLY-VAL-M3L-LYS-PRO-HIS-ARG,58,10,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CCCC[NH3+])CCCC[N+](C)(C)C)C(C)C)[C@H](O)C)[NH3+],Kd=36uM,4.443697,4.44,1,A,A,1,A,A,0,,C,A,,1,1,58,10,0,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.8633148670196533,0.7894816398620605,95.2350845336914,95.92537689208984,0.3445885479450226,0.6012189984321594,0.8727421760559082,0.840070366859436,0.7690462470054626,0.7768344879150391,STGGVKKPHR,Low,"(4.319, 4.456]",train
4HTP,protein-peptide,P49917 Q96SD1,MAASQTSQTVASHVPFADLCSTLERIQKSKGRAEKIRHFREFLDSWRKFHDALHKNHKDVTDSFYPAMRLILPQLERERMAYGIKETMLAKLYIELLNLPRDGKDALKLLNYRTPTGTHGDAGDFAMIAYFVLKPRCLQKGSLTIQQVNDLLDSIASNNSAKRKDLIKKSLLQLITQSSALEQKWLIRMIIKDLKLGVSQQTIFSVFHNDAAELHNVTTDLEKVCRQLHDPSVGLSDISI,DVPQWEVFFKR,MET-ALA-ALA-SER-GLN-THR-SER-GLN-THR-VAL-ALA-SER-HIS-VAL-PRO-PHE-ALA-ASP-LEU-CYS-SER-THR-LEU-GLU-ARG-ILE-GLN-LYS-SER-LYS-GLY-ARG-ALA-GLU-LYS-ILE-ARG-HIS-PHE-ARG-GLU-PHE-LEU-ASP-SER-TRP-ARG-LYS-PHE-HIS-ASP-ALA-LEU-HIS-LYS-ASN-HIS-LYS-ASP-VAL-THR-ASP-SER-PHE-TYR-PRO-ALA-MET-ARG-LEU-ILE-LEU-PRO-GLN-LEU-GLU-ARG-GLU-ARG-MET-ALA-TYR-GLY-ILE-LYS-GLU-THR-MET-LEU-ALA-LYS-LEU-TYR-ILE-GLU-LEU-LEU-ASN-LEU-PRO-ARG-ASP-GLY-LYS-ASP-ALA-LEU-LYS-LEU-LEU-ASN-TYR-ARG-THR-PRO-THR-GLY-THR-HIS-GLY-ASP-ALA-GLY-ASP-PHE-ALA-MET-ILE-ALA-TYR-PHE-VAL-LEU-LYS-PRO-ARG-CYS-LEU-GLN-LYS-GLY-SER-LEU-THR-ILE-GLN-GLN-VAL-ASN-ASP-LEU-LEU-ASP-SER-ILE-ALA-SER-ASN-ASN-SER-ALA-LYS-ARG-LYS-ASP-LEU-ILE-LYS-LYS-SER-LEU-LEU-GLN-LEU-ILE-THR-GLN-SER-SER-ALA-LEU-GLU-GLN-LYS-TRP-LEU-ILE-ARG-MET-ILE-ILE-LYS-ASP-LEU-LYS-LEU-GLY-VAL-SER-GLN-GLN-THR-ILE-PHE-SER-VAL-PHE-HIS-ASN-ASP-ALA-ALA-GLU-LEU-HIS-ASN-VAL-THR-THR-ASP-LEU-GLU-LYS-VAL-CYS-ARG-GLN-LEU-HIS-ASP-PRO-SER-VAL-GLY-LEU-SER-ASP-ILE-SER-ILE,ASP-VAL-PRO-GLN-TRP-GLU-VAL-PHE-PHE-LYS-ARG,240,11,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)Cc1ccccc1)C(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)CCC(=O)N,Kd=2.4uM,5.619789,5.62,1,A,A,1,A,A,0,,C,A,,1,1,240,11,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.9436342120170592,0.7163318991661072,87.92259216308594,83.1791763305664,0.3877665102481842,0.842942476272583,0.9147288799285888,0.8293724656105042,0.9234700798988342,0.6880717873573303,DVPQWEVFFKR,Low,"(5.6, 5.699]",train
4HYB,protein-peptide,P37362 P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,VDKLYAIPRPP,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,VAL-ASP-LYS-LEU-TYR-ALC-ILE-PRO-ARG-PRO-PRO,219,11,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](CC(C)C)[NH3+])CC1CCCCC1)C,Kd=0.35uM,6.455932,6.46,1,A,A,1,A,A,0,,C,A,dimer,1,1,219,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8992230296134949,0.8644318580627441,93.08300018310548,86.56489562988281,0.3535745739936828,0.5451059341430664,0.909196138381958,0.8904690742492676,0.8668384552001953,0.8579225540161133,VDKLYAIPRPP,Low,"(6.398, 6.523]",train
4I2W,protein-peptide,P09446 G5EG62,MVARVQTAEEIRDEGNAAVKDQDYIKADELYTEALQLTTDEDKALRPVLYRNRAMARLKRDDFEGAQSDCTKALEFDGADVKALFRRSLAREQLGNVGPAFQDAKEALRLSPNDKGIVEVLQRLVKANNDKIKQTTSLANKVTDMEKLAFRGEAKDTEQKMTALNNLLVLCRESESGATGVWNQGALVPFVLNLINDASENEEVTVTAIRILDETIKNSVRCMKFLAMHDPDGPKSVRFVCRLMCKKSTKDFVDATGILVQRVFNAMAKMDRQKEMKPDPEVAEANKIWIIRVLLELQEMLQDPKVGAVQRETCIDLFLKNLMHMDGGIPRGWSWKFVEERGLLALLDVASQIPELCEYPVSAETRQHVAICLQRLEEDMVFDTKRTIFKEKVDMFFNALISRCTNDDEGHKYRIKLSCFLITMLQGPVDIGINLITNDQLTPIMLEMAASQDHLMQGIAAELIVATVSKHERAINMLKVGIPVLRALYDSEDPTVKVRALVGLCKIGAAGGDDISKATMKEEAVISLAKTCKKFLLETEKYSVDIRRYACEGLSYLSLDADVKEWIVDDSLLLKALVLLAKKAGALCVYTLATIYANLSNAFEKPKVDEEMVKLAQFAKHHVPETHPKDTEEYVEKRVRALVEEGAVPACVAVSKTESKNALELIARSLLAFAEYEDLRGRIIAEGGTVLCLRLTKEASGEGKIKAGHAIAKLGAKADPMISFPGQRAYEVVKPLCDLLHPDVEGKANYDSLLTLTNLASVSDSIRGRILKEKAIPKIEEFWFMTDHEHLRAAAAELLLNLLFFEKFYEETVAPGTDRLKLWVLYSAEVEEERLSRASAAGFAILTEDENACARIMDEIKSWPEVFKDIAMHEDAETQRRGLMGIANIMHSSNKLCSEIVSSEVFRVLVAVTKLGTINQERAGSTEQAKRGLEAAEKFGLIKATDREIYERENQMSTIQE,AGGPTIEEVD,MSE-VAL-ALA-ARG-VAL-GLN-THR-ALA-GLU-GLU-ILE-ARG-ASP-GLU-GLY-ASN-ALA-ALA-VAL-LYS-ASP-GLN-ASP-TYR-ILE-LYS-ALA-ASP-GLU-LEU-TYR-THR-GLU-ALA-LEU-GLN-LEU-THR-THR-ASP-GLU-ASP-LYS-ALA-LEU-ARG-PRO-VAL-LEU-TYR-ARG-ASN-ARG-ALA-MSE-ALA-ARG-LEU-LYS-ARG-ASP-ASP-PHE-GLU-GLY-ALA-GLN-SER-ASP-CYS-THR-LYS-ALA-LEU-GLU-PHE-ASP-GLY-ALA-ASP-VAL-LYS-ALA-LEU-PHE-ARG-ARG-SER-LEU-ALA-ARG-GLU-GLN-LEU-GLY-ASN-VAL-GLY-PRO-ALA-PHE-GLN-ASP-ALA-LYS-GLU-ALA-LEU-ARG-LEU-SER-PRO-ASN-ASP-LYS-GLY-ILE-VAL-GLU-VAL-LEU-GLN-ARG-LEU-VAL-LYS-ALA-ASN-ASN-ASP-LYS-ILE-LYS-GLN-THR-THR-SER-LEU-ALA-ASN-LYS-VAL-THR-ASP-MSE-GLU-LYS-LEU-ALA-PHE-ARG-GLY-GLU-ALA-LYS-ASP-THR-GLU-GLN-LYS-MSE-THR-ALA-LEU-ASN-ASN-LEU-LEU-VAL-LEU-CYS-ARG-GLU-SER-GLU-SER-GLY-ALA-THR-GLY-VAL-TRP-ASN-GLN-GLY-ALA-LEU-VAL-PRO-PHE-VAL-LEU-ASN-LEU-ILE-ASN-ASP-ALA-SER-GLU-ASN-GLU-GLU-VAL-THR-VAL-THR-ALA-ILE-ARG-ILE-LEU-ASP-GLU-THR-ILE-LYS-ASN-SER-VAL-ARG-CYS-MSE-LYS-PHE-LEU-ALA-MSE-HIS-ASP-PRO-ASP-GLY-PRO-LYS-SER-VAL-ARG-PHE-VAL-CYS-ARG-LEU-MSE-CYS-LYS-LYS-SER-THR-LYS-ASP-PHE-VAL-ASP-ALA-THR-GLY-ILE-LEU-VAL-GLN-ARG-VAL-PHE-ASN-ALA-MSE-ALA-LYS-MSE-ASP-ARG-GLN-LYS-GLU-MSE-LYS-PRO-ASP-PRO-GLU-VAL-ALA-GLU-ALA-ASN-LYS-ILE-TRP-ILE-ILE-ARG-VAL-LEU-LEU-GLU-LEU-GLN-GLU-MSE-LEU-GLN-ASP-PRO-LYS-VAL-GLY-ALA-VAL-GLN-ARG-GLU-THR-CYS-ILE-ASP-LEU-PHE-LEU-LYS-ASN-LEU-MSE-HIS-MSE-ASP-GLY-GLY-ILE-PRO-ARG-GLY-TRP-SER-TRP-LYS-PHE-VAL-GLU-GLU-ARG-GLY-LEU-LEU-ALA-LEU-LEU-ASP-VAL-ALA-SER-GLN-ILE-PRO-GLU-LEU-CYS-GLU-TYR-PRO-VAL-SER-ALA-GLU-THR-ARG-GLN-HIS-VAL-ALA-ILE-CYS-LEU-GLN-ARG-LEU-GLU-GLU-ASP-MSE-VAL-PHE-ASP-THR-LYS-ARG-THR-ILE-PHE-LYS-GLU-LYS-VAL-ASP-MSE-PHE-PHE-ASN-ALA-LEU-ILE-SER-ARG-CYS-THR-ASN-ASP-ASP-GLU-GLY-HIS-LYS-TYR-ARG-ILE-LYS-LEU-SER-CYS-PHE-LEU-ILE-THR-MSE-LEU-GLN-GLY-PRO-VAL-ASP-ILE-GLY-ILE-ASN-LEU-ILE-THR-ASN-ASP-GLN-LEU-THR-PRO-ILE-MSE-LEU-GLU-MSE-ALA-ALA-SER-GLN-ASP-HIS-LEU-MSE-GLN-GLY-ILE-ALA-ALA-GLU-LEU-ILE-VAL-ALA-THR-VAL-SER-LYS-HIS-GLU-ARG-ALA-ILE-ASN-MSE-LEU-LYS-VAL-GLY-ILE-PRO-VAL-LEU-ARG-ALA-LEU-TYR-ASP-SER-GLU-ASP-PRO-THR-VAL-LYS-VAL-ARG-ALA-LEU-VAL-GLY-LEU-CYS-LYS-ILE-GLY-ALA-ALA-GLY-GLY-ASP-ASP-ILE-SER-LYS-ALA-THR-MSE-LYS-GLU-GLU-ALA-VAL-ILE-SER-LEU-ALA-LYS-THR-CYS-LYS-LYS-PHE-LEU-LEU-GLU-THR-GLU-LYS-TYR-SER-VAL-ASP-ILE-ARG-ARG-TYR-ALA-CYS-GLU-GLY-LEU-SER-TYR-LEU-SER-LEU-ASP-ALA-ASP-VAL-LYS-GLU-TRP-ILE-VAL-ASP-ASP-SER-LEU-LEU-LEU-LYS-ALA-LEU-VAL-LEU-LEU-ALA-LYS-LYS-ALA-GLY-ALA-LEU-CYS-VAL-TYR-THR-LEU-ALA-THR-ILE-TYR-ALA-ASN-LEU-SER-ASN-ALA-PHE-GLU-LYS-PRO-LYS-VAL-ASP-GLU-GLU-MSE-VAL-LYS-LEU-ALA-GLN-PHE-ALA-LYS-HIS-HIS-VAL-PRO-GLU-THR-HIS-PRO-LYS-ASP-THR-GLU-GLU-TYR-VAL-GLU-LYS-ARG-VAL-ARG-ALA-LEU-VAL-GLU-GLU-GLY-ALA-VAL-PRO-ALA-CYS-VAL-ALA-VAL-SER-LYS-THR-GLU-SER-LYS-ASN-ALA-LEU-GLU-LEU-ILE-ALA-ARG-SER-LEU-LEU-ALA-PHE-ALA-GLU-TYR-GLU-ASP-LEU-ARG-GLY-ARG-ILE-ILE-ALA-GLU-GLY-GLY-THR-VAL-LEU-CYS-LEU-ARG-LEU-THR-LYS-GLU-ALA-SER-GLY-GLU-GLY-LYS-ILE-LYS-ALA-GLY-HIS-ALA-ILE-ALA-LYS-LEU-GLY-ALA-LYS-ALA-ASP-PRO-MSE-ILE-SER-PHE-PRO-GLY-GLN-ARG-ALA-TYR-GLU-VAL-VAL-LYS-PRO-LEU-CYS-ASP-LEU-LEU-HIS-PRO-ASP-VAL-GLU-GLY-LYS-ALA-ASN-TYR-ASP-SER-LEU-LEU-THR-LEU-THR-ASN-LEU-ALA-SER-VAL-SER-ASP-SER-ILE-ARG-GLY-ARG-ILE-LEU-LYS-GLU-LYS-ALA-ILE-PRO-LYS-ILE-GLU-GLU-PHE-TRP-PHE-MSE-THR-ASP-HIS-GLU-HIS-LEU-ARG-ALA-ALA-ALA-ALA-GLU-LEU-LEU-LEU-ASN-LEU-LEU-PHE-PHE-GLU-LYS-PHE-TYR-GLU-GLU-THR-VAL-ALA-PRO-GLY-THR-ASP-ARG-LEU-LYS-LEU-TRP-VAL-LEU-TYR-SER-ALA-GLU-VAL-GLU-GLU-GLU-ARG-LEU-SER-ARG-ALA-SER-ALA-ALA-GLY-PHE-ALA-ILE-LEU-THR-GLU-ASP-GLU-ASN-ALA-CYS-ALA-ARG-ILE-MSE-ASP-GLU-ILE-LYS-SER-TRP-PRO-GLU-VAL-PHE-LYS-ASP-ILE-ALA-MSE-HIS-GLU-ASP-ALA-GLU-THR-GLN-ARG-ARG-GLY-LEU-MSE-GLY-ILE-ALA-ASN-ILE-MSE-HIS-SER-SER-ASN-LYS-LEU-CYS-SER-GLU-ILE-VAL-SER-SER-GLU-VAL-PHE-ARG-VAL-LEU-VAL-ALA-VAL-THR-LYS-LEU-GLY-THR-ILE-ASN-GLN-GLU-ARG-ALA-GLY-SER-THR-GLU-GLN-ALA-LYS-ARG-GLY-LEU-GLU-ALA-ALA-GLU-LYS-PHE-GLY-LEU-ILE-LYS-ALA-THR-ASP-ARG-GLU-ILE-TYR-GLU-ARG-GLU-ASN-GLN-MSE-SER-THR-ILE-GLN-GLU,ALA-GLY-GLY-PRO-THR-ILE-GLU-GLU-VAL-ASP,961,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CNC(=O)[C@@H]([NH3+])C)C,Kd=120.8uM,3.917933,3.92,1,A,A,1,A,A,0,,B,A,,1,1,961,10,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CNC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7548257112503052,0.7717028260231018,51.22843933105469,50.90501022338867,0.641492486000061,0.8032236695289612,0.6390483975410461,0.6178767681121826,0.7747586965560913,0.803655743598938,AGGPTIEEVD,Low,"(3.548, 3.924]",train
4I2Z,protein-peptide,Q18688 G5EG62,MVARVQTAEEIRDEGNAAVKDQDYIKADELYTEALQLTTDEDKALRPVLYRNRAMARLKRDDFEGAQSDCTKALEFDGADVKALFRRSLAREQLGNVGPAFQDAKEALRLSPNDKGIVEVLQRLVKANNDKIKQTTSLANKVTDMEKLAFRGEAKDTEQKMTALNNLLVLCRESESGATGVWNQGALVPFVLNLINDASENEEVTVTAIRILDETIKNSVRCMKFLAMHDPDGPKSVRFVCRLMCKKSTKDFVDATGILVQRVFNAMAKMDRQKEMKPDPEVAEANKIWIIRVLLELQEMLQDPKVGAVQRETCIDLFLKNLMHMDGGIPRGWSWKFVEERGLLALLDVASQIPELCEYPVSAETRQHVAICLQRLEEDMVFDTKRTIFKEKVDMFFNALISRCTNDDEGHKYRIKLSCFLITMLQGPVDIGINLITNDQLTPIMLEMAASQDHLMQGIAAELIVATVSKHERAINMLKVGIPVLRALYDSEDPTVKVRALVGLCKIGAAGGDDISKATMKEEAVISLAKTCKKFLLETEKYSVDIRRYACEGLSYLSLDADVKEWIVDDSLLLKALVLLAKKAGALCVYTLATIYANLSNAFEKPKVDEEMVKLAQFAKHHVPETHPKDTEEYVEKRVRALVEEGAVPACVAVSKTESKNALELIARSLLAFAEYEDLRGRIIAEGGTVLCLRLTKEASGEGKIKAGHAIAKLGAKADPMISFPGQRAYEVVKPLCDLLHPDVEGKANYDSLLTLTNLASVSDSIRGRILKEKAIPKIEEFWFMTDHEHLRAAAAELLLNLLFFEKFYEETVAPGTDRLKLWVLYSAEVEEERLSRASAAGFAILTEDENACARIMDEIKSWPEVFKDIAMHEDAETQRRGLMGIANIMHSSNKLCSEIVSSEVFRVLVAVTKLGTINQERAGSTEQAKRGLEAAEKFGLIKATDREIYERENQMSTIQE,EDASRMEEVD,MSE-VAL-ALA-ARG-VAL-GLN-THR-ALA-GLU-GLU-ILE-ARG-ASP-GLU-GLY-ASN-ALA-ALA-VAL-LYS-ASP-GLN-ASP-TYR-ILE-LYS-ALA-ASP-GLU-LEU-TYR-THR-GLU-ALA-LEU-GLN-LEU-THR-THR-ASP-GLU-ASP-LYS-ALA-LEU-ARG-PRO-VAL-LEU-TYR-ARG-ASN-ARG-ALA-MSE-ALA-ARG-LEU-LYS-ARG-ASP-ASP-PHE-GLU-GLY-ALA-GLN-SER-ASP-CYS-THR-LYS-ALA-LEU-GLU-PHE-ASP-GLY-ALA-ASP-VAL-LYS-ALA-LEU-PHE-ARG-ARG-SER-LEU-ALA-ARG-GLU-GLN-LEU-GLY-ASN-VAL-GLY-PRO-ALA-PHE-GLN-ASP-ALA-LYS-GLU-ALA-LEU-ARG-LEU-SER-PRO-ASN-ASP-LYS-GLY-ILE-VAL-GLU-VAL-LEU-GLN-ARG-LEU-VAL-LYS-ALA-ASN-ASN-ASP-LYS-ILE-LYS-GLN-THR-THR-SER-LEU-ALA-ASN-LYS-VAL-THR-ASP-MSE-GLU-LYS-LEU-ALA-PHE-ARG-GLY-GLU-ALA-LYS-ASP-THR-GLU-GLN-LYS-MSE-THR-ALA-LEU-ASN-ASN-LEU-LEU-VAL-LEU-CYS-ARG-GLU-SER-GLU-SER-GLY-ALA-THR-GLY-VAL-TRP-ASN-GLN-GLY-ALA-LEU-VAL-PRO-PHE-VAL-LEU-ASN-LEU-ILE-ASN-ASP-ALA-SER-GLU-ASN-GLU-GLU-VAL-THR-VAL-THR-ALA-ILE-ARG-ILE-LEU-ASP-GLU-THR-ILE-LYS-ASN-SER-VAL-ARG-CYS-MSE-LYS-PHE-LEU-ALA-MSE-HIS-ASP-PRO-ASP-GLY-PRO-LYS-SER-VAL-ARG-PHE-VAL-CYS-ARG-LEU-MSE-CYS-LYS-LYS-SER-THR-LYS-ASP-PHE-VAL-ASP-ALA-THR-GLY-ILE-LEU-VAL-GLN-ARG-VAL-PHE-ASN-ALA-MSE-ALA-LYS-MSE-ASP-ARG-GLN-LYS-GLU-MSE-LYS-PRO-ASP-PRO-GLU-VAL-ALA-GLU-ALA-ASN-LYS-ILE-TRP-ILE-ILE-ARG-VAL-LEU-LEU-GLU-LEU-GLN-GLU-MSE-LEU-GLN-ASP-PRO-LYS-VAL-GLY-ALA-VAL-GLN-ARG-GLU-THR-CYS-ILE-ASP-LEU-PHE-LEU-LYS-ASN-LEU-MSE-HIS-MSE-ASP-GLY-GLY-ILE-PRO-ARG-GLY-TRP-SER-TRP-LYS-PHE-VAL-GLU-GLU-ARG-GLY-LEU-LEU-ALA-LEU-LEU-ASP-VAL-ALA-SER-GLN-ILE-PRO-GLU-LEU-CYS-GLU-TYR-PRO-VAL-SER-ALA-GLU-THR-ARG-GLN-HIS-VAL-ALA-ILE-CYS-LEU-GLN-ARG-LEU-GLU-GLU-ASP-MSE-VAL-PHE-ASP-THR-LYS-ARG-THR-ILE-PHE-LYS-GLU-LYS-VAL-ASP-MSE-PHE-PHE-ASN-ALA-LEU-ILE-SER-ARG-CYS-THR-ASN-ASP-ASP-GLU-GLY-HIS-LYS-TYR-ARG-ILE-LYS-LEU-SER-CYS-PHE-LEU-ILE-THR-MSE-LEU-GLN-GLY-PRO-VAL-ASP-ILE-GLY-ILE-ASN-LEU-ILE-THR-ASN-ASP-GLN-LEU-THR-PRO-ILE-MSE-LEU-GLU-MSE-ALA-ALA-SER-GLN-ASP-HIS-LEU-MSE-GLN-GLY-ILE-ALA-ALA-GLU-LEU-ILE-VAL-ALA-THR-VAL-SER-LYS-HIS-GLU-ARG-ALA-ILE-ASN-MSE-LEU-LYS-VAL-GLY-ILE-PRO-VAL-LEU-ARG-ALA-LEU-TYR-ASP-SER-GLU-ASP-PRO-THR-VAL-LYS-VAL-ARG-ALA-LEU-VAL-GLY-LEU-CYS-LYS-ILE-GLY-ALA-ALA-GLY-GLY-ASP-ASP-ILE-SER-LYS-ALA-THR-MSE-LYS-GLU-GLU-ALA-VAL-ILE-SER-LEU-ALA-LYS-THR-CYS-LYS-LYS-PHE-LEU-LEU-GLU-THR-GLU-LYS-TYR-SER-VAL-ASP-ILE-ARG-ARG-TYR-ALA-CYS-GLU-GLY-LEU-SER-TYR-LEU-SER-LEU-ASP-ALA-ASP-VAL-LYS-GLU-TRP-ILE-VAL-ASP-ASP-SER-LEU-LEU-LEU-LYS-ALA-LEU-VAL-LEU-LEU-ALA-LYS-LYS-ALA-GLY-ALA-LEU-CYS-VAL-TYR-THR-LEU-ALA-THR-ILE-TYR-ALA-ASN-LEU-SER-ASN-ALA-PHE-GLU-LYS-PRO-LYS-VAL-ASP-GLU-GLU-MSE-VAL-LYS-LEU-ALA-GLN-PHE-ALA-LYS-HIS-HIS-VAL-PRO-GLU-THR-HIS-PRO-LYS-ASP-THR-GLU-GLU-TYR-VAL-GLU-LYS-ARG-VAL-ARG-ALA-LEU-VAL-GLU-GLU-GLY-ALA-VAL-PRO-ALA-CYS-VAL-ALA-VAL-SER-LYS-THR-GLU-SER-LYS-ASN-ALA-LEU-GLU-LEU-ILE-ALA-ARG-SER-LEU-LEU-ALA-PHE-ALA-GLU-TYR-GLU-ASP-LEU-ARG-GLY-ARG-ILE-ILE-ALA-GLU-GLY-GLY-THR-VAL-LEU-CYS-LEU-ARG-LEU-THR-LYS-GLU-ALA-SER-GLY-GLU-GLY-LYS-ILE-LYS-ALA-GLY-HIS-ALA-ILE-ALA-LYS-LEU-GLY-ALA-LYS-ALA-ASP-PRO-MSE-ILE-SER-PHE-PRO-GLY-GLN-ARG-ALA-TYR-GLU-VAL-VAL-LYS-PRO-LEU-CYS-ASP-LEU-LEU-HIS-PRO-ASP-VAL-GLU-GLY-LYS-ALA-ASN-TYR-ASP-SER-LEU-LEU-THR-LEU-THR-ASN-LEU-ALA-SER-VAL-SER-ASP-SER-ILE-ARG-GLY-ARG-ILE-LEU-LYS-GLU-LYS-ALA-ILE-PRO-LYS-ILE-GLU-GLU-PHE-TRP-PHE-MSE-THR-ASP-HIS-GLU-HIS-LEU-ARG-ALA-ALA-ALA-ALA-GLU-LEU-LEU-LEU-ASN-LEU-LEU-PHE-PHE-GLU-LYS-PHE-TYR-GLU-GLU-THR-VAL-ALA-PRO-GLY-THR-ASP-ARG-LEU-LYS-LEU-TRP-VAL-LEU-TYR-SER-ALA-GLU-VAL-GLU-GLU-GLU-ARG-LEU-SER-ARG-ALA-SER-ALA-ALA-GLY-PHE-ALA-ILE-LEU-THR-GLU-ASP-GLU-ASN-ALA-CYS-ALA-ARG-ILE-MSE-ASP-GLU-ILE-LYS-SER-TRP-PRO-GLU-VAL-PHE-LYS-ASP-ILE-ALA-MSE-HIS-GLU-ASP-ALA-GLU-THR-GLN-ARG-ARG-GLY-LEU-MSE-GLY-ILE-ALA-ASN-ILE-MSE-HIS-SER-SER-ASN-LYS-LEU-CYS-SER-GLU-ILE-VAL-SER-SER-GLU-VAL-PHE-ARG-VAL-LEU-VAL-ALA-VAL-THR-LYS-LEU-GLY-THR-ILE-ASN-GLN-GLU-ARG-ALA-GLY-SER-THR-GLU-GLN-ALA-LYS-ARG-GLY-LEU-GLU-ALA-ALA-GLU-LYS-PHE-GLY-LEU-ILE-LYS-ALA-THR-ASP-ARG-GLU-ILE-TYR-GLU-ARG-GLU-ASN-GLN-MSE-SER-THR-ILE-GLN-GLU,GLU-ASP-ALA-SER-ARG-MET-GLU-GLU-VAL-ASP,961,10,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)CCC[NH+]=C(N)N,Kd=13.5uM,4.869666,4.87,1,A,A,1,A,A,0,,B,A,,1,1,961,10,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.774584174156189,0.6888296604156494,52.216094970703125,51.17305374145508,0.6380456686019897,1.060472011566162,0.6356047987937927,0.6250609159469604,0.8022486567497253,0.7021703720092773,EDASRMEEVD,Low,"(4.866, 5.014]",train
4I31,protein-peptide,P26662,MAPITAYSQQTRGLLGCIITSLTGRDKNQVDGEVQVLSTATQSFLATCVNGVCWTVYHGAGSKTLAGPKGPITQMYTNVDQDLVGWPAPPGARSMTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPVSYLKGSSGGPLLCPSGHVVGIFRAAVCTRGVAKAVDFIPVESMETTMRASKKKK,KKGSVVIVGRIILSGRK,MET-ALA-PRO-ILE-THR-ALA-TYR-SER-GLN-GLN-THR-ARG-GLY-LEU-LEU-GLY-CYS-ILE-ILE-THR-SER-LEU-THR-GLY-ARG-ASP-LYS-ASN-GLN-VAL-ASP-GLY-GLU-VAL-GLN-VAL-LEU-SER-THR-ALA-THR-GLN-SER-PHE-LEU-ALA-THR-CYS-VAL-ASN-GLY-VAL-CYS-TRP-THR-VAL-TYR-HIS-GLY-ALA-GLY-SER-LYS-THR-LEU-ALA-GLY-PRO-LYS-GLY-PRO-ILE-THR-GLN-MET-TYR-THR-ASN-VAL-ASP-GLN-ASP-LEU-VAL-GLY-TRP-PRO-ALA-PRO-PRO-GLY-ALA-ARG-SER-MET-THR-PRO-CYS-THR-CYS-GLY-SER-SER-ASP-LEU-TYR-LEU-VAL-THR-ARG-HIS-ALA-ASP-VAL-ILE-PRO-VAL-ARG-ARG-ARG-GLY-ASP-SER-ARG-GLY-SER-LEU-LEU-SER-PRO-ARG-PRO-VAL-SER-TYR-LEU-LYS-GLY-SER-SER-GLY-GLY-PRO-LEU-LEU-CYS-PRO-SER-GLY-HIS-VAL-VAL-GLY-ILE-PHE-ARG-ALA-ALA-VAL-CYS-THR-ARG-GLY-VAL-ALA-LYS-ALA-VAL-ASP-PHE-ILE-PRO-VAL-GLU-SER-MET-GLU-THR-THR-MET-ARG-ALA-SER-LYS-LYS-LYS-LYS,LYS-LYS-GLY-SER-VAL-VAL-ILE-VAL-GLY-ARG-ILE-ILE-LEU-SER-GLY-ARG-LYS,187,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CO)C,IC50=0.48nM,9.318759,9.32,1,A,A,1,A,A,0,,C,A,,1,1,187,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,0.9902098178863524,0.8765989542007446,89.9114990234375,82.60941314697266,0.3489721715450287,0.5289841294288635,0.9387416243553162,0.9068939089775084,0.9234200119972228,0.8690252304077148,KKGSVVIVGRIILSGRK,High,"(8.824, 12.12]",val
4I32,protein-peptide,P26662,MAPITAYSQQTRGLLGCIITSLTGRDKNQVDGEVQVLSTATQSFLATCVNGVCWTVYHGAGSKTLAGPKGPITQMYTNVDQDLVGWPAPPGARSMTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPVSYLKGSSGGPLLCPSGHVVGIFRAAVCTRGVAKAVVFIPVESMETTMRASKKKK,KKGSVVIVGRIILSGRK,MET-ALA-PRO-ILE-THR-ALA-TYR-SER-GLN-GLN-THR-ARG-GLY-LEU-LEU-GLY-CYS-ILE-ILE-THR-SER-LEU-THR-GLY-ARG-ASP-LYS-ASN-GLN-VAL-ASP-GLY-GLU-VAL-GLN-VAL-LEU-SER-THR-ALA-THR-GLN-SER-PHE-LEU-ALA-THR-CYS-VAL-ASN-GLY-VAL-CYS-TRP-THR-VAL-TYR-HIS-GLY-ALA-GLY-SER-LYS-THR-LEU-ALA-GLY-PRO-LYS-GLY-PRO-ILE-THR-GLN-MET-TYR-THR-ASN-VAL-ASP-GLN-ASP-LEU-VAL-GLY-TRP-PRO-ALA-PRO-PRO-GLY-ALA-ARG-SER-MET-THR-PRO-CYS-THR-CYS-GLY-SER-SER-ASP-LEU-TYR-LEU-VAL-THR-ARG-HIS-ALA-ASP-VAL-ILE-PRO-VAL-ARG-ARG-ARG-GLY-ASP-SER-ARG-GLY-SER-LEU-LEU-SER-PRO-ARG-PRO-VAL-SER-TYR-LEU-LYS-GLY-SER-SER-GLY-GLY-PRO-LEU-LEU-CYS-PRO-SER-GLY-HIS-VAL-VAL-GLY-ILE-PHE-ARG-ALA-ALA-VAL-CYS-THR-ARG-GLY-VAL-ALA-LYS-ALA-VAL-VAL-PHE-ILE-PRO-VAL-GLU-SER-MET-GLU-THR-THR-MET-ARG-ALA-SER-LYS-LYS-LYS-LYS,LYS-LYS-GLY-SER-VAL-VAL-ILE-VAL-GLY-ARG-ILE-ILE-LEU-SER-GLY-ARG-LYS,187,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CO)C,IC50=58nM,7.236572,7.24,1,A,A,1,A,A,0,,C,A,,1,1,187,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,0.9897517561912536,0.8695211410522461,90.324462890625,85.24740600585938,0.3411039710044861,0.5431333780288696,0.940968096256256,0.9006611108779907,0.9253544807434082,0.8483672142028809,KKGSVVIVGRIILSGRK,Moderate,"(7.049, 7.268]",train
4I33,protein-peptide,P26662,MAPITAYSQQTRGLLGCIITSLTGRDKNQVDGEVQVLSTATQSFLATCVNGVCWTVYHGAGSKTLAGPKGPITQMYTNVDQDLVGWPAPPGARSMTPCTCGSSDLYLVTRHADVIPVRRRGDSRGSLLSPRPVSYLKGSSGGPLLCPSGHVVGIFKAAVCTRGVAKAVDFIPVESMETTMRASKKKK,KKGSVVIVGRIILSGRK,MET-ALA-PRO-ILE-THR-ALA-TYR-SER-GLN-GLN-THR-ARG-GLY-LEU-LEU-GLY-CYS-ILE-ILE-THR-SER-LEU-THR-GLY-ARG-ASP-LYS-ASN-GLN-VAL-ASP-GLY-GLU-VAL-GLN-VAL-LEU-SER-THR-ALA-THR-GLN-SER-PHE-LEU-ALA-THR-CYS-VAL-ASN-GLY-VAL-CYS-TRP-THR-VAL-TYR-HIS-GLY-ALA-GLY-SER-LYS-THR-LEU-ALA-GLY-PRO-LYS-GLY-PRO-ILE-THR-GLN-MET-TYR-THR-ASN-VAL-ASP-GLN-ASP-LEU-VAL-GLY-TRP-PRO-ALA-PRO-PRO-GLY-ALA-ARG-SER-MET-THR-PRO-CYS-THR-CYS-GLY-SER-SER-ASP-LEU-TYR-LEU-VAL-THR-ARG-HIS-ALA-ASP-VAL-ILE-PRO-VAL-ARG-ARG-ARG-GLY-ASP-SER-ARG-GLY-SER-LEU-LEU-SER-PRO-ARG-PRO-VAL-SER-TYR-LEU-LYS-GLY-SER-SER-GLY-GLY-PRO-LEU-LEU-CYS-PRO-SER-GLY-HIS-VAL-VAL-GLY-ILE-PHE-LYS-ALA-ALA-VAL-CYS-THR-ARG-GLY-VAL-ALA-LYS-ALA-VAL-ASP-PHE-ILE-PRO-VAL-GLU-SER-MET-GLU-THR-THR-MET-ARG-ALA-SER-LYS-LYS-LYS-LYS,LYS-LYS-GLY-SER-VAL-VAL-ILE-VAL-GLY-ARG-ILE-ILE-LEU-SER-GLY-ARG-LYS,187,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CO)C,IC50=4.7nM,8.327902,8.33,1,A,A,1,A,A,0,,C,A,,1,1,187,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(C)C)[C@@H](C)CC)C(C)C)[C@@H](C)CC,0.9716376066207886,0.8638429641723633,89.97645568847656,84.3091049194336,0.3566115498542785,0.543816864490509,0.9354204535484314,0.8989862203598022,0.916353702545166,0.8550571203231812,KKGSVVIVGRIILSGRK,Moderate,"(7.921, 8.383]",train
4I7B,protein-peptide,Q27934 Q8IUQ4,GSHVANSVLFPCKYASSGCEITLPHTEKADHEELCEFRPYSCPCPGASCKWQGSLDAVMPHLMHQHKSITTLQGEDIVFLATDINLPGAVDWVMMQSCFGFHFMLVLEKQEKYDGHQQFFAIVQLIGTRKQAENFAYRLELNGHRRRLTWEATPRSIHEGIATAIMNSDCLVFDTSIAQLFAENGNLGINVTISMC,KLRPVAMVRPTVR,GLY-SER-HIS-VAL-ALA-ASN-SER-VAL-LEU-PHE-PRO-CYS-LYS-TYR-ALA-SER-SER-GLY-CYS-GLU-ILE-THR-LEU-PRO-HIS-THR-GLU-LYS-ALA-ASP-HIS-GLU-GLU-LEU-CYS-GLU-PHE-ARG-PRO-TYR-SER-CYS-PRO-CYS-PRO-GLY-ALA-SER-CYS-LYS-TRP-GLN-GLY-SER-LEU-ASP-ALA-VAL-MET-PRO-HIS-LEU-MET-HIS-GLN-HIS-LYS-SER-ILE-THR-THR-LEU-GLN-GLY-GLU-ASP-ILE-VAL-PHE-LEU-ALA-THR-ASP-ILE-ASN-LEU-PRO-GLY-ALA-VAL-ASP-TRP-VAL-MET-MET-GLN-SER-CYS-PHE-GLY-PHE-HIS-PHE-MET-LEU-VAL-LEU-GLU-LYS-GLN-GLU-LYS-TYR-ASP-GLY-HIS-GLN-GLN-PHE-PHE-ALA-ILE-VAL-GLN-LEU-ILE-GLY-THR-ARG-LYS-GLN-ALA-GLU-ASN-PHE-ALA-TYR-ARG-LEU-GLU-LEU-ASN-GLY-HIS-ARG-ARG-ARG-LEU-THR-TRP-GLU-ALA-THR-PRO-ARG-SER-ILE-HIS-GLU-GLY-ILE-ALA-THR-ALA-ILE-MET-ASN-SER-ASP-CYS-LEU-VAL-PHE-ASP-THR-SER-ILE-ALA-GLN-LEU-PHE-ALA-GLU-ASN-GLY-ASN-LEU-GLY-ILE-ASN-VAL-THR-ILE-SER-MET-CYS,ACE-LYS-LEU-ARG-PRO-VAL-ABA-MET-VAL-ARG-PRO-THR-VAL-ARG,196,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@H](O)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CCC[NH+]=C(N)N)CC,IC50=2uM,5.69897,5.7,1,A,A,1,A,A,0,,B,A,,1,1,196,14,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)[C@@H](C)O)C(C)C,,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)[C@@H](C)O)C(C)C,0.9590356349945068,0.8586475253105164,88.39030456542969,86.30660247802734,0.3968893885612488,0.6476982831954956,0.888853132724762,0.8708577156066895,0.9048109650611876,0.8237071633338928,KLRPVAMVRPTVR,Low,"(5.6, 5.699]",train
4I9C,protein-peptide,P71002,MTGVISSSSIGEKINEWYMYIRRFSIPDAEYLRREIKQELDQMEEDQDLHLYYSLMEFRHNLMLEYLEPLEKMRIEEQPRLSDLLLEIDKKQARLTGLLEYYFNFFRGMYELDQREYLSAIKFFKKAESKLIFVKDRIEKAEFFFKMSESYYYMKQTYFSMDYARQAYEIYKEHEAYNIRLLQCHSLFATNFLDLKQYEDAISHFQKAYSMAEAEKQPQLMGRTLYNIGLCKNSQSQYEDAIPYFKRAIAVFEESNILPSLPQAYFLITQIHYKLGKIDKAHEYHSKGMAYSQKAGDVIYLSEFEFLKSLYLSGPDEEAIQGFFDFLESKMLYADLEDFAIDVAKYYHERKNFQKASAYFLKVEQVRQLIQGGVSLYEIEV,QRGMI,MET-THR-GLY-VAL-ILE-SER-SER-SER-SER-ILE-GLY-GLU-LYS-ILE-ASN-GLU-TRP-TYR-MET-TYR-ILE-ARG-ARG-PHE-SER-ILE-PRO-ASP-ALA-GLU-TYR-LEU-ARG-ARG-GLU-ILE-LYS-GLN-GLU-LEU-ASP-GLN-MET-GLU-GLU-ASP-GLN-ASP-LEU-HIS-LEU-TYR-TYR-SER-LEU-MET-GLU-PHE-ARG-HIS-ASN-LEU-MET-LEU-GLU-TYR-LEU-GLU-PRO-LEU-GLU-LYS-MET-ARG-ILE-GLU-GLU-GLN-PRO-ARG-LEU-SER-ASP-LEU-LEU-LEU-GLU-ILE-ASP-LYS-LYS-GLN-ALA-ARG-LEU-THR-GLY-LEU-LEU-GLU-TYR-TYR-PHE-ASN-PHE-PHE-ARG-GLY-MET-TYR-GLU-LEU-ASP-GLN-ARG-GLU-TYR-LEU-SER-ALA-ILE-LYS-PHE-PHE-LYS-LYS-ALA-GLU-SER-LYS-LEU-ILE-PHE-VAL-LYS-ASP-ARG-ILE-GLU-LYS-ALA-GLU-PHE-PHE-PHE-LYS-MET-SER-GLU-SER-TYR-TYR-TYR-MET-LYS-GLN-THR-TYR-PHE-SER-MET-ASP-TYR-ALA-ARG-GLN-ALA-TYR-GLU-ILE-TYR-LYS-GLU-HIS-GLU-ALA-TYR-ASN-ILE-ARG-LEU-LEU-GLN-CYS-HIS-SER-LEU-PHE-ALA-THR-ASN-PHE-LEU-ASP-LEU-LYS-GLN-TYR-GLU-ASP-ALA-ILE-SER-HIS-PHE-GLN-LYS-ALA-TYR-SER-MET-ALA-GLU-ALA-GLU-LYS-GLN-PRO-GLN-LEU-MET-GLY-ARG-THR-LEU-TYR-ASN-ILE-GLY-LEU-CYS-LYS-ASN-SER-GLN-SER-GLN-TYR-GLU-ASP-ALA-ILE-PRO-TYR-PHE-LYS-ARG-ALA-ILE-ALA-VAL-PHE-GLU-GLU-SER-ASN-ILE-LEU-PRO-SER-LEU-PRO-GLN-ALA-TYR-PHE-LEU-ILE-THR-GLN-ILE-HIS-TYR-LYS-LEU-GLY-LYS-ILE-ASP-LYS-ALA-HIS-GLU-TYR-HIS-SER-LYS-GLY-MET-ALA-TYR-SER-GLN-LYS-ALA-GLY-ASP-VAL-ILE-TYR-LEU-SER-GLU-PHE-GLU-PHE-LEU-LYS-SER-LEU-TYR-LEU-SER-GLY-PRO-ASP-GLU-GLU-ALA-ILE-GLN-GLY-PHE-PHE-ASP-PHE-LEU-GLU-SER-LYS-MET-LEU-TYR-ALA-ASP-LEU-GLU-ASP-PHE-ALA-ILE-ASP-VAL-ALA-LYS-TYR-TYR-HIS-GLU-ARG-LYS-ASN-PHE-GLN-LYS-ALA-SER-ALA-TYR-PHE-LEU-LYS-VAL-GLU-GLN-VAL-ARG-GLN-LEU-ILE-GLN-GLY-GLY-VAL-SER-LEU-TYR-GLU-ILE-GLU-VAL,GLN-ARG-GLY-MET-ILE,381,5,CSCC[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC[NH+]=C(N)N,Kd=3.1uM,5.508638,5.51,1,A,A,1,A,A,0,,C,A,,1,1,381,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.95588219165802,0.906767964363098,76.78764343261719,68.37754821777344,0.3896606564521789,0.5002137422561646,0.9055482745170592,0.8579234480857849,0.9603697657585144,0.9189791083335876,QRGMI,Low,"(5.463, 5.6]",val
4IFI,protein-peptide,Q6PJG6 P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTREWVLDSVALYQCQELDTYLIPQIP,RSPVFS,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-GLU-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,ARG-SEP-PRO-VAL-PHE-SER,214,6,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])COP(O)(O)O)Cc1ccccc1,Kd=3.34uM,5.476254,5.48,1,A,A,1,A,A,0,,B,A,,1,1,214,6,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O,0.8911792039871216,0.9195023775100708,92.90724182128906,93.5827178955078,0.3272395431995392,0.4169597029685974,0.946520209312439,0.9400540590286256,0.8602984547615051,0.914364457130432,RSPVFS,Low,"(5.463, 5.6]",train
4IGK,protein-peptide,Q8WXE1 P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTREWVLDSVALYQCQELDTYLIPQIP,ACSPQFG,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-GLU-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,ALA-CYS-SEP-PRO-GLN-PHE-GLY,214,7,SC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccccc1)CCC(=O)N)COP(O)(O)O)NC(=O)[C@@H]([NH3+])C,Kd=28.2uM,4.549751,4.55,1,A,A,1,A,A,0,,C,A,,1,1,214,7,0,C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](CS)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](CS)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,0.8331536650657654,0.9023998975753784,91.7510223388672,93.4326629638672,0.3379797339439392,0.4423795938491821,0.9427307844161988,0.93757164478302,0.7859629392623901,0.8936069011688232,ACSPQFG,Low,"(4.456, 4.606]",train
4IKN,protein-peptide,P19814 P53676,GAMDPEFIPWRRAGVKYTNNEAYFDVVEEIDAIIDKSGSTVFAEIQGVIDACIKLSGMPDLSLSFMNPRLLDDVSFHPCIRFKRWESERVLSFIPPDGNFRLISYRVSSQNLVAIPVYVKHNISFKENSSCGRFDITIGPKQNMGKTIEGITVTVHMPKVVLNMNLTPTQGSYTFDPVTKVLAWDVGKITPQKLPSLKGLVNLQSGAPKPEENPNLNIQFKIQQLAISGLKVNRLDMYGEKYKPFKGVKYITKAGKFQVRT,SDYQRL,GLY-ALA-MET-ASP-PRO-GLU-PHE-ILE-PRO-TRP-ARG-ARG-ALA-GLY-VAL-LYS-TYR-THR-ASN-ASN-GLU-ALA-TYR-PHE-ASP-VAL-VAL-GLU-GLU-ILE-ASP-ALA-ILE-ILE-ASP-LYS-SER-GLY-SER-THR-VAL-PHE-ALA-GLU-ILE-GLN-GLY-VAL-ILE-ASP-ALA-CYS-ILE-LYS-LEU-SER-GLY-MET-PRO-ASP-LEU-SER-LEU-SER-PHE-MET-ASN-PRO-ARG-LEU-LEU-ASP-ASP-VAL-SER-PHE-HIS-PRO-CYS-ILE-ARG-PHE-LYS-ARG-TRP-GLU-SER-GLU-ARG-VAL-LEU-SER-PHE-ILE-PRO-PRO-ASP-GLY-ASN-PHE-ARG-LEU-ILE-SER-TYR-ARG-VAL-SER-SER-GLN-ASN-LEU-VAL-ALA-ILE-PRO-VAL-TYR-VAL-LYS-HIS-ASN-ILE-SER-PHE-LYS-GLU-ASN-SER-SER-CYS-GLY-ARG-PHE-ASP-ILE-THR-ILE-GLY-PRO-LYS-GLN-ASN-MET-GLY-LYS-THR-ILE-GLU-GLY-ILE-THR-VAL-THR-VAL-HIS-MET-PRO-LYS-VAL-VAL-LEU-ASN-MET-ASN-LEU-THR-PRO-THR-GLN-GLY-SER-TYR-THR-PHE-ASP-PRO-VAL-THR-LYS-VAL-LEU-ALA-TRP-ASP-VAL-GLY-LYS-ILE-THR-PRO-GLN-LYS-LEU-PRO-SER-LEU-LYS-GLY-LEU-VAL-ASN-LEU-GLN-SER-GLY-ALA-PRO-LYS-PRO-GLU-GLU-ASN-PRO-ASN-LEU-ASN-ILE-GLN-PHE-LYS-ILE-GLN-GLN-LEU-ALA-ILE-SER-GLY-LEU-LYS-VAL-ASN-ARG-LEU-ASP-MET-TYR-GLY-GLU-LYS-TYR-LYS-PRO-PHE-LYS-GLY-VAL-LYS-TYR-ILE-THR-LYS-ALA-GLY-LYS-PHE-GLN-VAL-ARG-THR,SER-ASP-TYR-GLN-ARG-LEU,261,6,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)N)CCC[NH+]=C(N)N)C,Kd=14uM,4.853872,4.85,1,A,A,1,A,A,0,,B,A,,1,1,261,6,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CO)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9647942781448364,0.8727060556411743,91.08956909179688,85.284423828125,0.3493072688579559,0.5780866146087646,0.92290061712265,0.8895953893661499,0.935473620891571,0.8421427011489868,SDYQRL,Low,"(4.745, 4.866]",val
4J09,protein-peptide,P39352 P0A722,MIDKSAFVHPTAIVEEGASIGANAHIGPFCIVGPHVEIGEGTVLKSHVVVNGHTKIGRDNEIYQFASIGEVNQDLKYAGEPTRVEIGDRNRIRESVTIHRGTVQGGGLTKVGSDNLLMINAHIAHDCTVGNRCILANNATLAGHVSVDDFAIIGGMTAVHQFCIIGAHVMVGGCSGVAQDVPPYVIAQGNHATPFGVNIEGLKRRGFSREAITAIRNAYKLIYRSGKTLDEVKPEIAELAETYPEVKAFTDFFARSTRGLIR,TNLYML,MET-ILE-ASP-LYS-SER-ALA-PHE-VAL-HIS-PRO-THR-ALA-ILE-VAL-GLU-GLU-GLY-ALA-SER-ILE-GLY-ALA-ASN-ALA-HIS-ILE-GLY-PRO-PHE-CYS-ILE-VAL-GLY-PRO-HIS-VAL-GLU-ILE-GLY-GLU-GLY-THR-VAL-LEU-LYS-SER-HIS-VAL-VAL-VAL-ASN-GLY-HIS-THR-LYS-ILE-GLY-ARG-ASP-ASN-GLU-ILE-TYR-GLN-PHE-ALA-SER-ILE-GLY-GLU-VAL-ASN-GLN-ASP-LEU-LYS-TYR-ALA-GLY-GLU-PRO-THR-ARG-VAL-GLU-ILE-GLY-ASP-ARG-ASN-ARG-ILE-ARG-GLU-SER-VAL-THR-ILE-HIS-ARG-GLY-THR-VAL-GLN-GLY-GLY-GLY-LEU-THR-LYS-VAL-GLY-SER-ASP-ASN-LEU-LEU-MET-ILE-ASN-ALA-HIS-ILE-ALA-HIS-ASP-CYS-THR-VAL-GLY-ASN-ARG-CYS-ILE-LEU-ALA-ASN-ASN-ALA-THR-LEU-ALA-GLY-HIS-VAL-SER-VAL-ASP-ASP-PHE-ALA-ILE-ILE-GLY-GLY-MET-THR-ALA-VAL-HIS-GLN-PHE-CYS-ILE-ILE-GLY-ALA-HIS-VAL-MET-VAL-GLY-GLY-CYS-SER-GLY-VAL-ALA-GLN-ASP-VAL-PRO-PRO-TYR-VAL-ILE-ALA-GLN-GLY-ASN-HIS-ALA-THR-PRO-PHE-GLY-VAL-ASN-ILE-GLU-GLY-LEU-LYS-ARG-ARG-GLY-PHE-SER-ARG-GLU-ALA-ILE-THR-ALA-ILE-ARG-ASN-ALA-TYR-LYS-LEU-ILE-TYR-ARG-SER-GLY-LYS-THR-LEU-ASP-GLU-VAL-LYS-PRO-GLU-ILE-ALA-GLU-LEU-ALA-GLU-THR-TYR-PRO-GLU-VAL-LYS-ALA-PHE-THR-ASP-PHE-PHE-ALA-ARG-SER-THR-ARG-GLY-LEU-ILE-ARG,THR-ASN-LEU-TYR-MET-LEU,262,6,CSCC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(=O)N)CC(C)C)Cc1ccc(cc1)O,Kd=17uM,4.769551,4.77,1,A,A,1,A,A,0,,B,A,,1,1,262,6,0,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.888103723526001,0.8332486152648926,94.947509765625,95.48957061767578,0.3085872828960418,0.5132281184196472,0.951860010623932,0.926291286945343,0.8581721186637878,0.8099879026412964,TNLYML,Low,"(4.745, 4.866]",val
4J26,protein-peptide,Q92731,DALSPEQLVLTLLEAEPPHVLISRPSAPFTEASMMMSLTKLADKELVHMISWAKKIPGFVELSLFDQVRLLESCWMEVLMMGLMWRSIDHPGKLIFAPDLVLDRDEGKCVEGILEIFDMLLATTSRFRELKLQHKEYLCVKAMILLNSSMYPLVTATQDADSSRKLAHLLNAVTDALVWVIAKSGISSQQQSMRLANLLMLLSHVRHASNKGMEHLLNMKCKNVVPVYDLLLEMLNAHVL,HPLLMRLLHHPS,ASP-ALA-LEU-SER-PRO-GLU-GLN-LEU-VAL-LEU-THR-LEU-LEU-GLU-ALA-GLU-PRO-PRO-HIS-VAL-LEU-ILE-SER-ARG-PRO-SER-ALA-PRO-PHE-THR-GLU-ALA-SER-MET-MET-MET-SER-LEU-THR-LYS-LEU-ALA-ASP-LYS-GLU-LEU-VAL-HIS-MET-ILE-SER-TRP-ALA-LYS-LYS-ILE-PRO-GLY-PHE-VAL-GLU-LEU-SER-LEU-PHE-ASP-GLN-VAL-ARG-LEU-LEU-GLU-SER-CYS-TRP-MET-GLU-VAL-LEU-MET-MET-GLY-LEU-MET-TRP-ARG-SER-ILE-ASP-HIS-PRO-GLY-LYS-LEU-ILE-PHE-ALA-PRO-ASP-LEU-VAL-LEU-ASP-ARG-ASP-GLU-GLY-LYS-CYS-VAL-GLU-GLY-ILE-LEU-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-THR-SER-ARG-PHE-ARG-GLU-LEU-LYS-LEU-GLN-HIS-LYS-GLU-TYR-LEU-CYS-VAL-LYS-ALA-MET-ILE-LEU-LEU-ASN-SER-SER-MET-TYR-PRO-LEU-VAL-THR-ALA-THR-GLN-ASP-ALA-ASP-SER-SER-ARG-LYS-LEU-ALA-HIS-LEU-LEU-ASN-ALA-VAL-THR-ASP-ALA-LEU-VAL-TRP-VAL-ILE-ALA-LYS-SER-GLY-ILE-SER-SER-GLN-GLN-GLN-SER-MET-ARG-LEU-ALA-ASN-LEU-LEU-MET-LEU-LEU-SER-HIS-VAL-ARG-HIS-ALA-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-LEU-ASN-MET-LYS-CYS-LYS-ASN-VAL-VAL-PRO-VAL-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASN-ALA-HIS-VAL-LEU,HIS-PRO-LEU-LEU-MET-ARG-LEU-LEU-HIS-HIS-PRO-SER,240,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)Cc1c[nH]cn1)Cc1c[nH]cn1)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)[NH3+])CC(C)C)CC(C)C,Ki=3.64uM,5.438899,5.44,1,A,A,1,A,A,0,,I,A,dimer,1,1,240,12,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,0.9525265693664552,0.7545007467269897,93.59063720703124,85.00016021728516,0.3536553084850311,0.7814159393310547,0.939501941204071,0.8581052422523499,0.9260208010673524,0.7285995483398438,HPLLMRLLHHPS,Low,"(5.31, 5.463]",train
4J2C,protein-peptide,O43752 Q9UID3,GAMEDPFFVVKGEVQKAVNTAQGLFQRWTELLQDPSTATREEIDWTTNELRNNLRSIEWDLEDLDETISIVEANPRKFNLDATELSIRKAFITSTRQVVRDMKDQMSTSS,AHGMLKLYYGLSEGEAA,GLY-ALA-MET-GLU-ASP-PRO-PHE-PHE-VAL-VAL-LYS-GLY-GLU-VAL-GLN-LYS-ALA-VAL-ASN-THR-ALA-GLN-GLY-LEU-PHE-GLN-ARG-TRP-THR-GLU-LEU-LEU-GLN-ASP-PRO-SER-THR-ALA-THR-ARG-GLU-GLU-ILE-ASP-TRP-THR-THR-ASN-GLU-LEU-ARG-ASN-ASN-LEU-ARG-SER-ILE-GLU-TRP-ASP-LEU-GLU-ASP-LEU-ASP-GLU-THR-ILE-SER-ILE-VAL-GLU-ALA-ASN-PRO-ARG-LYS-PHE-ASN-LEU-ASP-ALA-THR-GLU-LEU-SER-ILE-ARG-LYS-ALA-PHE-ILE-THR-SER-THR-ARG-GLN-VAL-VAL-ARG-ASP-MET-LYS-ASP-GLN-MET-SER-THR-SER-SER,ALA-HIS-GLY-MET-LEU-LYS-LEU-TYR-TYR-GLY-LEU-SER-GLU-GLY-GLU-ALA-ALA,110,17,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(C)C)CCCC[NH3+])CC(C)C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]([NH3+])C,Kd=5.6uM,5.251812,5.25,1,A,A,1,A,A,0,,B,A,dimer,1,1,110,17,0,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O,0.9478164911270142,0.8312044143676758,96.02117919921876,92.2850570678711,0.327867329120636,0.6228716373443604,0.9042998552322388,0.8703414797782898,0.8750342130661011,0.8214200735092163,AHGMLKLYYGLSEGEAA,Low,"(5.222, 5.31]",val
4J73,protein-peptide,Q3T133 P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,FEAKKLV,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,PHE-GLU-ALA-LYS-LYS-LEU-VAL,301,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCCC[NH3+],Kd=27.7uM,4.55752,4.56,1,A,A,1,A,A,0,,B,A,,1,1,301,7,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,0.904926598072052,0.8207499384880066,96.23706817626952,95.7078094482422,0.3102324604988098,0.5696150064468384,0.9516911506652832,0.9223031997680664,0.8790308833122253,0.7953615784645081,FEAKKLV,Low,"(4.456, 4.606]",train
4J77,protein-peptide,P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,AKEKSD,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,ALA-LYS-GLU-LYS-SER-ASP,301,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)O,Kd=3.4uM,5.468521,5.47,1,A,A,1,A,A,0,,C,A,,1,1,301,6,0,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O,0.9268120527267456,0.8699124455451965,96.6236801147461,95.95809936523438,0.3061748147010803,0.4985443949699402,0.9524549841880798,0.9378039240837096,0.9081862568855286,0.8529395461082458,AKEKSD,Low,"(5.463, 5.6]",train
4J78,protein-peptide,P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,KTKLL,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,LYS-THR-LYS-LEU-LEU,301,5,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=22.5uM,4.647817,4.65,1,A,A,1,A,A,0,,B,A,,1,1,301,5,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.95436829328537,0.8303587436676025,96.99560546875,95.76486206054688,0.295943945646286,0.5259755849838257,0.9573296308517456,0.931047022342682,0.9434155225753784,0.8051866888999939,KTKLL,Low,"(4.606, 4.745]",train
4J79,protein-peptide,P41811 Q91AV1,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLA,EKVHVQ,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-ALA,GLU-LYS-VAL-HIS-VAL-GLN,301,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)C(C)C)Cc1nc[nH]c1)C(C)C)NC(=O)[C@H](CCC(=O)O)[NH3+],Kd>800uM,3.1,3.1,1,A,A,1,A,A,0,,B,A,,1,1,301,6,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9280598163604736,0.8422126173973083,96.86424255371094,96.01568603515624,0.3021341264247894,0.5116032361984253,0.9541252255439758,0.9316646456718444,0.9093284606933594,0.8198495507240295,EKVHVQ,Low,"(2.044, 3.548]",train
4J7I,protein-peptide,Q12962 Q8WTS6,GAMGYKDNIRHGVCWIYYPDGGSLVGEVNEDGEMTGEKIAYVYPDERTALYGKFIDGEMIEGKLATLMSTEEGRPHFELMPGNSVYHFDKSTSSCISTNALLPDPYESERVYVAESLISSAGEGLFSKVAVGPNTVMSFYNGVRITHQEVDSRDWALNGNTLSLDEETVIDVPEPYNHVSKYCASLGHKANHSFTPNCIYDMFVHPRFGPIKCIRTLRAVEADEELTVAFGYDHSPPGKSGPEAPEWYQVELKAFQATQQK,SKSKDRKYTL,GLY-ALA-MET-GLY-TYR-LYS-ASP-ASN-ILE-ARG-HIS-GLY-VAL-CYS-TRP-ILE-TYR-TYR-PRO-ASP-GLY-GLY-SER-LEU-VAL-GLY-GLU-VAL-ASN-GLU-ASP-GLY-GLU-MET-THR-GLY-GLU-LYS-ILE-ALA-TYR-VAL-TYR-PRO-ASP-GLU-ARG-THR-ALA-LEU-TYR-GLY-LYS-PHE-ILE-ASP-GLY-GLU-MET-ILE-GLU-GLY-LYS-LEU-ALA-THR-LEU-MET-SER-THR-GLU-GLU-GLY-ARG-PRO-HIS-PHE-GLU-LEU-MET-PRO-GLY-ASN-SER-VAL-TYR-HIS-PHE-ASP-LYS-SER-THR-SER-SER-CYS-ILE-SER-THR-ASN-ALA-LEU-LEU-PRO-ASP-PRO-TYR-GLU-SER-GLU-ARG-VAL-TYR-VAL-ALA-GLU-SER-LEU-ILE-SER-SER-ALA-GLY-GLU-GLY-LEU-PHE-SER-LYS-VAL-ALA-VAL-GLY-PRO-ASN-THR-VAL-MET-SER-PHE-TYR-ASN-GLY-VAL-ARG-ILE-THR-HIS-GLN-GLU-VAL-ASP-SER-ARG-ASP-TRP-ALA-LEU-ASN-GLY-ASN-THR-LEU-SER-LEU-ASP-GLU-GLU-THR-VAL-ILE-ASP-VAL-PRO-GLU-PRO-TYR-ASN-HIS-VAL-SER-LYS-TYR-CYS-ALA-SER-LEU-GLY-HIS-LYS-ALA-ASN-HIS-SER-PHE-THR-PRO-ASN-CYS-ILE-TYR-ASP-MET-PHE-VAL-HIS-PRO-ARG-PHE-GLY-PRO-ILE-LYS-CYS-ILE-ARG-THR-LEU-ARG-ALA-VAL-GLU-ALA-ASP-GLU-GLU-LEU-THR-VAL-ALA-PHE-GLY-TYR-ASP-HIS-SER-PRO-PRO-GLY-LYS-SER-GLY-PRO-GLU-ALA-PRO-GLU-TRP-TYR-GLN-VAL-GLU-LEU-LYS-ALA-PHE-GLN-ALA-THR-GLN-GLN-LYS,ACE-SER-LYS-SER-LYS-ASP-ARG-LYS-TYR-THR-LEU,261,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])C)CO,Kd=8.8uM,5.055517,5.06,1,A,A,1,A,A,0,,B,A,,1,1,261,11,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,0.9210510849952698,0.7857847213745117,92.05943298339844,85.97868347167969,0.3766324520111084,0.8461006283760071,0.9271878004074096,0.8721008896827698,0.8964541554450989,0.7642056941986084,SKSKDRKYTL,Low,"(5.014, 5.105]",train
4J81,protein-peptide,O15503 P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,KPHSD,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,LYS-PRO-HIS-SER-ASP,301,5,OC[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC[NH3+])[NH3+],Kd=31.9uM,4.496209,4.5,1,A,A,1,A,A,0,,C,A,,0,1,301,5,0,NCCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9430553913116456,0.8851297497749329,96.4365005493164,96.07818603515624,0.301442801952362,0.4598645269870758,0.9557634592056274,0.9422754049301147,0.9296659231185912,0.8708432912826538,KPHSD,Low,"(4.456, 4.606]",train
4J82,protein-peptide,Q9Y5U4 P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,KSHQE,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,LYS-SER-HIS-GLN-GLU,301,5,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCC(=O)N)Cc1nc[nH]c1)CO)[NH3+],Kd=44.2uM,4.354578,4.35,1,A,A,1,A,A,0,,C,A,,1,1,301,5,0,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O,0.9354657530784608,0.8681211471557617,96.69225311279295,95.89214324951172,0.2998524904251098,0.5038129687309265,0.9558099508285522,0.9405938386917114,0.9201672673225404,0.8500030040740967,KSHQE,Low,"(4.319, 4.456]",train
4J84,protein-peptide,P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVEIWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLG,ARKLD,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-ILE-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY,ALA-ARG-LYS-LEU-ASP,301,5,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=20.4uM,4.69037,4.69,1,A,A,1,A,A,0,,C,A,,1,1,301,5,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.9343380331993104,0.8636632561683655,96.87683868408205,95.95999908447266,0.3005930185317993,0.4849790930747986,0.9555962085723876,0.939045786857605,0.918811023235321,0.844817578792572,ARKLD,Low,"(4.606, 4.745]",train
4J8B,protein-peptide,Q96WV5,MAMLTKFESRSSRAKGVAFHPTQPWILTSLHNGRIQLWDYRMGTLLDRFDGHDGPVRGIAFHPTQPIFVSGGDDYKVNVWNYKSRKLLFSLCGHMDYVRVCTFHHEYPWILSCSDDQTIRIWNWQSRNCIAILTGHSHYVMCAAFHPSEDLIVSASLDQTVRVWDISGLRMKNAAPVSMSKEDQKAQAHNSISNDLFGSADAIVKFVLEGHDRGVNWCAFHPTLPLILSAGDDRLVKLWRMTASKAWEVDTCRGHFNNVSCCLFHPHQELILSASEDKTIRVWDLNRRTAVQTFRRANDRFWFITVHPKLNLFAAAHDSGVMVFKLE,LKTKLL,MET-ALA-MET-LEU-THR-LYS-PHE-GLU-SER-ARG-SER-SER-ARG-ALA-LYS-GLY-VAL-ALA-PHE-HIS-PRO-THR-GLN-PRO-TRP-ILE-LEU-THR-SER-LEU-HIS-ASN-GLY-ARG-ILE-GLN-LEU-TRP-ASP-TYR-ARG-MET-GLY-THR-LEU-LEU-ASP-ARG-PHE-ASP-GLY-HIS-ASP-GLY-PRO-VAL-ARG-GLY-ILE-ALA-PHE-HIS-PRO-THR-GLN-PRO-ILE-PHE-VAL-SER-GLY-GLY-ASP-ASP-TYR-LYS-VAL-ASN-VAL-TRP-ASN-TYR-LYS-SER-ARG-LYS-LEU-LEU-PHE-SER-LEU-CYS-GLY-HIS-MET-ASP-TYR-VAL-ARG-VAL-CYS-THR-PHE-HIS-HIS-GLU-TYR-PRO-TRP-ILE-LEU-SER-CYS-SER-ASP-ASP-GLN-THR-ILE-ARG-ILE-TRP-ASN-TRP-GLN-SER-ARG-ASN-CYS-ILE-ALA-ILE-LEU-THR-GLY-HIS-SER-HIS-TYR-VAL-MET-CYS-ALA-ALA-PHE-HIS-PRO-SER-GLU-ASP-LEU-ILE-VAL-SER-ALA-SER-LEU-ASP-GLN-THR-VAL-ARG-VAL-TRP-ASP-ILE-SER-GLY-LEU-ARG-MET-LYS-ASN-ALA-ALA-PRO-VAL-SER-MET-SER-LYS-GLU-ASP-GLN-LYS-ALA-GLN-ALA-HIS-ASN-SER-ILE-SER-ASN-ASP-LEU-PHE-GLY-SER-ALA-ASP-ALA-ILE-VAL-LYS-PHE-VAL-LEU-GLU-GLY-HIS-ASP-ARG-GLY-VAL-ASN-TRP-CYS-ALA-PHE-HIS-PRO-THR-LEU-PRO-LEU-ILE-LEU-SER-ALA-GLY-ASP-ASP-ARG-LEU-VAL-LYS-LEU-TRP-ARG-MET-THR-ALA-SER-LYS-ALA-TRP-GLU-VAL-ASP-THR-CYS-ARG-GLY-HIS-PHE-ASN-ASN-VAL-SER-CYS-CYS-LEU-PHE-HIS-PRO-HIS-GLN-GLU-LEU-ILE-LEU-SER-ALA-SER-GLU-ASP-LYS-THR-ILE-ARG-VAL-TRP-ASP-LEU-ASN-ARG-ARG-THR-ALA-VAL-GLN-THR-PHE-ARG-ARG-ALA-ASN-ASP-ARG-PHE-TRP-PHE-ILE-THR-VAL-HIS-PRO-LYS-LEU-ASN-LEU-PHE-ALA-ALA-ALA-HIS-ASP-SER-GLY-VAL-MET-VAL-PHE-LYS-LEU-GLU,LEU-LYS-THR-LYS-LEU-LEU,327,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CCCC[NH3+],Kd=16.1uM,4.793174,4.79,1,A,A,1,A,A,0,,B,A,,1,1,327,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,0.9022520780563354,0.7839654088020325,89.4181137084961,88.353271484375,0.3751469254493713,0.6233941316604614,0.91441148519516,0.8815836310386658,0.8879509568214417,0.7595608234405518,LKTKLL,Low,"(4.745, 4.866]",train
4J8S,protein-peptide,P26651 A5YKK6,SGFNNDPFVQRKLGTSGLNQPTFQQTDLSQVWPEANQHFSKEIDDEANSYFQRIYNHPPHPTMSVDEVLEMLQRFKDSTIKREREVFNCMLRNLFEEYRFFPQYPDKELHITACLFGGIIEKGLVTYMALGLALRYVLEALRKPFGSKMYYFGIAALDRFKNRLKDYPQYCQHLASISHFMQFPHHLQEYIEYGQQSRDPPVK,APRRLPIFNRISVSE,SER-GLY-PHE-ASN-ASN-ASP-PRO-PHE-VAL-GLN-ARG-LYS-LEU-GLY-THR-SER-GLY-LEU-ASN-GLN-PRO-THR-PHE-GLN-GLN-THR-ASP-LEU-SER-GLN-VAL-TRP-PRO-GLU-ALA-ASN-GLN-HIS-PHE-SER-LYS-GLU-ILE-ASP-ASP-GLU-ALA-ASN-SER-TYR-PHE-GLN-ARG-ILE-TYR-ASN-HIS-PRO-PRO-HIS-PRO-THR-MET-SER-VAL-ASP-GLU-VAL-LEU-GLU-MET-LEU-GLN-ARG-PHE-LYS-ASP-SER-THR-ILE-LYS-ARG-GLU-ARG-GLU-VAL-PHE-ASN-CYS-MET-LEU-ARG-ASN-LEU-PHE-GLU-GLU-TYR-ARG-PHE-PHE-PRO-GLN-TYR-PRO-ASP-LYS-GLU-LEU-HIS-ILE-THR-ALA-CYS-LEU-PHE-GLY-GLY-ILE-ILE-GLU-LYS-GLY-LEU-VAL-THR-TYR-MET-ALA-LEU-GLY-LEU-ALA-LEU-ARG-TYR-VAL-LEU-GLU-ALA-LEU-ARG-LYS-PRO-PHE-GLY-SER-LYS-MET-TYR-TYR-PHE-GLY-ILE-ALA-ALA-LEU-ASP-ARG-PHE-LYS-ASN-ARG-LEU-LYS-ASP-TYR-PRO-GLN-TYR-CYS-GLN-HIS-LEU-ALA-SER-ILE-SER-HIS-PHE-MET-GLN-PHE-PRO-HIS-HIS-LEU-GLN-GLU-TYR-ILE-GLU-TYR-GLY-GLN-GLN-SER-ARG-ASP-PRO-PRO-VAL-LYS,ALA-PRO-ARG-ARG-LEU-PRO-ILE-PHE-ASN-ARG-ILE-SER-VAL-SER-GLU,203,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)C(C)C)CO)[C@H](CC)C)CCC[NH+]=C(N)N)CC(=O)N)Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)CC(C)C)C,Kd~2uM,5.7,5.7,1,A,A,1,A,A,0,,B,A,,1,1,203,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)CC,0.9196397066116332,0.8033280968666077,84.22098541259766,75.3604507446289,0.46059051156044,0.8688190579414368,0.8556708693504333,0.8058090806007385,0.8152190446853638,0.7195797562599182,APRRLPIFNRISVSE,Low,"(5.699, 5.821]",train
4JIZ,protein-peptide,Q9H8S9,NLRQAVMLPEGEDLNEWIAVNTVDFFNQINMLYGTITEFCTEASCPVMSAGPRYEYHWADGTNIKKPIKCSAPKYIDYLMTWVQDQLDDETLFPSKIGVPFPKNFMSVAKTILKRLFRVYAHIYHQHFDSVMQLQEEAHLNTSFKHFIFFVQEFNLIDRRELAPLQELIEKL,YHSVVRYA,ASN-LEU-ARG-GLN-ALA-VAL-MET-LEU-PRO-GLU-GLY-GLU-ASP-LEU-ASN-GLU-TRP-ILE-ALA-VAL-ASN-THR-VAL-ASP-PHE-PHE-ASN-GLN-ILE-ASN-MET-LEU-TYR-GLY-THR-ILE-THR-GLU-PHE-CYS-THR-GLU-ALA-SER-CYS-PRO-VAL-MET-SER-ALA-GLY-PRO-ARG-TYR-GLU-TYR-HIS-TRP-ALA-ASP-GLY-THR-ASN-ILE-LYS-LYS-PRO-ILE-LYS-CYS-SER-ALA-PRO-LYS-TYR-ILE-ASP-TYR-LEU-MET-THR-TRP-VAL-GLN-ASP-GLN-LEU-ASP-ASP-GLU-THR-LEU-PHE-PRO-SER-LYS-ILE-GLY-VAL-PRO-PHE-PRO-LYS-ASN-PHE-MET-SER-VAL-ALA-LYS-THR-ILE-LEU-LYS-ARG-LEU-PHE-ARG-VAL-TYR-ALA-HIS-ILE-TYR-HIS-GLN-HIS-PHE-ASP-SER-VAL-MET-GLN-LEU-GLN-GLU-GLU-ALA-HIS-LEU-ASN-THR-SER-PHE-LYS-HIS-PHE-ILE-PHE-PHE-VAL-GLN-GLU-PHE-ASN-LEU-ILE-ASP-ARG-ARG-GLU-LEU-ALA-PRO-LEU-GLN-GLU-LEU-ILE-GLU-LYS-LEU,TYR-HIS-SEP-VAL-VAL-ARG-TYR-ALA,172,8,Oc1ccc(cc1)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)C(C)C)C(C)C)COP(O)(O)O)Cc1c[nH]cn1)[NH3+],Kd=2.4uM,5.619789,5.62,1,A,A,1,A,A,0,,B,A,,1,1,172,8,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,0.823978841304779,0.8729966878890991,93.72280883789062,92.20195770263672,0.347030907869339,0.476470947265625,0.9341045022010804,0.9259624481201172,0.768669605255127,0.8597552180290222,YHSVVRYA,Low,"(5.6, 5.699]",train
4JJQ,protein-peptide,P51965 Q93009,GSMTAEEDMEDDTSWRSEATFQFTVERFSRLSESVLSPPCFVRNLPWKIMVMPRFYPDRPHQKSVGFFLQCNAESDSTSWSCHAQAVLKIINYRDDEKSFSRRISHLFFHKENDWGFSNFMAWSEVTDPEKGFIDDDKVTFEVFVQADAPHGVAWASTS,DSRASTSSSS,GLY-SER-MET-THR-ALA-GLU-GLU-ASP-MET-GLU-ASP-ASP-THR-SER-TRP-ARG-SER-GLU-ALA-THR-PHE-GLN-PHE-THR-VAL-GLU-ARG-PHE-SER-ARG-LEU-SER-GLU-SER-VAL-LEU-SER-PRO-PRO-CYS-PHE-VAL-ARG-ASN-LEU-PRO-TRP-LYS-ILE-MET-VAL-MET-PRO-ARG-PHE-TYR-PRO-ASP-ARG-PRO-HIS-GLN-LYS-SER-VAL-GLY-PHE-PHE-LEU-GLN-CYS-ASN-ALA-GLU-SER-ASP-SER-THR-SER-TRP-SER-CYS-HIS-ALA-GLN-ALA-VAL-LEU-LYS-ILE-ILE-ASN-TYR-ARG-ASP-ASP-GLU-LYS-SER-PHE-SER-ARG-ARG-ILE-SER-HIS-LEU-PHE-PHE-HIS-LYS-GLU-ASN-ASP-TRP-GLY-PHE-SER-ASN-PHE-MET-ALA-TRP-SER-GLU-VAL-THR-ASP-PRO-GLU-LYS-GLY-PHE-ILE-ASP-ASP-ASP-LYS-VAL-THR-PHE-GLU-VAL-PHE-VAL-GLN-ALA-ASP-ALA-PRO-HIS-GLY-VAL-ALA-TRP-ALA-SER-THR-SER,ASP-SER-ARG-ALA-SER-THR-SER-SER-SER-SER,159,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C=O)CO)[C@H](O)C)NC(=O)[C@@H]([NH3+])C,Kd=9.4uM,5.026872,5.03,1,A,A,1,A,A,0,,B,A,,1,1,159,10,0,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.924072802066803,0.871680498123169,93.46273803710938,90.89596557617188,0.3596771657466888,0.5573960542678833,0.9140523672103882,0.8990873098373413,0.8415187001228333,0.8373130559921265,DSRASTSSSS,Low,"(5.014, 5.105]",train
4JK5,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,ACSRYEVDCRGRSSACG,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,ALA-CYS-SER-ARG-TYR-GLU-VAL-ASP-CYS-ARG-GLY-ARG-DSN-SER-ALA-CYS-GLY-NH2,245,18,OC[C@@H]1NC(=O)[C@H](CSCc2cc3CSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCC(=O)O)C(C)C)CC(=O)O)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)NCC(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCc(c2)c3)C(=O)NCC(=O)N)C)CO)CO)NC(=O)[C@@H]([NH3+])C,Ki=0.028uM,7.552842,7.55,1,A,A,1,A,A,0,,B,A,,1,1,245,18,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.8578836917877197,0.7649667859077454,94.64118957519533,94.44058990478516,0.3609320819377899,0.7469688653945923,0.9507259726524352,0.8842671513557434,0.794119656085968,0.7351416945457458,ACSRYEVDCRGRSSACG,Moderate,"(7.523, 7.921]",train
4JK6,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,ACSRYEVDCRGRTSACG,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,ALA-CYS-SER-ARG-TYR-GLU-VAL-ASP-CYS-ARG-GLY-ARG-DBB-SER-ALA-CYS-GLY-NH2,245,18,OC[C@@H]1NC(=O)[C@H](CSCc2cc3CSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCC(=O)O)C(C)C)CC(=O)O)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)NCC(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCc(c2)c3)C(=O)NCC(=O)N)C)CO)CC)NC(=O)[C@@H]([NH3+])C,Ki=0.064uM,7.19382,7.19,1,A,A,1,A,A,0,,B,A,,1,1,245,18,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C)O,CCC(NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)C(=O)O,CCC(NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.8587915301322937,0.7665506601333618,94.18578338623048,94.385009765625,0.3614314794540405,0.7432432770729065,0.9496190547943116,0.8854544758796692,0.7955312132835388,0.7368246912956238,ACSRYEVDCRGRTSACG,Moderate,"(7.049, 7.268]",train
4JMG,protein-peptide,Q06124,GSVKFNSLNELVDYHRSTSVSRNQQIFLRDIGGSGGGHPWYKGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVGGSGGSVSSVPTKLEVVAATPTSLLISWDAWSGSDWPVSYYRITYGETGGNSPVQEFTVPGSSYTATISGLSPGVDYTITVYAGYDGKYYYQSPISINYRT,DSARVYENVGLMQ,GLY-SER-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLY-GLY-SER-GLY-GLY-GLY-HIS-PRO-TRP-TYR-LYS-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-GLY-GLY-SER-GLY-GLY-SER-VAL-SER-SER-VAL-PRO-THR-LYS-LEU-GLU-VAL-VAL-ALA-ALA-THR-PRO-THR-SER-LEU-LEU-ILE-SER-TRP-ASP-ALA-TRP-SER-GLY-SER-ASP-TRP-PRO-VAL-SER-TYR-TYR-ARG-ILE-THR-TYR-GLY-GLU-THR-GLY-GLY-ASN-SER-PRO-VAL-GLN-GLU-PHE-THR-VAL-PRO-GLY-SER-SER-TYR-THR-ALA-THR-ILE-SER-GLY-LEU-SER-PRO-GLY-VAL-ASP-TYR-THR-ILE-THR-VAL-TYR-ALA-GLY-TYR-ASP-GLY-LYS-TYR-TYR-TYR-GLN-SER-PRO-ILE-SER-ILE-ASN-TYR-ARG-THR,ASP-SER-ALA-ARG-VAL-PTR-GLU-ASN-VAL-GLY-LEU-MET-GLN,203,13,CSCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])Cc1ccc(cc1)OP(O)(O)O)CCC(=O)O)CC(=O)N)CC(C)C,Kd=1.5nM,8.823909,8.82,1,A,A,1,A,A,0,,B,A,,1,1,203,13,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)C,0.8290579319000244,0.7762065529823303,71.405029296875,67.47034454345703,0.5374661684036255,0.7956067323684692,0.7750956416130066,0.7928031086921692,0.804932713508606,0.7720574140548706,DSARVYENVGLMQ,Moderate,"(8.383, 8.824]",train
4JMH,protein-peptide,P29353,GSVKFNSLDELVDYHRSTSVSRNQQIFLRDIGGSGGGHPWYKGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVGGSGGSVSSVPTKLEVVAATPTSLLISWDAIWYPYYVSYYRITYGETGGNSPVQEFTVPGYSSTATISGLSPGVDYTITIYAKYHRAKYYSSPISINYRT,PPDHQYYNDFPGK,GLY-SER-VAL-LYS-PHE-ASN-SER-LEU-ASP-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLY-GLY-SER-GLY-GLY-GLY-HIS-PRO-TRP-TYR-LYS-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-GLY-GLY-SER-GLY-GLY-SER-VAL-SER-SER-VAL-PRO-THR-LYS-LEU-GLU-VAL-VAL-ALA-ALA-THR-PRO-THR-SER-LEU-LEU-ILE-SER-TRP-ASP-ALA-ILE-TRP-TYR-PRO-TYR-TYR-VAL-SER-TYR-TYR-ARG-ILE-THR-TYR-GLY-GLU-THR-GLY-GLY-ASN-SER-PRO-VAL-GLN-GLU-PHE-THR-VAL-PRO-GLY-TYR-SER-SER-THR-ALA-THR-ILE-SER-GLY-LEU-SER-PRO-GLY-VAL-ASP-TYR-THR-ILE-THR-ILE-TYR-ALA-LYS-TYR-HIS-ARG-ALA-LYS-TYR-TYR-SER-SER-PRO-ILE-SER-ILE-ASN-TYR-ARG-THR,PRO-PRO-ASP-HIS-GLN-PTR-PTR-ASN-ASP-PHE-PRO-GLY-LYS,202,13,NC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1ccccc1)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC(=O)N)Cc1ccc(cc1)OP(O)(O)O)Cc1ccc(cc1)OP(O)(O)O,Kd=2.1nM,8.677781,8.68,1,A,A,1,A,A,0,,B,A,,1,1,202,13,0,NCCCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)O,NCCCC[C@H](NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)NCC(=O)O)C(=O)O,NCCCC[C@H](NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)NCC(=O)O)C(=O)O,0.8632714748382568,0.8097954988479614,74.2513198852539,66.60411834716797,0.428010880947113,0.7511602640151978,0.8246501088142395,0.8063229918479919,0.8351361155509949,0.810663640499115,PPDHQYYNDFPGK,Moderate,"(8.383, 8.824]",train
4K0U,protein-peptide,Q01565 Q01567,KNTASRSAASVPANEQISQLASLVAASKYLRVQCERSDLPDDGTILKTAVNVAVQKGWDTGRYQSLPQLSENLYQGLLKDGTPKATQCSSFNRTMTPFLDAMRTVR,RTFRQVQSSISDFYD,LYS-ASN-THR-ALA-SER-ARG-SER-ALA-ALA-SER-VAL-PRO-ALA-ASN-GLU-GLN-ILE-SER-GLN-LEU-ALA-SER-LEU-VAL-ALA-ALA-SER-LYS-TYR-LEU-ARG-VAL-GLN-CYS-GLU-ARG-SER-ASP-LEU-PRO-ASP-ASP-GLY-THR-ILE-LEU-LYS-THR-ALA-VAL-ASN-VAL-ALA-VAL-GLN-LYS-GLY-TRP-ASP-THR-GLY-ARG-TYR-GLN-SER-LEU-PRO-GLN-LEU-SER-GLU-ASN-LEU-TYR-GLN-GLY-LEU-LEU-LYS-ASP-GLY-THR-PRO-LYS-ALA-THR-GLN-CYS-SER-SER-PHE-ASN-ARG-THR-MET-THR-PRO-PHE-LEU-ASP-ALA-MET-ARG-THR-VAL-ARG,ARG-THR-PHE-ARG-GLN-VAL-GLN-SER-SER-ILE-SER-ASP-PHE-TYR-ASP,106,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccc(cc1)O)Cc1ccccc1)CC(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1ccccc1)CCC[NH+]=C(N)N)CCC(=O)N)CCC(=O)N)CO)CO)C,Kd=55nM,7.259637,7.26,1,A,A,1,A,A,0,,B,A,,1,1,106,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,1.030578374862671,0.886953592300415,94.61693572998048,86.16378784179688,0.3390475511550903,0.7003358006477356,0.9074078798294068,0.8639334440231323,0.9270734190940856,0.8278501033782959,RTFRQVQSSISDFYD,Moderate,"(7.049, 7.268]",val
4K1E,protein-peptide,Q4GWU5 Q9Y5K2,IINGEDCSPHSQPWQAALVMENELFCSGVLVHPQWVLSAAHCFQNSYTIGLGLHSLEADQEPGSQMVEASLSVRHPEYNRPLLANDLMLIKLDESVSESDTIRSISIASQCPTAGNSCLVSGWGLLANGRMPTVLQCVNVSVVSEEVCSKLYDPLYHPSMFCAGGGQDQKDSCNGDSGGPLICNGYLQGLVSFGKAPCGQVGVPGVYTNLCKFTEWIEKTVQA,GFCQRSIPPICFPD,ILE-ILE-ASN-GLY-GLU-ASP-CYS-SER-PRO-HIS-SER-GLN-PRO-TRP-GLN-ALA-ALA-LEU-VAL-MET-GLU-ASN-GLU-LEU-PHE-CYS-SER-GLY-VAL-LEU-VAL-HIS-PRO-GLN-TRP-VAL-LEU-SER-ALA-ALA-HIS-CYS-PHE-GLN-ASN-SER-TYR-THR-ILE-GLY-LEU-GLY-LEU-HIS-SER-LEU-GLU-ALA-ASP-GLN-GLU-PRO-GLY-SER-GLN-MET-VAL-GLU-ALA-SER-LEU-SER-VAL-ARG-HIS-PRO-GLU-TYR-ASN-ARG-PRO-LEU-LEU-ALA-ASN-ASP-LEU-MET-LEU-ILE-LYS-LEU-ASP-GLU-SER-VAL-SER-GLU-SER-ASP-THR-ILE-ARG-SER-ILE-SER-ILE-ALA-SER-GLN-CYS-PRO-THR-ALA-GLY-ASN-SER-CYS-LEU-VAL-SER-GLY-TRP-GLY-LEU-LEU-ALA-ASN-GLY-ARG-MET-PRO-THR-VAL-LEU-GLN-CYS-VAL-ASN-VAL-SER-VAL-VAL-SER-GLU-GLU-VAL-CYS-SER-LYS-LEU-TYR-ASP-PRO-LEU-TYR-HIS-PRO-SER-MET-PHE-CYS-ALA-GLY-GLY-GLY-GLN-ASP-GLN-LYS-ASP-SER-CYS-ASN-GLY-ASP-SER-GLY-GLY-PRO-LEU-ILE-CYS-ASN-GLY-TYR-LEU-GLN-GLY-LEU-VAL-SER-PHE-GLY-LYS-ALA-PRO-CYS-GLY-GLN-VAL-GLY-VAL-PRO-GLY-VAL-TYR-THR-ASN-LEU-CYS-LYS-PHE-THR-GLU-TRP-ILE-GLU-LYS-THR-VAL-GLN-ALA,GLY-PHE-CYS-GLN-ARG-SER-ILE-PRO-PRO-ILE-CYS-PHE-PRO-ASP,223,14,CC[C@@H]([C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N2)Cc1ccccc1)CCC(=O)N)CCC[NH+]=C(N)N)[C@H](CC)C)C,Ki=3.59nM,8.444906,8.44,1,A,A,1,A,A,0,,B,A,,1,1,223,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9825863242149352,0.821033239364624,94.87915802001952,92.71885681152344,0.3148227632045746,0.5990906953811646,0.9573819041252136,0.9078772664070128,0.9519675374031068,0.7993221879005432,GFCQRSIPPICFPD,Moderate,"(8.383, 8.824]",val
4K3M,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,ALDLF,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ALA-LEU-ASP-LEU-PHE,366,5,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=281.2uM,3.550985,3.55,1,A,A,1,A,A,0,,E,A,,1,1,366,5,0,CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)N[C@@H](C)C(=O)O,0.9223264455795288,0.758044958114624,90.0907211303711,87.0609359741211,0.3982389569282532,0.6525877118110657,0.8920679688453674,0.872555673122406,0.921467900276184,0.7294172644615173,ALDLF,Low,"(3.548, 3.924]",val
4K3P,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QLALF,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-LEU-ALA-LEU-PHE,366,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC(C)C)C)C,Kd=1.6uM,5.79588,5.8,1,A,A,1,A,A,0,,E,A,,1,1,366,6,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9133647680282592,0.8333408236503601,89.75070190429688,88.51998138427734,0.3924107849597931,0.5523324012756348,0.8967395424842834,0.89718097448349,0.9090978503227234,0.8173807859420776,QLALF,Low,"(5.699, 5.821]",train
4K3Q,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QLDAF,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-LEU-ASP-ALA-PHE,366,6,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)C)CC(=O)O)NC(=O)[C@@H](NC(=O)C)CCC(=O)N)C,Kd=115.1uM,3.938925,3.94,1,A,A,1,A,A,0,,E,A,,1,1,366,6,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.7855687737464905,0.8962391018867493,89.3255386352539,87.63323211669922,0.3907234668731689,0.5047829151153564,0.9080395102500916,0.8960492014884949,0.746527910232544,0.8962865471839905,QLDAF,Low,"(3.924, 4.155]",train
4K3R,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QLDLA,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-LEU-ASP-LEU-ALA,366,6,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(=O)O)NC(=O)[C@@H]([NH2+][C@@H](O)C)CCC(=O)N)C,Kd=259.1uM,3.586533,3.59,1,A,A,1,A,A,0,,E,A,,1,1,366,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)O,0.8522722721099854,0.9010275602340698,89.3245849609375,87.6407470703125,0.4007168710231781,0.4852268695831299,0.8973743319511414,0.8975504636764526,0.8325735330581665,0.9018967747688292,QLDLA,Low,"(3.548, 3.924]",train
4K75,protein-peptide,Q9HD26,GPIRKVLLLKEDHEGLGISITGGKEHGVPILISEIHPGQPADRCGGLHVGDAILAVNGVNLRDTKHKEAVTILSQQRGEIEFEVVYV,ANSRWQDTRL,GLY-PRO-ILE-ARG-LYS-VAL-LEU-LEU-LEU-LYS-GLU-ASP-HIS-GLU-GLY-LEU-GLY-ILE-SER-ILE-THR-GLY-GLY-LYS-GLU-HIS-GLY-VAL-PRO-ILE-LEU-ILE-SER-GLU-ILE-HIS-PRO-GLY-GLN-PRO-ALA-ASP-ARG-CSU-GLY-GLY-LEU-HIS-VAL-GLY-ASP-ALA-ILE-LEU-ALA-VAL-ASN-GLY-VAL-ASN-LEU-ARG-ASP-THR-LYS-HIS-LYS-GLU-ALA-VAL-THR-ILE-LEU-SER-GLN-GLN-ARG-GLY-GLU-ILE-GLU-PHE-GLU-VAL-VAL-TYR-VAL,ALA-ASN-SER-ARG-TRP-GLN-ASP-THR-ARG-LEU,87,10,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)[C@H](O)C)CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Ki=56.2uM,4.250264,4.25,1,A,A,1,A,A,0,,B,A,,1,1,87,10,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,0.968372642993927,0.7989998459815979,97.66099548339844,93.55765533447266,0.2822723090648651,0.6236811280250549,0.9396947622299194,0.8625810146331787,0.9111090302467346,0.7831044793128967,ANSRWQDTRL,Low,"(4.155, 4.319]",val
4K78,protein-peptide,Q9HD26,GPIRKVLLLKEDHEGLGISITGGKEHGVPILISAIHPGQPADRCGGLHVGDAILAVNGVNLRDTKHKEAVTILSQQRGEIEFEVVYV,ANSRWQDTRL,GLY-PRO-ILE-ARG-LYS-VAL-LEU-LEU-LEU-LYS-GLU-ASP-HIS-GLU-GLY-LEU-GLY-ILE-SER-ILE-THR-GLY-GLY-LYS-GLU-HIS-GLY-VAL-PRO-ILE-LEU-ILE-SER-ALA-ILE-HIS-PRO-GLY-GLN-PRO-ALA-ASP-ARG-CSU-GLY-GLY-LEU-HIS-VAL-GLY-ASP-ALA-ILE-LEU-ALA-VAL-ASN-GLY-VAL-ASN-LEU-ARG-ASP-THR-LYS-HIS-LYS-GLU-ALA-VAL-THR-ILE-LEU-SER-GLN-GLN-ARG-GLY-GLU-ILE-GLU-PHE-GLU-VAL-VAL-TYR-VAL,ALA-ASN-SER-ARG-TRP-GLN-ASP-THR-ARG-LEU,87,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)[C@H](O)C)CC(=O)O)CCC(=O)N)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)N,Ki=16.2uM,4.790485,4.79,1,A,A,1,A,A,0,,B,A,,1,1,87,10,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,0.9729909300804138,0.7937296628952026,97.65167999267578,93.4891586303711,0.2815317809581756,0.6341348886489868,0.9419400095939636,0.8578504920005798,0.9163206815719604,0.7776994109153748,ANSRWQDTRL,Low,"(4.745, 4.866]",train
4KMD,protein-peptide,P08151 Q9UMX1,MGSSHHHHHHSSGLVPRGSHMAELRPSGAPGPTAPPAPGPTAPPAFASLFPPGLHAIYGECRRLYPDQPNPLQVTAIVKYWLGGPDPLDYVSMYRNVGSPSANIPEHWHYISFGLSDLYGDNRVHEFTGTDGPSGFGFELTFRLKRETGESAPPTWPAELMQGLARYVFQSENTFCSGDHVSWHSPLDNSESRIQHMLLTEDPQMQPVQTPFGVVTFLQIVGVCTEELHSAQQWNGQGILELLRTVPIAGGPWLITDMRRGETIFEIDPHLQERVDKGIETDGSNLSGVSAKCAWDDLSRPPEDDSLESDSSTAIIPHELIRTRQLESVHLKFNQESGALIPLCLRGRLLHGRHFTYKSITGDMAITFVSTGVEGAFATEEHPYAAHGPWLQILLTEEFVEKMLEDLEDLTSPEEFKLPKEYSWPEKKLKVSILPDVVFDSPLH,SRCTSPGGSYGHLSIGT,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-GLU-LEU-ARG-PRO-SER-GLY-ALA-PRO-GLY-PRO-THR-ALA-PRO-PRO-ALA-PRO-GLY-PRO-THR-ALA-PRO-PRO-ALA-PHE-ALA-SER-LEU-PHE-PRO-PRO-GLY-LEU-HIS-ALA-ILE-TYR-GLY-GLU-CYS-ARG-ARG-LEU-TYR-PRO-ASP-GLN-PRO-ASN-PRO-LEU-GLN-VAL-THR-ALA-ILE-VAL-LYS-TYR-TRP-LEU-GLY-GLY-PRO-ASP-PRO-LEU-ASP-TYR-VAL-SER-MET-TYR-ARG-ASN-VAL-GLY-SER-PRO-SER-ALA-ASN-ILE-PRO-GLU-HIS-TRP-HIS-TYR-ILE-SER-PHE-GLY-LEU-SER-ASP-LEU-TYR-GLY-ASP-ASN-ARG-VAL-HIS-GLU-PHE-THR-GLY-THR-ASP-GLY-PRO-SER-GLY-PHE-GLY-PHE-GLU-LEU-THR-PHE-ARG-LEU-LYS-ARG-GLU-THR-GLY-GLU-SER-ALA-PRO-PRO-THR-TRP-PRO-ALA-GLU-LEU-MET-GLN-GLY-LEU-ALA-ARG-TYR-VAL-PHE-GLN-SER-GLU-ASN-THR-PHE-CYS-SER-GLY-ASP-HIS-VAL-SER-TRP-HIS-SER-PRO-LEU-ASP-ASN-SER-GLU-SER-ARG-ILE-GLN-HIS-MET-LEU-LEU-THR-GLU-ASP-PRO-GLN-MET-GLN-PRO-VAL-GLN-THR-PRO-PHE-GLY-VAL-VAL-THR-PHE-LEU-GLN-ILE-VAL-GLY-VAL-CYS-THR-GLU-GLU-LEU-HIS-SER-ALA-GLN-GLN-TRP-ASN-GLY-GLN-GLY-ILE-LEU-GLU-LEU-LEU-ARG-THR-VAL-PRO-ILE-ALA-GLY-GLY-PRO-TRP-LEU-ILE-THR-ASP-MET-ARG-ARG-GLY-GLU-THR-ILE-PHE-GLU-ILE-ASP-PRO-HIS-LEU-GLN-GLU-ARG-VAL-ASP-LYS-GLY-ILE-GLU-THR-ASP-GLY-SER-ASN-LEU-SER-GLY-VAL-SER-ALA-LYS-CYS-ALA-TRP-ASP-ASP-LEU-SER-ARG-PRO-PRO-GLU-ASP-ASP-SER-LEU-GLU-SER-ASP-SER-SER-THR-ALA-ILE-ILE-PRO-HIS-GLU-LEU-ILE-ARG-THR-ARG-GLN-LEU-GLU-SER-VAL-HIS-LEU-LYS-PHE-ASN-GLN-GLU-SER-GLY-ALA-LEU-ILE-PRO-LEU-CYS-LEU-ARG-GLY-ARG-LEU-LEU-HIS-GLY-ARG-HIS-PHE-THR-TYR-LYS-SER-ILE-THR-GLY-ASP-MET-ALA-ILE-THR-PHE-VAL-SER-THR-GLY-VAL-GLU-GLY-ALA-PHE-ALA-THR-GLU-GLU-HIS-PRO-TYR-ALA-ALA-HIS-GLY-PRO-TRP-LEU-GLN-ILE-LEU-LEU-THR-GLU-GLU-PHE-VAL-GLU-LYS-MET-LEU-GLU-ASP-LEU-GLU-ASP-LEU-THR-SER-PRO-GLU-GLU-PHE-LYS-LEU-PRO-LYS-GLU-TYR-SER-TRP-PRO-GLU-LYS-LYS-LEU-LYS-VAL-SER-ILE-LEU-PRO-ASP-VAL-VAL-PHE-ASP-SER-PRO-LEU-HIS,SER-ARG-CYS-THR-SER-PRO-GLY-GLY-SER-TYR-GLY-HIS-LEU-SER-ILE-GLY-THR,444,17,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)C[NH3+])CO)CC(C)C,Kd=3.86uM,5.413413,5.41,1,A,A,1,A,A,0,,B,A,,1,1,444,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8870554566383362,0.7847856879234314,74.01323699951172,69.86546325683594,0.5531057715415955,1.0459027290344238,0.788537859916687,0.7521714568138123,0.80186927318573,0.7056644558906555,SRCTSPGGSYGHLSIGT,Low,"(5.31, 5.463]",train
4L58,protein-peptide,Q8IZD2 P84243,GSHMDVTRCICGFTHDDGYMICCDKCSVWQHIDCMGIDRQHIPDTYLCERCQPRNLDKERAVLLQRRKR,ARTKQTARKSTG,GLY-SER-HIS-MET-ASP-VAL-THR-ARG-CYS-ILE-CYS-GLY-PHE-THR-HIS-ASP-ASP-GLY-TYR-MET-ILE-CYS-CYS-ASP-LYS-CYS-SER-VAL-TRP-GLN-HIS-ILE-ASP-CYS-MET-GLY-ILE-ASP-ARG-GLN-HIS-ILE-PRO-ASP-THR-TYR-LEU-CYS-GLU-ARG-CYS-GLN-PRO-ARG-ASN-LEU-ASP-LYS-GLU-ARG-ALA-VAL-LEU-LEU-GLN-ARG-ARG-LYS-ARG,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,69,12,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=21uM,4.677781,4.68,1,A,A,1,A,A,0,,B,A,,1,1,69,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9019583463668824,0.7416564226150513,91.34468841552734,91.55142211914062,0.3437782824039459,0.7040340304374695,0.8806913495063782,0.8124367594718933,0.8146824836730957,0.7239612936973572,ARTKQTARKSTG,Low,"(4.606, 4.745]",train
4LG6,protein-peptide,Q9H0W5 Q9H9E1,GSTTPLLANSLSVHQLAAQGEMLYLATRIEQENVINHTDEEGFTPLMWAAAHGQIAVVEFLLQNGADPQLLGKGRESALSLACSKGYTDIVKMLLDCGVDVNEYDWNGGTPLLYAVHGNHVKCVKMLLESGADPTIETDSGYNSMDLAVALGYRSVQQVIESHLLKLLQNIKE,RAFWHTPRLPTLPKRVP,GLY-SER-THR-THR-PRO-LEU-LEU-ALA-ASN-SER-LEU-SER-VAL-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-MET-LEU-TYR-LEU-ALA-THR-ARG-ILE-GLU-GLN-GLU-ASN-VAL-ILE-ASN-HIS-THR-ASP-GLU-GLU-GLY-PHE-THR-PRO-LEU-MET-TRP-ALA-ALA-ALA-HIS-GLY-GLN-ILE-ALA-VAL-VAL-GLU-PHE-LEU-LEU-GLN-ASN-GLY-ALA-ASP-PRO-GLN-LEU-LEU-GLY-LYS-GLY-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-CYS-SER-LYS-GLY-TYR-THR-ASP-ILE-VAL-LYS-MET-LEU-LEU-ASP-CYS-GLY-VAL-ASP-VAL-ASN-GLU-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-LYS-MET-LEU-LEU-GLU-SER-GLY-ALA-ASP-PRO-THR-ILE-GLU-THR-ASP-SER-GLY-TYR-ASN-SER-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-SER-VAL-GLN-GLN-VAL-ILE-GLU-SER-HIS-LEU-LEU-LYS-LEU-LEU-GLN-ASN-ILE-LYS-GLU,ARG-ALA-PHE-TRP-HIS-THR-PRO-ARG-LEU-PRO-THR-LEU-PRO-LYS-ARG-VAL-PRO,173,17,CCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCCC1)C(C)C)C)CCC)CC(C)C)[C@H](O)C)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C,Kd=0.18uM,6.744727,6.74,1,A,A,1,A,A,0,,B,A,,1,1,173,17,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,0.9269059896469116,0.822274386882782,91.41708374023438,87.2249984741211,0.3469065427780151,0.6622904539108276,0.9244455695152284,0.8800613284111023,0.8584420680999756,0.8078275918960571,RAFWHTPRLPTLPKRVP,Low,"(6.696, 6.824]",train
4LN2,protein-peptide,Q9BX66 P18206,QHMVLEYGEAIAKFNFNGDTQVEMSFRKGERITLLRQVDENWYEGRIPGTSRQGIFPITYVDVIKRPL,ELAPPKPPLPE,GLN-HIS-MET-VAL-LEU-GLU-TYR-GLY-GLU-ALA-ILE-ALA-LYS-PHE-ASN-PHE-ASN-GLY-ASP-THR-GLN-VAL-GLU-MET-SER-PHE-ARG-LYS-GLY-GLU-ARG-ILE-THR-LEU-LEU-ARG-GLN-VAL-ASP-GLU-ASN-TRP-TYR-GLU-GLY-ARG-ILE-PRO-GLY-THR-SER-ARG-GLN-GLY-ILE-PHE-PRO-ILE-THR-TYR-VAL-ASP-VAL-ILE-LYS-ARG-PRO-LEU,GLU-LEU-ALA-PRO-PRO-LYS-PRO-PRO-LEU-PRO-GLU,68,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C,Kd=248uM,3.605548,3.61,1,A,A,1,A,A,0,,B,A,,1,1,68,11,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.9663692712783812,0.8899247050285339,97.88643646240234,95.90363311767578,0.2991337776184082,0.4224454164505005,0.9125655889511108,0.910390555858612,0.8927948474884033,0.8848082423210144,ELAPPKPPLPE,Low,"(3.548, 3.924]",train
4LNP,protein-peptide,Q9BX66 P18206,EMRPARAKFDFKAQTLKELPLQKGDIVYIYKQIDQNWYEGEHHGRVGIFPRTYIELLPPAE,VPPPRPPPPE,GLU-MET-ARG-PRO-ALA-ARG-ALA-LYS-PHE-ASP-PHE-LYS-ALA-GLN-THR-LEU-LYS-GLU-LEU-PRO-LEU-GLN-LYS-GLY-ASP-ILE-VAL-TYR-ILE-TYR-LYS-GLN-ILE-ASP-GLN-ASN-TRP-TYR-GLU-GLY-GLU-HIS-HIS-GLY-ARG-VAL-GLY-ILE-PHE-PRO-ARG-THR-TYR-ILE-GLU-LEU-LEU-PRO-PRO-ALA-GLU,VAL-PRO-PRO-PRO-ARG-PRO-PRO-PRO-PRO-GLU,61,10,OC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=214uM,3.669586,3.67,1,A,A,1,A,A,0,,B,A,,1,1,61,10,0,CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.959226131439209,0.8127598762512207,97.77765655517578,95.22186279296876,0.3008358478546142,0.4498330950736999,0.904848039150238,0.8563960194587708,0.8847925066947937,0.8018508553504944,VPPPRPPPPE,Low,"(3.548, 3.924]",train
4M7C,protein-peptide,Q8IY92 Q15554,EARLEEAVNRWVLKFYFHEALRAFRGSRYGDFRQIRDIMQALLVRPLGKEHTVSRLLRVMQCLSRIEEGENLDCSFDMEAELTPLESAINVLEMIKTEFTLTEAVVESSRKLVKEAAVIICIKNKEFEKASKILKKHMSKDPTTQKLRNDLLNIIREKNLAHPVIQNFSYETFQQKMLRFLESHLDDAEPYLLTMAKKAL,SRGLEVSHRLAPW,GLU-ALA-ARG-LEU-GLU-GLU-ALA-VAL-ASN-ARG-TRP-VAL-LEU-LYS-PHE-TYR-PHE-HIS-GLU-ALA-LEU-ARG-ALA-PHE-ARG-GLY-SER-ARG-TYR-GLY-ASP-PHE-ARG-GLN-ILE-ARG-ASP-ILE-MET-GLN-ALA-LEU-LEU-VAL-ARG-PRO-LEU-GLY-LYS-GLU-HIS-THR-VAL-SER-ARG-LEU-LEU-ARG-VAL-MET-GLN-CYS-LEU-SER-ARG-ILE-GLU-GLU-GLY-GLU-ASN-LEU-ASP-CYS-SER-PHE-ASP-MET-GLU-ALA-GLU-LEU-THR-PRO-LEU-GLU-SER-ALA-ILE-ASN-VAL-LEU-GLU-MET-ILE-LYS-THR-GLU-PHE-THR-LEU-THR-GLU-ALA-VAL-VAL-GLU-SER-SER-ARG-LYS-LEU-VAL-LYS-GLU-ALA-ALA-VAL-ILE-ILE-CYS-ILE-LYS-ASN-LYS-GLU-PHE-GLU-LYS-ALA-SER-LYS-ILE-LEU-LYS-LYS-HIS-MET-SER-LYS-ASP-PRO-THR-THR-GLN-LYS-LEU-ARG-ASN-ASP-LEU-LEU-ASN-ILE-ILE-ARG-GLU-LYS-ASN-LEU-ALA-HIS-PRO-VAL-ILE-GLN-ASN-PHE-SER-TYR-GLU-THR-PHE-GLN-GLN-LYS-MET-LEU-ARG-PHE-LEU-GLU-SER-HIS-LEU-ASP-ASP-ALA-GLU-PRO-TYR-LEU-LEU-THR-MET-ALA-LYS-LYS-ALA-LEU,SER-ARG-GLY-LEU-GLU-VAL-SER-HIS-ARG-LEU-ALA-PRO-TRP,200,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC[NH+]=C(N)N)CC(C)C)CCC(=O)O,Kd=0.75uM,6.124939,6.12,1,A,A,1,A,A,0,,C,A,,1,1,200,13,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,0.9416837692260742,0.8340803384780884,91.49608612060548,88.78584289550781,0.3410028219223022,0.6553936004638672,0.9338613152503968,0.8975349068641663,0.9054937958717346,0.8182166218757629,SRGLEVSHRLAPW,Low,"(6.097, 6.26]",train
4MDR,protein-peptide,O00189 P05067,GAMDPEFQQSKVAPSSAASRPVLSSRSDQSQKNEVFLAVVERLSVLIASNGSLLKVDVQGEIRLKSFLPSGSEMRIGLTEEFSVGKSELRGYGPGIRVDEVSFHSSVNLDEFESHRILRLQPPQGELTVMRYQLSDDLPSPLPFRLFPSVQWDRGSGRLQVYLKLRCDLLSKSQALNVRLHLPLPRGVVSLSQELSSPEQKAELAEGALRWDLPRVQGGSQLSGLFQMDVPGPPGPPSHGLSTSASPLGLGPASLSFELPRHTCSGLQVRFLRLAFRPSGNANPHKWVRHLSHSDAYVIRI,ENPTYKFFEQ,GLY-ALA-MET-ASP-PRO-GLU-PHE-GLN-GLN-SER-LYS-VAL-ALA-PRO-SER-SER-ALA-ALA-SER-ARG-PRO-VAL-LEU-SER-SER-ARG-SER-ASP-GLN-SER-GLN-LYS-ASN-GLU-VAL-PHE-LEU-ALA-VAL-VAL-GLU-ARG-LEU-SER-VAL-LEU-ILE-ALA-SER-ASN-GLY-SER-LEU-LEU-LYS-VAL-ASP-VAL-GLN-GLY-GLU-ILE-ARG-LEU-LYS-SER-PHE-LEU-PRO-SER-GLY-SER-GLU-MET-ARG-ILE-GLY-LEU-THR-GLU-GLU-PHE-SER-VAL-GLY-LYS-SER-GLU-LEU-ARG-GLY-TYR-GLY-PRO-GLY-ILE-ARG-VAL-ASP-GLU-VAL-SER-PHE-HIS-SER-SER-VAL-ASN-LEU-ASP-GLU-PHE-GLU-SER-HIS-ARG-ILE-LEU-ARG-LEU-GLN-PRO-PRO-GLN-GLY-GLU-LEU-THR-VAL-MET-ARG-TYR-GLN-LEU-SER-ASP-ASP-LEU-PRO-SER-PRO-LEU-PRO-PHE-ARG-LEU-PHE-PRO-SER-VAL-GLN-TRP-ASP-ARG-GLY-SER-GLY-ARG-LEU-GLN-VAL-TYR-LEU-LYS-LEU-ARG-CYS-ASP-LEU-LEU-SER-LYS-SER-GLN-ALA-LEU-ASN-VAL-ARG-LEU-HIS-LEU-PRO-LEU-PRO-ARG-GLY-VAL-VAL-SER-LEU-SER-GLN-GLU-LEU-SER-SER-PRO-GLU-GLN-LYS-ALA-GLU-LEU-ALA-GLU-GLY-ALA-LEU-ARG-TRP-ASP-LEU-PRO-ARG-VAL-GLN-GLY-GLY-SER-GLN-LEU-SER-GLY-LEU-PHE-GLN-MET-ASP-VAL-PRO-GLY-PRO-PRO-GLY-PRO-PRO-SER-HIS-GLY-LEU-SER-THR-SER-ALA-SER-PRO-LEU-GLY-LEU-GLY-PRO-ALA-SER-LEU-SER-PHE-GLU-LEU-PRO-ARG-HIS-THR-CYS-SER-GLY-LEU-GLN-VAL-ARG-PHE-LEU-ARG-LEU-ALA-PHE-ARG-PRO-SER-GLY-ASN-ALA-ASN-PRO-HIS-LYS-TRP-VAL-ARG-HIS-LEU-SER-HIS-SER-ASP-ALA-TYR-VAL-ILE-ARG-ILE,GLU-ASN-PRO-THR-TYR-LYS-PHE-PHE-GLU-GLN,301,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)O)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O,Kd=40.6uM,4.391474,4.39,1,A,A,1,A,A,0,,B,A,,1,1,301,10,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8886164426803589,0.8656008839607239,79.3216323852539,77.31453704833984,0.5634612441062927,0.8140365481376648,0.7940198183059692,0.796729564666748,0.833889365196228,0.8246791362762451,ENPTYKFFEQ,Low,"(4.319, 4.456]",val
4MNW,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,QCWDRGCENRKCN,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,GLN-CYS-TRP-ASP-ARG-GLY-CYS-GLU-ASN-ARG-LYS-CYS-ASN-NH2,245,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(=O)N)CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CS)CC(=O)O)CCC[NH+]=C(N)N)CS)CCC(=O)O)CC(=O)N)CCC[NH+]=C(N)N,Ki=1.72uM,5.764472,5.76,1,A,A,1,A,A,0,,B,A,,1,1,245,14,0,N=C(N)NCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,0.9171334505081176,0.740646481513977,95.40717315673828,94.31257629394533,0.330733984708786,0.8485392332077026,0.9566335678100586,0.8804057240486145,0.8757660984992981,0.7057066559791565,QCWDRGCENRKCN,Low,"(5.699, 5.821]",val
4MNX,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,LCSDRGCENRWCK,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,LEU-CYS-SER-ASP-ARG-GLY-CYS-GLU-ASN-ARG-TRP-CYS-LYS-NH2,245,14,[NH3+]CCCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CS)CO)CC(=O)O)CCC[NH+]=C(N)N)CS)CCC(=O)O)CC(=O)N)CCC[NH+]=C(N)N)CS,Ki=17.73uM,4.751291,4.75,1,A,A,1,A,A,0,,B,A,,1,1,245,14,0,CC(C)C[C@H](N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CS)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)O,0.9070267677307128,0.761145830154419,95.9742660522461,94.63426208496094,0.3344782292842865,0.8177790641784668,0.9569891691207886,0.8895518779754639,0.8630438446998596,0.7290442585945129,LCSDRGCENRWCK,Low,"(4.745, 4.866]",train
4MNY,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHT,GCQVNYCPPVPCL,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR,GLY-CYS-GLN-VAL-ASN-TYR-CYS-PRO-PRO-VAL-PRO-CYS-LEU-NH2,245,14,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)CS)C(C)C)CS)Cc1ccc(cc1)O)CC(=O)N)C(C)C)CCC(=O)N)CS,Ki=1.96uM,5.707744,5.71,1,A,A,1,A,A,0,,C,A,,1,1,245,14,0,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)CN)C(C)C)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,0.8729509711265564,0.7637081146240234,94.57284545898438,94.93082427978516,0.3534721434116363,0.7185959219932556,0.9525734186172484,0.8952983021736145,0.821553111076355,0.7308105230331421,GCQVNYCPPVPCL,Low,"(5.699, 5.821]",train
4MZH,protein-peptide,Q71DI3 Q9Y657,GSSHHHHHHGSRRNIVGCRIQHGWKEGNGPVTQWKGTVLDQVPVNPSLYLIKYDGFDCVYGLELNKDERVSALEVLPDRVATSRISDAHLADTMIGKAVEHMFETEDGSKDEWRGMVLARAPVMNTWFYITYEKDPVLYMYQLLDDYKEGDLRIMPDSNDSPPAEREPGEVVDSLVGKQVEYAKEDGSKRTGMVIHQVEAKPSVYFIKFDDDFHIYVYDLVKTS,ARTKQTARK,GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-SER-ARG-ARG-ASN-ILE-VAL-GLY-CYS-ARG-ILE-GLN-HIS-GLY-TRP-LYS-GLU-GLY-ASN-GLY-PRO-VAL-THR-GLN-TRP-LYS-GLY-THR-VAL-LEU-ASP-GLN-VAL-PRO-VAL-ASN-PRO-SER-LEU-TYR-LEU-ILE-LYS-TYR-ASP-GLY-PHE-ASP-CYS-VAL-TYR-GLY-LEU-GLU-LEU-ASN-LYS-ASP-GLU-ARG-VAL-SER-ALA-LEU-GLU-VAL-LEU-PRO-ASP-ARG-VAL-ALA-THR-SER-ARG-ILE-SER-ASP-ALA-HIS-LEU-ALA-ASP-THR-MET-ILE-GLY-LYS-ALA-VAL-GLU-HIS-MET-PHE-GLU-THR-GLU-ASP-GLY-SER-LYS-ASP-GLU-TRP-ARG-GLY-MET-VAL-LEU-ALA-ARG-ALA-PRO-VAL-MET-ASN-THR-TRP-PHE-TYR-ILE-THR-TYR-GLU-LYS-ASP-PRO-VAL-LEU-TYR-MET-TYR-GLN-LEU-LEU-ASP-ASP-TYR-LYS-GLU-GLY-ASP-LEU-ARG-ILE-MET-PRO-ASP-SER-ASN-ASP-SER-PRO-PRO-ALA-GLU-ARG-GLU-PRO-GLY-GLU-VAL-VAL-ASP-SER-LEU-VAL-GLY-LYS-GLN-VAL-GLU-TYR-ALA-LYS-GLU-ASP-GLY-SER-LYS-ARG-THR-GLY-MET-VAL-ILE-HIS-GLN-VAL-GLU-ALA-LYS-PRO-SER-VAL-TYR-PHE-ILE-LYS-PHE-ASP-ASP-ASP-PHE-HIS-ILE-TYR-VAL-TYR-ASP-LEU-VAL-LYS-THR-SER,ALA-ARG-THR-M3L-GLN-THR-ALA-2MR-LYS,224,9,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=66nM,7.180456,7.18,1,A,A,1,A,A,0,,B,A,,1,1,224,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CN=C(NC)NCCCC(NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CN=C(NC)NCCCC(NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8693496584892273,0.8133041262626648,78.3740463256836,73.090576171875,0.5572170615196228,0.9086316823959352,0.8115161061286926,0.7491859793663025,0.7791942954063416,0.7539988160133362,ARTKQTARK,Moderate,"(7.049, 7.268]",train
4MZJ,protein-peptide,Q8IDR3 Q8I4W8,GSVADIQQLEEKVDESDVRIYFNEKSSGGKISIDNASYNARKLGLAPSSIDEKKIKELYGDNLTYEQYLEYLSICVHDKDNVEELIKMFAHFDNNCTGYLTKSQMKNILTTWGDALTDQEAIDALNAFSSEDNIDYKLFCEDILQ,KNLPSLLRVQAHIRKKMV,GLY-SER-VAL-ALA-ASP-ILE-GLN-GLN-LEU-GLU-GLU-LYS-VAL-ASP-GLU-SER-ASP-VAL-ARG-ILE-TYR-PHE-ASN-GLU-LYS-SER-SER-GLY-GLY-LYS-ILE-SER-ILE-ASP-ASN-ALA-SER-TYR-ASN-ALA-ARG-LYS-LEU-GLY-LEU-ALA-PRO-SER-SER-ILE-ASP-GLU-LYS-LYS-ILE-LYS-GLU-LEU-TYR-GLY-ASP-ASN-LEU-THR-TYR-GLU-GLN-TYR-LEU-GLU-TYR-LEU-SER-ILE-CYS-VAL-HIS-ASP-LYS-ASP-ASN-VAL-GLU-GLU-LEU-ILE-LYS-MET-PHE-ALA-HIS-PHE-ASP-ASN-ASN-CYS-THR-GLY-TYR-LEU-THR-LYS-SER-GLN-MET-LYS-ASN-ILE-LEU-THR-THR-TRP-GLY-ASP-ALA-LEU-THR-ASP-GLN-GLU-ALA-ILE-ASP-ALA-LEU-ASN-ALA-PHE-SER-SER-GLU-ASP-ASN-ILE-ASP-TYR-LYS-LEU-PHE-CYS-GLU-ASP-ILE-LEU-GLN,ACE-LYS-ASN-NLE-PRO-SER-LEU-NLE-ARG-VAL-GLN-ALA-HIS-ILE-ARG-LYS-LYS-MET-VAL,145,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCSC)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC/C=C\CCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCCC[NH3+])CC(=O)N)C(=O)N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CO)CCC2)CCC[NH+]=C(N)N)CCC(=O)N)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N,IC50=1.6uM,5.79588,5.8,1,A,A,1,A,A,0,,T,A,,1,1,145,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,0.9771443009376526,0.7590861320495605,95.68511962890624,84.41039276123047,0.3155979514122009,0.8209708333015442,0.922700822353363,0.7996298670768738,0.9332398176193236,0.7489501237869263,KNLPSLLRVQAHIRKKMV,Low,"(5.699, 5.821]",train
4MZK,protein-peptide,Q8IDR3 Q8I4W8,GSVADIQQLEEKVDESDVRIYFNEKSSGGKISIDNASYNARKLGLAPSSIDEKKIKELYGDNLTYEQYLEYLSICVHDKDNVEELIKMFAHFDNNCTGYLTKSQMKNILTTWGDALTDQEAIDALNAFSSEDNIDYKLFCEDILQ,KNIPSLLRLQAHLRKKMV,GLY-SER-VAL-ALA-ASP-ILE-GLN-GLN-LEU-GLU-GLU-LYS-VAL-ASP-GLU-SER-ASP-VAL-ARG-ILE-TYR-PHE-ASN-GLU-LYS-SER-SER-GLY-GLY-LYS-ILE-SER-ILE-ASP-ASN-ALA-SER-TYR-ASN-ALA-ARG-LYS-LEU-GLY-LEU-ALA-PRO-SER-SER-ILE-ASP-GLU-LYS-LYS-ILE-LYS-GLU-LEU-TYR-GLY-ASP-ASN-LEU-THR-TYR-GLU-GLN-TYR-LEU-GLU-TYR-LEU-SER-ILE-CYS-VAL-HIS-ASP-LYS-ASP-ASN-VAL-GLU-GLU-LEU-ILE-LYS-MET-PHE-ALA-HIS-PHE-ASP-ASN-ASN-CYS-THR-GLY-TYR-LEU-THR-LYS-SER-GLN-MET-LYS-ASN-ILE-LEU-THR-THR-TRP-GLY-ASP-ALA-LEU-THR-ASP-GLN-GLU-ALA-ILE-ASP-ALA-LEU-ASN-ALA-PHE-SER-SER-GLU-ASP-ASN-ILE-ASP-TYR-LYS-LEU-PHE-CYS-GLU-ASP-ILE-LEU-GLN,ACE-LYS-ASN-ILE-PRO-SER-LEU-LEU-ARG-NLE-GLN-ALA-HIS-NLE-ARG-LYS-LYS-MET-VAL,145,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCSC)CC)NC(=O)[C@@H](NC(=O)[C@@H]1CCC/C=C\CCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCCC[NH3+])CC(=O)N)CO)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)Cc1nc[nH]c1)C)CCC(=O)N)CCC[NH+]=C(N)N,IC50=4.9uM,5.309804,5.31,1,A,A,1,A,A,0,,T,A,,1,1,145,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,0.9415059685707092,0.7217267751693726,92.8284149169922,85.0055160522461,0.3612008392810821,0.8917402029037476,0.8605899214744568,0.7741638422012329,0.8927165269851685,0.7086174488067627,KNIPSLLRLQAHLRKKMV,Low,"(5.222, 5.31]",train
4N3W,protein-peptide,Q92793 P62805,PRKKIFKPEELRQALMPTLEALYRQDPESLPFRQPVDPQLLGIPDYFDIVKNPMDLSTIKRKLDTGQYQEPWQYVDDVWLMFNNAWLYNRKTSRVYKFCSKLAEVFEQEIDPVMQSLGYCCGRKYEFSPQTLCCYGKQLCTIPRDAAYYSYQNRYHFCEKCFTEIQGENVTLGDDPSQPQTTISKDQFEKKKNDTLDPEPFVDCKECGRKMHQICVLHYDIIWPSGFVCDNCLKKTG,GGAKRHRKVLRDNIQ,PRO-ARG-LYS-LYS-ILE-PHE-LYS-PRO-GLU-GLU-LEU-ARG-GLN-ALA-LEU-MET-PRO-THR-LEU-GLU-ALA-LEU-TYR-ARG-GLN-ASP-PRO-GLU-SER-LEU-PRO-PHE-ARG-GLN-PRO-VAL-ASP-PRO-GLN-LEU-LEU-GLY-ILE-PRO-ASP-TYR-PHE-ASP-ILE-VAL-LYS-ASN-PRO-MET-ASP-LEU-SER-THR-ILE-LYS-ARG-LYS-LEU-ASP-THR-GLY-GLN-TYR-GLN-GLU-PRO-TRP-GLN-TYR-VAL-ASP-ASP-VAL-TRP-LEU-MET-PHE-ASN-ASN-ALA-TRP-LEU-TYR-ASN-ARG-LYS-THR-SER-ARG-VAL-TYR-LYS-PHE-CYS-SER-LYS-LEU-ALA-GLU-VAL-PHE-GLU-GLN-GLU-ILE-ASP-PRO-VAL-MET-GLN-SER-LEU-GLY-TYR-CYS-CYS-GLY-ARG-LYS-TYR-GLU-PHE-SER-PRO-GLN-THR-LEU-CYS-CYS-TYR-GLY-LYS-GLN-LEU-CYS-THR-ILE-PRO-ARG-ASP-ALA-ALA-TYR-TYR-SER-TYR-GLN-ASN-ARG-TYR-HIS-PHE-CYS-GLU-LYS-CYS-PHE-THR-GLU-ILE-GLN-GLY-GLU-ASN-VAL-THR-LEU-GLY-ASP-ASP-PRO-SER-GLN-PRO-GLN-THR-THR-ILE-SER-LYS-ASP-GLN-PHE-GLU-LYS-LYS-LYS-ASN-ASP-THR-LEU-ASP-PRO-GLU-PRO-PHE-VAL-ASP-CYS-LYS-GLU-CYS-GLY-ARG-LYS-MET-HIS-GLN-ILE-CYS-VAL-LEU-HIS-TYR-ASP-ILE-ILE-TRP-PRO-SER-GLY-PHE-VAL-CYS-ASP-ASN-CYS-LEU-LYS-LYS-THR-GLY,GLY-GLY-ALA-LYS-ARG-HIS-ARG-ALY-VAL-LEU-ARG-ASP-ASN-ILE-GLN,237,15,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCCCNC(=O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1nc[nH]c1)N,Ki=315uM,3.501689,3.5,1,A,A,1,A,A,0,,C,A,,1,1,237,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)CN)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,0.7289882302284241,0.6592939496040344,66.81070709228516,75.95667266845703,0.4767513275146484,1.1578043699264526,0.7952607274055481,0.7726589441299438,0.6752176880836487,0.6309527158737183,GGAKRHRKVLRDNIQ,Low,"(2.044, 3.548]",train
4N7G,protein-peptide,Q93SQ3 P63104,GAMGSMDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTS,QGLLDALDLAS,GLY-ALA-MET-GLY-SER-MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,GLN-GLY-LEU-LEU-ASP-ALA-LEU-ASP-LEU-ALA-SER,235,11,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)N)[NH3+])CC(C)C)CC(C)C)CC(=O)O)C)CC(C)C)CC(=O)O)CC(C)C)C,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,B,A,,1,1,235,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,0.9627100229263306,0.8148298859596252,91.13609313964844,90.69270324707033,0.3234340250492096,0.6313050985336304,0.9397627711296082,0.9031494855880736,0.9125524759292604,0.7927499413490295,QGLLDALDLAS,Low,"(5.6, 5.699]",train
4NUF,protein-peptide,Q62227 Q9DCR4 P0AEX9,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFPHRTCREALDVLAKTVAFLRNLPSFCHLPHDDQRRLLECCWGPLFLLGLAQDAVTFEVAEAPVPSILKKILTTRASSGTQGAQPSDRPQPSLAAVQWLQRCLESFWSLELGPKEYAYLKGTILFNPDVPGLRASCHIAHLQQEAHWALCEVLEPWYPASQGRLARILLMASTLRNIPGTLLVDLFFRPIMGDVDITELLEDMLLLR,MHRVSAALEEANKVFL,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-PRO-HIS-ARG-THR-CYS-ARG-GLU-ALA-LEU-ASP-VAL-LEU-ALA-LYS-THR-VAL-ALA-PHE-LEU-ARG-ASN-LEU-PRO-SER-PHE-CYS-HIS-LEU-PRO-HIS-ASP-ASP-GLN-ARG-ARG-LEU-LEU-GLU-CYS-CYS-TRP-GLY-PRO-LEU-PHE-LEU-LEU-GLY-LEU-ALA-GLN-ASP-ALA-VAL-THR-PHE-GLU-VAL-ALA-GLU-ALA-PRO-VAL-PRO-SER-ILE-LEU-LYS-LYS-ILE-LEU-THR-THR-ARG-ALA-SER-SER-GLY-THR-GLN-GLY-ALA-GLN-PRO-SER-ASP-ARG-PRO-GLN-PRO-SER-LEU-ALA-ALA-VAL-GLN-TRP-LEU-GLN-ARG-CYS-LEU-GLU-SER-PHE-TRP-SER-LEU-GLU-LEU-GLY-PRO-LYS-GLU-TYR-ALA-TYR-LEU-LYS-GLY-THR-ILE-LEU-PHE-ASN-PRO-ASP-VAL-PRO-GLY-LEU-ARG-ALA-SER-CYS-HIS-ILE-ALA-HIS-LEU-GLN-GLN-GLU-ALA-HIS-TRP-ALA-LEU-CYS-GLU-VAL-LEU-GLU-PRO-TRP-TYR-PRO-ALA-SER-GLN-GLY-ARG-LEU-ALA-ARG-ILE-LEU-LEU-MET-ALA-SER-THR-LEU-ARG-ASN-ILE-PRO-GLY-THR-LEU-LEU-VAL-ASP-LEU-PHE-PHE-ARG-PRO-ILE-MET-GLY-ASP-VAL-ASP-ILE-THR-GLU-LEU-LEU-GLU-ASP-MET-LEU-LEU-LEU-ARG,MET-HIS-ARG-VAL-SER-ALA-ALA-LEU-GLU-GLU-ALA-ASN-LYS-VAL-PHE-LEU,580,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)[NH3+])Cc1nc[nH]c1)CCC[NH+]=C(N)N)CO)C)C)CC(C)C)CCC(=O)O)CCC(=O)O)C)CC(=O)N,IC50=5uM,5.30103,5.3,1,A,A,1,A,A,0,,P,A,,1,1,580,16,0,CSCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.8617997169494629,0.6367654204368591,53.33628082275391,56.24528503417969,0.7306614518165588,1.3271026611328125,0.6239292621612549,0.6623546481132507,0.8866616487503052,0.6163594126701355,MHRVSAALEEANKVFL,Low,"(5.222, 5.31]",train
4NXR,protein-peptide,P58401 Q13009,GAMGKVTHSIHIEKSDTAADTYGFSLSSVEEDGIRRLYVNSVKETGLASKKGLKAGDEILEINNRAADALNSSMMEDFFSQPSVGLLVRTYPEL,NKDKEYYV,GLY-ALA-MET-GLY-LYS-VAL-THR-HIS-SER-ILE-HIS-ILE-GLU-LYS-SER-ASP-THR-ALA-ALA-ASP-THR-TYR-GLY-PHE-SER-LEU-SER-SER-VAL-GLU-GLU-ASP-GLY-ILE-ARG-ARG-LEU-TYR-VAL-ASN-SER-VAL-LYS-GLU-THR-GLY-LEU-ALA-SER-LYS-LYS-GLY-LEU-LYS-ALA-GLY-ASP-GLU-ILE-LEU-GLU-ILE-ASN-ASN-ARG-ALA-ALA-ASP-ALA-LEU-ASN-SER-SER-MET-MET-GLU-ASP-PHE-PHE-SER-GLN-PRO-SER-VAL-GLY-LEU-LEU-VAL-ARG-THR-TYR-PRO-GLU-LEU,ASN-LYS-ASP-LYS-GLU-TYR-TYR-VAL,94,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCCC[NH3+])CC(=O)O,Kd=46uM,4.337242,4.34,1,A,A,1,A,A,0,,B,A,,1,1,94,8,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(N)=O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,0.9437100291252136,0.8736125826835632,96.6613311767578,95.08680725097656,0.3086977005004883,0.5360332131385803,0.9187336564064026,0.9005473852157593,0.9009344577789308,0.866878867149353,NKDKEYYV,Low,"(4.319, 4.456]",train
4NY3,protein-peptide,Q15257,SRNFIIPKKEIHTVPDMGKWKRSQAYADYIGFILTLNEGVKGKKLTFEYRVSEAIEKLVALLNTLDRWIDETPPVDQPSRFGNKAYRTWYAKLDEEAENLVATVVPTHLAAAVPEVAVYLKESVGNSTRIDYGTGHEAAFAAFLCCLCKIGVLRVDDQIAIVFKVFNRYLEVMRKLQKTYRMEPAGSQGVWGLDDFQFLPFIWGSSQLIDHPYLEPRHFVDEKAVNENHKDYMFLECILFITEMKTGPFAEHSNQLWNISAVPSWSKVNQGLIRMYKAECLEKFPVIQHFKFGSLLPIHPVTSG,TPDYFL,SER-ARG-ASN-PHE-ILE-ILE-PRO-LYS-LYS-GLU-ILE-HIS-THR-VAL-PRO-ASP-MET-GLY-LYS-TRP-LYS-ARG-SER-GLN-ALA-TYR-ALA-ASP-TYR-ILE-GLY-PHE-ILE-LEU-THR-LEU-ASN-GLU-GLY-VAL-LYS-GLY-LYS-LYS-LEU-THR-PHE-GLU-TYR-ARG-VAL-SER-GLU-ALA-ILE-GLU-LYS-LEU-VAL-ALA-LEU-LEU-ASN-THR-LEU-ASP-ARG-TRP-ILE-ASP-GLU-THR-PRO-PRO-VAL-ASP-GLN-PRO-SER-ARG-PHE-GLY-ASN-LYS-ALA-TYR-ARG-THR-TRP-TYR-ALA-LYS-LEU-ASP-GLU-GLU-ALA-GLU-ASN-LEU-VAL-ALA-THR-VAL-VAL-PRO-THR-HIS-LEU-ALA-ALA-ALA-VAL-PRO-GLU-VAL-ALA-VAL-TYR-LEU-LYS-GLU-SER-VAL-GLY-ASN-SER-THR-ARG-ILE-ASP-TYR-GLY-THR-GLY-HIS-GLU-ALA-ALA-PHE-ALA-ALA-PHE-LEU-CYS-CYS-LEU-CYS-LYS-ILE-GLY-VAL-LEU-ARG-VAL-ASP-ASP-GLN-ILE-ALA-ILE-VAL-PHE-LYS-VAL-PHE-ASN-ARG-TYR-LEU-GLU-VAL-MET-ARG-LYS-LEU-GLN-LYS-THR-TYR-ARG-MET-GLU-PRO-ALA-GLY-SER-GLN-GLY-VAL-TRP-GLY-LEU-ASP-ASP-PHE-GLN-PHE-LEU-PRO-PHE-ILE-TRP-GLY-SER-SER-GLN-LEU-ILE-ASP-HIS-PRO-TYR-LEU-GLU-PRO-ARG-HIS-PHE-VAL-ASP-GLU-LYS-ALA-VAL-ASN-GLU-ASN-HIS-LYS-ASP-TYR-MET-PHE-LEU-GLU-CYS-ILE-LEU-PHE-ILE-THR-GLU-MET-LYS-THR-GLY-PRO-PHE-ALA-GLU-HIS-SER-ASN-GLN-LEU-TRP-ASN-ILE-SER-ALA-VAL-PRO-SER-TRP-SER-LYS-VAL-ASN-GLN-GLY-LEU-ILE-ARG-MET-TYR-LYS-ALA-GLU-CYS-LEU-GLU-LYS-PHE-PRO-VAL-ILE-GLN-HIS-PHE-LYS-PHE-GLY-SER-LEU-LEU-PRO-ILE-HIS-PRO-VAL-THR-SER-GLY,THR-PRO-ASP-TYR-PHE-LEU,304,6,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CC(=O)O)Cc1ccc(cc1)O)Cc1ccccc1)C,Kd=49.5uM,4.305395,4.31,1,A,A,1,A,A,0,,C,A,,1,1,304,6,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.924229860305786,0.8354378342628479,94.26292419433594,92.2510223388672,0.3486407101154327,0.5948421359062195,0.9430643320083618,0.9250635504722596,0.9074244499206544,0.8130313754081726,TPDYFL,Low,"(4.155, 4.319]",train
4O36,protein-peptide,P61823,SSSNYCNQMMKSRNLTKDRCKPVNTFVHESLADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTTQANKHIIVACEGNPYVPVHFDASV,KETAAAHFEQHHMDS,SER-SER-SER-ASN-TYR-CYS-ASN-GLN-MET-MET-LYS-SER-ARG-ASN-LEU-THR-LYS-ASP-ARG-CYS-LYS-PRO-VAL-ASN-THR-PHE-VAL-HIS-GLU-SER-LEU-ALA-ASP-VAL-GLN-ALA-VAL-CYS-SER-GLN-LYS-ASN-VAL-ALA-CYS-LYS-ASN-GLY-GLN-THR-ASN-CYS-TYR-GLN-SER-TYR-SER-THR-MET-SER-ILE-THR-ASP-CYS-ARG-GLU-THR-GLY-SER-SER-LYS-TYR-PRO-ASN-CYS-ALA-TYR-LYS-THR-THR-GLN-ALA-ASN-LYS-HIS-ILE-ILE-VAL-ALA-CYS-GLU-GLY-ASN-PRO-TYR-VAL-PRO-VAL-HIS-PHE-ASP-ALA-SER-VAL,LYS-GLU-THR-ALA-ALA-ALA-HIS-PHE-GLU-GLN-HIS-HIS-MET-ASP-SER,104,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)[NH3+])C)C)C)Cc1nc[nH]c1)Cc1ccccc1)CCC(=O)O)CCC(=O)N)Cc1[nH]cnc1)Cc1nc[nH]c1,Kd=436nM,6.360514,6.36,1,A,A,1,A,A,0,,A,B,,1,1,104,15,0,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.8684264421463013,0.7079903483390808,95.78565979003906,89.10939025878906,0.3857151865959167,0.9139760732650756,0.8715126514434814,0.7948136925697327,0.7888733148574829,0.6862845420837402,KETAAAHFEQHHMDS,Low,"(6.26, 6.398]",train
4O45,protein-peptide,P03495 P61964,GTQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,PKQKRKMARTARSKV,GLY-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,PRO-LYS-GLN-LYS-ARG-LYS-MET-ALA-ARG-THR-ALA-ARG-SER-LYS-VAL,312,15,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)[C@H](O)C)NC(=O)[C@@H]([NH3+])C)N,Kd=70uM,4.154902,4.15,1,A,A,1,A,A,0,,B,A,,1,1,312,15,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,0.8671746850013733,0.7398238778114319,93.88938903808594,93.25523376464844,0.3571650981903076,0.8802321553230286,0.9317264556884766,0.8700101375579834,0.8013425469398499,0.6892484426498413,PKQKRKMARTARSKV,Low,"(3.924, 4.155]",train
4O62,protein-peptide,Q504Y3 P84243,GVENMYVNKVWVQCENENCLKWRLLSSEDSAKVDHDEPWYCFMNTDSRYNNCSISEEDF,ARTKQTARKST,GLY-VAL-GLU-ASN-MET-TYR-VAL-ASN-LYS-VAL-TRP-VAL-GLN-CYS-GLU-ASN-GLU-ASN-CYS-LEU-LYS-TRP-ARG-LEU-LEU-SER-SER-GLU-ASP-SER-ALA-LYS-VAL-ASP-HIS-ASP-GLU-PRO-TRP-TYR-CYS-PHE-MET-ASN-THR-ASP-SER-ARG-TYR-ASN-ASN-CYS-SER-ILE-SER-GLU-GLU-ASP-PHE,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR,59,11,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=9.9uM,5.004365,5.0,1,A,A,1,A,A,0,,D,A,,0,1,59,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9196072816848756,0.875656008720398,93.3563003540039,90.1538543701172,0.3712678551673889,0.6786075830459595,0.8358628153800964,0.8313683867454529,0.7887576818466187,0.7807957530021667,ARTKQTARKST,Low,"(4.866, 5.014]",val
4O9W,protein-peptide,P53350,HLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSR,VLSTL,HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG,VAL-LEU-SER-TPO-LEU-NH2,222,6,OC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CC(C)C,Kd=69.91nM,7.155461,7.16,1,A,A,1,A,A,0,,B,A,,1,1,222,6,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H](N)CC(C)C)C(C)OP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H](N)CC(C)C)C(C)OP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C,0.893045961856842,0.8775968551635742,91.2287139892578,91.6449203491211,0.3352268040180206,0.4918441772460937,0.9420531392097472,0.9218063950538636,0.8670276403427124,0.8665444850921631,VLSTL,Moderate,"(7.049, 7.268]",val
4ODN,protein-peptide,P0A7V0 Q5SLE7,MKVGQDKVVTIRYTLQVEGEVLDQGELSYLHGHRNLIPGLEEALEGREEGEAFQAHVPAEKAYGPHDPEGVQVVPLSAFPEDAEVVPGAQFYAQDMEGNPMPLTVVAVEGEEVTVDFNHPLAGKDLDFQVEVVKVREATPEELLHGHAHPSGHHHHHH,KMKPFIFGARNKVHIY,MET-LYS-VAL-GLY-GLN-ASP-LYS-VAL-VAL-THR-ILE-ARG-TYR-THR-LEU-GLN-VAL-GLU-GLY-GLU-VAL-LEU-ASP-GLN-GLY-GLU-LEU-SER-TYR-LEU-HIS-GLY-HIS-ARG-ASN-LEU-ILE-PRO-GLY-LEU-GLU-GLU-ALA-LEU-GLU-GLY-ARG-GLU-GLU-GLY-GLU-ALA-PHE-GLN-ALA-HIS-VAL-PRO-ALA-GLU-LYS-ALA-TYR-GLY-PRO-HIS-ASP-PRO-GLU-GLY-VAL-GLN-VAL-VAL-PRO-LEU-SER-ALA-PHE-PRO-GLU-ASP-ALA-GLU-VAL-VAL-PRO-GLY-ALA-GLN-PHE-TYR-ALA-GLN-ASP-MET-GLU-GLY-ASN-PRO-MET-PRO-LEU-THR-VAL-VAL-ALA-VAL-GLU-GLY-GLU-GLU-VAL-THR-VAL-ASP-PHE-ASN-HIS-PRO-LEU-ALA-GLY-LYS-ASP-LEU-ASP-PHE-GLN-VAL-GLU-VAL-VAL-LYS-VAL-ARG-GLU-ALA-THR-PRO-GLU-GLU-LEU-LEU-HIS-GLY-HIS-ALA-HIS-PRO-SER-GLY-HIS-HIS-HIS-HIS-HIS-HIS,LYS-MET-LYS-PRO-PHE-ILE-PHE-GLY-ALA-ARG-ASN-LYS-VAL-HIS-ILE-TYR-NH2,158,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1ccccc1)[NH3+])C)CCC[NH+]=C(N)N)CC(=O)N)CCCC[NH3+])C,Kd=0.183uM,6.737549,6.74,1,A,A,1,A,A,0,,B,A,,1,1,158,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.7616437673568726,0.8548376560211182,70.50071716308594,78.22364044189453,0.5342187285423279,0.6644194722175598,0.7578297853469849,0.8384533524513245,0.669206440448761,0.8075096011161804,KMKPFIFGARNKVHIY,Low,"(6.696, 6.824]",train
4ODP,protein-peptide,P0A7V0 Q5SLE7 P62942,MKVGQDKVVTIRYTLQVEGEVLDQGELSYLHGHRNLIPGLEEALEGREEGEAFQAHVPAEKAYGATGHPGIIPPHATLDFQVEVVKVREATPEELLHGHAHPSGHHHHHH,TRYANPKMKPFIFGA,MET-LYS-VAL-GLY-GLN-ASP-LYS-VAL-VAL-THR-ILE-ARG-TYR-THR-LEU-GLN-VAL-GLU-GLY-GLU-VAL-LEU-ASP-GLN-GLY-GLU-LEU-SER-TYR-LEU-HIS-GLY-HIS-ARG-ASN-LEU-ILE-PRO-GLY-LEU-GLU-GLU-ALA-LEU-GLU-GLY-ARG-GLU-GLU-GLY-GLU-ALA-PHE-GLN-ALA-HIS-VAL-PRO-ALA-GLU-LYS-ALA-TYR-GLY-ALA-THR-GLY-HIS-PRO-GLY-ILE-ILE-PRO-PRO-HIS-ALA-THR-LEU-ASP-PHE-GLN-VAL-GLU-VAL-VAL-LYS-VAL-ARG-GLU-ALA-THR-PRO-GLU-GLU-LEU-LEU-HIS-GLY-HIS-ALA-HIS-PRO-SER-GLY-HIS-HIS-HIS-HIS-HIS-HIS,THR-ARG-TYR-ALA-ASN-PRO-LYS-MET-LYS-PRO-PHE-ILE-PHE-GLY-ALA-NH2,110,16,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)Cc1ccccc1)NC(=O)[C@H](CCSC)[NH3+],Kd=17.06uM,4.768021,4.77,1,A,A,1,A,A,0,,B,A,,1,1,110,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.9499565362930298,0.7990034818649292,91.88278198242188,87.5904541015625,0.3728606104850769,0.7232978343963623,0.8832399845123291,0.819237470626831,0.8366355895996094,0.7314449548721313,TRYANPKMKPFIFGA,Low,"(4.745, 4.866]",train
4ODQ,protein-peptide,P0A7V3 Q5SLE7 P62942,MKVGQDKVVTIRYTLQVEGEVLDQGELSYLHGHRNLIPGLEEALEGREEGEAFQAHVPAEKAYGATGHPGIIPPHATLDFQVEVVKVREATPEELLHGHAHPSGHHHHHH,RLGIVKPWNSTWFAN,MET-LYS-VAL-GLY-GLN-ASP-LYS-VAL-VAL-THR-ILE-ARG-TYR-THR-LEU-GLN-VAL-GLU-GLY-GLU-VAL-LEU-ASP-GLN-GLY-GLU-LEU-SER-TYR-LEU-HIS-GLY-HIS-ARG-ASN-LEU-ILE-PRO-GLY-LEU-GLU-GLU-ALA-LEU-GLU-GLY-ARG-GLU-GLU-GLY-GLU-ALA-PHE-GLN-ALA-HIS-VAL-PRO-ALA-GLU-LYS-ALA-TYR-GLY-ALA-THR-GLY-HIS-PRO-GLY-ILE-ILE-PRO-PRO-HIS-ALA-THR-LEU-ASP-PHE-GLN-VAL-GLU-VAL-VAL-LYS-VAL-ARG-GLU-ALA-THR-PRO-GLU-GLU-LEU-LEU-HIS-GLY-HIS-ALA-HIS-PRO-SER-GLY-HIS-HIS-HIS-HIS-HIS-HIS,ARG-LEU-GLY-ILE-VAL-LYS-PRO-TRP-ASN-SER-THR-TRP-PHE-ALA-ASN-NH2,110,16,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)C[NH3+],Kd=34.25uM,4.465339,4.47,1,A,A,1,A,A,0,,B,A,,1,1,110,16,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,0.9856017827987672,0.838776171207428,91.55225372314452,89.10370635986328,0.3489778339862823,0.6939427256584167,0.8979811072349548,0.8491413593292236,0.8775069713592529,0.7793666124343872,RLGIVKPWNSTWFAN,Low,"(4.456, 4.606]",train
4OFB,protein-peptide,P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTREWVLDSVALYQCQELDTYLIPQIP,TIDFDEYRFRKT,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-GLU-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,ACE-THR-ILE-ASP-PFF-ASP-GLU-TYR-ARG-PFF-ARG-LYS-THR-NH2,214,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)C)CC(=O)O)Cc1ccc(cc1)F)CC(=O)O)CCC(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)F)CCC[NH+]=C(N)N,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,B,A,,1,1,214,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9375858902931212,0.7519521117210388,94.00373077392578,91.46341705322266,0.336146593093872,0.7877912521362305,0.9401029348373412,0.8703992366790771,0.9037707448005676,0.7223403453826904,TIDFDEYRFRKT,Low,"(5.31, 5.463]",train
4OU3,protein-peptide,P15145,QSKPWNRYRLPTTLLPDSYNVTLRPYLTPNADGLYIFKGKSIVRFLCQEPTDVIIIHSKKLNYTTQGHMVVLRGVGDSQVPEIDRTELVELTEYLVVHLKGSLQPGHMYEMESEFQGELADDLAGFYRSEYMEGNVKKVLATTQMQSTDARKSFPCFDEPAMKATFNITLIHPNNLTALSNMPPKGSSTPLAEDPNWSVTEFETTPVMSTYLLAYIVSEFQSVNETAQNGVLIRIWARPNAIAEGHGMYALNVTGPILNFFANHYNTSYPLPKSDQIALPDFNAGAMENWGLVTYRENALLFDPQSSSISNKERVVTVIAHELAHQWFGNLVTLAWWNDLWLNEGFASYVEYLGADHAEPTWNLKDLIVPGDVYRVMAVDALASSHPLTTPAEEVNTPAQISEMFDSISYSKGASVIRMLSNFLTEDLFKEGLASYLHAFAYQNTTYLDLWEHLQKAVDAQTSIRLPDTVRAIMDRWTLQMGFPVITVDTKTGNISQKHFLLDSESNVTRSSAFDYLWIVPISSIKNGVMQDHYWLRDVSQAQNDLFKTASDDWVLLNVNVTGYFQVNYDEDNWRMIQHQLQTNLSVIPVINRAQVIYDSFNLATAHMVPVTLALDNTLFLNGEKEYMPWQAALSSLSYFSLMFDRSEVYGPMKKYLRKQVEPLFQHFETLTKNWTERPENLMDQYSEINAISTACSNGLPQCENLAKTLFDQWMSDPENNPIHPNLRSTIYCNAIAQGGQDQWDFAWGQLQQAQLVNEADKLRSALACSNEVWLLNRYLGYTLNPDLIRKQDATSTINSIASNVIGQPLAWDFVQSNWKKLFQDYGGGSFSFSNLIQGVTRRFSSEFELQQLEQFKKNNMDVGFGSGTRALEQALEKTKANIKWVKENKEVVLNWFIEHSSHHHHHH,CNGRCG,GLN-SER-LYS-PRO-TRP-ASN-ARG-TYR-ARG-LEU-PRO-THR-THR-LEU-LEU-PRO-ASP-SER-TYR-ASN-VAL-THR-LEU-ARG-PRO-TYR-LEU-THR-PRO-ASN-ALA-ASP-GLY-LEU-TYR-ILE-PHE-LYS-GLY-LYS-SER-ILE-VAL-ARG-PHE-LEU-CYS-GLN-GLU-PRO-THR-ASP-VAL-ILE-ILE-ILE-HIS-SER-LYS-LYS-LEU-ASN-TYR-THR-THR-GLN-GLY-HIS-MET-VAL-VAL-LEU-ARG-GLY-VAL-GLY-ASP-SER-GLN-VAL-PRO-GLU-ILE-ASP-ARG-THR-GLU-LEU-VAL-GLU-LEU-THR-GLU-TYR-LEU-VAL-VAL-HIS-LEU-LYS-GLY-SER-LEU-GLN-PRO-GLY-HIS-MET-TYR-GLU-MET-GLU-SER-GLU-PHE-GLN-GLY-GLU-LEU-ALA-ASP-ASP-LEU-ALA-GLY-PHE-TYR-ARG-SER-GLU-TYR-MET-GLU-GLY-ASN-VAL-LYS-LYS-VAL-LEU-ALA-THR-THR-GLN-MET-GLN-SER-THR-ASP-ALA-ARG-LYS-SER-PHE-PRO-CYS-PHE-ASP-GLU-PRO-ALA-MET-LYS-ALA-THR-PHE-ASN-ILE-THR-LEU-ILE-HIS-PRO-ASN-ASN-LEU-THR-ALA-LEU-SER-ASN-MET-PRO-PRO-LYS-GLY-SER-SER-THR-PRO-LEU-ALA-GLU-ASP-PRO-ASN-TRP-SER-VAL-THR-GLU-PHE-GLU-THR-THR-PRO-VAL-MET-SER-THR-TYR-LEU-LEU-ALA-TYR-ILE-VAL-SER-GLU-PHE-GLN-SER-VAL-ASN-GLU-THR-ALA-GLN-ASN-GLY-VAL-LEU-ILE-ARG-ILE-TRP-ALA-ARG-PRO-ASN-ALA-ILE-ALA-GLU-GLY-HIS-GLY-MET-TYR-ALA-LEU-ASN-VAL-THR-GLY-PRO-ILE-LEU-ASN-PHE-PHE-ALA-ASN-HIS-TYR-ASN-THR-SER-TYR-PRO-LEU-PRO-LYS-SER-ASP-GLN-ILE-ALA-LEU-PRO-ASP-PHE-ASN-ALA-GLY-ALA-MET-GLU-ASN-TRP-GLY-LEU-VAL-THR-TYR-ARG-GLU-ASN-ALA-LEU-LEU-PHE-ASP-PRO-GLN-SER-SER-SER-ILE-SER-ASN-LYS-GLU-ARG-VAL-VAL-THR-VAL-ILE-ALA-HIS-GLU-LEU-ALA-HIS-GLN-TRP-PHE-GLY-ASN-LEU-VAL-THR-LEU-ALA-TRP-TRP-ASN-ASP-LEU-TRP-LEU-ASN-GLU-GLY-PHE-ALA-SER-TYR-VAL-GLU-TYR-LEU-GLY-ALA-ASP-HIS-ALA-GLU-PRO-THR-TRP-ASN-LEU-LYS-ASP-LEU-ILE-VAL-PRO-GLY-ASP-VAL-TYR-ARG-VAL-MET-ALA-VAL-ASP-ALA-LEU-ALA-SER-SER-HIS-PRO-LEU-THR-THR-PRO-ALA-GLU-GLU-VAL-ASN-THR-PRO-ALA-GLN-ILE-SER-GLU-MET-PHE-ASP-SER-ILE-SER-TYR-SER-LYS-GLY-ALA-SER-VAL-ILE-ARG-MET-LEU-SER-ASN-PHE-LEU-THR-GLU-ASP-LEU-PHE-LYS-GLU-GLY-LEU-ALA-SER-TYR-LEU-HIS-ALA-PHE-ALA-TYR-GLN-ASN-THR-THR-TYR-LEU-ASP-LEU-TRP-GLU-HIS-LEU-GLN-LYS-ALA-VAL-ASP-ALA-GLN-THR-SER-ILE-ARG-LEU-PRO-ASP-THR-VAL-ARG-ALA-ILE-MET-ASP-ARG-TRP-THR-LEU-GLN-MET-GLY-PHE-PRO-VAL-ILE-THR-VAL-ASP-THR-LYS-THR-GLY-ASN-ILE-SER-GLN-LYS-HIS-PHE-LEU-LEU-ASP-SER-GLU-SER-ASN-VAL-THR-ARG-SER-SER-ALA-PHE-ASP-TYR-LEU-TRP-ILE-VAL-PRO-ILE-SER-SER-ILE-LYS-ASN-GLY-VAL-MET-GLN-ASP-HIS-TYR-TRP-LEU-ARG-ASP-VAL-SER-GLN-ALA-GLN-ASN-ASP-LEU-PHE-LYS-THR-ALA-SER-ASP-ASP-TRP-VAL-LEU-LEU-ASN-VAL-ASN-VAL-THR-GLY-TYR-PHE-GLN-VAL-ASN-TYR-ASP-GLU-ASP-ASN-TRP-ARG-MET-ILE-GLN-HIS-GLN-LEU-GLN-THR-ASN-LEU-SER-VAL-ILE-PRO-VAL-ILE-ASN-ARG-ALA-GLN-VAL-ILE-TYR-ASP-SER-PHE-ASN-LEU-ALA-THR-ALA-HIS-MET-VAL-PRO-VAL-THR-LEU-ALA-LEU-ASP-ASN-THR-LEU-PHE-LEU-ASN-GLY-GLU-LYS-GLU-TYR-MET-PRO-TRP-GLN-ALA-ALA-LEU-SER-SER-LEU-SER-TYR-PHE-SER-LEU-MET-PHE-ASP-ARG-SER-GLU-VAL-TYR-GLY-PRO-MET-LYS-LYS-TYR-LEU-ARG-LYS-GLN-VAL-GLU-PRO-LEU-PHE-GLN-HIS-PHE-GLU-THR-LEU-THR-LYS-ASN-TRP-THR-GLU-ARG-PRO-GLU-ASN-LEU-MET-ASP-GLN-TYR-SER-GLU-ILE-ASN-ALA-ILE-SER-THR-ALA-CYS-SER-ASN-GLY-LEU-PRO-GLN-CYS-GLU-ASN-LEU-ALA-LYS-THR-LEU-PHE-ASP-GLN-TRP-MET-SER-ASP-PRO-GLU-ASN-ASN-PRO-ILE-HIS-PRO-ASN-LEU-ARG-SER-THR-ILE-TYR-CYS-ASN-ALA-ILE-ALA-GLN-GLY-GLY-GLN-ASP-GLN-TRP-ASP-PHE-ALA-TRP-GLY-GLN-LEU-GLN-GLN-ALA-GLN-LEU-VAL-ASN-GLU-ALA-ASP-LYS-LEU-ARG-SER-ALA-LEU-ALA-CYS-SER-ASN-GLU-VAL-TRP-LEU-LEU-ASN-ARG-TYR-LEU-GLY-TYR-THR-LEU-ASN-PRO-ASP-LEU-ILE-ARG-LYS-GLN-ASP-ALA-THR-SER-THR-ILE-ASN-SER-ILE-ALA-SER-ASN-VAL-ILE-GLY-GLN-PRO-LEU-ALA-TRP-ASP-PHE-VAL-GLN-SER-ASN-TRP-LYS-LYS-LEU-PHE-GLN-ASP-TYR-GLY-GLY-GLY-SER-PHE-SER-PHE-SER-ASN-LEU-ILE-GLN-GLY-VAL-THR-ARG-ARG-PHE-SER-SER-GLU-PHE-GLU-LEU-GLN-GLN-LEU-GLU-GLN-PHE-LYS-LYS-ASN-ASN-MET-ASP-VAL-GLY-PHE-GLY-SER-GLY-THR-ARG-ALA-LEU-GLU-GLN-ALA-LEU-GLU-LYS-THR-LYS-ALA-ASN-ILE-LYS-TRP-VAL-LYS-GLU-ASN-LYS-GLU-VAL-VAL-LEU-ASN-TRP-PHE-ILE-GLU-HIS-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS,CYS-ASN-GLY-ARG-CYS-GLY,908,6,NC(=[NH+]CCC[C@@H]1NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)NCC(=O)O)[NH3+])N,Ki=38.7uM,4.412289,4.41,1,A,A,1,A,A,0,,B,A,,1,1,908,6,0,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CS)C(=O)NCC(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)O,0.8282812237739563,0.825447142124176,76.31922912597656,77.78363037109375,0.40696582198143,0.5412867069244385,0.9177451729774476,0.9105005860328674,0.8018124103546143,0.8041837811470032,CNGRCG,Low,"(4.319, 4.456]",train
4OYK,protein-peptide,Q96EP0 Q96BN8,GPEEERAFLVAREELASALRRDSGQAFSLEQLRPLLASSLPLAARYLQLDAARLVRCNAHGEPRNYLNTLSTALNILEKYGRNLLSPQRPRYWRGVKFNNPVFRSTVDAVQGGRDVLRLYGYTEEQPDGLSFPEGQEEPDEHQVATVTLEVLLLRTELSLLLQNTHPRQQALEQLLE,AEHEEDMYRAADEIEKEKE,GLY-PRO-GLU-GLU-GLU-ARG-ALA-PHE-LEU-VAL-ALA-ARG-GLU-GLU-LEU-ALA-SER-ALA-LEU-ARG-ARG-ASP-SER-GLY-GLN-ALA-PHE-SER-LEU-GLU-GLN-LEU-ARG-PRO-LEU-LEU-ALA-SER-SER-LEU-PRO-LEU-ALA-ALA-ARG-TYR-LEU-GLN-LEU-ASP-ALA-ALA-ARG-LEU-VAL-ARG-CYS-ASN-ALA-HIS-GLY-GLU-PRO-ARG-ASN-TYR-LEU-ASN-THR-LEU-SER-THR-ALA-LEU-ASN-ILE-LEU-GLU-LYS-TYR-GLY-ARG-ASN-LEU-LEU-SER-PRO-GLN-ARG-PRO-ARG-TYR-TRP-ARG-GLY-VAL-LYS-PHE-ASN-ASN-PRO-VAL-PHE-ARG-SER-THR-VAL-ASP-ALA-VAL-GLN-GLY-GLY-ARG-ASP-VAL-LEU-ARG-LEU-TYR-GLY-TYR-THR-GLU-GLU-GLN-PRO-ASP-GLY-LEU-SER-PHE-PRO-GLU-GLY-GLN-GLU-GLU-PRO-ASP-GLU-HIS-GLN-VAL-ALA-THR-VAL-THR-LEU-GLU-VAL-LEU-LEU-LEU-ARG-THR-GLU-LEU-SER-LEU-LEU-LEU-GLN-ASN-THR-HIS-PRO-ARG-GLN-GLN-ALA-LEU-GLU-GLN-LEU-LEU-GLU,ALA-GLU-HIS-GLU-GLU-ASP-MET-TYR-ARG-ALA-ALA-ASP-GLU-ILE-GLU-LYS-GLU-LYS-GLU,177,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CCSC)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)C)C)CC(=O)O)CCC(=O)O)C,Kd=0.18uM,6.744727,6.74,1,A,A,1,A,A,0,,C,A,,1,1,177,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8531228303909302,0.7545755505561829,90.69557189941406,87.22879028320312,0.3760291337966919,0.8376502394676208,0.9241299629211426,0.8446782231330872,0.7747842669487,0.7320498824119568,AEHEEDMYRAADEIEKEKE,Low,"(6.696, 6.824]",train
4OZ1,protein-peptide,Q14498 O75533,GSVQPLATQCFQLSNMFNPQTEEEVGWDTEIKDDVIEECNKHGGVIHIYVDKNSAQGNVYVKCPSIAAAIAAVNALHGRWFAGKMITAAYVPLPTYHNLFPDSMTATQLLVPSRR,KRKSRWDETP,GLY-SER-VAL-GLN-PRO-LEU-ALA-THR-GLN-CYS-PHE-GLN-LEU-SER-ASN-MET-PHE-ASN-PRO-GLN-THR-GLU-GLU-GLU-VAL-GLY-TRP-ASP-THR-GLU-ILE-LYS-ASP-ASP-VAL-ILE-GLU-GLU-CYS-ASN-LYS-HIS-GLY-GLY-VAL-ILE-HIS-ILE-TYR-VAL-ASP-LYS-ASN-SER-ALA-GLN-GLY-ASN-VAL-TYR-VAL-LYS-CYS-PRO-SER-ILE-ALA-ALA-ALA-ILE-ALA-ALA-VAL-ASN-ALA-LEU-HIS-GLY-ARG-TRP-PHE-ALA-GLY-LYS-MET-ILE-THR-ALA-ALA-TYR-VAL-PRO-LEU-PRO-THR-TYR-HIS-ASN-LEU-PHE-PRO-ASP-SER-MET-THR-ALA-THR-GLN-LEU-LEU-VAL-PRO-SER-ARG-ARG,LYS-ARG-LYS-SER-ARG-TRP-ASP-GLU-THR-PRO,115,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)CCC(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)NC(=O)[C@@H]([NH3+])C,Kd=2400nM,5.619789,5.62,1,A,A,1,A,A,0,,C,A,dimer,1,1,115,10,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O,0.9654622077941896,0.8876116275787354,95.6430206298828,91.9813461303711,0.2991142570972442,0.5220546722412109,0.93759685754776,0.9185978770256042,0.9224284887313844,0.8798650503158569,KRKSRWDETP,Low,"(5.6, 5.699]",train
4P0A,protein-peptide,P55072 Q96EP0,GPLGSMPGEEEERAFLVAREELASALRRDSGQAFSLEQLRPLLASSLPLAARYLQLDAARLVRCNAHGEPRNYLNTLSTALNILEKYGRNLLSPQRPRYWRGVKFNNPVFRSTVDAVQGGRDVLRLYGYTEEQPDGLSFPEGQEEPDEHQVATVTLEVLLLRTELSLLLQNTHPRQQALEQLLE,TEDNDDDLYG,GLY-PRO-LEU-GLY-SER-MET-PRO-GLY-GLU-GLU-GLU-GLU-ARG-ALA-PHE-LEU-VAL-ALA-ARG-GLU-GLU-LEU-ALA-SER-ALA-LEU-ARG-ARG-ASP-SER-GLY-GLN-ALA-PHE-SER-LEU-GLU-GLN-LEU-ARG-PRO-LEU-LEU-ALA-SER-SER-LEU-PRO-LEU-ALA-ALA-ARG-TYR-LEU-GLN-LEU-ASP-ALA-ALA-ARG-LEU-VAL-ARG-CYS-ASN-ALA-HIS-GLY-GLU-PRO-ARG-ASN-TYR-LEU-ASN-THR-LEU-SER-THR-ALA-LEU-ASN-ILE-LEU-GLU-LYS-TYR-GLY-ARG-ASN-LEU-LEU-SER-PRO-GLN-ARG-PRO-ARG-TYR-TRP-ARG-GLY-VAL-LYS-PHE-ASN-ASN-PRO-VAL-PHE-ARG-SER-THR-VAL-ASP-ALA-VAL-GLN-GLY-GLY-ARG-ASP-VAL-LEU-ARG-LEU-TYR-GLY-TYR-THR-GLU-GLU-GLN-PRO-ASP-GLY-LEU-SER-PHE-PRO-GLU-GLY-GLN-GLU-GLU-PRO-ASP-GLU-HIS-GLN-VAL-ALA-THR-VAL-THR-LEU-GLU-VAL-LEU-LEU-LEU-ARG-THR-GLU-LEU-SER-LEU-LEU-LEU-GLN-ASN-THR-HIS-PRO-ARG-GLN-GLN-ALA-LEU-GLU-GLN-LEU-LEU-GLU,THR-GLU-ASP-ASN-ASP-ASP-ASP-LEU-TYR-GLY,184,10,CC(C[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=30.3uM,4.518557,4.52,1,A,A,1,A,A,0,,B,A,,1,1,184,10,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8985415101051331,0.8309657573699951,91.9247589111328,88.4771499633789,0.3511450290679931,0.6771091818809509,0.9264851212501526,0.8998938202857971,0.8367875814437866,0.813733696937561,TEDNDDDLYG,Low,"(4.456, 4.606]",train
4P0B,protein-peptide,Q96EP0 Q96BN8,GPLGSMPGEEEERAFLVAREELASALRRDSGQAFSLEQLRPLLASSLPLAARYLQLDAARLVRCNAHGEPRNYLNTLSTALNILEKYGRNLLSPQRPRYWRGVKFNNPVFRSTVDAVQGGRDVLRLYGYTEEQPDGLSFPEGQEEPDEHQVATVTLEVLLLRTELSLLLQNTHPRQQALEQLLE,EEDMYRAADE,GLY-PRO-LEU-GLY-SER-MET-PRO-GLY-GLU-GLU-GLU-GLU-ARG-ALA-PHE-LEU-VAL-ALA-ARG-GLU-GLU-LEU-ALA-SER-ALA-LEU-ARG-ARG-ASP-SER-GLY-GLN-ALA-PHE-SER-LEU-GLU-GLN-LEU-ARG-PRO-LEU-LEU-ALA-SER-SER-LEU-PRO-LEU-ALA-ALA-ARG-TYR-LEU-GLN-LEU-ASP-ALA-ALA-ARG-LEU-VAL-ARG-CYS-ASN-ALA-HIS-GLY-GLU-PRO-ARG-ASN-TYR-LEU-ASN-THR-LEU-SER-THR-ALA-LEU-ASN-ILE-LEU-GLU-LYS-TYR-GLY-ARG-ASN-LEU-LEU-SER-PRO-GLN-ARG-PRO-ARG-TYR-TRP-ARG-GLY-VAL-LYS-PHE-ASN-ASN-PRO-VAL-PHE-ARG-SER-THR-VAL-ASP-ALA-VAL-GLN-GLY-GLY-ARG-ASP-VAL-LEU-ARG-LEU-TYR-GLY-TYR-THR-GLU-GLU-GLN-PRO-ASP-GLY-LEU-SER-PHE-PRO-GLU-GLY-GLN-GLU-GLU-PRO-ASP-GLU-HIS-GLN-VAL-ALA-THR-VAL-THR-LEU-GLU-VAL-LEU-LEU-LEU-ARG-THR-GLU-LEU-SER-LEU-LEU-LEU-GLN-ASN-THR-HIS-PRO-ARG-GLN-GLN-ALA-LEU-GLU-GLN-LEU-LEU-GLU,GLU-GLU-ASP-MET-TYR-ARG-ALA-ALA-ASP-GLU,184,10,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)NC(=O)[C@H](CC(=O)O)[NH3+],Kd=0.29uM,6.537602,6.54,1,A,A,1,A,A,0,,B,A,,1,1,184,10,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9427355527877808,0.8481510877609253,92.57151794433594,88.39749145507812,0.3495800197124481,0.6502829194068909,0.9271171689033508,0.9031073451042176,0.885428786277771,0.8344119787216187,EEDMYRAADE,Low,"(6.523, 6.696]",train
4PXF,protein-peptide,P02699 P08168,MNGTEGPNFYVPFSNKTGVVRSPFEAPQYYLAEPWQFSMLAAYMFLLIMLGFPINFLTLYVTVQHKKLRTPLNYILLNLAVADLFMVFGGFTTTLYTSLHGYFVFGPTGCNLEGFFATLGGEIALWSLVVLAIERYVVVCKPMSNFRFGENHAIMGVAFTWVMALACAAPPLVGWSRYIPEGMQCSCGIDYYTPHEETNNESFVIYMFVVHFIIPLIVIFFCYGQLVFTVKEAAAQQQESATTQKAEKEVTRMVIIMVIAFLICWLPYAGVAFYIFTHQGSDFGPIFMTIPAFFAKTSAVYNPVIYIMMNKQFRNCMVTTLCCGKNPLGDDEASTTVSKTETSQVAPA,YGQEDIDVMGL,MET-ASN-GLY-THR-GLU-GLY-PRO-ASN-PHE-TYR-VAL-PRO-PHE-SER-ASN-LYS-THR-GLY-VAL-VAL-ARG-SER-PRO-PHE-GLU-ALA-PRO-GLN-TYR-TYR-LEU-ALA-GLU-PRO-TRP-GLN-PHE-SER-MET-LEU-ALA-ALA-TYR-MET-PHE-LEU-LEU-ILE-MET-LEU-GLY-PHE-PRO-ILE-ASN-PHE-LEU-THR-LEU-TYR-VAL-THR-VAL-GLN-HIS-LYS-LYS-LEU-ARG-THR-PRO-LEU-ASN-TYR-ILE-LEU-LEU-ASN-LEU-ALA-VAL-ALA-ASP-LEU-PHE-MET-VAL-PHE-GLY-GLY-PHE-THR-THR-THR-LEU-TYR-THR-SER-LEU-HIS-GLY-TYR-PHE-VAL-PHE-GLY-PRO-THR-GLY-CYS-ASN-LEU-GLU-GLY-PHE-PHE-ALA-THR-LEU-GLY-GLY-GLU-ILE-ALA-LEU-TRP-SER-LEU-VAL-VAL-LEU-ALA-ILE-GLU-ARG-TYR-VAL-VAL-VAL-CYS-LYS-PRO-MET-SER-ASN-PHE-ARG-PHE-GLY-GLU-ASN-HIS-ALA-ILE-MET-GLY-VAL-ALA-PHE-THR-TRP-VAL-MET-ALA-LEU-ALA-CYS-ALA-ALA-PRO-PRO-LEU-VAL-GLY-TRP-SER-ARG-TYR-ILE-PRO-GLU-GLY-MET-GLN-CYS-SER-CYS-GLY-ILE-ASP-TYR-TYR-THR-PRO-HIS-GLU-GLU-THR-ASN-ASN-GLU-SER-PHE-VAL-ILE-TYR-MET-PHE-VAL-VAL-HIS-PHE-ILE-ILE-PRO-LEU-ILE-VAL-ILE-PHE-PHE-CYS-TYR-GLY-GLN-LEU-VAL-PHE-THR-VAL-LYS-GLU-ALA-ALA-ALA-GLN-GLN-GLN-GLU-SER-ALA-THR-THR-GLN-LYS-ALA-GLU-LYS-GLU-VAL-THR-ARG-MET-VAL-ILE-ILE-MET-VAL-ILE-ALA-PHE-LEU-ILE-CYS-TRP-LEU-PRO-TYR-ALA-GLY-VAL-ALA-PHE-TYR-ILE-PHE-THR-HIS-GLN-GLY-SER-ASP-PHE-GLY-PRO-ILE-PHE-MET-THR-ILE-PRO-ALA-PHE-PHE-ALA-LYS-THR-SER-ALA-VAL-TYR-ASN-PRO-VAL-ILE-TYR-ILE-MET-MET-ASN-LYS-GLN-PHE-ARG-ASN-CYS-MET-VAL-THR-THR-LEU-CYS-CYS-GLY-LYS-ASN-PRO-LEU-GLY-ASP-ASP-GLU-ALA-SER-THR-THR-VAL-SER-LYS-THR-GLU-THR-SER-GLN-VAL-ALA-PRO-ALA,TYR-GLY-GLN-GLU-ASP-ILE-ASP-VAL-MET-GLY-LEU,348,11,CSCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O,Kd=0.8mM,3.09691,3.1,1,A,A,1,A,A,0,,B,A,,1,1,348,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O,0.5040071606636047,0.5294164419174194,63.649017333984375,68.0343246459961,0.7583842873573303,1.6887884140014648,0.8171554207801819,0.7453943490982056,0.4065696597099304,0.4412983655929565,YGQEDIDVMGL,Low,"(2.044, 3.548]",val
4PZ5,protein-peptide,O50835 P02751,AEETCFDKYTGNTYRVGDTYERPKDSMIWDCTCIGAGRGRISCTIANRCHEGGQSYKIGDTWRRPHETGGYMLECVCLGNGKGEWTCKPI,SISYTDEIEEEDYDQ,ALA-GLU-GLU-THR-CYS-PHE-ASP-LYS-TYR-THR-GLY-ASN-THR-TYR-ARG-VAL-GLY-ASP-THR-TYR-GLU-ARG-PRO-LYS-ASP-SER-MET-ILE-TRP-ASP-CYS-THR-CYS-ILE-GLY-ALA-GLY-ARG-GLY-ARG-ILE-SER-CYS-THR-ILE-ALA-ASN-ARG-CYS-HIS-GLU-GLY-GLY-GLN-SER-TYR-LYS-ILE-GLY-ASP-THR-TRP-ARG-ARG-PRO-HIS-GLU-THR-GLY-GLY-TYR-MET-LEU-GLU-CYS-VAL-CYS-LEU-GLY-ASN-GLY-LYS-GLY-GLU-TRP-THR-CYS-LYS-PRO-ILE,ACE-SER-ILE-SER-TYR-THR-ASP-GLU-ILE-GLU-GLU-GLU-ASP-TYR-ASP-GLN,90,16,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccc(cc1)O)CC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)C)CO)CO)Cc1ccc(cc1)O)CC(=O)O)CCC(=O)O)C,Kd=121nM,6.917215,6.92,1,A,A,1,A,A,0,,B,A,,1,1,90,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8033806681632996,0.8157311677932739,92.31470489501952,82.47842407226562,0.4364627301692962,0.5907103419303894,0.8261911869049072,0.8367156982421875,0.7083922624588013,0.8104850053787231,SISYTDEIEEEDYDQ,Low,"(6.824, 7.049]",train
4PZ8,protein-peptide,O13936 P40997,SMAPSEKDIEEVSVPGVLAPRDDVRVLKTRIAKLLGTSPDTFPGSQPVSFSKKHLQALKEKNYFVCEKSDGIRCLLYMTEHPRYENRPSVYLFDRKMNFYHVEKIFYPVENDKSGKKYHVDTLLDGELVLDIYPGGKKQLRYLVFDCLACDGIVYMSRLLDKRLGIFAKSIQKPLDEYTKTHMRETAIFPFLTSLKKMELGHGILKLFNEVIPRLRHGNDGLIFTCTETPYVSGTDQSLLKWKPKEMNTIDFMLKLEFAQPEEGDIDYSAMPEFQLGVWEGRNMYSFFAFMYVDEKEWEKLKSFNVPLSERIVECYLDDENRWRFLRFRDDKRDANHISTVKSVLQSIEDGVSKEDLLKEMPIIREAYYNRKKPSVTKRKLDETSNDDAPAIKKVAKESEKEI,TPAWNSGSRTPAWNSGSK,SER-MET-ALA-PRO-SER-GLU-LYS-ASP-ILE-GLU-GLU-VAL-SER-VAL-PRO-GLY-VAL-LEU-ALA-PRO-ARG-ASP-ASP-VAL-ARG-VAL-LEU-LYS-THR-ARG-ILE-ALA-LYS-LEU-LEU-GLY-THR-SER-PRO-ASP-THR-PHE-PRO-GLY-SER-GLN-PRO-VAL-SER-PHE-SER-LYS-LYS-HIS-LEU-GLN-ALA-LEU-LYS-GLU-LYS-ASN-TYR-PHE-VAL-CYS-GLU-GPL-SER-ASP-GLY-ILE-ARG-CYS-LEU-LEU-TYR-MET-THR-GLU-HIS-PRO-ARG-TYR-GLU-ASN-ARG-PRO-SER-VAL-TYR-LEU-PHE-ASP-ARG-LYS-MET-ASN-PHE-TYR-HIS-VAL-GLU-LYS-ILE-PHE-TYR-PRO-VAL-GLU-ASN-ASP-LYS-SER-GLY-LYS-LYS-TYR-HIS-VAL-ASP-THR-LEU-LEU-ASP-GLY-GLU-LEU-VAL-LEU-ASP-ILE-TYR-PRO-GLY-GLY-LYS-LYS-GLN-LEU-ARG-TYR-LEU-VAL-PHE-ASP-CYS-LEU-ALA-CYS-ASP-GLY-ILE-VAL-TYR-MET-SER-ARG-LEU-LEU-ASP-LYS-ARG-LEU-GLY-ILE-PHE-ALA-LYS-SER-ILE-GLN-LYS-PRO-LEU-ASP-GLU-TYR-THR-LYS-THR-HIS-MET-ARG-GLU-THR-ALA-ILE-PHE-PRO-PHE-LEU-THR-SER-LEU-LYS-LYS-MET-GLU-LEU-GLY-HIS-GLY-ILE-LEU-LYS-LEU-PHE-ASN-GLU-VAL-ILE-PRO-ARG-LEU-ARG-HIS-GLY-ASN-ASP-GLY-LEU-ILE-PHE-THR-CYS-THR-GLU-THR-PRO-TYR-VAL-SER-GLY-THR-ASP-GLN-SER-LEU-LEU-LYS-TRP-LYS-PRO-LYS-GLU-MET-ASN-THR-ILE-ASP-PHE-MET-LEU-LYS-LEU-GLU-PHE-ALA-GLN-PRO-GLU-GLU-GLY-ASP-ILE-ASP-TYR-SER-ALA-MET-PRO-GLU-PHE-GLN-LEU-GLY-VAL-TRP-GLU-GLY-ARG-ASN-MET-TYR-SER-PHE-PHE-ALA-PHE-MET-TYR-VAL-ASP-GLU-LYS-GLU-TRP-GLU-LYS-LEU-LYS-SER-PHE-ASN-VAL-PRO-LEU-SER-GLU-ARG-ILE-VAL-GLU-CYS-TYR-LEU-ASP-ASP-GLU-ASN-ARG-TRP-ARG-PHE-LEU-ARG-PHE-ARG-ASP-ASP-LYS-ARG-ASP-ALA-ASN-HIS-ILE-SER-THR-VAL-LYS-SER-VAL-LEU-GLN-SER-ILE-GLU-ASP-GLY-VAL-SER-LYS-GLU-ASP-LEU-LEU-LYS-GLU-MET-PRO-ILE-ILE-ARG-GLU-ALA-TYR-TYR-ASN-ARG-LYS-LYS-PRO-SER-VAL-THR-LYS-ARG-LYS-LEU-ASP-GLU-THR-SER-ASN-ASP-ASP-ALA-PRO-ALA-ILE-LYS-LYS-VAL-ALA-LYS-GLU-SER-GLU-LYS-GLU-ILE,THR-PRO-ALA-TRP-ASN-SER-GLY-SER-ARG-THR-PRO-ALA-TRP-ASN-SER-GLY-SER-LYS,403,18,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1c[nH]c2c1cccc2)CC(=O)N,Kd=1.19uM,5.924453,5.92,1,A,A,1,A,A,0,,B,A,,1,1,403,18,0,C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.4366490244865417,0.7110100388526917,64.28044891357422,66.63834381103516,0.9026073813438416,1.2601113319396973,0.7249652743339539,0.7511014938354492,0.2858882546424866,0.6467068195343018,TPAWNSGSRTPAWNSGSK,Low,"(5.821, 5.959]",val
4QC1,protein-peptide,Q9UIF8,SMDSKDLALCSMILTEMETHEDAWPFLLPVNLKLVPGYKKVIKKPMDFSTIREKLSSGQYPNLETFALDVRLVFDNCETFNEDDSDIGRAGHNMRKYFEKKWTDTFK,KSTGGKAPRKQ,SER-MET-ASP-SER-LYS-ASP-LEU-ALA-LEU-CYS-SER-MET-ILE-LEU-THR-GLU-MET-GLU-THR-HIS-GLU-ASP-ALA-TRP-PRO-PHE-LEU-LEU-PRO-VAL-ASN-LEU-LYS-LEU-VAL-PRO-GLY-TYR-LYS-LYS-VAL-ILE-LYS-LYS-PRO-MET-ASP-PHE-SER-THR-ILE-ARG-GLU-LYS-LEU-SER-SER-GLY-GLN-TYR-PRO-ASN-LEU-GLU-THR-PHE-ALA-LEU-ASP-VAL-ARG-LEU-VAL-PHE-ASP-ASN-CYS-GLU-THR-PHE-ASN-GLU-ASP-ASP-SER-ASP-ILE-GLY-ARG-ALA-GLY-HIS-ASN-MET-ARG-LYS-TYR-PHE-GLU-LYS-LYS-TRP-THR-ASP-THR-PHE-LYS,LYS-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN,107,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CCCCNC(=O)C)C)CCC[NH+]=C(N)N,Kd=10.35uM,4.98506,4.99,1,A,A,1,A,A,0,,D,A,,1,1,107,11,0,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.9085635542869568,0.7159443497657776,95.1944808959961,94.43617248535156,0.3160423040390014,0.7318039536476135,0.9360716342926024,0.8345059156417847,0.8434238433837891,0.686303973197937,KSTGGKAPRKQ,Low,"(4.866, 5.014]",train
4QH7,protein-peptide,Q9XZ31 Q24117,GPLGSMSDRKAVIKNADMSEEMQQDAVDCATQALEKYNIEKDIAAYIKKEFDKKYNPTWHCIVGRNFGSYVTHETRHFIYFYLGQVAILLFKSG,NYTICAGTQTDP,GLY-PRO-LEU-GLY-SER-MET-SER-ASP-ARG-LYS-ALA-VAL-ILE-LYS-ASN-ALA-ASP-MET-SER-GLU-GLU-MET-GLN-GLN-ASP-ALA-VAL-ASP-CYS-ALA-THR-GLN-ALA-LEU-GLU-LYS-TYR-ASN-ILE-GLU-LYS-ASP-ILE-ALA-ALA-TYR-ILE-LYS-LYS-GLU-PHE-ASP-LYS-LYS-TYR-ASN-PRO-THR-TRP-HIS-CYS-ILE-VAL-GLY-ARG-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-THR-ARG-HIS-PHE-ILE-TYR-PHE-TYR-LEU-GLY-GLN-VAL-ALA-ILE-LEU-LEU-PHE-LYS-SER-GLY,ASN-TYR-THR-ILE-CYS-ALA-GLY-THR-GLN-THR-ASP-PRO,94,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(=O)O)[C@H](O)C)CCC(=O)N)[C@H](O)C)C)CS)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccc(cc1)O)C,Kd=1.14uM,5.943095,5.94,1,A,A,1,A,A,0,,C,A,dimer,1,1,94,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,0.947456419467926,0.9341858625411988,95.09040832519533,92.845703125,0.3343020975589752,0.5057216882705688,0.9193884134292604,0.8979092240333557,0.8424450755119324,0.863467812538147,NYTICAGTQTDP,Low,"(5.821, 5.959]",train
4QQ4,protein-peptide,Q14149 P84243,GEDIQKRPDQTWVQCDACLKWRKLPDGMDQLPEKWYCSNNPDPQFRNCEVPEEPEDEDLVHP,ARTKQTARKSTGGKA,GLY-GLU-ASP-ILE-GLN-LYS-ARG-PRO-ASP-GLN-THR-TRP-VAL-GLN-CYS-ASP-ALA-CYS-LEU-LYS-TRP-ARG-LYS-LEU-PRO-ASP-GLY-MET-ASP-GLN-LEU-PRO-GLU-LYS-TRP-TYR-CYS-SER-ASN-ASN-PRO-ASP-PRO-GLN-PHE-ARG-ASN-CYS-GLU-VAL-PRO-GLU-GLU-PRO-GLU-ASP-GLU-ASP-LEU-VAL-HIS-PRO,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA-NH2,62,16,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,C,A,,1,1,62,16,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9490975141525269,0.966956913471222,77.1204605102539,83.94896697998047,0.4508513510227203,0.7056540250778198,0.7652770280838013,0.8014092445373535,0.735312283039093,0.7764890193939209,ARTKQTARKSTGGKA,Low,"(5.699, 5.821]",train
4QQI,protein-peptide,Q2KHR2 Q9H9E1,MHHHHHHSSGRENLYFQGSTTPLLANSLSVHQLAAQGEMLYLATRIEQENVINHTDEEGFTPLMWAAAHGQIAVVEFLLQNGADPQLLGKGRESALSLACSKGYTDIVKMLLDCGVDVNEYDWNGGTPLLYAVHGNHVKCVKMLLESGADPTIETDSGYNSMDLAVALGYRSVQQVIESHLLKLLQNIKE,KAFVHMPTLPNLDFHKT,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-SER-THR-THR-PRO-LEU-LEU-ALA-ASN-SER-LEU-SER-VAL-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-MET-LEU-TYR-LEU-ALA-THR-ARG-ILE-GLU-GLN-GLU-ASN-VAL-ILE-ASN-HIS-THR-ASP-GLU-GLU-GLY-PHE-THR-PRO-LEU-MET-TRP-ALA-ALA-ALA-HIS-GLY-GLN-ILE-ALA-VAL-VAL-GLU-PHE-LEU-LEU-GLN-ASN-GLY-ALA-ASP-PRO-GLN-LEU-LEU-GLY-LYS-GLY-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-CYS-SER-LYS-GLY-TYR-THR-ASP-ILE-VAL-LYS-MET-LEU-LEU-ASP-CYS-GLY-VAL-ASP-VAL-ASN-GLU-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-LYS-MET-LEU-LEU-GLU-SER-GLY-ALA-ASP-PRO-THR-ILE-GLU-THR-ASP-SER-GLY-TYR-ASN-SER-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-SER-VAL-GLN-GLN-VAL-ILE-GLU-SER-HIS-LEU-LEU-LYS-LEU-LEU-GLN-ASN-ILE-LYS-GLU,LYS-ALA-PHE-VAL-HIS-MET-PRO-THR-LEU-PRO-ASN-LEU-ASP-PHE-HIS-LYS-THR,190,17,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])Cc1c[nH]cn1)Cc1ccccc1)CC(=O)O)CC(C)C)CC(=O)N)CC(C)C)[C@H](O)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC,Kd=3.0uM,5.522879,5.52,1,A,A,1,A,A,0,,X,A,,1,1,190,17,0,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(C)C,0.9098989367485046,0.8184439539909363,84.00907135009766,80.42266845703125,0.4122324883937835,0.7433726787567139,0.8696559071540833,0.8272024393081665,0.8112640380859375,0.7504648566246033,KAFVHMPTLPNLDFHKT,Low,"(5.463, 5.6]",val
4R1E,protein-peptide,Q8IDR3 Q8I4W8,GSVADIQQLEEKVDESDVRIYFNEKSSGGKISIDNASYNARKLGLAPSSIDEKKIKELYGDNLTYEQYLEYLSICVHDKDNVEELIKMFAHFDNNCTGYLTKSQMKNILTTWGDALTDQEAIDALNAFSSEDNIDYKLFCEDILQ,GSLLRVQAHIRKKMV,GLY-SER-VAL-ALA-ASP-ILE-GLN-GLN-LEU-GLU-GLU-LYS-VAL-ASP-GLU-SER-ASP-VAL-ARG-ILE-TYR-PHE-ASN-GLU-LYS-SER-SER-GLY-GLY-LYS-ILE-SER-ILE-ASP-ASN-ALA-SER-TYR-ASN-ALA-ARG-LYS-LEU-GLY-LEU-ALA-PRO-SER-SER-ILE-ASP-GLU-LYS-LYS-ILE-LYS-GLU-LEU-TYR-GLY-ASP-ASN-LEU-THR-TYR-GLU-GLN-TYR-LEU-GLU-TYR-LEU-SER-ILE-CYS-VAL-HIS-ASP-LYS-ASP-ASN-VAL-GLU-GLU-LEU-ILE-LYS-MET-PHE-ALA-HIS-PHE-ASP-ASN-ASN-CYS-THR-GLY-TYR-LEU-THR-LYS-SER-GLN-MET-LYS-ASN-ILE-LEU-THR-THR-TRP-GLY-ASP-ALA-LEU-THR-ASP-GLN-GLU-ALA-ILE-ASP-ALA-LEU-ASN-ALA-PHE-SER-SER-GLU-ASP-ASN-ILE-ASP-TYR-LYS-LEU-PHE-CYS-GLU-ASP-ILE-LEU-GLN,GLY-SER-LEU-LEU-ARG-VAL-GLN-ALA-HIS-ILE-ARG-LYS-LYS-MET-VAL,145,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCSC)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CO)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)N)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N,Kd=52nM,7.283997,7.28,1,A,A,1,A,A,0,,B,A,,1,1,145,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C,0.9802327752113342,0.7216284275054932,96.1645965576172,87.98719787597656,0.3191636204719543,0.8392108082771301,0.9174689054489136,0.7849603891372681,0.9373299479484558,0.705795407295227,GSLLRVQAHIRKKMV,Moderate,"(7.268, 7.523]",train
4PN1,protein-peptide,Q9P6Q6,SMDLKGLLHEENELPSIEKRKIDENAVEHDKVERKRTKSVAVPKIEMNFLNKPIVPDTTKVISNFLTHYLITEPVEHVEIEAKLGTLIDLETQNRFEFPVMNETILNPEFNLRTRFESDMTASEHKYLNEFLNQAFRDSQKPGRLPFAYKHTKQVDLFYETEDNSRDKIRVSKNQSDNQVLACVKKRRVADLFLYCPNDAFDIRISISDELPVSMPSGNQQPSLTRLKDRVGYVHQEIKIDLTKTTQNDPVYDTTERHELEVEFGNIADLRDRAQKAKDGMEAPLFRRVQLFMDNVRILRREHS,TPAWNSGSRTPAWNSGSK,SER-MET-ASP-LEU-LYS-GLY-LEU-LEU-HIS-GLU-GLU-ASN-GLU-LEU-PRO-SER-ILE-GLU-LYS-ARG-LYS-ILE-ASP-GLU-ASN-ALA-VAL-GLU-HIS-ASP-LYS-VAL-GLU-ARG-LYS-ARG-THR-LYS-SER-VAL-ALA-VAL-PRO-LYS-ILE-GLU-MET-ASN-PHE-LEU-ASN-LYS-PRO-ILE-VAL-PRO-ASP-THR-THR-LYS-VAL-ILE-SER-ASN-PHE-LEU-THR-HIS-TYR-LEU-ILE-THR-GLU-PRO-VAL-GLU-HIS-VAL-GLU-ILE-GLU-ALA-LYS-LEU-GLY-THR-LEU-ILE-ASP-LEU-GLU-THR-GLN-ASN-ARG-PHE-GLU-PHE-PRO-VAL-MET-ASN-GLU-THR-ILE-LEU-ASN-PRO-GLU-PHE-ASN-LEU-ARG-THR-ARG-PHE-GLU-SER-ASP-MET-THR-ALA-SER-GLU-HIS-LYS-TYR-LEU-ASN-GLU-PHE-LEU-ASN-GLN-ALA-PHE-ARG-ASP-SER-GLN-LYS-PRO-GLY-ARG-LEU-PRO-PHE-ALA-TYR-LYS-HIS-THR-LYS-GLN-VAL-ASP-LEU-PHE-TYR-GLU-THR-GLU-ASP-ASN-SER-ARG-ASP-LYS-ILE-ARG-VAL-SER-LYS-ASN-GLN-SER-ASP-ASN-GLN-VAL-LEU-ALA-CYS-VAL-LYS-LYS-ARG-ARG-VAL-ALA-ASP-LEU-PHE-LEU-TYR-CYS-PRO-ASN-ASP-ALA-PHE-ASP-ILE-ARG-ILE-SER-ILE-SER-ASP-GLU-LEU-PRO-VAL-SER-MET-PRO-SER-GLY-ASN-GLN-GLN-PRO-SER-LEU-THR-ARG-LEU-LYS-ASP-ARG-VAL-GLY-TYR-VAL-HIS-GLN-GLU-ILE-LYS-ILE-ASP-LEU-THR-LYS-THR-THR-GLN-ASN-ASP-PRO-VAL-TYR-ASP-THR-THR-GLU-ARG-HIS-GLU-LEU-GLU-VAL-GLU-PHE-GLY-ASN-ILE-ALA-ASP-LEU-ARG-ASP-ARG-ALA-GLN-LYS-ALA-LYS-ASP-GLY-MET-GLU-ALA-PRO-LEU-PHE-ARG-ARG-VAL-GLN-LEU-PHE-MET-ASP-ASN-VAL-ARG-ILE-LEU-ARG-ARG-GLU-HIS-SER,THR-PRO-ALA-TRP-ASN-SER-GLY-SER-ARG-THR-PRO-ALA-TRP-ASN-SER-GLY-SER-LYS,304,18,NC(=O)C[C@@H](C(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)C,Kd=0.68uM,6.167491,6.17,1,A,A,1,A,A,0,,E,A,dimer,1,1,304,18,0,C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.6131798028945923,0.5443387627601624,65.50682067871094,66.68367767333984,0.7707265615463257,1.6861085891723633,0.7335715293884277,0.6578559875488281,0.4510942995548248,0.413163423538208,TPAWNSGSRTPAWNSGSK,Low,"(6.097, 6.26]",train
4RH5,protein-peptide,P42566 P26045,MHHHHHHSSGVDLGTENLYFQSNADTLEGSMAQLKKGLESGTVLIQFEQLYRKKPGLAITFAKLPQNLDKNRYKDVLPYDTTRVLLQGNEDYINASYVNMEIPAANLVNKYIATQGPLPHTCAQFWQVVWDQKLSLIVMLTTLTERGRTKCHQYWPDPPDVMNHGGFHIQCQSEDCTIAYVSREMLVTNTQTGEEHTVTHLQYVAWPAHGVPDDSSDFLEFVNYVRSLRVDSEPVLVHSSAGIGRTGVLVTMETAMCLTERNLPIYPLDIVRKMRDQRAMMVQTSSQYKFVCEAILRVYEEGLVQM,FSAYPSEED,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-VAL-ASP-LEU-GLY-THR-GLU-ASN-LEU-TYR-PHE-GLN-SER-ASN-ALA-ASP-THR-LEU-GLU-GLY-SER-MET-ALA-GLN-LEU-LYS-LYS-GLY-LEU-GLU-SER-GLY-THR-VAL-LEU-ILE-GLN-PHE-GLU-GLN-LEU-TYR-ARG-LYS-LYS-PRO-GLY-LEU-ALA-ILE-THR-PHE-ALA-LYS-LEU-PRO-GLN-ASN-LEU-ASP-LYS-ASN-ARG-TYR-LYS-ASP-VAL-LEU-PRO-TYR-ASP-THR-THR-ARG-VAL-LEU-LEU-GLN-GLY-ASN-GLU-ASP-TYR-ILE-ASN-ALA-SER-TYR-VAL-ASN-MET-GLU-ILE-PRO-ALA-ALA-ASN-LEU-VAL-ASN-LYS-TYR-ILE-ALA-THR-GLN-GLY-PRO-LEU-PRO-HIS-THR-CYS-ALA-GLN-PHE-TRP-GLN-VAL-VAL-TRP-ASP-GLN-LYS-LEU-SER-LEU-ILE-VAL-MET-LEU-THR-THR-LEU-THR-GLU-ARG-GLY-ARG-THR-LYS-CYS-HIS-GLN-TYR-TRP-PRO-ASP-PRO-PRO-ASP-VAL-MET-ASN-HIS-GLY-GLY-PHE-HIS-ILE-GLN-CYS-GLN-SER-GLU-ASP-CYS-THR-ILE-ALA-TYR-VAL-SER-ARG-GLU-MET-LEU-VAL-THR-ASN-THR-GLN-THR-GLY-GLU-GLU-HIS-THR-VAL-THR-HIS-LEU-GLN-TYR-VAL-ALA-TRP-PRO-ALA-HIS-GLY-VAL-PRO-ASP-ASP-SER-SER-ASP-PHE-LEU-GLU-PHE-VAL-ASN-TYR-VAL-ARG-SER-LEU-ARG-VAL-ASP-SER-GLU-PRO-VAL-LEU-VAL-HIS-SER-SER-ALA-GLY-ILE-GLY-ARG-THR-GLY-VAL-LEU-VAL-THR-MET-GLU-THR-ALA-MET-CYS-LEU-THR-GLU-ARG-ASN-LEU-PRO-ILE-TYR-PRO-LEU-ASP-ILE-VAL-ARG-LYS-MET-ARG-ASP-GLN-ARG-ALA-MET-MET-VAL-GLN-THR-SER-SER-GLN-TYR-LYS-PHE-VAL-CYS-GLU-ALA-ILE-LEU-ARG-VAL-TYR-GLU-GLU-GLY-LEU-VAL-GLN-MET,PHE-SER-ALA-PTR-PRO-SER-GLU-GLU-ASP,306,9,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)Cc1ccc(cc1)OP(O)(O)O)C)NC(=O)[C@H](Cc1ccccc1)[NH3+],Kd=127.3nM,6.895172,6.9,1,A,A,1,A,A,0,,B,A,,1,1,306,9,0,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8866601586341858,0.8880602717399597,85.1062240600586,87.69566345214844,0.3707219958305359,0.5450939536094666,0.905747890472412,0.8976033329963684,0.8283166885375977,0.8509522676467896,FSAYPSEED,Low,"(6.824, 7.049]",train
4RME,protein-peptide,P19793 Q15596,EDMPVERILEAELAVEPKTETYVEANMGLNPSSPNDPVTNICQAADKQLFTLVEWAKRIPHFSELPLDDQVILLRAGWNELLIASFSHRSIAVKDGILLATGLHVHRNSAHSAGVGAIFDRVLTELVSKMRDMQMDKTELGCLRAIVLFNPDSKGLSNPAEVEALREKVYASLEAYCKHKYPEQPGRFAKLLLRLPALRSIGLKCLEHLFFFKLIGDTPIDTFLMEMLEAPHQMT,KHKILHRLLQDSS,GLU-ASP-MET-PRO-VAL-GLU-ARG-ILE-LEU-GLU-ALA-GLU-LEU-ALA-VAL-GLU-PRO-LYS-THR-GLU-THR-TYR-VAL-GLU-ALA-ASN-MET-GLY-LEU-ASN-PRO-SER-SER-PRO-ASN-ASP-PRO-VAL-THR-ASN-ILE-CYS-GLN-ALA-ALA-ASP-LYS-GLN-LEU-PHE-THR-LEU-VAL-GLU-TRP-ALA-LYS-ARG-ILE-PRO-HIS-PHE-SER-GLU-LEU-PRO-LEU-ASP-ASP-GLN-VAL-ILE-LEU-LEU-ARG-ALA-GLY-TRP-ASN-GLU-LEU-LEU-ILE-ALA-SER-PHE-SER-HIS-ARG-SER-ILE-ALA-VAL-LYS-ASP-GLY-ILE-LEU-LEU-ALA-THR-GLY-LEU-HIS-VAL-HIS-ARG-ASN-SER-ALA-HIS-SER-ALA-GLY-VAL-GLY-ALA-ILE-PHE-ASP-ARG-VAL-LEU-THR-GLU-LEU-VAL-SER-LYS-MET-ARG-ASP-MET-GLN-MET-ASP-LYS-THR-GLU-LEU-GLY-CYS-LEU-ARG-ALA-ILE-VAL-LEU-PHE-ASN-PRO-ASP-SER-LYS-GLY-LEU-SER-ASN-PRO-ALA-GLU-VAL-GLU-ALA-LEU-ARG-GLU-LYS-VAL-TYR-ALA-SER-LEU-GLU-ALA-TYR-CYS-LYS-HIS-LYS-TYR-PRO-GLU-GLN-PRO-GLY-ARG-PHE-ALA-LYS-LEU-LEU-LEU-ARG-LEU-PRO-ALA-LEU-ARG-SER-ILE-GLY-LEU-LYS-CYS-LEU-GLU-HIS-LEU-PHE-PHE-PHE-LYS-LEU-ILE-GLY-ASP-THR-PRO-ILE-ASP-THR-PHE-LEU-MET-GLU-MET-LEU-GLU-ALA-PRO-HIS-GLN-MET-THR,LYS-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-ASP-SER-SER,235,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+])C,Kd=1.21uM,5.917215,5.92,1,A,A,1,A,A,0,,B,A,,0,1,235,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O,0.6377965807914734,0.7280130386352539,84.96376037597656,74.0841064453125,0.6185623407363892,0.9382044672966005,0.8577085733413696,0.829001784324646,0.550056517124176,0.7027658224105835,KHKILHRLLQDSS,Low,"(5.821, 5.959]",train
4RQZ,protein-peptide,P0AEE3,MTPASYNLAVRRAAPAVVNVYNRGLNTNSHNQLEIRTLGSGVIMDQRGYIITNKHVINDADQIIVALQDGRVFEALLVGSDSLTDLAVLKINATGGLPTIPINARRVPHIGDVVLAIGNPYNLGQTITQGIISATGRIGLNPTGRQNFLQTDASINHGNSGGALVNSLGELMGINTLSFDKSNDGETPEGIGFAIPFQLATKIMDKLIRDGRVIRGYIGIGGREIAPLHAQGGGIDQLQGIVVNEVSPDGPAANAGIQVNDLIISVDNKPAISALETMDQVAEIRPGSVIPVVVMRDDKQLTLQVTIQEYPATN,DNRLGLVYQF,MET-THR-PRO-ALA-SER-TYR-ASN-LEU-ALA-VAL-ARG-ARG-ALA-ALA-PRO-ALA-VAL-VAL-ASN-VAL-TYR-ASN-ARG-GLY-LEU-ASN-THR-ASN-SER-HIS-ASN-GLN-LEU-GLU-ILE-ARG-THR-LEU-GLY-SER-GLY-VAL-ILE-MET-ASP-GLN-ARG-GLY-TYR-ILE-ILE-THR-ASN-LYS-HIS-VAL-ILE-ASN-ASP-ALA-ASP-GLN-ILE-ILE-VAL-ALA-LEU-GLN-ASP-GLY-ARG-VAL-PHE-GLU-ALA-LEU-LEU-VAL-GLY-SER-ASP-SER-LEU-THR-ASP-LEU-ALA-VAL-LEU-LYS-ILE-ASN-ALA-THR-GLY-GLY-LEU-PRO-THR-ILE-PRO-ILE-ASN-ALA-ARG-ARG-VAL-PRO-HIS-ILE-GLY-ASP-VAL-VAL-LEU-ALA-ILE-GLY-ASN-PRO-TYR-ASN-LEU-GLY-GLN-THR-ILE-THR-GLN-GLY-ILE-ILE-SER-ALA-THR-GLY-ARG-ILE-GLY-LEU-ASN-PRO-THR-GLY-ARG-GLN-ASN-PHE-LEU-GLN-THR-ASP-ALA-SER-ILE-ASN-HIS-GLY-ASN-SER-GLY-GLY-ALA-LEU-VAL-ASN-SER-LEU-GLY-GLU-LEU-MET-GLY-ILE-ASN-THR-LEU-SER-PHE-ASP-LYS-SER-ASN-ASP-GLY-GLU-THR-PRO-GLU-GLY-ILE-GLY-PHE-ALA-ILE-PRO-PHE-GLN-LEU-ALA-THR-LYS-ILE-MET-ASP-LYS-LEU-ILE-ARG-ASP-GLY-ARG-VAL-ILE-ARG-GLY-TYR-ILE-GLY-ILE-GLY-GLY-ARG-GLU-ILE-ALA-PRO-LEU-HIS-ALA-GLN-GLY-GLY-GLY-ILE-ASP-GLN-LEU-GLN-GLY-ILE-VAL-VAL-ASN-GLU-VAL-SER-PRO-ASP-GLY-PRO-ALA-ALA-ASN-ALA-GLY-ILE-GLN-VAL-ASN-ASP-LEU-ILE-ILE-SER-VAL-ASP-ASN-LYS-PRO-ALA-ILE-SER-ALA-LEU-GLU-THR-MET-ASP-GLN-VAL-ALA-GLU-ILE-ARG-PRO-GLY-SER-VAL-ILE-PRO-VAL-VAL-VAL-MET-ARG-ASP-ASP-LYS-GLN-LEU-THR-LEU-GLN-VAL-THR-ILE-GLN-GLU-TYR-PRO-ALA-THR-ASN,ASP-ASN-ARG-LEU-GLY-LEU-VAL-TYR-GLN-PHE,314,10,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+],Kd=4.0uM,5.39794,5.4,1,A,A,1,A,A,0,,D,A,,0,1,314,10,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7703292965888977,0.7656437754631042,73.14510345458984,74.66592407226562,0.5527545809745789,0.90478253364563,0.8295612335205078,0.8133363723754883,0.7362311482429504,0.7537205815315247,DNRLGLVYQF,Low,"(5.31, 5.463]",train
4RRV,protein-peptide,O15530 Q16513,GAMDGTAAEPRPGAGSLQHAQPPPQPRKKRPEDFKFGKILGEGSFSTVVLARELATSREYAIKILEKRHIIKENKVPYVTRERDVMSRLDHPFFVKLYFTFQDDEKLYFGLSYAKNGELLKYIRKIGSFDETCTRFYTAEIVSALEYLHGKGIIHRDLKPENILLNEDMHIQITDFGTAKVLSPESKQARANSFVGTAQYVSPELLTEKSACKSSDLWALGCIIYQLVAGLPPFRAGNEGLIFAKIIKLEYDFPEKFFPKARDLVEKLLVLDATKRLGCEEMEGYGPLKAHPFFESVTWENLHQQTPPKLT,EEQEMFRDFDYIADW,GLY-ALA-MET-ASP-GLY-THR-ALA-ALA-GLU-PRO-ARG-PRO-GLY-ALA-GLY-SER-LEU-GLN-HIS-ALA-GLN-PRO-PRO-PRO-GLN-PRO-ARG-LYS-LYS-ARG-PRO-GLU-ASP-PHE-LYS-PHE-GLY-LYS-ILE-LEU-GLY-GLU-GLY-SER-PHE-SER-THR-VAL-VAL-LEU-ALA-ARG-GLU-LEU-ALA-THR-SER-ARG-GLU-TYR-ALA-ILE-LYS-ILE-LEU-GLU-LYS-ARG-HIS-ILE-ILE-LYS-GLU-ASN-LYS-VAL-PRO-TYR-VAL-THR-ARG-GLU-ARG-ASP-VAL-MET-SER-ARG-LEU-ASP-HIS-PRO-PHE-PHE-VAL-LYS-LEU-TYR-PHE-THR-PHE-GLN-ASP-ASP-GLU-LYS-LEU-TYR-PHE-GLY-LEU-SER-TYR-ALA-LYS-ASN-GLY-GLU-LEU-LEU-LYS-TYR-ILE-ARG-LYS-ILE-GLY-SER-PHE-ASP-GLU-THR-CYS-THR-ARG-PHE-TYR-THR-ALA-GLU-ILE-VAL-SER-ALA-LEU-GLU-TYR-LEU-HIS-GLY-LYS-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-GLU-ASN-ILE-LEU-LEU-ASN-GLU-ASP-MET-HIS-ILE-GLN-ILE-THR-ASP-PHE-GLY-THR-ALA-LYS-VAL-LEU-SER-PRO-GLU-SER-LYS-GLN-ALA-ARG-ALA-ASN-SEP-PHE-VAL-GLY-THR-ALA-GLN-TYR-VAL-SER-PRO-GLU-LEU-LEU-THR-GLU-LYS-SER-ALA-CYS-LYS-SER-SER-ASP-LEU-TRP-ALA-LEU-GLY-CYS-ILE-ILE-TYR-GLN-LEU-VAL-ALA-GLY-LEU-PRO-PRO-PHE-ARG-ALA-GLY-ASN-GLU-GLY-LEU-ILE-PHE-ALA-LYS-ILE-ILE-LYS-LEU-GLU-TYR-ASP-PHE-PRO-GLU-LYS-PHE-PHE-PRO-LYS-ALA-ARG-ASP-LEU-VAL-GLU-LYS-LEU-LEU-VAL-LEU-ASP-ALA-THR-LYS-ARG-LEU-GLY-CYS-GLU-GLU-MET-GLU-GLY-TYR-GLY-PRO-LEU-LYS-ALA-HIS-PRO-PHE-PHE-GLU-SER-VAL-THR-TRP-GLU-ASN-LEU-HIS-GLN-GLN-THR-PRO-PRO-LYS-LEU-THR,GLU-GLU-GLN-GLU-MET-PHE-ARG-ASP-PHE-ASP-TYR-ILE-ALA-ASP-TRP,311,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)Cc1ccc(cc1)O)CC(=O)O)Cc1ccccc1)C)C)Cc1ccccc1)[NH3+],Kd=40nM,7.39794,7.4,1,A,A,1,A,A,0,,B,A,,1,1,311,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8915771245956421,0.7847379446029663,83.5280532836914,79.59264373779297,0.4741118252277374,1.0185296535491943,0.8455833196640015,0.8015429973602295,0.8110509514808655,0.7162279486656189,EEQEMFRDFDYIADW,Moderate,"(7.268, 7.523]",train
4RXZ,protein-peptide,O15151,INQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDQQEQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVT,TSFAEYWNLLSP,ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-GLN-GLN-GLU-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-PTR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR,THR-SER-PHE-ALA-GLU-TYR-TRP-ASN-LEU-LEU-SER-PRO,85,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)CC(C)C)CC(=O)N)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)CCC(=O)O)C)Cc1ccccc1)NC(=O)[C@H]([C@H](O)C)[NH3+],Kd=181nM,6.742321,6.74,1,A,A,1,A,A,0,,C,A,dimer,1,1,85,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.9719520211219788,0.8209373950958252,93.31053924560548,73.36483001708984,0.3077916800975799,0.6220553517341614,0.9281480312347412,0.8630039691925049,0.905583381652832,0.8104207515716553,TSFAEYWNLLSP,Low,"(6.696, 6.824]",train
4TMP,protein-peptide,P84243 P42568,GSHMASSCAVQVKLELGHRAQVRKKPTVEGFTHDWMVFVRGPEHSNIQHFVEKVVFHLHESFPRPKRVCKDPPYKVEESGYAGFILPIEVYFKNKEEPRKVRFDYDLFLHLEGHPPVNHLRCEKLTFNNPTEDFRRKLLKA,ARTKQTARKST,GLY-SER-HIS-MET-ALA-SER-SER-CYS-ALA-VAL-GLN-VAL-LYS-LEU-GLU-LEU-GLY-HIS-ARG-ALA-GLN-VAL-ARG-LYS-LYS-PRO-THR-VAL-GLU-GLY-PHE-THR-HIS-ASP-TRP-MET-VAL-PHE-VAL-ARG-GLY-PRO-GLU-HIS-SER-ASN-ILE-GLN-HIS-PHE-VAL-GLU-LYS-VAL-VAL-PHE-HIS-LEU-HIS-GLU-SER-PHE-PRO-ARG-PRO-LYS-ARG-VAL-CYS-LYS-ASP-PRO-PRO-TYR-LYS-VAL-GLU-GLU-SER-GLY-TYR-ALA-GLY-PHE-ILE-LEU-PRO-ILE-GLU-VAL-TYR-PHE-LYS-ASN-LYS-GLU-GLU-PRO-ARG-LYS-VAL-ARG-PHE-ASP-TYR-ASP-LEU-PHE-LEU-HIS-LEU-GLU-GLY-HIS-PRO-PRO-VAL-ASN-HIS-LEU-ARG-CYS-GLU-LYS-LEU-THR-PHE-ASN-ASN-PRO-THR-GLU-ASP-PHE-ARG-ARG-LYS-LEU-LEU-LYS-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-ALY-SER-THR,141,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CCCCNC(=O)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)[NH3+],Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,B,A,,1,1,141,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8932600617408752,0.7989202737808228,91.8431625366211,91.4781265258789,0.3509127497673034,0.6850544810295105,0.9201865196228028,0.8560236692428589,0.8412981629371643,0.7713465094566345,ARTKQTARKST,Low,"(5.31, 5.463]",train
4TT2,protein-peptide,Q6PL18,SMQEEDTFRELRIFLRNVTHRLAIDKRFRVFTKPVDPDEVPDYVTVIKQPMDLSSVISKIDLHKYLTVKDYLRDIDLICSNALEYNPDRDPGDRLIRHRACALRDTAYAIIKEELDEDFEQLCEEIQESR,SGRGKG,SER-MET-GLN-GLU-GLU-ASP-THR-PHE-ARG-GLU-LEU-ARG-ILE-PHE-LEU-ARG-ASN-VAL-THR-HIS-ARG-LEU-ALA-ILE-ASP-LYS-ARG-PHE-ARG-VAL-PHE-THR-LYS-PRO-VAL-ASP-PRO-ASP-GLU-VAL-PRO-ASP-TYR-VAL-THR-VAL-ILE-LYS-GLN-PRO-MET-ASP-LEU-SER-SER-VAL-ILE-SER-LYS-ILE-ASP-LEU-HIS-LYS-TYR-LEU-THR-VAL-LYS-ASP-TYR-LEU-ARG-ASP-ILE-ASP-LEU-ILE-CYS-SER-ASN-ALA-LEU-GLU-TYR-ASN-PRO-ASP-ARG-ASP-PRO-GLY-ASP-ARG-LEU-ILE-ARG-HIS-ARG-ALA-CYS-ALA-LEU-ARG-ASP-THR-ALA-TYR-ALA-ILE-ILE-LYS-GLU-GLU-LEU-ASP-GLU-ASP-PHE-GLU-GLN-LEU-CYS-GLU-GLU-ILE-GLN-GLU-SER-ARG,SER-GLY-ARG-GLY-ALY-GLY,130,6,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)CCCCNC(=O)C)CCC[NH+]=C(N)N)[NH3+],Kd=22uM,4.657577,4.66,1,A,A,1,A,A,0,,P,A,,1,1,130,6,0,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC(=O)NCCCCC(NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.8877923488616943,0.8137942552566528,94.6321258544922,96.34825134277344,0.3089810907840729,0.5654808878898621,0.9431942105293274,0.9050143361091614,0.8463683128356934,0.7909892201423645,SGRGKG,Low,"(4.606, 4.745]",train
4TZM,protein-peptide,Q95XC8 O01820,MAPLENNYNESLNKSKDAIDDKTWSKLFPSIVSDPDRSSNFMIRAIYVVFSAVLRQRNILEKEYFSKNYITENLSCMTLSFKNLRAHQIAQLLRAAGDATKDGFLKEISLVVTEHDGDVEAIEVFSMKFIYFENGGVVARLSTDNNDQEDPHFAELAQLRYEGAESVRDQMVTIVRSVQFLCTKVLEPLPAEFTANFRLKYTNDAPSNFRIDGFDDSSTFYTLPDGIQSVTIGHLRPGHHAAHMQCWSKSMSD,TARYGVSNTSINRKKP,MET-ALA-PRO-LEU-GLU-ASN-ASN-TYR-ASN-GLU-SER-LEU-ASN-LYS-SER-LYS-ASP-ALA-ILE-ASP-ASP-LYS-THR-TRP-SER-LYS-LEU-PHE-PRO-SER-ILE-VAL-SER-ASP-PRO-ASP-ARG-SER-SER-ASN-PHE-MET-ILE-ARG-ALA-ILE-TYR-VAL-VAL-PHE-SER-ALA-VAL-LEU-ARG-GLN-ARG-ASN-ILE-LEU-GLU-LYS-GLU-TYR-PHE-SER-LYS-ASN-TYR-ILE-THR-GLU-ASN-LEU-SER-CYS-MET-THR-LEU-SER-PHE-LYS-ASN-LEU-ARG-ALA-HIS-GLN-ILE-ALA-GLN-LEU-LEU-ARG-ALA-ALA-GLY-ASP-ALA-THR-LYS-ASP-GLY-PHE-LEU-LYS-GLU-ILE-SER-LEU-VAL-VAL-THR-GLU-HIS-ASP-GLY-ASP-VAL-GLU-ALA-ILE-GLU-VAL-PHE-SER-MET-LYS-PHE-ILE-TYR-PHE-GLU-ASN-GLY-GLY-VAL-VAL-ALA-ARG-LEU-SER-THR-ASP-ASN-ASN-ASP-GLN-GLU-ASP-PRO-HIS-PHE-ALA-GLU-LEU-ALA-GLN-LEU-ARG-TYR-GLU-GLY-ALA-GLU-SER-VAL-ARG-ASP-GLN-MET-VAL-THR-ILE-VAL-ARG-SER-VAL-GLN-PHE-LEU-CYS-THR-LYS-VAL-LEU-GLU-PRO-LEU-PRO-ALA-GLU-PHE-THR-ALA-ASN-PHE-ARG-LEU-LYS-TYR-THR-ASN-ASP-ALA-PRO-SER-ASN-PHE-ARG-ILE-ASP-GLY-PHE-ASP-ASP-SER-SER-THR-PHE-TYR-THR-LEU-PRO-ASP-GLY-ILE-GLN-SER-VAL-THR-ILE-GLY-HIS-LEU-ARG-PRO-GLY-HIS-HIS-ALA-ALA-HIS-MET-GLN-CYS-TRP-SER-LYS-SER-MET-SER-ASP,THR-ALA-ARG-TYR-GLY-VAL-SER-ASN-THR-SER-ILE-ASN-ARG-LYS-LYS-PRO,253,16,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CO)CC(=O)N)CO)CC(=O)N)CCC[NH+]=C(N)N,Kd=0.2uM,6.69897,6.7,1,A,A,1,A,A,0,,C,A,,1,1,253,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,0.7917096614837646,0.7953519821166992,71.54561614990234,83.43660736083984,0.9854410886764526,0.7899569272994995,0.783248782157898,0.8706797361373901,0.7566500902175903,0.7765200734138489,TARYGVSNTSINRKKP,Low,"(6.696, 6.824]",train
4TZN,protein-peptide,Q95XC8 O01820,MAPLENNYNESLNKSKDAIDDKTWSKLFPSIVSDPDRSSNFMIRAIYVVFSAVLRQRNILEKEYFSKNYITENLSCMTLSFKNLRAHQIAQLLRAAGDATKDGFLKEISLVVTEHDGDVEAIEVFSMKFIYFENGGVVARLSTDNNDQEDPHFAELAQLRYEGAESVRDQMVTIVRSVQFLCTKVLEPLPAEFTANFRLKYTNDAPSNFRIDGFDDSSTFYTLPDGIQSVTIGHLRPGHHAAHMQCWSKSMSD,AMRYGQSPNMPSRRGN,MET-ALA-PRO-LEU-GLU-ASN-ASN-TYR-ASN-GLU-SER-LEU-ASN-LYS-SER-LYS-ASP-ALA-ILE-ASP-ASP-LYS-THR-TRP-SER-LYS-LEU-PHE-PRO-SER-ILE-VAL-SER-ASP-PRO-ASP-ARG-SER-SER-ASN-PHE-MET-ILE-ARG-ALA-ILE-TYR-VAL-VAL-PHE-SER-ALA-VAL-LEU-ARG-GLN-ARG-ASN-ILE-LEU-GLU-LYS-GLU-TYR-PHE-SER-LYS-ASN-TYR-ILE-THR-GLU-ASN-LEU-SER-CYS-MET-THR-LEU-SER-PHE-LYS-ASN-LEU-ARG-ALA-HIS-GLN-ILE-ALA-GLN-LEU-LEU-ARG-ALA-ALA-GLY-ASP-ALA-THR-LYS-ASP-GLY-PHE-LEU-LYS-GLU-ILE-SER-LEU-VAL-VAL-THR-GLU-HIS-ASP-GLY-ASP-VAL-GLU-ALA-ILE-GLU-VAL-PHE-SER-MET-LYS-PHE-ILE-TYR-PHE-GLU-ASN-GLY-GLY-VAL-VAL-ALA-ARG-LEU-SER-THR-ASP-ASN-ASN-ASP-GLN-GLU-ASP-PRO-HIS-PHE-ALA-GLU-LEU-ALA-GLN-LEU-ARG-TYR-GLU-GLY-ALA-GLU-SER-VAL-ARG-ASP-GLN-MET-VAL-THR-ILE-VAL-ARG-SER-VAL-GLN-PHE-LEU-CYS-THR-LYS-VAL-LEU-GLU-PRO-LEU-PRO-ALA-GLU-PHE-THR-ALA-ASN-PHE-ARG-LEU-LYS-TYR-THR-ASN-ASP-ALA-PRO-SER-ASN-PHE-ARG-ILE-ASP-GLY-PHE-ASP-ASP-SER-SER-THR-PHE-TYR-THR-LEU-PRO-ASP-GLY-ILE-GLN-SER-VAL-THR-ILE-GLY-HIS-LEU-ARG-PRO-GLY-HIS-HIS-ALA-ALA-HIS-MET-GLN-CYS-TRP-SER-LYS-SER-MET-SER-ASP,ALA-MET-ARG-TYR-GLY-GLN-SER-PRO-ASN-MET-PRO-SER-ARG-ARG-GLY-ASN,253,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCSC)CC(=O)N)CO)CCC(=O)N)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)[NH3+],Kd=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,C,A,,1,1,253,16,0,CSCC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,0.7236788272857666,0.7722606658935547,81.86748504638672,70.64173889160156,0.6251893639564514,1.0059936046600342,0.8561444282531738,0.8227054476737976,0.6533876657485962,0.759649395942688,AMRYGQSPNMPSRRGN,Low,"(6.398, 6.523]",val
4TZQ,protein-peptide,O01820 Q20305,MAPLETIYDESLNKSADSIDDKKWSKLFPRIVSDPDRSSNFMTRAIYVAFSAVLRNRNILGQEYFTKNYITEKLKCMTLCFRNLRSNQIAQLLRNAGDATKDGFLKEVSLVITNNEGDLEAIEVFSMKFIYFENGGVVARLSTDKNGQEDPHFAKLAQLVYEGGDSVRDQMVTIVRSVQFLCTKVLEPLPEEFTANFRLEYTNDAPSNFRIDGFEDSSTFYTLPDDIQSATIGHLRPGCHAANMECWSMLMSD,STARYGVSNTSINRKKP,MET-ALA-PRO-LEU-GLU-THR-ILE-TYR-ASP-GLU-SER-LEU-ASN-LYS-SER-ALA-ASP-SER-ILE-ASP-ASP-LYS-LYS-TRP-SER-LYS-LEU-PHE-PRO-ARG-ILE-VAL-SER-ASP-PRO-ASP-ARG-SER-SER-ASN-PHE-MET-THR-ARG-ALA-ILE-TYR-VAL-ALA-PHE-SER-ALA-VAL-LEU-ARG-ASN-ARG-ASN-ILE-LEU-GLY-GLN-GLU-TYR-PHE-THR-LYS-ASN-TYR-ILE-THR-GLU-LYS-LEU-LYS-CYS-MET-THR-LEU-CYS-PHE-ARG-ASN-LEU-ARG-SER-ASN-GLN-ILE-ALA-GLN-LEU-LEU-ARG-ASN-ALA-GLY-ASP-ALA-THR-LYS-ASP-GLY-PHE-LEU-LYS-GLU-VAL-SER-LEU-VAL-ILE-THR-ASN-ASN-GLU-GLY-ASP-LEU-GLU-ALA-ILE-GLU-VAL-PHE-SER-MET-LYS-PHE-ILE-TYR-PHE-GLU-ASN-GLY-GLY-VAL-VAL-ALA-ARG-LEU-SER-THR-ASP-LYS-ASN-GLY-GLN-GLU-ASP-PRO-HIS-PHE-ALA-LYS-LEU-ALA-GLN-LEU-VAL-TYR-GLU-GLY-GLY-ASP-SER-VAL-ARG-ASP-GLN-MET-VAL-THR-ILE-VAL-ARG-SER-VAL-GLN-PHE-LEU-CYS-THR-LYS-VAL-LEU-GLU-PRO-LEU-PRO-GLU-GLU-PHE-THR-ALA-ASN-PHE-ARG-LEU-GLU-TYR-THR-ASN-ASP-ALA-PRO-SER-ASN-PHE-ARG-ILE-ASP-GLY-PHE-GLU-ASP-SER-SER-THR-PHE-TYR-THR-LEU-PRO-ASP-ASP-ILE-GLN-SER-ALA-THR-ILE-GLY-HIS-LEU-ARG-PRO-GLY-CYS-HIS-ALA-ALA-ASN-MET-GLU-CYS-TRP-SER-MET-LEU-MET-SER-ASP,SER-THR-ALA-ARG-TYR-GLY-VAL-SER-ASN-THR-SER-ILE-ASN-ARG-LYS-LYS-PRO,253,17,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CO)CC(=O)N)CO)CC(=O)N)CCC[NH+]=C(N)N,Kd=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,B,A,,1,1,253,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,0.8586889505386353,0.8226289749145508,83.85260009765625,83.12870788574219,0.5599069595336914,0.7203524708747864,0.8753358125686646,0.8821908831596375,0.7827678918838501,0.8077384233474731,STARYGVSNTSINRKKP,Low,"(6.398, 6.523]",train
4U2W,protein-peptide,B1VC43 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,IGCWTKSIPPRPCFVK,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,ILE-GLY-CYS-TRP-THR-LYS-SER-ILE-PRO-PRO-ARG-PRO-CYS-PHE-VAL-LYS,223,16,[NH3+]CCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)[C@H](CC)C)CCC4)CCC3)CC)CCC2)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC)C(C)C)Cc1ccccc1)NC(=O)C[NH3+])Cc1c[nH]c2c1cccc2)[C@H](O)C,Ki=1000nM,6.0,6.0,1,A,A,1,A,A,0,,B,A,,1,1,223,16,0,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,0.8987302780151367,0.8083136677742004,95.31946563720705,93.63053131103516,0.331918329000473,0.5906142592430115,0.9582602381706238,0.9029935598373412,0.8420068025588989,0.7846436500549316,IGCWTKSIPPRPCFVK,Low,"(5.959, 6.097]",val
4U68,protein-peptide,Q7JXA8 P68431,GPGSHVEEYVVEKILGKRFVNGRPQVLVKWSGFPNENNTWEPLENVGNCMKLVSDFESEVFRLHRKAAAKSVGKS,KQTARKSTGGK,GLY-PRO-GLY-SER-HIS-VAL-GLU-GLU-TYR-VAL-VAL-GLU-LYS-ILE-LEU-GLY-LYS-ARG-PHE-VAL-ASN-GLY-ARG-PRO-GLN-VAL-LEU-VAL-LYS-TRP-SER-GLY-PHE-PRO-ASN-GLU-ASN-ASN-THR-TRP-GLU-PRO-LEU-GLU-ASN-VAL-GLY-ASN-CYS-MET-LYS-LEU-VAL-SER-ASP-PHE-GLU-SER-GLU-VAL-PHE-ARG-LEU-HIS-ARG-LYS-ALA-ALA-ALA-LYS-SER-VAL-GLY-LYS-SER,LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS,75,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)[NH3+],Kd=49.3uM,4.307153,4.31,1,A,A,1,A,A,0,,D,A,,1,1,75,11,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,1.0461169481277466,0.9364490509033204,92.16322326660156,90.59954071044922,0.3686806857585907,0.6644539833068848,0.8352775573730469,0.8128604292869568,0.8299314379692078,0.7673461437225342,KQTARKSTGGK,Low,"(4.155, 4.319]",train
4U90,protein-peptide,P20236 Q03555,MSPFPLTSMDKAFITVLEMTPVLGTEIINYRDGMGRVLAQDVYAKDNLPPFPASVKDGYAVRAADGPGDRFIIGESQAGEQPTQTVMPGQVMRVTTGAPIPCGADAVVQVEDTELIRESDDGTEELEVRILVQARPGQDIRPIGHDIKRGECVLAKGTHMGPSEIGLLATVGVTEVEVNKFPVVAVMSTGNELLNPEDDLLPGKIRDSNRSTLLATIQEHGYPTINLGIVGDNPDDLLNALNEGISRADVIITSGGVSMGEKDYLKQVLDIDLHAQIHFGRVFMKPGLPTTFATLDIDGVRKIIFALPGNPVSAVVTCNLFVVPALRKMQGILDPRPTIIKARLSCDVKLDPRPEYHRCILTWHHQEPLPWAQSTGNQMSSRLMSMRSANGLLMLPPKTEQYVELHKGEVVDVMVIGRL,FNIVGTTYPC,MET-SER-PRO-PHE-PRO-LEU-THR-SER-MET-ASP-LYS-ALA-PHE-ILE-THR-VAL-LEU-GLU-MET-THR-PRO-VAL-LEU-GLY-THR-GLU-ILE-ILE-ASN-TYR-ARG-ASP-GLY-MET-GLY-ARG-VAL-LEU-ALA-GLN-ASP-VAL-TYR-ALA-LYS-ASP-ASN-LEU-PRO-PRO-PHE-PRO-ALA-SER-VAL-LYS-ASP-GLY-TYR-ALA-VAL-ARG-ALA-ALA-ASP-GLY-PRO-GLY-ASP-ARG-PHE-ILE-ILE-GLY-GLU-SER-GLN-ALA-GLY-GLU-GLN-PRO-THR-GLN-THR-VAL-MET-PRO-GLY-GLN-VAL-MET-ARG-VAL-THR-THR-GLY-ALA-PRO-ILE-PRO-CYS-GLY-ALA-ASP-ALA-VAL-VAL-GLN-VAL-GLU-ASP-THR-GLU-LEU-ILE-ARG-GLU-SER-ASP-ASP-GLY-THR-GLU-GLU-LEU-GLU-VAL-ARG-ILE-LEU-VAL-GLN-ALA-ARG-PRO-GLY-GLN-ASP-ILE-ARG-PRO-ILE-GLY-HIS-ASP-ILE-LYS-ARG-GLY-GLU-CYS-VAL-LEU-ALA-LYS-GLY-THR-HIS-MET-GLY-PRO-SER-GLU-ILE-GLY-LEU-LEU-ALA-THR-VAL-GLY-VAL-THR-GLU-VAL-GLU-VAL-ASN-LYS-PHE-PRO-VAL-VAL-ALA-VAL-MET-SER-THR-GLY-ASN-GLU-LEU-LEU-ASN-PRO-GLU-ASP-ASP-LEU-LEU-PRO-GLY-LYS-ILE-ARG-ASP-SER-ASN-ARG-SER-THR-LEU-LEU-ALA-THR-ILE-GLN-GLU-HIS-GLY-TYR-PRO-THR-ILE-ASN-LEU-GLY-ILE-VAL-GLY-ASP-ASN-PRO-ASP-ASP-LEU-LEU-ASN-ALA-LEU-ASN-GLU-GLY-ILE-SER-ARG-ALA-ASP-VAL-ILE-ILE-THR-SER-GLY-GLY-VAL-SER-MET-GLY-GLU-LYS-ASP-TYR-LEU-LYS-GLN-VAL-LEU-ASP-ILE-ASP-LEU-HIS-ALA-GLN-ILE-HIS-PHE-GLY-ARG-VAL-PHE-MET-LYS-PRO-GLY-LEU-PRO-THR-THR-PHE-ALA-THR-LEU-ASP-ILE-ASP-GLY-VAL-ARG-LYS-ILE-ILE-PHE-ALA-LEU-PRO-GLY-ASN-PRO-VAL-SER-ALA-VAL-VAL-THR-CYS-ASN-LEU-PHE-VAL-VAL-PRO-ALA-LEU-ARG-LYS-MET-GLN-GLY-ILE-LEU-ASP-PRO-ARG-PRO-THR-ILE-ILE-LYS-ALA-ARG-LEU-SER-CYS-ASP-VAL-LYS-LEU-ASP-PRO-ARG-PRO-GLU-TYR-HIS-ARG-CYS-ILE-LEU-THR-TRP-HIS-HIS-GLN-GLU-PRO-LEU-PRO-TRP-ALA-GLN-SER-THR-GLY-ASN-GLN-MET-SER-SER-ARG-LEU-MET-SER-MET-ARG-SER-ALA-ASN-GLY-LEU-LEU-MET-LEU-PRO-PRO-LYS-THR-GLU-GLN-TYR-VAL-GLU-LEU-HIS-LYS-GLY-GLU-VAL-VAL-ASP-VAL-MET-VAL-ILE-GLY-ARG-LEU,PHE-ASN-ILE-VAL-GLY-THR-THR-TYR-PRO-CYS,419,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CS)Cc1ccc(cc1)O)[C@H](O)C)[C@H](O)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(=O)N)C,Kd=288nM,6.540608,6.54,1,A,A,1,A,A,0,,D,A,,1,1,419,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)O,0.6618674993515015,0.7720049619674683,80.06681060791016,84.67356872558594,0.5396577715873718,0.8985795974731445,0.8262627720832825,0.8459165692329407,0.6061999201774597,0.753527045249939,FNIVGTTYPC,Low,"(6.523, 6.696]",val
4UU5,protein-peptide,P82279 Q8N3R9,GPLGSGETVKIVRIEKARDIPLGATVRNEMDSVIISRIVKGGAAEKSGLLHEGDEVLEINGIEIRGKDVNEVFDLLSDMHGTLTFVLIPS,RVEMWNLMPPPAMERLI,GLY-PRO-LEU-GLY-SER-GLY-GLU-THR-VAL-LYS-ILE-VAL-ARG-ILE-GLU-LYS-ALA-ARG-ASP-ILE-PRO-LEU-GLY-ALA-THR-VAL-ARG-ASN-GLU-MET-ASP-SER-VAL-ILE-ILE-SER-ARG-ILE-VAL-LYS-GLY-GLY-ALA-ALA-GLU-LYS-SER-GLY-LEU-LEU-HIS-GLU-GLY-ASP-GLU-VAL-LEU-GLU-ILE-ASN-GLY-ILE-GLU-ILE-ARG-GLY-LYS-ASP-VAL-ASN-GLU-VAL-PHE-ASP-LEU-LEU-SER-ASP-MET-HIS-GLY-THR-LEU-THR-PHE-VAL-LEU-ILE-PRO-SER,ARG-VAL-GLU-MET-TRP-ASN-LEU-MET-PRO-PRO-PRO-ALA-SME-GLU-ARG-LEU-ILE,90,17,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)O)CC[S@](O)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)[NH3+])Cc1c[nH]c2c1cccc2)CC(=O)N)CC(C)C,Kd=9.2uM,5.036212,5.04,1,A,A,1,A,A,0,,B,A,,1,1,90,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCS(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCS(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,1.0265775918960571,0.6741117238998413,90.91522979736328,85.63253784179688,0.3441843390464782,0.8998550176620483,0.8926330208778381,0.715308427810669,0.884830117225647,0.5804792046546936,RVEMWNLMPPPAMERLI,Low,"(5.014, 5.105]",train
4UX9,protein-peptide,P45983 O14733,MSRSKRDNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGLLNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDLWSVGCIMGEMVCHKILFPGRDYIDQWNKVIEQLGTPCPEFMKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKLKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSEAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLE,QRPRPTLQLPLA,MET-SER-ARG-SER-LYS-ARG-ASP-ASN-ASN-PHE-TYR-SER-VAL-GLU-ILE-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-ILE-LEU-GLU-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-GLY-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-SER-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-ILE-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-LEU-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-VAL-CYS-HIS-LYS-ILE-LEU-PHE-PRO-GLY-ARG-ASP-TYR-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-THR-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-TYR-SER-PHE-GLU-LYS-LEU-PHE-PRO-ASP-VAL-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-ALA-SER-LYS-ARG-ILE-SER-VAL-ASP-GLU-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-SER-GLU-ALA-GLU-ALA-PRO-PRO-PRO-LYS-ILE-PRO-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASP-LEU-GLU,GLN-ARG-PRO-ARG-PRO-THR-LEU-GLN-LEU-PRO-LEU-ALA,364,12,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC[NH+]=C(N)N)C,Kd=7.9uM,5.102373,5.1,1,A,A,1,A,A,0,,F,A,,1,1,364,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,0.8683936595916748,0.6863850355148315,76.69783020019531,78.64237213134766,0.5519659519195557,0.9629983305931092,0.8658588528633118,0.8364449143409729,0.849080502986908,0.6488699913024902,QRPRPTLQLPLA,Low,"(5.014, 5.105]",train
4V11,protein-peptide,P21579 Q7L0J3,KLGDICFSLRYVPTAGKLTVVILEAKNLKKMDVGGLSDPYVKIHLMQNGKRLKKKKTTIKKNTLNPYYNESFSFEVPFEQIQKVQVVVTVLDYDKIGKNDAIGKVFVGYNSTGAELRHWSDMLANPRRPIAQWHTLQVEEEVDAMLAVKK,SDATEGHDED,LYS-LEU-GLY-ASP-ILE-CYS-PHE-SER-LEU-ARG-TYR-VAL-PRO-THR-ALA-GLY-LYS-LEU-THR-VAL-VAL-ILE-LEU-GLU-ALA-LYS-ASN-LEU-LYS-LYS-MET-ASP-VAL-GLY-GLY-LEU-SER-ASP-PRO-TYR-VAL-LYS-ILE-HIS-LEU-MET-GLN-ASN-GLY-LYS-ARG-LEU-LYS-LYS-LYS-LYS-THR-THR-ILE-LYS-LYS-ASN-THR-LEU-ASN-PRO-TYR-TYR-ASN-GLU-SER-PHE-SER-PHE-GLU-VAL-PRO-PHE-GLU-GLN-ILE-GLN-LYS-VAL-GLN-VAL-VAL-VAL-THR-VAL-LEU-ASP-TYR-ASP-LYS-ILE-GLY-LYS-ASN-ASP-ALA-ILE-GLY-LYS-VAL-PHE-VAL-GLY-TYR-ASN-SER-THR-GLY-ALA-GLU-LEU-ARG-HIS-TRP-SER-ASP-MET-LEU-ALA-ASN-PRO-ARG-ARG-PRO-ILE-ALA-GLN-TRP-HIS-THR-LEU-GLN-VAL-GLU-GLU-GLU-VAL-ASP-ALA-MET-LEU-ALA-VAL-LYS-LYS,SER-ASP-ALA-TPO-GLU-GLY-HIS-ASP-GLU-ASP,150,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)Cc1c[nH]cn1)CCC(=O)O)C)CC(=O)O)[NH3+],Kd=324nM,6.489455,6.49,1,A,A,1,A,A,0,,B,A,,1,1,150,10,0,C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9188086986541748,0.823951244354248,92.34019470214844,88.73693084716797,0.3183385133743286,0.6171761751174927,0.9444950222969056,0.9002521634101868,0.8733245730400085,0.8048759698867798,SDATEGHDED,Low,"(6.398, 6.523]",train
6ISO,protein-peptide,Q9NTG7,GKLSLQDVAELIRARACQRVVVMVGAGISTPSGIPDFRSPGSGLYSNLQQYDLPYPEAIFELPFFFHNPKPFFTLAKELYPGNYKPNVTHYFLRLLHDKGLLLRLYTQNIDGLERVSGIPASKLVEAHGTFASATCTVCQRPFPGEDIRADVMADRVPRCPVCTGVVKPDIVFFGEPLPQRFLLHVVDFPMADLLLILGTSLEVEPFASLTEAVRSSVPRLLINRDLVGPLAWHPRSRDVAQLGDVVHGVESLVELLGWTEEMRDLVQRETGKLA,RTKQTAR,GLY-LYS-LEU-SER-LEU-GLN-ASP-VAL-ALA-GLU-LEU-ILE-ARG-ALA-ARG-ALA-CYS-GLN-ARG-VAL-VAL-VAL-MET-VAL-GLY-ALA-GLY-ILE-SER-THR-PRO-SER-GLY-ILE-PRO-ASP-PHE-ARG-SER-PRO-GLY-SER-GLY-LEU-TYR-SER-ASN-LEU-GLN-GLN-TYR-ASP-LEU-PRO-TYR-PRO-GLU-ALA-ILE-PHE-GLU-LEU-PRO-PHE-PHE-PHE-HIS-ASN-PRO-LYS-PRO-PHE-PHE-THR-LEU-ALA-LYS-GLU-LEU-TYR-PRO-GLY-ASN-TYR-LYS-PRO-ASN-VAL-THR-HIS-TYR-PHE-LEU-ARG-LEU-LEU-HIS-ASP-LYS-GLY-LEU-LEU-LEU-ARG-LEU-TYR-THR-GLN-ASN-ILE-ASP-GLY-LEU-GLU-ARG-VAL-SER-GLY-ILE-PRO-ALA-SER-LYS-LEU-VAL-GLU-ALA-HIS-GLY-THR-PHE-ALA-SER-ALA-THR-CYS-THR-VAL-CYS-GLN-ARG-PRO-PHE-PRO-GLY-GLU-ASP-ILE-ARG-ALA-ASP-VAL-MET-ALA-ASP-ARG-VAL-PRO-ARG-CYS-PRO-VAL-CYS-THR-GLY-VAL-VAL-LYS-PRO-ASP-ILE-VAL-PHE-PHE-GLY-GLU-PRO-LEU-PRO-GLN-ARG-PHE-LEU-LEU-HIS-VAL-VAL-ASP-PHE-PRO-MET-ALA-ASP-LEU-LEU-LEU-ILE-LEU-GLY-THR-SER-LEU-GLU-VAL-GLU-PRO-PHE-ALA-SER-LEU-THR-GLU-ALA-VAL-ARG-SER-SER-VAL-PRO-ARG-LEU-LEU-ILE-ASN-ARG-ASP-LEU-VAL-GLY-PRO-LEU-ALA-TRP-HIS-PRO-ARG-SER-ARG-ASP-VAL-ALA-GLN-LEU-GLY-ASP-VAL-VAL-HIS-GLY-VAL-GLU-SER-LEU-VAL-GLU-LEU-LEU-GLY-TRP-THR-GLU-GLU-MET-ARG-ASP-LEU-VAL-GLN-ARG-GLU-THR-GLY-LYS-LEU-ALA,ARG-THR-LYS-GLN-THR-ALA-ARG,275,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=25.1uM,4.600326,4.6,1,A,A,1,A,A,0,,C,A,,1,1,275,7,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8348140120506287,0.8578293919563293,90.20187377929688,83.65389251708984,0.3719834387302398,0.6040714383125305,0.9348934292793274,0.9226003289222716,0.794279932975769,0.8416366577148438,RTKQTAR,Low,"(4.456, 4.606]",train
4WCI,protein-peptide,Q8TB24 Q9Y5K6,GPLGSMVDYIVEYDYDAVHDDELTIRVGEIIRNVKKLQEEGWLEGELNGRRGMFPDNFVKEIKRE,AKKNLPTAPPRRRVSE,GLY-PRO-LEU-GLY-SER-MET-VAL-ASP-TYR-ILE-VAL-GLU-TYR-ASP-TYR-ASP-ALA-VAL-HIS-ASP-ASP-GLU-LEU-THR-ILE-ARG-VAL-GLY-GLU-ILE-ILE-ARG-ASN-VAL-LYS-LYS-LEU-GLN-GLU-GLU-GLY-TRP-LEU-GLU-GLY-GLU-LEU-ASN-GLY-ARG-ARG-GLY-MET-PHE-PRO-ASP-ASN-PHE-VAL-LYS-GLU-ILE-LYS-ARG-GLU,ALA-LYS-LYS-ASN-LEU-PRO-THR-ALA-PRO-PRO-ARG-ARG-ARG-VAL-SER-GLU,65,16,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@H](CC(=O)N)[NH3+])C,Kd=8.9uM,5.05061,5.05,1,A,A,1,A,A,0,,B,A,,1,1,65,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O,0.9422937631607056,0.7258388996124268,94.22847747802734,89.7704849243164,0.3261823356151581,0.6948124766349792,0.8816360831260681,0.7838537096977234,0.8185693025588989,0.7113351225852966,AKKNLPTAPPRRRVSE,Low,"(5.014, 5.105]",train
4WJ7,protein-peptide,Q9BSQ5,GSERVEPDRLLSDYIEKEVKYLGQLTSIPGYLNPSSRTEILHFIDNAKRAHQLPGHLTQEHDAVLSLSAYNVKLAWRDGEDIILRVPIHDIAAVSYVRDDAAHLVVLKTAQDPGISPSQSLCAESSRGLSAGSLSESAVGPVEACCLVILAAESKVAAEELCCLLGQVFQVVYTESTIDF,VDKVVINPYFGLG,GLY-SER-GLU-ARG-VAL-GLU-PRO-ASP-ARG-LEU-LEU-SER-ASP-TYR-ILE-GLU-LYS-GLU-VAL-LYS-TYR-LEU-GLY-GLN-LEU-THR-SER-ILE-PRO-GLY-TYR-LEU-ASN-PRO-SER-SER-ARG-THR-GLU-ILE-LEU-HIS-PHE-ILE-ASP-ASN-ALA-LYS-ARG-ALA-HIS-GLN-LEU-PRO-GLY-HIS-LEU-THR-GLN-GLU-HIS-ASP-ALA-VAL-LEU-SER-LEU-SER-ALA-TYR-ASN-VAL-LYS-LEU-ALA-TRP-ARG-ASP-GLY-GLU-ASP-ILE-ILE-LEU-ARG-VAL-PRO-ILE-HIS-ASP-ILE-ALA-ALA-VAL-SER-TYR-VAL-ARG-ASP-ASP-ALA-ALA-HIS-LEU-VAL-VAL-LEU-LYS-THR-ALA-GLN-ASP-PRO-GLY-ILE-SER-PRO-SER-GLN-SER-LEU-CYS-ALA-GLU-SER-SER-ARG-GLY-LEU-SER-ALA-GLY-SER-LEU-SER-GLU-SER-ALA-VAL-GLY-PRO-VAL-GLU-ALA-CYS-CYS-LEU-VAL-ILE-LEU-ALA-ALA-GLU-SER-LYS-VAL-ALA-ALA-GLU-GLU-LEU-CYS-CYS-LEU-LEU-GLY-GLN-VAL-PHE-GLN-VAL-VAL-TYR-THR-GLU-SER-THR-ILE-ASP-PHE,VAL-ASP-LYS-VAL-VAL-ILE-ASN-PRO-TYR-PHE-GLY-LEU-GLY,180,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccccc1)Cc1ccc(cc1)O)CC(=O)N)[C@H](CC)C)C(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CC(=O)O,Kd=13uM,4.886057,4.89,1,A,A,1,A,A,0,,W,A,,1,1,180,13,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(C)C,0.9782384634017944,0.8549318313598633,82.62651824951172,75.36504364013672,0.4456127882003784,0.692762553691864,0.8524404764175415,0.8180239796638489,0.9028226137161256,0.7947142720222473,VDKVVINPYFGLG,Low,"(4.866, 5.014]",train
4WRQ,protein-peptide,Q9Y3M2 P63104,GMDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,KTPPRKSASLSNLHSLDR,GLY-MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,LYS-THR-PRO-PRO-ARG-LYS-SER-ALA-SEP-LEU-SER-ASN-LEU-HIS-SER-LEU-ASP-ARG,246,18,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])C)COP(O)(O)O)CC(C)C,Kd=4.6uM,5.337242,5.34,1,A,A,1,A,A,0,,C,A,,1,1,246,18,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8914309144020081,0.8083283305168152,85.42142486572266,86.16497039794922,0.3823533952236175,0.8035215735435486,0.9018515944480896,0.8651050329208374,0.8201704025268555,0.7636463642120361,KTPPRKSASLSNLHSLDR,Low,"(5.31, 5.463]",train
4X1Q,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAYHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKE,CPAYSRYLDC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU,CYS-PRO-ALA-TYR-SER-ARG-TYR-LEU-ASP-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CC(C)C)CC(=O)O)C(=O)O,Kd=5.04uM,5.297569,5.3,1,A,A,1,A,A,0,,P,U,,1,1,247,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,0.9636126756668092,0.8418343663215637,96.35220336914062,95.20410919189452,0.3124595582485199,0.6049175262451172,0.9611675143241882,0.9255557656288148,0.9399048686027528,0.8209039568901062,CPAYSRYLDC,Low,"(5.222, 5.31]",train
4X1S,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAYHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKE,CPAYSAYLAC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU,CYS-PRO-ALA-TYR-SER-ALA-TYR-LEU-ALA-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)Cc1ccc(cc1)O)CC(C)C)C)C(=O)O,Kd=0.134uM,6.872895,6.87,1,A,A,1,A,A,0,,P,U,,1,1,247,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O,0.8921306133270264,0.7684389352798462,95.78600311279295,94.77951049804688,0.3319114744663238,0.6827436685562134,0.95781672000885,0.9093542098999025,0.85139000415802,0.7332100868225098,CPAYSAYLAC,Low,"(6.824, 7.049]",train
4X34,protein-peptide,Q12888 P04637,NSFVGLRVVAKWSSNGYFYSGKITRDVGAGKYKLLFDDGYECDVLGKDILLCDPIPLDTEVTALSEDEYFSAGVVKGHRKESGELYYSIEKEGQRKWYKRMAVILSLEQGNRLREQYGLG,TSRHKKLMFK,ASN-SER-PHE-VAL-GLY-LEU-ARG-VAL-VAL-ALA-LYS-TRP-SER-SER-ASN-GLY-TYR-PHE-TYR-SER-GLY-LYS-ILE-THR-ARG-ASP-VAL-GLY-ALA-GLY-LYS-TYR-LYS-LEU-LEU-PHE-ASP-ASP-GLY-TYR-GLU-CYS-ASP-VAL-LEU-GLY-LYS-ASP-ILE-LEU-LEU-CYS-ASP-PRO-ILE-PRO-LEU-ASP-THR-GLU-VAL-THR-ALA-LEU-SER-GLU-ASP-GLU-TYR-PHE-SER-ALA-GLY-VAL-VAL-LYS-GLY-HIS-ARG-LYS-GLU-SER-GLY-GLU-LEU-TYR-TYR-SER-ILE-GLU-LYS-GLU-GLY-GLN-ARG-LYS-TRP-TYR-LYS-ARG-MET-ALA-VAL-ILE-LEU-SER-LEU-GLU-GLN-GLY-ASN-ARG-LEU-ARG-GLU-GLN-TYR-GLY-LEU-GLY,THR-SER-ARG-HIS-ALY-MLY-LEU-MET-PHE-LYS,120,10,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CO)CCC[NH+]=C(N)N)CCCCNC(=O)C)CCCC[NH+](C)C)CC(C)C,Kd=0.76uM,6.119186,6.12,1,A,A,1,A,A,0,,C,A,,1,1,120,10,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCN(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCN(C)C)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8890734314918518,0.8351729512214661,94.34738159179688,93.15478515625,0.3371575474739074,0.615921139717102,0.9160399436950684,0.8904151916503906,0.8342548608779907,0.8213623762130737,TSRHKKLMFK,Low,"(6.097, 6.26]",train
4X3E,protein-peptide,O75530,GSKCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,RLQAQRKFAQSQY,GLY-SER-LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,ARG-LEU-GLN-ALA-GLN-ARG-M3L-PHE-ALA-GLN-SER-GLN-TYR,367,13,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC(=O)N)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)Cc1ccccc1)C)CCC(=O)N,Kd=3.4uM,5.468521,5.47,1,A,A,1,A,A,0,,B,A,,1,1,367,13,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8526086211204529,0.753558874130249,94.17431640625,94.60232543945312,0.3496500253677368,0.7680522203445435,0.946259617805481,0.8940355181694031,0.8078143000602722,0.7184396386146545,RLQAQRKFAQSQY,Low,"(5.463, 5.6]",train
4X3H,protein-peptide,O88602 Q63053,GPLGSPEFPGLDTQIFEDPREFLSHLEEYLRQVGGSEEYWLSQIQNHMNGPAKKWWEFKQGSVKNWVEFKKEFLQYSEG,RIPSYRYRY,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-PRO-GLY-LEU-ASP-THR-GLN-ILE-PHE-GLU-ASP-PRO-ARG-GLU-PHE-LEU-SER-HIS-LEU-GLU-GLU-TYR-LEU-ARG-GLN-VAL-GLY-GLY-SER-GLU-GLU-TYR-TRP-LEU-SER-GLN-ILE-GLN-ASN-HIS-MET-ASN-GLY-PRO-ALA-LYS-LYS-TRP-TRP-GLU-PHE-LYS-GLN-GLY-SER-VAL-LYS-ASN-TRP-VAL-GLU-PHE-LYS-LYS-GLU-PHE-LEU-GLN-TYR-SER-GLU-GLY,ARG-ILE-PRO-SER-TYR-ARG-TYR-ARG-TYR,79,9,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=59.4uM,4.226214,4.23,1,A,A,1,A,A,0,,B,A,,1,1,79,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,1.0287710428237915,0.9323484301567078,96.20003509521484,85.52289581298828,0.3041974604129791,0.6218391060829163,0.909255027770996,0.8508733510971069,0.9237067699432372,0.841957688331604,RIPSYRYRY,Low,"(4.155, 4.319]",train
4X3I,protein-peptide,P11798 Q63053,GPLGSPEFPGLDTQIFEDPREFLSHLEEYLRQVGGSEEYWLSQIQNHMNGPAKKWWEFKQGSVKNWVEFKKEFLQYSEG,ATRNFSG,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-PRO-GLY-LEU-ASP-THR-GLN-ILE-PHE-GLU-ASP-PRO-ARG-GLU-PHE-LEU-SER-HIS-LEU-GLU-GLU-TYR-LEU-ARG-GLN-VAL-GLY-GLY-SER-GLU-GLU-TYR-TRP-LEU-SER-GLN-ILE-GLN-ASN-HIS-MSE-ASN-GLY-PRO-ALA-LYS-LYS-TRP-TRP-GLU-PHE-LYS-GLN-GLY-SER-VAL-LYS-ASN-TRP-VAL-GLU-PHE-LYS-LYS-GLU-PHE-LEU-GLN-TYR-SER-GLU-GLY,ALA-THR-ARG-ASN-PHE-SER-GLY,79,7,OC[C@@H](C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CC(=O)N)Cc1ccccc1,Ki=671uM,3.173277,3.17,1,A,A,1,A,A,0,,B,A,,1,1,79,7,0,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)O,0.9890601634979248,0.922393262386322,94.9239501953125,85.78511047363281,0.3217934966087341,0.5936420559883118,0.8910149931907654,0.8398312926292419,0.8754900693893433,0.8401856422424316,ATRNFSG,Low,"(2.044, 3.548]",train
4X3K,protein-peptide,Q8VDS3 P68431,GSHMGEQVFAVESIRKKRVRKGKVEYLVKWKGWPPKYSTWEPEEHILDPRLVMAYEEKEERDRA,KAARKSA,GLY-SER-HIS-MET-GLY-GLU-GLN-VAL-PHE-ALA-VAL-GLU-SER-ILE-ARG-LYS-LYS-ARG-VAL-ARG-LYS-GLY-LYS-VAL-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-PRO-PRO-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-HIS-ILE-LEU-ASP-PRO-ARG-LEU-VAL-MET-ALA-TYR-GLU-GLU-LYS-GLU-GLU-ARG-ASP-ARG-ALA,LYS-ALA-ALA-ARG-M3L-SER-ALA,64,7,OC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])C)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=27.7uM,4.55752,4.56,1,A,A,1,A,A,0,,C,A,,1,1,64,7,0,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O,C[C@H](N)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](N)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,1.0285338163375854,0.8091261386871338,94.4573211669922,93.252197265625,0.3141546249389648,0.5819029211997986,0.8925660252571106,0.8451563119888306,0.886469304561615,0.7903529405593872,KAARKSA,Low,"(4.456, 4.606]",train
4X3S,protein-peptide,Q8VDS3 Q15047,GSHMGEQVFAVESIRKKRVRKGKVEYLVKWKGWPPKYSTWEPEEHILDPRLVMAYEEKEERDRA,RGFALKSTHG,GLY-SER-HIS-MET-GLY-GLU-GLN-VAL-PHE-ALA-VAL-GLU-SER-ILE-ARG-LYS-LYS-ARG-VAL-ARG-LYS-GLY-LYS-VAL-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-PRO-PRO-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-HIS-ILE-LEU-ASP-PRO-ARG-LEU-VAL-MET-ALA-TYR-GLU-GLU-LYS-GLU-GLU-ARG-ASP-ARG-ALA,ARG-GLY-PHE-ALA-LEU-M3L-SER-THR-HIS-GLY,64,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]cn1)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)CC(C)C)CCCC[N+](C)(C)C,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,C,A,,0,1,64,10,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9952327013015748,0.8135632872581482,92.2503890991211,91.90666961669922,0.3556466400623321,0.5905105471611023,0.8667173385620117,0.841671884059906,0.8246588706970215,0.7870048880577087,RGFALKSTHG,Low,"(5.821, 5.959]",train
4X8N,protein-peptide,Q9UBL3 Q15291,RVLLALHDRAPQLKISDDRLTVVGEKGYSMVRASHGVRKGAWYFEITVDEMPPDTAARLGWSQPLGNLQAPLGYDKFSYSWRSKKGTKFHQSIGKHYSSGYGQGDVLGFYINLPEDISGRGSEIIFYKNGVNQGVAYKDIFEGVYFPAISLYKSCTVSINFGPCFKYPPKDLTYRPMSDMG,ERESEFDIED,ARG-VAL-LEU-LEU-ALA-LEU-HIS-ASP-ARG-ALA-PRO-GLN-LEU-LYS-ILE-SER-ASP-ASP-ARG-LEU-THR-VAL-VAL-GLY-GLU-LYS-GLY-TYR-SER-MET-VAL-ARG-ALA-SER-HIS-GLY-VAL-ARG-LYS-GLY-ALA-TRP-TYR-PHE-GLU-ILE-THR-VAL-ASP-GLU-MET-PRO-PRO-ASP-THR-ALA-ALA-ARG-LEU-GLY-TRP-SER-GLN-PRO-LEU-GLY-ASN-LEU-GLN-ALA-PRO-LEU-GLY-TYR-ASP-LYS-PHE-SER-TYR-SER-TRP-ARG-SER-LYS-LYS-GLY-THR-LYS-PHE-HIS-GLN-SER-ILE-GLY-LYS-HIS-TYR-SER-SER-GLY-TYR-GLY-GLN-GLY-ASP-VAL-LEU-GLY-PHE-TYR-ILE-ASN-LEU-PRO-GLU-ASP-ILE-SER-GLY-ARG-GLY-SER-GLU-ILE-ILE-PHE-TYR-LYS-ASN-GLY-VAL-ASN-GLN-GLY-VAL-ALA-TYR-LYS-ASP-ILE-PHE-GLU-GLY-VAL-TYR-PHE-PRO-ALA-ILE-SER-LEU-TYR-LYS-SER-CYS-THR-VAL-SER-ILE-ASN-PHE-GLY-PRO-CYS-PHE-LYS-TYR-PRO-PRO-LYS-ASP-LEU-THR-TYR-ARG-PRO-MET-SER-ASP-MET-GLY,GLU-ARG-GLU-SEP-GLU-PHE-ASP-ILE-GLU-ASP,181,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC[NH+]=C(N)N)CCC(=O)O)COP(O)(O)O)CCC(=O)O)Cc1ccccc1)CC(=O)O)C,Kd=0.24uM,6.619789,6.62,1,A,A,1,A,A,0,,B,A,,1,1,181,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9093612432479858,0.8825067281723022,96.1178207397461,96.2530746459961,0.332750529050827,0.539729654788971,0.9460799098014832,0.9303800463676452,0.8674589991569519,0.8705384135246277,ERESEFDIED,Low,"(6.523, 6.696]",train
4X8P,protein-peptide,Q9UBL3 Q15291,SRVLLALHDRAPQLKISDDRLTVVGEKGYSMVRASHGVRKGAWYFEITVDEMPPDTAARLGWSQPLGNLQAPLGYDKFSYSWRSKKGTKFHQSIGKHYSSGYGQGDVLGFYINLPEDISGRGSEIIFYKNGVNQGVAYKDIFEGVYFPAISLYKSCTVSINFGPCFKYPPKDLTYRPMSDMG,EYEERESEFDIE,SER-ARG-VAL-LEU-LEU-ALA-LEU-HIS-ASP-ARG-ALA-PRO-GLN-LEU-LYS-ILE-SER-ASP-ASP-ARG-LEU-THR-VAL-VAL-GLY-GLU-LYS-GLY-TYR-SER-MET-VAL-ARG-ALA-SER-HIS-GLY-VAL-ARG-LYS-GLY-ALA-TRP-TYR-PHE-GLU-ILE-THR-VAL-ASP-GLU-MET-PRO-PRO-ASP-THR-ALA-ALA-ARG-LEU-GLY-TRP-SER-GLN-PRO-LEU-GLY-ASN-LEU-GLN-ALA-PRO-LEU-GLY-TYR-ASP-LYS-PHE-SER-TYR-SER-TRP-ARG-SER-LYS-LYS-GLY-THR-LYS-PHE-HIS-GLN-SER-ILE-GLY-LYS-HIS-TYR-SER-SER-GLY-TYR-GLY-GLN-GLY-ASP-VAL-LEU-GLY-PHE-TYR-ILE-ASN-LEU-PRO-GLU-ASP-ILE-SER-GLY-ARG-GLY-SER-GLU-ILE-ILE-PHE-TYR-LYS-ASN-GLY-VAL-ASN-GLN-GLY-VAL-ALA-TYR-LYS-ASP-ILE-PHE-GLU-GLY-VAL-TYR-PHE-PRO-ALA-ILE-SER-LEU-TYR-LYS-SER-CYS-THR-VAL-SER-ILE-ASN-PHE-GLY-PRO-CYS-PHE-LYS-TYR-PRO-PRO-LYS-ASP-LEU-THR-TYR-ARG-PRO-MET-SER-ASP-MET-GLY,GLU-TYR-GLU-GLU-ARG-GLU-SER-GLU-PHE-ASP-ILE-GLU,182,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccc(cc1)O)CCC(=O)O)CCC(=O)O)CCC[NH+]=C(N)N)CCC(=O)O)CO)CCC(=O)O)Cc1ccccc1)CC(=O)O)C,Kd=3.3uM,5.481486,5.48,1,A,A,1,A,A,0,,B,A,,1,1,182,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8754675388336182,0.789050281047821,95.92949676513672,94.7434310913086,0.3459452688694,0.696357011795044,0.947021782398224,0.8842783570289612,0.8189191818237305,0.7652432322502136,EYEERESEFDIE,Low,"(5.463, 5.6]",train
4XEK,protein-peptide,O60711 Q14289,GSHMANLDRTDDLVYLNVMELVRAVLELKNELSQLPPEGYVVVVKNVGLTLRKLIGSVDDLLPSLPSSSRTEIEGTQKLLNKDLAELINKMRLAQQNAVTSLSEEAKRQMLTASHTLAVDAKNLLDAVDQAKVLANLAH,KTSAAAQLDELMAHLTEMQ,GLY-SER-HIS-MET-ALA-ASN-LEU-ASP-ARG-THR-ASP-ASP-LEU-VAL-TYR-LEU-ASN-VAL-MET-GLU-LEU-VAL-ARG-ALA-VAL-LEU-GLU-LEU-LYS-ASN-GLU-LEU-SER-GLN-LEU-PRO-PRO-GLU-GLY-TYR-VAL-VAL-VAL-VAL-LYS-ASN-VAL-GLY-LEU-THR-LEU-ARG-LYS-LEU-ILE-GLY-SER-VAL-ASP-ASP-LEU-LEU-PRO-SER-LEU-PRO-SER-SER-SER-ARG-THR-GLU-ILE-GLU-GLY-THR-GLN-LYS-LEU-LEU-ASN-LYS-ASP-LEU-ALA-GLU-LEU-ILE-ASN-LYS-MET-ARG-LEU-ALA-GLN-GLN-ASN-ALA-VAL-THR-SER-LEU-SER-GLU-GLU-ALA-LYS-ARG-GLN-MET-LEU-THR-ALA-SER-HIS-THR-LEU-ALA-VAL-ASP-ALA-LYS-ASN-LEU-LEU-ASP-ALA-VAL-ASP-GLN-ALA-LYS-VAL-LEU-ALA-ASN-LEU-ALA-HIS,LYS-THR-SER-ALA-ALA-ALA-GLN-LEU-ASP-GLU-LEU-MET-ALA-HIS-LEU-THR-GLU-MET-GLN,139,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)C)C)CCSC)CC(C)C)C)CC(=O)O)CC(C)C)CCC(=O)N)C)C)C)CO)[C@H](O)C)[NH3+],Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,C,A,,1,1,139,19,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,1.006157398223877,0.6165631413459778,93.6089859008789,86.97051239013672,0.3177520632743835,1.038198471069336,0.9300279021263124,0.7549604773521423,0.9381643533706664,0.5774673819541931,KTSAAAQLDELMAHLTEMQ,Low,"(5.6, 5.699]",train
4XHV,protein-peptide,M9NFI9 Q3KN41,GAMAHVFPVELMKGPEGLGLSIIGMGVGADAGLEKLGIFVKTITDNGAAARDGRIQVNDQIIEVDGKSLVGVTQAYAASVLRNTSGLVKFQIGR,DSKDVKEWYV,GLY-ALA-MET-ALA-HIS-VAL-PHE-PRO-VAL-GLU-LEU-MET-LYS-GLY-PRO-GLU-GLY-LEU-GLY-LEU-SER-ILE-ILE-GLY-MET-GLY-VAL-GLY-ALA-ASP-ALA-GLY-LEU-GLU-LYS-LEU-GLY-ILE-PHE-VAL-LYS-THR-ILE-THR-ASP-ASN-GLY-ALA-ALA-ALA-ARG-ASP-GLY-ARG-ILE-GLN-VAL-ASN-ASP-GLN-ILE-ILE-GLU-VAL-ASP-GLY-LYS-SER-LEU-VAL-GLY-VAL-THR-GLN-ALA-TYR-ALA-ALA-SER-VAL-LEU-ARG-ASN-THR-SER-GLY-LEU-VAL-LYS-PHE-GLN-ILE-GLY-ARG,ASP-SER-LYS-ASP-VAL-LYS-GLU-TRP-TYR-VAL,94,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2)CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CO)CCCC[NH3+])CC(=O)O,Kd=50uM,4.30103,4.3,1,A,A,1,A,A,0,,B,A,,1,1,94,10,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.9379960298538208,0.7875016331672668,96.77276611328124,89.95572662353516,0.3140290081501007,0.645073652267456,0.919815957546234,0.8537735939025879,0.8824448585510254,0.7709336280822754,DSKDVKEWYV,Low,"(4.155, 4.319]",train
4XYN,protein-peptide,P04271 Q15109,MSELEKAMVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDNDGDGECDFQEFMAFVAMVTTACHEFFEHE,NTGRTEAWKVLSPQG,MET-SER-GLU-LEU-GLU-LYS-ALA-MET-VAL-ALA-LEU-ILE-ASP-VAL-PHE-HIS-GLN-TYR-SER-GLY-ARG-GLU-GLY-ASP-LYS-HIS-LYS-LEU-LYS-LYS-SER-GLU-LEU-LYS-GLU-LEU-ILE-ASN-ASN-GLU-LEU-SER-HIS-PHE-LEU-GLU-GLU-ILE-LYS-GLU-GLN-GLU-VAL-VAL-ASP-LYS-VAL-MET-GLU-THR-LEU-ASP-ASN-ASP-GLY-ASP-GLY-GLU-CYS-ASP-PHE-GLN-GLU-PHE-MET-ALA-PHE-VAL-ALA-MET-VAL-THR-THR-ALA-CYS-HIS-GLU-PHE-PHE-GLU-HIS-GLU,ASN-THR-GLY-ARG-THR-GLU-ALA-TRP-LYS-VAL-LEU-SER-PRO-GLN-GLY,92,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)C(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC(=O)O)C,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,P,A,,1,1,92,15,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,0.8270552158355713,0.7156657576560974,75.69725036621094,78.74774169921875,0.4495688080787658,0.7933726906776428,0.8373097777366638,0.7954970002174377,0.7193513512611389,0.6957079172134399,NTGRTEAWKVLSPQG,Low,"(5.821, 5.959]",train
4Y7R,protein-peptide,P61964 P01106,SATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,EEIDVVSV,SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLU-GLU-ILE-ASP-VAL-VAL-SER-VAL,313,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)C(C)C)C(C)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)C,Kd=9.3uM,5.031517,5.03,1,A,A,1,A,A,0,,B,A,,1,1,313,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(C)C)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.9463375806808472,0.785481333732605,95.33548736572266,94.3736343383789,0.31560018658638,0.6423386335372925,0.9420318007469176,0.899582028388977,0.912367343902588,0.7329944372177124,EEIDVVSV,Low,"(5.014, 5.105]",val
4YJE,protein-peptide,Q5JTC6 P25054,MGHHHHHHMLHLLEQIRAYCETCWEWQEAHEPGMDQDKNPMPAPVEHQICPAVCVLMKLSFDEEHRHAMNELGGLQAIAELLQVDCEMYGLTNDHYSITLRRYAGMALTNLTFGDVANKATLCSMKGCMRALVAQLKSESEDLQQVIASVLRNLSWRADVNSKKTLREVGSVKALMECALEVKKESTLKSVLSALWNLSAHCTENKADICAVDGALAFLVGTLTYRSQTNTLAIIESGGGILRNVSSLIATNEDHRQILRENNCLQTLLQHLKSHSLTIVSNACGTLWNLSARNPKDQEALWDMGAVSMLKNLIHSKHKMIAMGSAAALRNLMANRPAKYKDANIMSPGSSLPS,LTGCGDIIAEQ,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-HIS-LEU-LEU-GLU-GLN-ILE-ARG-ALA-TYR-CYS-GLU-THR-CYS-TRP-GLU-TRP-GLN-GLU-ALA-HIS-GLU-PRO-GLY-MET-ASP-GLN-ASP-LYS-ASN-PRO-MET-PRO-ALA-PRO-VAL-GLU-HIS-GLN-ILE-CYS-PRO-ALA-VAL-CYS-VAL-LEU-MET-LYS-LEU-SER-PHE-ASP-GLU-GLU-HIS-ARG-HIS-ALA-MET-ASN-GLU-LEU-GLY-GLY-LEU-GLN-ALA-ILE-ALA-GLU-LEU-LEU-GLN-VAL-ASP-CYS-GLU-MET-TYR-GLY-LEU-THR-ASN-ASP-HIS-TYR-SER-ILE-THR-LEU-ARG-ARG-TYR-ALA-GLY-MET-ALA-LEU-THR-ASN-LEU-THR-PHE-GLY-ASP-VAL-ALA-ASN-LYS-ALA-THR-LEU-CYS-SER-MET-LYS-GLY-CYS-MET-ARG-ALA-LEU-VAL-ALA-GLN-LEU-LYS-SER-GLU-SER-GLU-ASP-LEU-GLN-GLN-VAL-ILE-ALA-SER-VAL-LEU-ARG-ASN-LEU-SER-TRP-ARG-ALA-ASP-VAL-ASN-SER-LYS-LYS-THR-LEU-ARG-GLU-VAL-GLY-SER-VAL-LYS-ALA-LEU-MET-GLU-CYS-ALA-LEU-GLU-VAL-LYS-LYS-GLU-SER-THR-LEU-LYS-SER-VAL-LEU-SER-ALA-LEU-TRP-ASN-LEU-SER-ALA-HIS-CYS-THR-GLU-ASN-LYS-ALA-ASP-ILE-CYS-ALA-VAL-ASP-GLY-ALA-LEU-ALA-PHE-LEU-VAL-GLY-THR-LEU-THR-TYR-ARG-SER-GLN-THR-ASN-THR-LEU-ALA-ILE-ILE-GLU-SER-GLY-GLY-GLY-ILE-LEU-ARG-ASN-VAL-SER-SER-LEU-ILE-ALA-THR-ASN-GLU-ASP-HIS-ARG-GLN-ILE-LEU-ARG-GLU-ASN-ASN-CYS-LEU-GLN-THR-LEU-LEU-GLN-HIS-LEU-LYS-SER-HIS-SER-LEU-THR-ILE-VAL-SER-ASN-ALA-CYS-GLY-THR-LEU-TRP-ASN-LEU-SER-ALA-ARG-ASN-PRO-LYS-ASP-GLN-GLU-ALA-LEU-TRP-ASP-MET-GLY-ALA-VAL-SER-MET-LEU-LYS-ASN-LEU-ILE-HIS-SER-LYS-HIS-LYS-MET-ILE-ALA-MET-GLY-SER-ALA-ALA-ALA-LEU-ARG-ASN-LEU-MET-ALA-ASN-ARG-PRO-ALA-LYS-TYR-LYS-ASP-ALA-ASN-ILE-MET-SER-PRO-GLY-SER-SER-LEU-PRO-SER,LEU-THR-GLY-CYS-GLY-ASP-ILE-ILE-ALA-GLU-GLN,354,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)C)[C@H](CC)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(C)C)[NH3+])CS)C,Kd=14.4uM,4.841638,4.84,1,A,A,1,A,A,0,,B,A,,1,1,354,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC,0.9509673714637756,0.840750515460968,85.93898010253906,85.24213409423828,0.3716006577014923,0.638130247592926,0.9099576473236084,0.8834232687950134,0.9184116125106812,0.805364727973938,LTGCGDIIAEQ,Low,"(4.745, 4.866]",train
4YK6,protein-peptide,Q5JTC6 P25054,MGHHHHHHMLHLLEQIRAYCETCWEWQEAHEPGMDQDKNPMPAPVEHQICPAVCVLMKLSFDEEHRHAMNELGGLQAIAELLQVDCEMYGLTNDHYSITLRRYAGMALTNLTFGDVANKATLCSMKGCMRALVAQLKSESEDLQQVIASVLRNLSWRADVNSKKTLREVGSVKALMECALEVKKESTLKSVLSALWNLSAHCTENKADICAVDGALAFLVGTLTYRSQTNTLAIIESGGGILRNVSSLIATNEDHRQILRENNCLQTLLQHLKSHSLTIVSNACGTLWNLSARNPKDQEALWDMGAVSMLKNLIHSKHKMIAMGSAAALRNLMANRPAKYKDANIMSPGSSLPS,YQGGGEEMALP,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-HIS-LEU-LEU-GLU-GLN-ILE-ARG-ALA-TYR-CYS-GLU-THR-CYS-TRP-GLU-TRP-GLN-GLU-ALA-HIS-GLU-PRO-GLY-MET-ASP-GLN-ASP-LYS-ASN-PRO-MET-PRO-ALA-PRO-VAL-GLU-HIS-GLN-ILE-CYS-PRO-ALA-VAL-CYS-VAL-LEU-MET-LYS-LEU-SER-PHE-ASP-GLU-GLU-HIS-ARG-HIS-ALA-MET-ASN-GLU-LEU-GLY-GLY-LEU-GLN-ALA-ILE-ALA-GLU-LEU-LEU-GLN-VAL-ASP-CYS-GLU-MET-TYR-GLY-LEU-THR-ASN-ASP-HIS-TYR-SER-ILE-THR-LEU-ARG-ARG-TYR-ALA-GLY-MET-ALA-LEU-THR-ASN-LEU-THR-PHE-GLY-ASP-VAL-ALA-ASN-LYS-ALA-THR-LEU-CYS-SER-MET-LYS-GLY-CYS-MET-ARG-ALA-LEU-VAL-ALA-GLN-LEU-LYS-SER-GLU-SER-GLU-ASP-LEU-GLN-GLN-VAL-ILE-ALA-SER-VAL-LEU-ARG-ASN-LEU-SER-TRP-ARG-ALA-ASP-VAL-ASN-SER-LYS-LYS-THR-LEU-ARG-GLU-VAL-GLY-SER-VAL-LYS-ALA-LEU-MET-GLU-CYS-ALA-LEU-GLU-VAL-LYS-LYS-GLU-SER-THR-LEU-LYS-SER-VAL-LEU-SER-ALA-LEU-TRP-ASN-LEU-SER-ALA-HIS-CYS-THR-GLU-ASN-LYS-ALA-ASP-ILE-CYS-ALA-VAL-ASP-GLY-ALA-LEU-ALA-PHE-LEU-VAL-GLY-THR-LEU-THR-TYR-ARG-SER-GLN-THR-ASN-THR-LEU-ALA-ILE-ILE-GLU-SER-GLY-GLY-GLY-ILE-LEU-ARG-ASN-VAL-SER-SER-LEU-ILE-ALA-THR-ASN-GLU-ASP-HIS-ARG-GLN-ILE-LEU-ARG-GLU-ASN-ASN-CYS-LEU-GLN-THR-LEU-LEU-GLN-HIS-LEU-LYS-SER-HIS-SER-LEU-THR-ILE-VAL-SER-ASN-ALA-CYS-GLY-THR-LEU-TRP-ASN-LEU-SER-ALA-ARG-ASN-PRO-LYS-ASP-GLN-GLU-ALA-LEU-TRP-ASP-MET-GLY-ALA-VAL-SER-MET-LEU-LYS-ASN-LEU-ILE-HIS-SER-LYS-HIS-LYS-MET-ILE-ALA-MET-GLY-SER-ALA-ALA-ALA-LEU-ARG-ASN-LEU-MET-ALA-ASN-ARG-PRO-ALA-LYS-TYR-LYS-ASP-ALA-ASN-ILE-MET-SER-PRO-GLY-SER-SER-LEU-PRO-SER,TYR-GLN-GLY-GLY-GLY-GLU-GLU-MET-ALA-LEU-PRO,354,11,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCC(=O)N)CCC(=O)O)CCC(=O)O,Kd=2.0uM,5.69897,5.7,1,A,A,1,A,A,0,,B,A,,1,1,354,11,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O,0.8464845418930054,0.8739115595817566,85.23712158203125,85.904052734375,0.4130711555480957,0.5612260699272156,0.8980252742767334,0.8962460160255432,0.7907910943031311,0.843610405921936,YQGGGEEMALP,Low,"(5.6, 5.699]",train
4YM4,protein-peptide,Q96CG3,EETVTCLQMTVYHPGQLQCGIFQSISFNREKLPSSEVVKFGRNSNICHYTFQDKQVSRVQFSLQLFKKFNSSVLSFEIKNMSKKTNLIVDSRELGYLNKMDLPYRCMVRFGEYQFLMEKEDGESLEFFETQFILSPRSLLQ,MTSFEDADTEET,GLU-GLU-THR-VAL-THR-CYS-LEU-GLN-MSE-THR-VAL-TYR-HIS-PRO-GLY-GLN-LEU-GLN-CYS-GLY-ILE-PHE-GLN-SER-ILE-SER-PHE-ASN-ARG-GLU-LYS-LEU-PRO-SER-SER-GLU-VAL-VAL-LYS-PHE-GLY-ARG-ASN-SER-ASN-ILE-CYS-HIS-TYR-THR-PHE-GLN-ASP-LYS-GLN-VAL-SER-ARG-VAL-GLN-PHE-SER-LEU-GLN-LEU-PHE-LYS-LYS-PHE-ASN-SER-SER-VAL-LEU-SER-PHE-GLU-ILE-LYS-ASN-MSE-SER-LYS-LYS-THR-ASN-LEU-ILE-VAL-ASP-SER-ARG-GLU-LEU-GLY-TYR-LEU-ASN-LYS-MSE-ASP-LEU-PRO-TYR-ARG-CYS-MSE-VAL-ARG-PHE-GLY-GLU-TYR-GLN-PHE-LEU-MSE-GLU-LYS-GLU-ASP-GLY-GLU-SER-LEU-GLU-PHE-PHE-GLU-THR-GLN-PHE-ILE-LEU-SER-PRO-ARG-SER-LEU-LEU-GLN,MET-THR-SER-PHE-GLU-ASP-ALA-ASP-TPO-GLU-GLU-THR,141,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)O)CCC(=O)O)CC(=O)O)C)CC(=O)O)CCC(=O)O)Cc1ccccc1)CO)[C@H](O)C)[NH3+],Kd=33.6uM,4.473661,4.47,1,A,A,1,A,A,0,,B,A,,1,1,141,12,0,CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.6491077542304993,0.7986646294593811,81.98207092285156,92.38023376464844,0.5954015254974365,0.6968048810958862,0.8311506509780884,0.8696040511131287,0.5545774102210999,0.7809297442436218,MTSFEDADTEET,Low,"(4.456, 4.606]",train
4YNL,protein-peptide,O52748 P27709,MGHHHHHHMDDQERTYIMVEDTARYFRMMKDWAEKRPNAMRALEELDVPPERWDEAMQELDEIIRTWADKYHQVGGIPMILQMVFGRKED,ERGSGR,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-ASP-ASP-GLN-GLU-ARG-THR-TYR-ILE-MET-VAL-GLU-ASP-THR-ALA-ARG-TYR-PHE-ARG-MET-MET-LYS-ASP-TRP-ALA-GLU-LYS-ARG-PRO-ASN-ALA-MET-ARG-ALA-LEU-GLU-GLU-LEU-ASP-VAL-PRO-PRO-GLU-ARG-TRP-ASP-GLU-ALA-MET-GLN-GLU-LEU-ASP-GLU-ILE-ILE-ARG-THR-TRP-ALA-ASP-LYS-TYR-HIS-GLN-VAL-GLY-GLY-ILE-PRO-MET-ILE-LEU-GLN-MET-VAL-PHE-GLY-ARG-LYS-GLU-ASP,GLU-ARG-GLY-SER-GLY-ARG,90,6,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC[NH+]=C(N)N,Kd=24uM,4.619789,4.62,1,A,A,1,A,A,0,,C,A,dimer,0,1,90,6,0,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8050557971000671,0.683473527431488,71.0297622680664,76.20619201660156,0.6190589070320129,0.903654396533966,0.703472912311554,0.706687867641449,0.706753671169281,0.6082254648208618,ERGSGR,Low,"(4.606, 4.745]",val
4YOZ,protein-peptide,P03129 P28749,GEFTQSVSRLQSIVAGLKNAPSDQLINIFESCVRNPVENIMKILKGIGETFCQHYTQSTDEQPGSHIDFAVNRLKLAEILYYKILETVMVQETRRLHGMDMSVLLEQDIFHRSLMACCLEIVLFAYSSPRTFPWIIEVLNLQPFYFYKVIEVVIRSEEGLSRDMVKHLNSIEEQILESLAWSHDSALWEALQVSANKVPTCEEVIFPNNFETGNNRPKRTGSLALFYRKVYHLASVRLRDLCLKLDVSNELRRKIWTCFEFTLVHCPDLMKDRHLDQLLLCAFYIMAKVTKEERTFQEIMKSYRNQPQANSHVYRSVLLKSIKEERGDLIKFYNTIYVGRVKSFALKYDLANQDHMMDAPPLSPFPHIKQQ,DLYCYEQLN,GLY-GLU-PHE-THR-GLN-SER-VAL-SER-ARG-LEU-GLN-SER-ILE-VAL-ALA-GLY-LEU-LYS-ASN-ALA-PRO-SER-ASP-GLN-LEU-ILE-ASN-ILE-PHE-GLU-SER-CYS-VAL-ARG-ASN-PRO-VAL-GLU-ASN-ILE-MET-LYS-ILE-LEU-LYS-GLY-ILE-GLY-GLU-THR-PHE-CYS-GLN-HIS-TYR-THR-GLN-SER-THR-ASP-GLU-GLN-PRO-GLY-SER-HIS-ILE-ASP-PHE-ALA-VAL-ASN-ARG-LEU-LYS-LEU-ALA-GLU-ILE-LEU-TYR-TYR-LYS-ILE-LEU-GLU-THR-VAL-MET-VAL-GLN-GLU-THR-ARG-ARG-LEU-HIS-GLY-MET-ASP-MET-SER-VAL-LEU-LEU-GLU-GLN-ASP-ILE-PHE-HIS-ARG-SER-LEU-MET-ALA-CYS-CYS-LEU-GLU-ILE-VAL-LEU-PHE-ALA-TYR-SER-SER-PRO-ARG-THR-PHE-PRO-TRP-ILE-ILE-GLU-VAL-LEU-ASN-LEU-GLN-PRO-PHE-TYR-PHE-TYR-LYS-VAL-ILE-GLU-VAL-VAL-ILE-ARG-SER-GLU-GLU-GLY-LEU-SER-ARG-ASP-MET-VAL-LYS-HIS-LEU-ASN-SER-ILE-GLU-GLU-GLN-ILE-LEU-GLU-SER-LEU-ALA-TRP-SER-HIS-ASP-SER-ALA-LEU-TRP-GLU-ALA-LEU-GLN-VAL-SER-ALA-ASN-LYS-VAL-PRO-THR-CYS-GLU-GLU-VAL-ILE-PHE-PRO-ASN-ASN-PHE-GLU-THR-GLY-ASN-ASN-ARG-PRO-LYS-ARG-THR-GLY-SER-LEU-ALA-LEU-PHE-TYR-ARG-LYS-VAL-TYR-HIS-LEU-ALA-SER-VAL-ARG-LEU-ARG-ASP-LEU-CYS-LEU-LYS-LEU-ASP-VAL-SER-ASN-GLU-LEU-ARG-ARG-LYS-ILE-TRP-THR-CYS-PHE-GLU-PHE-THR-LEU-VAL-HIS-CYS-PRO-ASP-LEU-MET-LYS-ASP-ARG-HIS-LEU-ASP-GLN-LEU-LEU-LEU-CYS-ALA-PHE-TYR-ILE-MET-ALA-LYS-VAL-THR-LYS-GLU-GLU-ARG-THR-PHE-GLN-GLU-ILE-MET-LYS-SER-TYR-ARG-ASN-GLN-PRO-GLN-ALA-ASN-SER-HIS-VAL-TYR-ARG-SER-VAL-LEU-LEU-LYS-SER-ILE-LYS-GLU-GLU-ARG-GLY-ASP-LEU-ILE-LYS-PHE-TYR-ASN-THR-ILE-TYR-VAL-GLY-ARG-VAL-LYS-SER-PHE-ALA-LEU-LYS-TYR-ASP-LEU-ALA-ASN-GLN-ASP-HIS-MET-MET-ASP-ALA-PRO-PRO-LEU-SER-PRO-PHE-PRO-HIS-ILE-LYS-GLN-GLN,ASP-LEU-TYR-CYS-TYR-GLU-GLN-LEU-ASN,371,9,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(C)C)CCC(=O)N)CCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(C)C)Cc1ccc(cc1)O,Kd=0.16uM,6.79588,6.8,1,A,A,1,A,A,0,,B,A,,1,1,371,9,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9284254908561708,0.7965798377990723,84.08595275878906,80.44324493408203,0.4790235757827759,0.7748423218727112,0.8916529417037964,0.8700332045555115,0.9162369966506958,0.7782164812088013,DLYCYEQLN,Low,"(6.696, 6.824]",val
4YSI,protein-peptide,F5HF68 Q93009,TSWRSEATFQFTVERFSRLSESVLSPPCFVRNLPWKIMVMPRFYPDRPHQKSVGFFLQCNAESDSTSWSCHAQAVLKIINYRDDEKSFSRRISHLFFHKENDWGFSNFMAWSEVTDPEKGFIDDDKVTFEVFVQADAPHGVAW,SPGEGPSG,THR-SER-TRP-ARG-SER-GLU-ALA-THR-PHE-GLN-PHE-THR-VAL-GLU-ARG-PHE-SER-ARG-LEU-SER-GLU-SER-VAL-LEU-SER-PRO-PRO-CYS-PHE-VAL-ARG-ASN-LEU-PRO-TRP-LYS-ILE-MET-VAL-MET-PRO-ARG-PHE-TYR-PRO-ASP-ARG-PRO-HIS-GLN-LYS-SER-VAL-GLY-PHE-PHE-LEU-GLN-CYS-ASN-ALA-GLU-SER-ASP-SER-THR-SER-TRP-SER-CYS-HIS-ALA-GLN-ALA-VAL-LEU-LYS-ILE-ILE-ASN-TYR-ARG-ASP-ASP-GLU-LYS-SER-PHE-SER-ARG-ARG-ILE-SER-HIS-LEU-PHE-PHE-HIS-LYS-GLU-ASN-ASP-TRP-GLY-PHE-SER-ASN-PHE-MET-ALA-TRP-SER-GLU-VAL-THR-ASP-PRO-GLU-LYS-GLY-PHE-ILE-ASP-ASP-ASP-LYS-VAL-THR-PHE-GLU-VAL-PHE-VAL-GLN-ALA-ASP-ALA-PRO-HIS-GLY-VAL-ALA-TRP,SER-PRO-GLY-GLU-GLY-PRO-SER-GLY,143,8,OC[C@@H](C(=O)NCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)[NH3+])CCC(=O)O,Kd=2.0uM,5.69897,5.7,1,A,A,1,A,A,0,,B,A,,1,1,143,8,0,N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)NCC(=O)O,O=C(O)CNC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1,O=C(O)CNC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1,0.9290591478347778,0.8232115507125854,96.64824676513672,93.98312377929688,0.3161793649196625,0.5397969484329224,0.9439108967781068,0.9019700884819032,0.8922336101531982,0.8035219311714172,SPGEGPSG,Low,"(5.6, 5.699]",train
4YYI,protein-peptide,Q9H8M2 P62805,GSAENESTPIQQLLEHFLRQLQRKDPHGFFAFPVTDAIAPGYSMIIKHPMDFGTMKDKIVANEYKSVTEFKADFKLMCDNAMTYNRPDTVYYKLAKKILHAGFKMMSK,SGRGKGGKGLG,GLY-SER-ALA-GLU-ASN-GLU-SER-THR-PRO-ILE-GLN-GLN-LEU-LEU-GLU-HIS-PHE-LEU-ARG-GLN-LEU-GLN-ARG-LYS-ASP-PRO-HIS-GLY-PHE-PHE-ALA-PHE-PRO-VAL-THR-ASP-ALA-ILE-ALA-PRO-GLY-TYR-SER-MET-ILE-ILE-LYS-HIS-PRO-MET-ASP-PHE-GLY-THR-MET-LYS-ASP-LYS-ILE-VAL-ALA-ASN-GLU-TYR-LYS-SER-VAL-THR-GLU-PHE-LYS-ALA-ASP-PHE-LYS-LEU-MET-CYS-ASP-ASN-ALA-MET-THR-TYR-ASN-ARG-PRO-ASP-THR-VAL-TYR-TYR-LYS-LEU-ALA-LYS-LYS-ILE-LEU-HIS-ALA-GLY-PHE-LYS-MET-MET-SER-LYS,SER-GLY-ARG-GLY-ALY-GLY-GLY-ALY-GLY-LEU-GLY,108,11,[NH3+]CC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)O)CCCCNC(=O)C)CCCCNC(=O)C,Kd=64uM,4.19382,4.19,1,A,A,1,A,A,0,,C,A,dimer,1,1,108,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.921076476573944,0.6072499752044678,93.3855972290039,93.99005126953124,0.3241735398769378,0.960323691368103,0.9326698780059814,0.7870840430259705,0.8604049682617188,0.5565044283866882,SGRGKGGKGLG,Low,"(4.155, 4.319]",train
4Z0U,protein-peptide,P0A7Y4 P0AGE0,MLKQVEIFTDGSCLGNPGPGGYGAILRYRGREKTFSAGYTRTTNNRMELMAAIVALEALKEHCEVILSTDSQYVRQGITQWIHNWKKRGWKTADKKPVKNVDLWQRLDAALGQHQIKWEWVKGHAGHPENERCDELARAAAMNPTLEDTGYQVEV,WMDFDDDIPF,MET-LEU-LYS-GLN-VAL-GLU-ILE-PHE-THR-ASP-GLY-SER-CYS-LEU-GLY-ASN-PRO-GLY-PRO-GLY-GLY-TYR-GLY-ALA-ILE-LEU-ARG-TYR-ARG-GLY-ARG-GLU-LYS-THR-PHE-SER-ALA-GLY-TYR-THR-ARG-THR-THR-ASN-ASN-ARG-MET-GLU-LEU-MET-ALA-ALA-ILE-VAL-ALA-LEU-GLU-ALA-LEU-LYS-GLU-HIS-CYS-GLU-VAL-ILE-LEU-SER-THR-ASP-SER-GLN-TYR-VAL-ARG-GLN-GLY-ILE-THR-GLN-TRP-ILE-HIS-ASN-TRP-LYS-LYS-ARG-GLY-TRP-LYS-THR-ALA-ASP-LYS-LYS-PRO-VAL-LYS-ASN-VAL-ASP-LEU-TRP-GLN-ARG-LEU-ASP-ALA-ALA-LEU-GLY-GLN-HIS-GLN-ILE-LYS-TRP-GLU-TRP-VAL-LYS-GLY-HIS-ALA-GLY-HIS-PRO-GLU-ASN-GLU-ARG-CYS-ASP-GLU-LEU-ALA-ARG-ALA-ALA-ALA-MET-ASN-PRO-THR-LEU-GLU-ASP-THR-GLY-TYR-GLN-VAL-GLU-VAL,TRP-MET-ASP-PHE-ASP-ASP-ASP-ILE-PRO-PHE,155,10,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=2.0uM,5.69897,5.7,1,A,A,1,A,A,0,,D,A,,1,1,155,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.8935539722442627,0.6872599124908447,96.06977081298828,92.59912109375,0.3460772931575775,0.9534960985183716,0.9184921979904176,0.8277541995048523,0.8494405746459961,0.6521363258361816,WMDFDDDIPF,Low,"(5.6, 5.699]",train
4Z2O,protein-peptide,A9D857,FADDHAMSPDMKLLAGASNWVNQSGSVAQFVFTPSPTQPQTYEVSGNYINNAQGTGCKGTPYPLSGAYYSGNQIISFSVVWSNASANCQSATGWTGYFDFSGSQAVLKTDWNLAFYSGSTPAIQQGQDDFMQSV,SVATVSESLLTE,PHE-ALA-ASP-ASP-HIS-ALA-MET-SER-PRO-ASP-MET-LYS-LEU-LEU-ALA-GLY-ALA-SER-ASN-TRP-VAL-ASN-GLN-SER-GLY-SER-VAL-ALA-GLN-PHE-VAL-PHE-THR-PRO-SER-PRO-THR-GLN-PRO-GLN-THR-TYR-GLU-VAL-SER-GLY-ASN-TYR-ILE-ASN-ASN-ALA-GLN-GLY-THR-GLY-CYS-LYS-GLY-THR-PRO-TYR-PRO-LEU-SER-GLY-ALA-TYR-TYR-SER-GLY-ASN-GLN-ILE-ILE-SER-PHE-SER-VAL-VAL-TRP-SER-ASN-ALA-SER-ALA-ASN-CYS-GLN-SER-ALA-THR-GLY-TRP-THR-GLY-TYR-PHE-ASP-PHE-SER-GLY-SER-GLN-ALA-VAL-LEU-LYS-THR-ASP-TRP-ASN-LEU-ALA-PHE-TYR-SER-GLY-SER-THR-PRO-ALA-ILE-GLN-GLN-GLY-GLN-ASP-ASP-PHE-MET-GLN-SER-VAL,SER-VAL-ALA-THR-VAL-SER-GLU-SER-LEU-LEU-THR-GLU,134,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](O)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])C)CO)CCC(=O)O,Kd=31uM,4.508638,4.51,1,A,A,1,A,A,0,,P,A,,1,1,134,12,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O,0.4859580099582672,0.7792345881462097,54.06607055664063,60.75810623168945,1.2311848402023315,0.8875694870948792,0.6261979937553406,0.7371293306350708,0.3995281755924225,0.7337906956672668,SVATVSESLLTE,Low,"(4.456, 4.606]",train
4Z2P,protein-peptide,A9D857,FADDHAMSPDMKLLAGASNWVNQSGSVAQFVFTPSPTQPQTYEVSGNYINNAQGTGCKGTPYPLSGAYYSGNQIISFSVVWSNASANCQSATGWTGYFDFSGSQAVLKTDWNLAFYSGSTPAIQQGQDDFMQSV,SVATVSESFLTE,PHE-ALA-ASP-ASP-HIS-ALA-MET-SER-PRO-ASP-MET-LYS-LEU-LEU-ALA-GLY-ALA-SER-ASN-TRP-VAL-ASN-GLN-SER-GLY-SER-VAL-ALA-GLN-PHE-VAL-PHE-THR-PRO-SER-PRO-THR-GLN-PRO-GLN-THR-TYR-GLU-VAL-SER-GLY-ASN-TYR-ILE-ASN-ASN-ALA-GLN-GLY-THR-GLY-CYS-LYS-GLY-THR-PRO-TYR-PRO-LEU-SER-GLY-ALA-TYR-TYR-SER-GLY-ASN-GLN-ILE-ILE-SER-PHE-SER-VAL-VAL-TRP-SER-ASN-ALA-SER-ALA-ASN-CYS-GLN-SER-ALA-THR-GLY-TRP-THR-GLY-TYR-PHE-ASP-PHE-SER-GLY-SER-GLN-ALA-VAL-LEU-LYS-THR-ASP-TRP-ASN-LEU-ALA-PHE-TYR-SER-GLY-SER-THR-PRO-ALA-ILE-GLN-GLN-GLY-GLN-ASP-ASP-PHE-MET-GLN-SER-VAL,SER-VAL-ALA-THR-VAL-SER-GLU-SER-PHE-LEU-THR-GLU,134,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](O)C)CC(C)C)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])C)CO)CCC(=O)O,Kd=25uM,4.60206,4.6,1,A,A,1,A,A,0,,C,A,,0,1,134,12,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O,0.5031879544258118,0.7815449833869934,49.16255569458008,62.561336517333984,1.2291287183761597,0.8950601816177368,0.6246077418327332,0.7374196648597717,0.3914973735809326,0.7319419980049133,SVATVSESFLTE,Low,"(4.456, 4.606]",val
4Z5W,protein-peptide,P58261 Q8LPB4,SQNLTCNSNDLKALEGFMRGLESSIDGWKWNESSSFSSNCCDWVGISCKSSVSLGLDDVNESGRVVELELGRRKLSGKLSESVAKLDQLKVLNLTHNSLSGSIAASLLNLSNLEVLDLSSNDFSGLFPSLINLPSLRVLNVYENSFHGLIPASLCNNLPRIREIDLAMNYFDGSIPVGIGNCSSVEYLGLASNNLSGSIPQELFQLSNLSVLALQNNRLSGALSSKLGKLSNLGRLDISSNKFSGKIPDVFLELNKLWYFSAQSNLFNGEMPRSLSNSRSISLLSLRNNTLSGQIYLNCSAMTNLTSLDLASNSFSGSIPSNLPNCLRLKTINFAKIKFIAQIPESFKNFQSLTSLSFSNSSIQNISSALEILQHCQNLKTLVLTLNFQKEELPSVPSLQFKNLKVLIIASCQLRGTVPQWLSNSPSLQLLDLSWNQLSGTIPPWLGSLNSLFYLDLSNNTFIGEIPHSLTSLQSLVSKENAVEEPSPDFPFFKKKNTNAGGLQYNQPSSFPPMIDLSYNSLNGSIWPEFGDLRQLHVLNLKNNNLSGNIPANLSGMTSLEVLDLSHNNLSGNIPPSLVKLSFLSTFSVAYNKLSGPIPTGVQFQTFPNSSFEGNQGLCGEHASPCHITDQSPHGSHHHHHH,YIYTQ,SER-GLN-ASN-LEU-THR-CYS-ASN-SER-ASN-ASP-LEU-LYS-ALA-LEU-GLU-GLY-PHE-MET-ARG-GLY-LEU-GLU-SER-SER-ILE-ASP-GLY-TRP-LYS-TRP-ASN-GLU-SER-SER-SER-PHE-SER-SER-ASN-CYS-CYS-ASP-TRP-VAL-GLY-ILE-SER-CYS-LYS-SER-SER-VAL-SER-LEU-GLY-LEU-ASP-ASP-VAL-ASN-GLU-SER-GLY-ARG-VAL-VAL-GLU-LEU-GLU-LEU-GLY-ARG-ARG-LYS-LEU-SER-GLY-LYS-LEU-SER-GLU-SER-VAL-ALA-LYS-LEU-ASP-GLN-LEU-LYS-VAL-LEU-ASN-LEU-THR-HIS-ASN-SER-LEU-SER-GLY-SER-ILE-ALA-ALA-SER-LEU-LEU-ASN-LEU-SER-ASN-LEU-GLU-VAL-LEU-ASP-LEU-SER-SER-ASN-ASP-PHE-SER-GLY-LEU-PHE-PRO-SER-LEU-ILE-ASN-LEU-PRO-SER-LEU-ARG-VAL-LEU-ASN-VAL-TYR-GLU-ASN-SER-PHE-HIS-GLY-LEU-ILE-PRO-ALA-SER-LEU-CYS-ASN-ASN-LEU-PRO-ARG-ILE-ARG-GLU-ILE-ASP-LEU-ALA-MET-ASN-TYR-PHE-ASP-GLY-SER-ILE-PRO-VAL-GLY-ILE-GLY-ASN-CYS-SER-SER-VAL-GLU-TYR-LEU-GLY-LEU-ALA-SER-ASN-ASN-LEU-SER-GLY-SER-ILE-PRO-GLN-GLU-LEU-PHE-GLN-LEU-SER-ASN-LEU-SER-VAL-LEU-ALA-LEU-GLN-ASN-ASN-ARG-LEU-SER-GLY-ALA-LEU-SER-SER-LYS-LEU-GLY-LYS-LEU-SER-ASN-LEU-GLY-ARG-LEU-ASP-ILE-SER-SER-ASN-LYS-PHE-SER-GLY-LYS-ILE-PRO-ASP-VAL-PHE-LEU-GLU-LEU-ASN-LYS-LEU-TRP-TYR-PHE-SER-ALA-GLN-SER-ASN-LEU-PHE-ASN-GLY-GLU-MET-PRO-ARG-SER-LEU-SER-ASN-SER-ARG-SER-ILE-SER-LEU-LEU-SER-LEU-ARG-ASN-ASN-THR-LEU-SER-GLY-GLN-ILE-TYR-LEU-ASN-CYS-SER-ALA-MET-THR-ASN-LEU-THR-SER-LEU-ASP-LEU-ALA-SER-ASN-SER-PHE-SER-GLY-SER-ILE-PRO-SER-ASN-LEU-PRO-ASN-CYS-LEU-ARG-LEU-LYS-THR-ILE-ASN-PHE-ALA-LYS-ILE-LYS-PHE-ILE-ALA-GLN-ILE-PRO-GLU-SER-PHE-LYS-ASN-PHE-GLN-SER-LEU-THR-SER-LEU-SER-PHE-SER-ASN-SER-SER-ILE-GLN-ASN-ILE-SER-SER-ALA-LEU-GLU-ILE-LEU-GLN-HIS-CYS-GLN-ASN-LEU-LYS-THR-LEU-VAL-LEU-THR-LEU-ASN-PHE-GLN-LYS-GLU-GLU-LEU-PRO-SER-VAL-PRO-SER-LEU-GLN-PHE-LYS-ASN-LEU-LYS-VAL-LEU-ILE-ILE-ALA-SER-CYS-GLN-LEU-ARG-GLY-THR-VAL-PRO-GLN-TRP-LEU-SER-ASN-SER-PRO-SER-LEU-GLN-LEU-LEU-ASP-LEU-SER-TRP-ASN-GLN-LEU-SER-GLY-THR-ILE-PRO-PRO-TRP-LEU-GLY-SER-LEU-ASN-SER-LEU-PHE-TYR-LEU-ASP-LEU-SER-ASN-ASN-THR-PHE-ILE-GLY-GLU-ILE-PRO-HIS-SER-LEU-THR-SER-LEU-GLN-SER-LEU-VAL-SER-LYS-GLU-ASN-ALA-VAL-GLU-GLU-PRO-SER-PRO-ASP-PHE-PRO-PHE-PHE-LYS-LYS-LYS-ASN-THR-ASN-ALA-GLY-GLY-LEU-GLN-TYR-ASN-GLN-PRO-SER-SER-PHE-PRO-PRO-MET-ILE-ASP-LEU-SER-TYR-ASN-SER-LEU-ASN-GLY-SER-ILE-TRP-PRO-GLU-PHE-GLY-ASP-LEU-ARG-GLN-LEU-HIS-VAL-LEU-ASN-LEU-LYS-ASN-ASN-ASN-LEU-SER-GLY-ASN-ILE-PRO-ALA-ASN-LEU-SER-GLY-MET-THR-SER-LEU-GLU-VAL-LEU-ASP-LEU-SER-HIS-ASN-ASN-LEU-SER-GLY-ASN-ILE-PRO-PRO-SER-LEU-VAL-LYS-LEU-SER-PHE-LEU-SER-THR-PHE-SER-VAL-ALA-TYR-ASN-LYS-LEU-SER-GLY-PRO-ILE-PRO-THR-GLY-VAL-GLN-PHE-GLN-THR-PHE-PRO-ASN-SER-SER-PHE-GLU-GLY-ASN-GLN-GLY-LEU-CYS-GLY-GLU-HIS-ALA-SER-PRO-CYS-HIS-ILE-THR-ASP-GLN-SER-PRO-HIS-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS,TYS-ILE-TYS-THR-GLN,642,5,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)[C@H](O)C)Cc1ccc(cc1)OS(O)(O)O)NC(=O)[C@H](Cc1ccc(cc1)OS(O)(O)O)[NH3+])C,Kd=1.55uM,5.809668,5.81,1,A,A,1,A,A,0,,P,A,,0,1,642,5,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)O,0.6333938837051392,0.9156412482261658,68.27035522460938,70.6124267578125,0.5752351880073547,0.5759370923042297,0.8220358490943909,0.8486599922180176,0.5640154480934143,0.9148631691932678,YIYTQ,Low,"(5.699, 5.821]",val
4Z68,protein-peptide,Q7Z6K5 Q9H2K2,SEADRQLLEAAKAGDVETVKKLCTVQSVNCRDIEGRQSTPLHFAAGYNRVSVVEYLLQHGADVHAKDKGGLVPLHNACSYGHYEVAELLVKHGAVVNVADLWKFTPLHEAAAKGKYEICKLLLQHGADPTKKNRDGNTPLDLVKDGDTDIQDLLR,EIREQGDGAEDE,SER-GLU-ALA-ASP-ARG-GLN-LEU-LEU-GLU-ALA-ALA-LYS-ALA-GLY-ASP-VAL-GLU-THR-VAL-LYS-LYS-LEU-CYS-THR-VAL-GLN-SER-VAL-ASN-CYS-ARG-ASP-ILE-GLU-GLY-ARG-GLN-SER-THR-PRO-LEU-HIS-PHE-ALA-ALA-GLY-TYR-ASN-ARG-VAL-SER-VAL-VAL-GLU-TYR-LEU-LEU-GLN-HIS-GLY-ALA-ASP-VAL-HIS-ALA-LYS-ASP-LYS-GLY-GLY-LEU-VAL-PRO-LEU-HIS-ASN-ALA-CYS-SER-TYR-GLY-HIS-TYR-GLU-VAL-ALA-GLU-LEU-LEU-VAL-LYS-HIS-GLY-ALA-VAL-VAL-ASN-VAL-ALA-ASP-LEU-TRP-LYS-PHE-THR-PRO-LEU-HIS-GLU-ALA-ALA-ALA-LYS-GLY-LYS-TYR-GLU-ILE-CYS-LYS-LEU-LEU-LEU-GLN-HIS-GLY-ALA-ASP-PRO-THR-LYS-LYS-ASN-ARG-ASP-GLY-ASN-THR-PRO-LEU-ASP-LEU-VAL-LYS-ASP-GLY-ASP-THR-ASP-ILE-GLN-ASP-LEU-LEU-ARG,GLU-ILE-ARG-GLU-GLN-GLY-ASP-GLY-ALA-GLU-ASP-GLU,155,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)O)C)CC(=O)O)CCC(=O)N)CCC(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@H](CCC(=O)O)[NH3+])C,Kd=0.32uM,6.49485,6.49,1,A,A,1,A,A,0,,E,A,,1,1,155,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.972925901412964,0.834991455078125,97.2868194580078,95.46144104003906,0.284038245677948,0.5951894521713257,0.9566911458969116,0.9085022211074828,0.9320743680000304,0.8166137337684631,EIREQGDGAEDE,Low,"(6.398, 6.523]",train
4Z8A,protein-peptide,P91645 A0A0B4JDC9,GPLGSPEFNRPVKRMIALYDYDPQELSPNVDAEQVELCFKTGEIILVYGDMDEDGFYMGELDGVRGLVPSNFLAD,IGRRLPPTPSKPSTL,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-ASN-ARG-PRO-VAL-LYS-ARG-MET-ILE-ALA-LEU-TYR-ASP-TYR-ASP-PRO-GLN-GLU-LEU-SER-PRO-ASN-VAL-ASP-ALA-GLU-GLN-VAL-GLU-LEU-CYS-PHE-LYS-THR-GLY-GLU-ILE-ILE-LEU-VAL-TYR-GLY-ASP-MET-ASP-GLU-ASP-GLY-PHE-TYR-MET-GLY-GLU-LEU-ASP-GLY-VAL-ARG-GLY-LEU-VAL-PRO-SER-ASN-PHE-LEU-ALA-ASP,ACE-ILE-GLY-ARG-ARG-LEU-PRO-PRO-THR-PRO-SER-LYS-PRO-SER-THR-LEU-NH2,75,17,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)[C@H](O)C)CO)CCCC[NH3+])NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](CC)C)NC(=O)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CC(C)C,Kd=17.3uM,4.761954,4.76,1,A,A,1,A,A,0,,B,A,,1,1,75,17,0,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O,,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.997270166873932,0.9063861966133118,91.93057250976562,88.71419525146484,0.3247862458229065,0.5832878351211548,0.8763037919998169,0.8521286249160767,0.8469561338424683,0.8116172552108765,IGRRLPPTPSKPSTL,Low,"(4.745, 4.866]",train
4Z8M,protein-peptide,Q7Z434 Q9Y4K3,MAAQQCNGIYIWKIGNFGMHLKCQEEEKPVVIHSPGFYTGKPGYKLCMRLHLQLPTAQRCANYISLFVHTMQGEYDSHLPWPFQGTIRLTILDQSEAPVRQNHEEIMDAKPELLAFQRPTIPRNPKGFGYVTFMHLEALRQRTFIKDDTLLVRCEVSTRFDLEHHHHHH,GPCHGPEENEYKSEGTFGI,MET-ALA-ALA-GLN-GLN-CYS-ASN-GLY-ILE-TYR-ILE-TRP-LYS-ILE-GLY-ASN-PHE-GLY-MET-HIS-LEU-LYS-CYS-GLN-GLU-GLU-GLU-LYS-PRO-VAL-VAL-ILE-HIS-SER-PRO-GLY-PHE-TYR-THR-GLY-LYS-PRO-GLY-TYR-LYS-LEU-CYS-MET-ARG-LEU-HIS-LEU-GLN-LEU-PRO-THR-ALA-GLN-ARG-CYS-ALA-ASN-TYR-ILE-SER-LEU-PHE-VAL-HIS-THR-MET-GLN-GLY-GLU-TYR-ASP-SER-HIS-LEU-PRO-TRP-PRO-PHE-GLN-GLY-THR-ILE-ARG-LEU-THR-ILE-LEU-ASP-GLN-SER-GLU-ALA-PRO-VAL-ARG-GLN-ASN-HIS-GLU-GLU-ILE-MET-ASP-ALA-LYS-PRO-GLU-LEU-LEU-ALA-PHE-GLN-ARG-PRO-THR-ILE-PRO-ARG-ASN-PRO-LYS-GLY-PHE-GLY-TYR-VAL-THR-PHE-MET-HIS-LEU-GLU-ALA-LEU-ARG-GLN-ARG-THR-PHE-ILE-LYS-ASP-ASP-THR-LEU-LEU-VAL-ARG-CYS-GLU-VAL-SER-THR-ARG-PHE-ASP-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-PRO-CYS-HIS-GLY-PRO-GLU-GLU-ASN-GLU-TYR-LYS-SER-GLU-GLY-THR-PHE-GLY-ILE,169,19,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]([NH3+])C)C)CCC(=O)O)CC(=O)N)CCC(=O)O)Cc1ccc(cc1)O,Kd=36nM,7.443697,7.44,1,A,A,1,A,A,0,,C,A,dimer,1,1,169,19,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)CN)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,0.8248090147972107,0.8773266077041626,85.06637573242188,88.74064636230469,0.481654554605484,0.5756207704544067,0.8819506764411926,0.905128538608551,0.7473586201667786,0.8703761696815491,GPCHGPEENEYKSEGTFGI,Moderate,"(7.268, 7.523]",train
4ZDU,protein-peptide,P03466 P52293,MGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSV,GSASQGTKRSYEQMET,MET-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL,GLY-SER-ALA-SER-GLN-GLY-THR-LYS-ARG-SER-TYR-GLU-GLN-MET-GLU-THR,428,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCSC)CCC(=O)N)CCC(=O)O)Cc1ccc(cc1)O)CO)CCC[NH+]=C(N)N)NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)N,Kd=1.7uM,5.769551,5.77,1,A,A,1,A,A,0,,B,A,,1,1,428,16,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,0.7937506437301636,0.7219072580337524,90.5387191772461,91.95609283447266,0.3891805708408355,0.9163019061088562,0.9093071818351746,0.8751915097236633,0.7423389554023743,0.6835861206054688,GSASQGTKRSYEQMET,Low,"(5.699, 5.821]",val
4ZHL,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAYHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKE,CPAYSRYIGC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU,CYS-PRO-ALA-TYR-SER-ARG-TYR-ILE-GLY-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)[C@H](CC)C)C(=O)O,Kd=0.34uM,6.468521,6.47,1,A,A,1,A,A,0,,P,U,,1,1,247,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,0.9702396392822266,0.8414194583892822,96.19610595703124,95.27400207519533,0.3095720112323761,0.5877174139022827,0.96176016330719,0.926059365272522,0.9480403661727904,0.8202594518661499,CPAYSRYIGC,Low,"(6.398, 6.523]",train
4ZHM,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAYHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKE,CPAYSAYIGC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU,CYS-PRO-ALA-TYR-SER-ALA-TYR-ILE-GLY-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)Cc1ccc(cc1)O)[C@H](CC)C)C(=O)O,Ki=0.009uM,8.045757,8.05,1,A,A,1,A,A,0,,P,U,,1,1,247,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,0.9326542615890504,0.749544084072113,95.04421997070312,94.66146850585938,0.3221172094345093,0.7228900194168091,0.959343194961548,0.9023285508155824,0.9016629457473756,0.7113479971885681,CPAYSAYIGC,Moderate,"(7.921, 8.383]",val
4ZNX,protein-peptide,P06241,VTLFVALYDYEARTEDDLSFHKGEKFQILNSSEGDWWEARSLTTGETGYIPSNYVAPV,APPLPPRNRPRL,VAL-THR-LEU-PHE-VAL-ALA-LEU-TYR-ASP-TYR-GLU-ALA-ARG-THR-GLU-ASP-ASP-LEU-SER-PHE-HIS-LYS-GLY-GLU-LYS-PHE-GLN-ILE-LEU-ASN-SER-SER-GLU-GLY-ASP-TRP-TRP-GLU-ALA-ARG-SER-LEU-THR-THR-GLY-GLU-THR-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-PRO-VAL,ALA-PRO-PRO-LEU-PRO-PRO-ARG-ASN-ARG-PRO-ARG-LEU,58,12,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC[NH+]=C(N)N)CC(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)C,Kd=0.24uM,6.619789,6.62,1,A,A,1,A,A,0,,E,A,dimer,1,1,58,12,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,0.929915964603424,0.8567793369293213,96.3945083618164,91.60932159423828,0.3062921166419983,0.5047587156295776,0.8986924290657043,0.8860148191452026,0.8305790424346924,0.8494704961776733,APPLPPRNRPRL,Low,"(6.523, 6.696]",train
5A2I,protein-peptide,P01727 P01801,QVQLQESGGGLVQPGGSMKLSCVASGFTFSNYWMNWVRQSPEKGLEWVAEIRLKSNNYATHYAESVKGRFTISRDDSKSSVYLQMNNLRAEDTGIYYCTGVGQFAYWGQGTTVTVSASSGGGGSGGGGGSSGSSDIVVTQESALTTSPGETVTLTCRSSTGAVTTSNYANWVQEKPDHLFTGLIGGTNNRAPGVPARFSGSLIGDKAALTITGAQTEDEAIYFCALWYSNHWVFGGGTKLTVLG,APDSRP,GLN-VAL-GLN-LEU-GLN-GLU-SER-GLY-GLY-GLY-LEU-VAL-GLN-PRO-GLY-GLY-SER-MET-LYS-LEU-SER-CYS-VAL-ALA-SER-GLY-PHE-THR-PHE-SER-ASN-TYR-TRP-MET-ASN-TRP-VAL-ARG-GLN-SER-PRO-GLU-LYS-GLY-LEU-GLU-TRP-VAL-ALA-GLU-ILE-ARG-LEU-LYS-SER-ASN-ASN-TYR-ALA-THR-HIS-TYR-ALA-GLU-SER-VAL-LYS-GLY-ARG-PHE-THR-ILE-SER-ARG-ASP-ASP-SER-LYS-SER-SER-VAL-TYR-LEU-GLN-MET-ASN-ASN-LEU-ARG-ALA-GLU-ASP-THR-GLY-ILE-TYR-TYR-CYS-THR-GLY-VAL-GLY-GLN-PHE-ALA-TYR-TRP-GLY-GLN-GLY-THR-THR-VAL-THR-VAL-SER-ALA-SER-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-GLY-SER-SER-GLY-SER-SER-ASP-ILE-VAL-VAL-THR-GLN-GLU-SER-ALA-LEU-THR-THR-SER-PRO-GLY-GLU-THR-VAL-THR-LEU-THR-CYS-ARG-SER-SER-THR-GLY-ALA-VAL-THR-THR-SER-ASN-TYR-ALA-ASN-TRP-VAL-GLN-GLU-LYS-PRO-ASP-HIS-LEU-PHE-THR-GLY-LEU-ILE-GLY-GLY-THR-ASN-ASN-ARG-ALA-PRO-GLY-VAL-PRO-ALA-ARG-PHE-SER-GLY-SER-LEU-ILE-GLY-ASP-LYS-ALA-ALA-LEU-THR-ILE-THR-GLY-ALA-GLN-THR-GLU-ASP-GLU-ALA-ILE-TYR-PHE-CYS-ALA-LEU-TRP-TYR-SER-ASN-HIS-TRP-VAL-PHE-GLY-GLY-GLY-THR-LYS-LEU-THR-VAL-LEU-GLY,ALA-PRO-ASP-SER-ARG-PRO,244,6,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CC(=O)O,Kd=8.8uM,5.055517,5.06,1,A,A,1,A,A,0,,P,H,,1,1,244,6,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.9601935744285583,0.8578553795814514,94.3708038330078,93.0632553100586,0.3432806432247162,0.5540239214897156,0.9273239374160768,0.9015128016471864,0.9059109687805176,0.7982730269432068,APDSRP,Low,"(5.014, 5.105]",train
5AWT,protein-peptide,P42566 Q9BQI5,GPLGSLTMGAQDTLPVAAAFTETVNAYFKGADPSKCIVKITGEMVLSFPAGITRHFANNPSPAALTFRVINFSRLEHVLPNPQLLCCDNTQNDANTKEFWVNMPNLMTHLKKVSEQKPQATYYNVDMLKYQVSAQGIQSTPLNLAVNWRCEPSSTDLRIDYKYNTDAMTTAVALNNVQFLVPIDGGVTKLQAVLPPAVWNAEQQRILWKIPDISQKSENGGVGSLLARFQLSEGPSKPSPLVVQFTSEGSTLSGCDIELVGAGYRFSLIKKRFAAGKYLADN,YDPFGGDPFKG,GLY-PRO-LEU-GLY-SER-LEU-THR-MET-GLY-ALA-GLN-ASP-THR-LEU-PRO-VAL-ALA-ALA-ALA-PHE-THR-GLU-THR-VAL-ASN-ALA-TYR-PHE-LYS-GLY-ALA-ASP-PRO-SER-LYS-CYS-ILE-VAL-LYS-ILE-THR-GLY-GLU-MET-VAL-LEU-SER-PHE-PRO-ALA-GLY-ILE-THR-ARG-HIS-PHE-ALA-ASN-ASN-PRO-SER-PRO-ALA-ALA-LEU-THR-PHE-ARG-VAL-ILE-ASN-PHE-SER-ARG-LEU-GLU-HIS-VAL-LEU-PRO-ASN-PRO-GLN-LEU-LEU-CYS-CYS-ASP-ASN-THR-GLN-ASN-ASP-ALA-ASN-THR-LYS-GLU-PHE-TRP-VAL-ASN-MET-PRO-ASN-LEU-MET-THR-HIS-LEU-LYS-LYS-VAL-SER-GLU-GLN-LYS-PRO-GLN-ALA-THR-TYR-TYR-ASN-VAL-ASP-MET-LEU-LYS-TYR-GLN-VAL-SER-ALA-GLN-GLY-ILE-GLN-SER-THR-PRO-LEU-ASN-LEU-ALA-VAL-ASN-TRP-ARG-CYS-GLU-PRO-SER-SER-THR-ASP-LEU-ARG-ILE-ASP-TYR-LYS-TYR-ASN-THR-ASP-ALA-MET-THR-THR-ALA-VAL-ALA-LEU-ASN-ASN-VAL-GLN-PHE-LEU-VAL-PRO-ILE-ASP-GLY-GLY-VAL-THR-LYS-LEU-GLN-ALA-VAL-LEU-PRO-PRO-ALA-VAL-TRP-ASN-ALA-GLU-GLN-GLN-ARG-ILE-LEU-TRP-LYS-ILE-PRO-ASP-ILE-SER-GLN-LYS-SER-GLU-ASN-GLY-GLY-VAL-GLY-SER-LEU-LEU-ALA-ARG-PHE-GLN-LEU-SER-GLU-GLY-PRO-SER-LYS-PRO-SER-PRO-LEU-VAL-VAL-GLN-PHE-THR-SER-GLU-GLY-SER-THR-LEU-SER-GLY-CYS-ASP-ILE-GLU-LEU-VAL-GLY-ALA-GLY-TYR-ARG-PHE-SER-LEU-ILE-LYS-LYS-ARG-PHE-ALA-ALA-GLY-LYS-TYR-LEU-ALA-ASP-ASN,TYR-ASP-PRO-PHE-GLY-GLY-ASP-PRO-PHE-LYS-GLY,282,11,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)O)Cc1ccccc1)Cc1ccccc1,Kd=30.2uM,4.519993,4.52,1,A,A,1,A,A,0,,B,A,,1,1,282,11,0,NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)O,NCCCC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](CC(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O,0.6969351172447205,0.7766450643539429,88.75196838378906,86.95794677734375,0.4543765187263489,0.8029733300209045,0.916537880897522,0.8783932328224182,0.6185702085494995,0.7512079477310181,YDPFGGDPFKG,Low,"(4.456, 4.606]",train
5AWU,protein-peptide,P42566 Q9BQI5,GPLGSLTMGAQDTLPVAAAFTETVNAYFKGADPSKCIVKITGEMVLSFPAGITRHFANNPSPAALTFRVINFSRLEHVLPNPQLLCCDNTQNDANTKEFWVNMPNLMTHLKKVSEQKPQATYYNVDMLKYQVSAQGIQSTPLNLAVNWRCEPSSTDLRIDYKYNTDAMTTAVALNNVQFLVPIDGGVTKLQAVLPPAVWNAEQQRILWKIPDISQKSENGGVGSLLARFQLSEGPSKPSPLVVQFTSEGSTLSGCDIELVGAGYRFSLIKKRFAAGKYLADN,YDPFKGSDPFA,GLY-PRO-LEU-GLY-SER-LEU-THR-MET-GLY-ALA-GLN-ASP-THR-LEU-PRO-VAL-ALA-ALA-ALA-PHE-THR-GLU-THR-VAL-ASN-ALA-TYR-PHE-LYS-GLY-ALA-ASP-PRO-SER-LYS-CYS-ILE-VAL-LYS-ILE-THR-GLY-GLU-MET-VAL-LEU-SER-PHE-PRO-ALA-GLY-ILE-THR-ARG-HIS-PHE-ALA-ASN-ASN-PRO-SER-PRO-ALA-ALA-LEU-THR-PHE-ARG-VAL-ILE-ASN-PHE-SER-ARG-LEU-GLU-HIS-VAL-LEU-PRO-ASN-PRO-GLN-LEU-LEU-CYS-CYS-ASP-ASN-THR-GLN-ASN-ASP-ALA-ASN-THR-LYS-GLU-PHE-TRP-VAL-ASN-MET-PRO-ASN-LEU-MET-THR-HIS-LEU-LYS-LYS-VAL-SER-GLU-GLN-LYS-PRO-GLN-ALA-THR-TYR-TYR-ASN-VAL-ASP-MET-LEU-LYS-TYR-GLN-VAL-SER-ALA-GLN-GLY-ILE-GLN-SER-THR-PRO-LEU-ASN-LEU-ALA-VAL-ASN-TRP-ARG-CYS-GLU-PRO-SER-SER-THR-ASP-LEU-ARG-ILE-ASP-TYR-LYS-TYR-ASN-THR-ASP-ALA-MET-THR-THR-ALA-VAL-ALA-LEU-ASN-ASN-VAL-GLN-PHE-LEU-VAL-PRO-ILE-ASP-GLY-GLY-VAL-THR-LYS-LEU-GLN-ALA-VAL-LEU-PRO-PRO-ALA-VAL-TRP-ASN-ALA-GLU-GLN-GLN-ARG-ILE-LEU-TRP-LYS-ILE-PRO-ASP-ILE-SER-GLN-LYS-SER-GLU-ASN-GLY-GLY-VAL-GLY-SER-LEU-LEU-ALA-ARG-PHE-GLN-LEU-SER-GLU-GLY-PRO-SER-LYS-PRO-SER-PRO-LEU-VAL-VAL-GLN-PHE-THR-SER-GLU-GLY-SER-THR-LEU-SER-GLY-CYS-ASP-ILE-GLU-LEU-VAL-GLY-ALA-GLY-TYR-ARG-PHE-SER-LEU-ILE-LYS-LYS-ARG-PHE-ALA-ALA-GLY-LYS-TYR-LEU-ALA-ASP-ASN,TYR-ASP-PRO-PHE-LYS-GLY-SER-ASP-PRO-PHE-ALA,282,11,[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)CC(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)O)Cc1ccccc1,Kd=22.4uM,4.649752,4.65,1,A,A,1,A,A,0,,B,A,,1,1,282,11,0,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O,C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.7740421295166016,0.8062493205070496,87.94605255126953,86.69171905517578,0.3944149613380432,0.7812274694442749,0.9240672588348388,0.8764416575431824,0.7130716443061829,0.7731870412826538,YDPFKGSDPFA,Low,"(4.606, 4.745]",train
5AXI,protein-peptide,P35569 Q3TTA7,SQAAADRRTVEKTWKLMDKVVRLCQNPKLQLKNSPPYILDILPDTYQHLRLILSKYDDNQKLAQLSENEYFKIYIDSLMKKSKRAIRLFKEGKERMYEEQSQDRRNLTKLSLIFSHMLAEIKAIFPNGQFQGDNFRITKADAAEFWRKFFGDKTIVPWKVFRQCLHEVHQISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWGSILRNWNFLAVTHPGYMAFLTYDEVKARLQKYSTKPGSYIFRLSCTRLGQWAIGYVTGDGNILQTIPHNKPLFQALIDGSREGFYLYPDGRSYNPDLTG,DGYMP,SER-GLN-ALA-ALA-ALA-ASP-ARG-ARG-THR-VAL-GLU-LYS-THR-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-GLN-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-ILE-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-LEU-ILE-LEU-SER-LYS-TYR-ASP-ASP-ASN-GLN-LYS-LEU-ALA-GLN-LEU-SER-GLU-ASN-GLU-TYR-PHE-LYS-ILE-TYR-ILE-ASP-SER-LEU-MET-LYS-LYS-SER-LYS-ARG-ALA-ILE-ARG-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-GLN-SER-GLN-ASP-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-ILE-LYS-ALA-ILE-PHE-PRO-ASN-GLY-GLN-PHE-GLN-GLY-ASP-ASN-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-PHE-PHE-GLY-ASP-LYS-THR-ILE-VAL-PRO-TRP-LYS-VAL-PHE-ARG-GLN-CYS-LEU-HIS-GLU-VAL-HIS-GLN-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-GLY-SER-ILE-LEU-ARG-ASN-TRP-ASN-PHE-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-TYR-SER-THR-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-GLY-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-SER-ARG-GLU-GLY-PHE-TYR-LEU-TYR-PRO-ASP-GLY-ARG-SER-TYR-ASN-PRO-ASP-LEU-THR-GLY,ASP-GLY-PTR-MET-PRO,307,5,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)NC(=O)CNC(=O)[C@H](CC(=O)O)[NH3+],IC50=120uM,3.920819,3.92,1,A,A,1,A,A,0,,E,A,,0,1,307,5,0,CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H](N)CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O,0.8744450211524963,0.859774649143219,88.110107421875,85.95394134521484,0.3318149745464325,0.5046312808990479,0.9449405074119568,0.9127578735351562,0.8468050956726074,0.8465288281440735,DGYMP,Low,"(3.548, 3.924]",train
5AZG,protein-peptide,Q23023 Q09490,GPHMKWAYKEENNFEKRRAEGDKIRRKYPDRIPVIVEKAPKSKLHDLDKKKYLVPSDLTVGQFYFLIRKRIQLRPEDALFFFVNNVIPQTMTTMGQLYQDHHEEDLFLYIAYSDESVYG,YQESTDFTFL,GLY-PRO-HIS-MET-LYS-TRP-ALA-TYR-LYS-GLU-GLU-ASN-ASN-PHE-GLU-LYS-ARG-ARG-ALA-GLU-GLY-ASP-LYS-ILE-ARG-ARG-LYS-TYR-PRO-ASP-ARG-ILE-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-SER-LYS-LEU-HIS-ASP-LEU-ASP-LYS-LYS-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-GLN-LEU-ARG-PRO-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-VAL-ILE-PRO-GLN-THR-MET-THR-THR-MET-GLY-GLN-LEU-TYR-GLN-ASP-HIS-HIS-GLU-GLU-ASP-LEU-PHE-LEU-TYR-ILE-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR-GLY,TYR-GLN-GLU-SER-THR-ASP-PHE-THR-PHE-LEU,119,10,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)[C@H](O)C)Cc1ccccc1)[NH3+],Kd=2.9uM,5.537602,5.54,1,A,A,1,A,A,0,,C,A,dimer,1,1,119,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.9280399084091188,0.7387669086456299,96.07648468017578,93.15332794189452,0.3136612474918365,0.7392541170120239,0.9347243309020996,0.8422092795372009,0.87791907787323,0.7129062414169312,YQESTDFTFL,Low,"(5.463, 5.6]",train
5B4W,protein-peptide,O43157,MDSKGSSQKGSRLLLLLVVSNLLLCQGVVSGSLQPLPPTAFTPNGTYLQHLARDPTSGTLYLGATNFLFQLSPGLQLEATVSTGPVLDSRDCLPPVMPDECPQAQPTNNPNQLLLVSPGALVVCGSVHQGVCEQRRLGQLEQLLLRPERPGDTQYVAANDPAVSTVGLVAQGLAGEPLLFVGRGYTSRGVGGGIPPITTRALWPPDPQAAFSYEETAKLAVGRLSEYSHHFVSAFARGASAYFLFLRRDLQAQSRAFRAYVSRVCLRDQHYYSYVELPLACEGGRYGLIQAAAVATSREVAHGEVLFAAFSSAAPPTVGRPPSAAAGASGASALCAFPLDEVDRLANRTRDACYTREGRAEDGTEVAYIEYDVNSDCAQLPVDTLDAYPCGSDHTPSPMASRVPLEATPILEWPGIQLTAVAVTMEDGHTIAFLGDSQGQLHRVYLGPGSDGHPYSTQSIQQGSAVSRDLTFDGTFEHLYVMTQSTLLKVPVASCAQHLDCASCLAHRDPYCGWCVLLGRCSRRSECSRGQGPEQWLWSFQPELGCLQTRENLYFQGKDGGGGGSHMGVAMPGAEDDVV,WRPRVARWTGQIIYCS,MET-ASP-SER-LYS-GLY-SER-SER-GLN-LYS-GLY-SER-ARG-LEU-LEU-LEU-LEU-LEU-VAL-VAL-SER-ASN-LEU-LEU-LEU-CYS-GLN-GLY-VAL-VAL-SER-GLY-SER-LEU-GLN-PRO-LEU-PRO-PRO-THR-ALA-PHE-THR-PRO-ASN-GLY-THR-TYR-LEU-GLN-HIS-LEU-ALA-ARG-ASP-PRO-THR-SER-GLY-THR-LEU-TYR-LEU-GLY-ALA-THR-ASN-PHE-LEU-PHE-GLN-LEU-SER-PRO-GLY-LEU-GLN-LEU-GLU-ALA-THR-VAL-SER-THR-GLY-PRO-VAL-LEU-ASP-SER-ARG-ASP-CYS-LEU-PRO-PRO-VAL-MET-PRO-ASP-GLU-CYS-PRO-GLN-ALA-GLN-PRO-THR-ASN-ASN-PRO-ASN-GLN-LEU-LEU-LEU-VAL-SER-PRO-GLY-ALA-LEU-VAL-VAL-CYS-GLY-SER-VAL-HIS-GLN-GLY-VAL-CYS-GLU-GLN-ARG-ARG-LEU-GLY-GLN-LEU-GLU-GLN-LEU-LEU-LEU-ARG-PRO-GLU-ARG-PRO-GLY-ASP-THR-GLN-TYR-VAL-ALA-ALA-ASN-ASP-PRO-ALA-VAL-SER-THR-VAL-GLY-LEU-VAL-ALA-GLN-GLY-LEU-ALA-GLY-GLU-PRO-LEU-LEU-PHE-VAL-GLY-ARG-GLY-TYR-THR-SER-ARG-GLY-VAL-GLY-GLY-GLY-ILE-PRO-PRO-ILE-THR-THR-ARG-ALA-LEU-TRP-PRO-PRO-ASP-PRO-GLN-ALA-ALA-PHE-SER-TYR-GLU-GLU-THR-ALA-LYS-LEU-ALA-VAL-GLY-ARG-LEU-SER-GLU-TYR-SER-HIS-HIS-PHE-VAL-SER-ALA-PHE-ALA-ARG-GLY-ALA-SER-ALA-TYR-PHE-LEU-PHE-LEU-ARG-ARG-ASP-LEU-GLN-ALA-GLN-SER-ARG-ALA-PHE-ARG-ALA-TYR-VAL-SER-ARG-VAL-CYS-LEU-ARG-ASP-GLN-HIS-TYR-TYR-SER-TYR-VAL-GLU-LEU-PRO-LEU-ALA-CYS-GLU-GLY-GLY-ARG-TYR-GLY-LEU-ILE-GLN-ALA-ALA-ALA-VAL-ALA-THR-SER-ARG-GLU-VAL-ALA-HIS-GLY-GLU-VAL-LEU-PHE-ALA-ALA-PHE-SER-SER-ALA-ALA-PRO-PRO-THR-VAL-GLY-ARG-PRO-PRO-SER-ALA-ALA-ALA-GLY-ALA-SER-GLY-ALA-SER-ALA-LEU-CYS-ALA-PHE-PRO-LEU-ASP-GLU-VAL-ASP-ARG-LEU-ALA-ASN-ARG-THR-ARG-ASP-ALA-CYS-TYR-THR-ARG-GLU-GLY-ARG-ALA-GLU-ASP-GLY-THR-GLU-VAL-ALA-TYR-ILE-GLU-TYR-ASP-VAL-ASN-SER-ASP-CYS-ALA-GLN-LEU-PRO-VAL-ASP-THR-LEU-ASP-ALA-TYR-PRO-CYS-GLY-SER-ASP-HIS-THR-PRO-SER-PRO-MET-ALA-SER-ARG-VAL-PRO-LEU-GLU-ALA-THR-PRO-ILE-LEU-GLU-TRP-PRO-GLY-ILE-GLN-LEU-THR-ALA-VAL-ALA-VAL-THR-MET-GLU-ASP-GLY-HIS-THR-ILE-ALA-PHE-LEU-GLY-ASP-SER-GLN-GLY-GLN-LEU-HIS-ARG-VAL-TYR-LEU-GLY-PRO-GLY-SER-ASP-GLY-HIS-PRO-TYR-SER-THR-GLN-SER-ILE-GLN-GLN-GLY-SER-ALA-VAL-SER-ARG-ASP-LEU-THR-PHE-ASP-GLY-THR-PHE-GLU-HIS-LEU-TYR-VAL-MET-THR-GLN-SER-THR-LEU-LEU-LYS-VAL-PRO-VAL-ALA-SER-CYS-ALA-GLN-HIS-LEU-ASP-CYS-ALA-SER-CYS-LEU-ALA-HIS-ARG-ASP-PRO-TYR-CYS-GLY-TRP-CYS-VAL-LEU-LEU-GLY-ARG-CYS-SER-ARG-ARG-SER-GLU-CYS-SER-ARG-GLY-GLN-GLY-PRO-GLU-GLN-TRP-LEU-TRP-SER-PHE-GLN-PRO-GLU-LEU-GLY-CYS-LEU-GLN-THR-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-LYS-ASP-GLY-GLY-GLY-GLY-GLY-SER-HIS-MET-GLY-VAL-ALA-MET-PRO-GLY-ALA-GLU-ASP-ASP-VAL-VAL,ACE-DTR-ARG-PRO-ARG-VAL-ALA-ARG-TRP-THR-GLY-GLN-ILE-ILE-TYR-CYS-SER-NH2,579,18,OC[C@@H](C(=O)N)NC(=O)[C@@H]1CSCC(=O)N[C@H](Cc2c[nH]c3c2cccc3)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)Cc1ccc(cc1)O)[C@H](CC)C)[C@H](CC)C)CCC(=O)N)[C@H](O)C)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N,Kd=3.5nM,8.455932,8.46,1,A,A,1,A,A,0,,G,A,dimer,1,1,579,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,0.7788854241371155,0.7309442162513733,71.85792541503906,70.87869262695312,0.6382287740707397,1.0576698780059814,0.8219876289367676,0.7926231622695923,0.6798745393753052,0.6388837099075317,WRPRVARWTGQIIYCS,Moderate,"(8.383, 8.824]",val
5B6C,protein-peptide,Q92890 P55072,GSNRPNRLIVDEAINEDNSVVSLSQPKMDELQLFRGDTVLLKGKKRREAVCIVLSDDTCSDEKIRMNRVVRNNLRVRLGDVISIQPCPDVKYGKRIHVLPIDDTVEGITGNLFEVYLKPYFLEAYRPIRKGDIFLVRGGMRAVEFKVVETDPSPYCIVAPDTVIHCEGEPIKRA,FRAFSGSGNRL,GLY-SER-ASN-ARG-PRO-ASN-ARG-LEU-ILE-VAL-ASP-GLU-ALA-ILE-ASN-GLU-ASP-ASN-SER-VAL-VAL-SER-LEU-SER-GLN-PRO-LYS-MET-ASP-GLU-LEU-GLN-LEU-PHE-ARG-GLY-ASP-THR-VAL-LEU-LEU-LYS-GLY-LYS-LYS-ARG-ARG-GLU-ALA-VAL-CYS-ILE-VAL-LEU-SER-ASP-ASP-THR-CYS-SER-ASP-GLU-LYS-ILE-ARG-MET-ASN-ARG-VAL-VAL-ARG-ASN-ASN-LEU-ARG-VAL-ARG-LEU-GLY-ASP-VAL-ILE-SER-ILE-GLN-PRO-CYS-PRO-ASP-VAL-LYS-TYR-GLY-LYS-ARG-ILE-HIS-VAL-LEU-PRO-ILE-ASP-ASP-THR-VAL-GLU-GLY-ILE-THR-GLY-ASN-LEU-PHE-GLU-VAL-TYR-LEU-LYS-PRO-TYR-PHE-LEU-GLU-ALA-TYR-ARG-PRO-ILE-ARG-LYS-GLY-ASP-ILE-PHE-LEU-VAL-ARG-GLY-GLY-MET-ARG-ALA-VAL-GLU-PHE-LYS-VAL-VAL-GLU-THR-ASP-PRO-SER-PRO-TYR-CYS-ILE-VAL-ALA-PRO-ASP-THR-VAL-ILE-HIS-CYS-GLU-GLY-GLU-PRO-ILE-LYS-ARG-ALA,PHE-ARG-ALA-PHE-SER-GLY-SER-GLY-ASN-ARG-LEU,174,11,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CC(=O)N)CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CCC[NH+]=C(N)N)C,Kd=221uM,3.655608,3.66,1,A,A,1,A,A,0,,B,A,,1,1,174,11,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9148454666137696,0.7949396371841431,91.65332794189452,89.5566177368164,0.3382710218429565,0.7058457136154175,0.92876935005188,0.872527003288269,0.874202311038971,0.7755427956581116,FRAFSGSGNRL,Low,"(3.548, 3.924]",train
5C6V,protein-peptide,Q9SV55 Q5NBT9,MSSLSRELVFLILQFLDEEKFKETVHKLEQESGFFFNMKYFEEKVHAGEWDEVEKYLSGFTKVDDNRYSMKIFFEIRKQKYLEALDRHDRAKAVDILVKDLKVFSTFNEELYKEITQLLTLENFRENEQLSKYGDTKSARSIMLIELKKLIEANPLFREKLVFPTLKASRLRTLINQSLNWQHQLCKNPRPNPDIKTLFTDHTCTPPNG,DNGLELSLGLS,MET-SER-SER-LEU-SER-ARG-GLU-LEU-VAL-PHE-LEU-ILE-LEU-GLN-PHE-LEU-ASP-GLU-GLU-LYS-PHE-LYS-GLU-THR-VAL-HIS-LYS-LEU-GLU-GLN-GLU-SER-GLY-PHE-PHE-PHE-ASN-MET-LYS-TYR-PHE-GLU-GLU-LYS-VAL-HIS-ALA-GLY-GLU-TRP-ASP-GLU-VAL-GLU-LYS-TYR-LEU-SER-GLY-PHE-THR-LYS-VAL-ASP-ASP-ASN-ARG-TYR-SER-MET-LYS-ILE-PHE-PHE-GLU-ILE-ARG-LYS-GLN-LYS-TYR-LEU-GLU-ALA-LEU-ASP-ARG-HIS-ASP-ARG-ALA-LYS-ALA-VAL-ASP-ILE-LEU-VAL-LYS-ASP-LEU-LYS-VAL-PHE-SER-THR-PHE-ASN-GLU-GLU-LEU-TYR-LYS-GLU-ILE-THR-GLN-LEU-LEU-THR-LEU-GLU-ASN-PHE-ARG-GLU-ASN-GLU-GLN-LEU-SER-LYS-TYR-GLY-ASP-THR-LYS-SER-ALA-ARG-SER-ILE-MET-LEU-ILE-GLU-LEU-LYS-LYS-LEU-ILE-GLU-ALA-ASN-PRO-LEU-PHE-ARG-GLU-LYS-LEU-VAL-PHE-PRO-THR-LEU-LYS-ALA-SER-ARG-LEU-ARG-THR-LEU-ILE-ASN-GLN-SER-LEU-ASN-TRP-GLN-HIS-GLN-LEU-CYS-LYS-ASN-PRO-ARG-PRO-ASN-PRO-ASP-ILE-LYS-THR-LEU-PHE-THR-ASP-HIS-THR-CYS-THR-PRO-PRO-ASN-GLY,ASP-ASN-GLY-LEU-GLU-LEU-SER-LEU-GLY-LEU-SER,209,11,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)CO)CC(C)C)CCC(=O)O)CC(C)C,IC50=16.0uM,4.79588,4.8,1,A,A,1,A,A,0,,E,A,,1,1,209,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9034072160720824,0.8354185819625854,87.74781799316406,85.19331359863281,0.4373809993267059,0.7328470945358276,0.8462750315666199,0.8407899737358093,0.8353039026260376,0.7802479863166809,DNGLELSLGLS,Low,"(4.745, 4.866]",train
5C7E,protein-peptide,Q38828 Q5NBT9,MSSLSRELVFLILQFLDEEKFKETVHKLEQESGFFFNMKYFEEKVHAGEWDEVEKYLSGFTKVDDNRYSMKIFFEIRKQKYLEALDRHDRAKAVDILVKDLKVFSTFNEELYKEITQLLTLENFRENEQLSKYGDTKSARSIMLIELKKLIEANPLFREKLVFPTLKASRLRTLINQSLNWQHQLCKNPRPNPDIKTLFTDHTCTPPNG,SETELDLALGL,MET-SER-SER-LEU-SER-ARG-GLU-LEU-VAL-PHE-LEU-ILE-LEU-GLN-PHE-LEU-ASP-GLU-GLU-LYS-PHE-LYS-GLU-THR-VAL-HIS-LYS-LEU-GLU-GLN-GLU-SER-GLY-PHE-PHE-PHE-ASN-MET-LYS-TYR-PHE-GLU-GLU-LYS-VAL-HIS-ALA-GLY-GLU-TRP-ASP-GLU-VAL-GLU-LYS-TYR-LEU-SER-GLY-PHE-THR-LYS-VAL-ASP-ASP-ASN-ARG-TYR-SER-MET-LYS-ILE-PHE-PHE-GLU-ILE-ARG-LYS-GLN-LYS-TYR-LEU-GLU-ALA-LEU-ASP-ARG-HIS-ASP-ARG-ALA-LYS-ALA-VAL-ASP-ILE-LEU-VAL-LYS-ASP-LEU-LYS-VAL-PHE-SER-THR-PHE-ASN-GLU-GLU-LEU-TYR-LYS-GLU-ILE-THR-GLN-LEU-LEU-THR-LEU-GLU-ASN-PHE-ARG-GLU-ASN-GLU-GLN-LEU-SER-LYS-TYR-GLY-ASP-THR-LYS-SER-ALA-ARG-SER-ILE-MET-LEU-ILE-GLU-LEU-LYS-LYS-LEU-ILE-GLU-ALA-ASN-PRO-LEU-PHE-ARG-GLU-LYS-LEU-VAL-PHE-PRO-THR-LEU-LYS-ALA-SER-ARG-LEU-ARG-THR-LEU-ILE-ASN-GLN-SER-LEU-ASN-TRP-GLN-HIS-GLN-LEU-CYS-LYS-ASN-PRO-ARG-PRO-ASN-PRO-ASP-ILE-LYS-THR-LEU-PHE-THR-ASP-HIS-THR-CYS-THR-PRO-PRO-ASN-GLY,SER-GLU-THR-GLU-LEU-ASP-LEU-ALA-LEU-GLY-LEU,209,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)C)CC(C)C)C)CC(C)C)CCC(=O)O)[C@H](O)C)C)[NH3+],IC50=10.0uM,5.0,5.0,1,A,A,1,A,A,0,,G,A,,1,1,209,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.8906418085098267,0.8611656427383423,87.90830993652344,85.40631866455078,0.4392808973789215,0.6460079550743103,0.841071367263794,0.8537963032722473,0.8234889507293701,0.8091802000999451,SETELDLALGL,Low,"(4.866, 5.014]",train
5C7F,protein-peptide,P49677 Q5NBT9,MSSLSRELVFLILQFLDEEKFKETVHKLEQESGFFFNMKYFEEKVHAGEWDEVEKYLSGFTKVDDNRYSMKIFFEIRKQKYLEALDRHDRAKAVDILVKDLKVFSTFNEELYKEITQLLTLENFRENEQLSKYGDTKSARSIMLIELKKLIEANPLFREKLVFPTLKASRLRTLINQSLNWQHQLCKNPRPNPDIKTLFTDHTCTPPNG,KDTELRLGLPG,MET-SER-SER-LEU-SER-ARG-GLU-LEU-VAL-PHE-LEU-ILE-LEU-GLN-PHE-LEU-ASP-GLU-GLU-LYS-PHE-LYS-GLU-THR-VAL-HIS-LYS-LEU-GLU-GLN-GLU-SER-GLY-PHE-PHE-PHE-ASN-MET-LYS-TYR-PHE-GLU-GLU-LYS-VAL-HIS-ALA-GLY-GLU-TRP-ASP-GLU-VAL-GLU-LYS-TYR-LEU-SER-GLY-PHE-THR-LYS-VAL-ASP-ASP-ASN-ARG-TYR-SER-MET-LYS-ILE-PHE-PHE-GLU-ILE-ARG-LYS-GLN-LYS-TYR-LEU-GLU-ALA-LEU-ASP-ARG-HIS-ASP-ARG-ALA-LYS-ALA-VAL-ASP-ILE-LEU-VAL-LYS-ASP-LEU-LYS-VAL-PHE-SER-THR-PHE-ASN-GLU-GLU-LEU-TYR-LYS-GLU-ILE-THR-GLN-LEU-LEU-THR-LEU-GLU-ASN-PHE-ARG-GLU-ASN-GLU-GLN-LEU-SER-LYS-TYR-GLY-ASP-THR-LYS-SER-ALA-ARG-SER-ILE-MET-LEU-ILE-GLU-LEU-LYS-LYS-LEU-ILE-GLU-ALA-ASN-PRO-LEU-PHE-ARG-GLU-LYS-LEU-VAL-PHE-PRO-THR-LEU-LYS-ALA-SER-ARG-LEU-ARG-THR-LEU-ILE-ASN-GLN-SER-LEU-ASN-TRP-GLN-HIS-GLN-LEU-CYS-LYS-ASN-PRO-ARG-PRO-ASN-PRO-ASP-ILE-LYS-THR-LEU-PHE-THR-ASP-HIS-THR-CYS-THR-PRO-PRO-ASN-GLY,LYS-ASP-THR-GLU-LEU-ARG-LEU-GLY-LEU-PRO-GLY,209,11,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCC(=O)O)CC(C)C)N,IC50=105.6uM,3.976336,3.98,1,A,A,1,A,A,0,,E,A,,1,1,209,11,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)O,0.9414141178131104,0.8953747153282166,89.0840072631836,86.25142669677734,0.4255323112010956,0.6116843819618225,0.8494537472724915,0.8701194524765015,0.8820178508758545,0.8508512377738953,KDTELRLGLPG,Low,"(3.924, 4.155]",train
5CFA,protein-peptide,P02671 Q14U76,GPLGSNNVNDLITVTKQMITEGIKDDGVIQAHDGEHIIYTSDFKIDNAVKAGDTMTVKYDKHTIPSDITDDFTPVDITDPSGEVIAKGTFDLNTKTITYKFTDYVDRYENVNAKLELNSYIDKKEVPNETNLNLTFATADKETSKNVKVEYQKPIVKDESNIQSIFSHLDTTKHEVEQTIYVNPLKLNAKNTNVTIKSGGVADNGDYYTGDGSTIIDSNTEIKVYKVASGQQLPQSNKIYDYSQYEDVTNSVTINKNYGTNMANINFGDIDSAYIVKVVSKYTPGAEDDLAVQQGVRMTTTNKYNYSSYAGYTNTILSTTDSGGGDGTVKP,SKQFTSSTSYNRGDS,GLY-PRO-LEU-GLY-SER-ASN-ASN-VAL-ASN-ASP-LEU-ILE-THR-VAL-THR-LYS-GLN-MET-ILE-THR-GLU-GLY-ILE-LYS-ASP-ASP-GLY-VAL-ILE-GLN-ALA-HIS-ASP-GLY-GLU-HIS-ILE-ILE-TYR-THR-SER-ASP-PHE-LYS-ILE-ASP-ASN-ALA-VAL-LYS-ALA-GLY-ASP-THR-MET-THR-VAL-LYS-TYR-ASP-LYS-HIS-THR-ILE-PRO-SER-ASP-ILE-THR-ASP-ASP-PHE-THR-PRO-VAL-ASP-ILE-THR-ASP-PRO-SER-GLY-GLU-VAL-ILE-ALA-LYS-GLY-THR-PHE-ASP-LEU-ASN-THR-LYS-THR-ILE-THR-TYR-LYS-PHE-THR-ASP-TYR-VAL-ASP-ARG-TYR-GLU-ASN-VAL-ASN-ALA-LYS-LEU-GLU-LEU-ASN-SER-TYR-ILE-ASP-LYS-LYS-GLU-VAL-PRO-ASN-GLU-THR-ASN-LEU-ASN-LEU-THR-PHE-ALA-THR-ALA-ASP-LYS-GLU-THR-SER-LYS-ASN-VAL-LYS-VAL-GLU-TYR-GLN-LYS-PRO-ILE-VAL-LYS-ASP-GLU-SER-ASN-ILE-GLN-SER-ILE-PHE-SER-HIS-LEU-ASP-THR-THR-LYS-HIS-GLU-VAL-GLU-GLN-THR-ILE-TYR-VAL-ASN-PRO-LEU-LYS-LEU-ASN-ALA-LYS-ASN-THR-ASN-VAL-THR-ILE-LYS-SER-GLY-GLY-VAL-ALA-ASP-ASN-GLY-ASP-TYR-TYR-THR-GLY-ASP-GLY-SER-THR-ILE-ILE-ASP-SER-ASN-THR-GLU-ILE-LYS-VAL-TYR-LYS-VAL-ALA-SER-GLY-GLN-GLN-LEU-PRO-GLN-SER-ASN-LYS-ILE-TYR-ASP-TYR-SER-GLN-TYR-GLU-ASP-VAL-THR-ASN-SER-VAL-THR-ILE-ASN-LYS-ASN-TYR-GLY-THR-ASN-MET-ALA-ASN-ILE-ASN-PHE-GLY-ASP-ILE-ASP-SER-ALA-TYR-ILE-VAL-LYS-VAL-VAL-SER-LYS-TYR-THR-PRO-GLY-ALA-GLU-ASP-ASP-LEU-ALA-VAL-GLN-GLN-GLY-VAL-ARG-MET-THR-THR-THR-ASN-LYS-TYR-ASN-TYR-SER-SER-TYR-ALA-GLY-TYR-THR-ASN-THR-ILE-LEU-SER-THR-THR-ASP-SER-GLY-GLY-GLY-ASP-GLY-THR-VAL-LYS-PRO,SER-LYS-GLN-PHE-THR-SER-SER-THR-SER-TYR-ASN-ARG-GLY-ASP-SER,331,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CO)[C@H](O)C)CO)CO)[C@H](O)C)Cc1ccccc1)CCC(=O)N)NC(=O)[C@@H]([NH3+])C,Kd=0.290uM,6.537602,6.54,1,A,A,1,A,A,0,,C,A,,0,1,331,15,0,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.90268212556839,0.8701956868171692,87.8764877319336,86.54181671142578,0.3860768377780914,0.6004610061645508,0.9243616461753844,0.9133586883544922,0.8701668381690979,0.8594049215316772,SKQFTSSTSYNRGDS,Low,"(6.523, 6.696]",train
5CQX,protein-peptide,P0AE72 P0AE70,MVSRYVPDMGDLIWVDFDPTKGSAQAGHRPAVVLSPFMYNNKTGMCLCVPCTTQSKGYPFEVVLSGQERDGVALADQVKSIAWRARGATKKGTVAPEELQLIKAKINVLIGLSHHHHHH,HENIDWGEPKDKEVW,MET-VAL-SER-ARG-TYR-VAL-PRO-ASP-MET-GLY-ASP-LEU-ILE-TRP-VAL-ASP-PHE-ASP-PRO-THR-LYS-GLY-SER-ALA-GLN-ALA-GLY-HIS-ARG-PRO-ALA-VAL-VAL-LEU-SER-PRO-PHE-MET-TYR-ASN-ASN-LYS-THR-GLY-MET-CYS-LEU-CYS-VAL-PRO-CYS-THR-THR-GLN-SER-LYS-GLY-TYR-PRO-PHE-GLU-VAL-VAL-LEU-SER-GLY-GLN-GLU-ARG-ASP-GLY-VAL-ALA-LEU-ALA-ASP-GLN-VAL-LYS-SER-ILE-ALA-TRP-ARG-ALA-ARG-GLY-ALA-THR-LYS-LYS-GLY-THR-VAL-ALA-PRO-GLU-GLU-LEU-GLN-LEU-ILE-LYS-ALA-LYS-ILE-ASN-VAL-LEU-ILE-GLY-LEU-SER-HIS-HIS-HIS-HIS-HIS-HIS,HIS-GLU-ASN-ILE-ASP-TRP-GLY-GLU-PRO-LYS-ASP-LYS-GLU-VAL-TRP,119,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C(C)C)CCC(=O)O)CCCC[NH3+])CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC(=O)O)C)CC(=O)O)CCC(=O)O,Kd=4.7uM,5.327902,5.33,1,A,A,1,A,A,0,,C,A,dimer,1,1,119,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C,0.8338515758514404,0.7616203427314758,77.95230102539062,82.71491241455078,0.4804306924343109,0.8116479516029358,0.8507682085037231,0.8148036599159241,0.7410029172897339,0.7220640182495117,HENIDWGEPKDKEVW,Low,"(5.31, 5.463]",val
5CS2,protein-peptide,Q8IL97,GPEKYKNILEKLEWYKNKSSEKYEFGIYEIDKREVFITTKYSYGFVNNKPLLPGHILLTTLKKKKHYNDLDIEEIIDINLLCNFMCYIMGNLFNTTDFSIAIQDGKEAGQTVDHVHIHIIPRKINDYKNNDNIYNDMNKINLGYGKNIICNSCNNTINVCSQNEIERNFKLEEFNTSIRSIEQMEEEANLIKSYINEKFSS,WLAFVLV,GLY-PRO-GLU-LYS-TYR-LYS-ASN-ILE-LEU-GLU-LYS-LEU-GLU-TRP-TYR-LYS-ASN-LYS-SER-SER-GLU-LYS-TYR-GLU-PHE-GLY-ILE-TYR-GLU-ILE-ASP-LYS-ARG-GLU-VAL-PHE-ILE-THR-THR-LYS-TYR-SER-TYR-GLY-PHE-VAL-ASN-ASN-LYS-PRO-LEU-LEU-PRO-GLY-HIS-ILE-LEU-LEU-THR-THR-LEU-LYS-LYS-LYS-LYS-HIS-TYR-ASN-ASP-LEU-ASP-ILE-GLU-GLU-ILE-ILE-ASP-ILE-ASN-LEU-LEU-CYS-ASN-PHE-MET-CYS-TYR-ILE-MET-GLY-ASN-LEU-PHE-ASN-THR-THR-ASP-PHE-SER-ILE-ALA-ILE-GLN-ASP-GLY-LYS-GLU-ALA-GLY-GLN-THR-VAL-ASP-HIS-VAL-HIS-ILE-HIS-ILE-ILE-PRO-ARG-LYS-ILE-ASN-ASP-TYR-LYS-ASN-ASN-ASP-ASN-ILE-TYR-ASN-ASP-MET-ASN-LYS-ILE-ASN-LEU-GLY-TYR-GLY-LYS-ASN-ILE-ILE-CYS-ASN-SER-CYS-ASN-ASN-THR-ILE-ASN-VAL-CYS-SER-GLN-ASN-GLU-ILE-GLU-ARG-ASN-PHE-LYS-LEU-GLU-GLU-PHE-ASN-THR-SER-ILE-ARG-SER-ILE-GLU-GLN-MET-GLU-GLU-GLU-ALA-ASN-LEU-ILE-LYS-SER-TYR-ILE-ASN-GLU-LYS-PHE-SER-SER,54C-WLU-ALA-WPA-VAL-MLE-WVL,201,7,OC[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C(C)C)C(=O)N([C@H](C(=O)N[C@H](C(=O)N2[C@](C(=O)N1C)(O2)[C@@H](c1cn(c2c1cccc2)C([C@H]1OC1)(C)C)O)[C@@H](C=C(C)C)C)CC(C)C)C)[C@@H](c1ccccc1)OC)C,IC50=0.004uM,8.39794,8.4,1,A,A,1,A,A,0,,B,A,,1,1,201,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C2CO2)c2ccccc12,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C2CO2)c2ccccc12,0.8433807492256165,0.7527742385864258,81.85589599609375,75.31437683105469,0.5645561814308167,0.8089656233787537,0.8554610013961792,0.8042418360710144,0.8193269968032837,0.7399073243141174,WLAFVLV,Moderate,"(8.383, 8.824]",train
5D0J,protein-peptide,Q14451,GSPASGTSLSAAIHRTQLWFHGRISREESQRLIGQQGLVDGLFLVRESQRNPQGFVLSLCHLQKVKHYLILPSEEEGRLYFSMDDGQTRFTDLLQLVEFHQLNRGILPCLLRHCCTRVAL,SFEGYDNSC,GLY-SER-PRO-ALA-SER-GLY-THR-SER-LEU-SER-ALA-ALA-ILE-HIS-ARG-THR-GLN-LEU-TRP-PHE-HIS-GLY-ARG-ILE-SER-ARG-GLU-GLU-SER-GLN-ARG-LEU-ILE-GLY-GLN-GLN-GLY-LEU-VAL-ASP-GLY-LEU-PHE-LEU-VAL-ARG-GLU-SER-GLN-ARG-ASN-PRO-GLN-GLY-PHE-VAL-LEU-SER-LEU-CYS-HIS-LEU-GLN-LYS-VAL-LYS-HIS-TYR-LEU-ILE-LEU-PRO-SER-GLU-GLU-GLU-GLY-ARG-LEU-TYR-PHE-SER-MET-ASP-ASP-GLY-GLN-THR-ARG-PHE-THR-ASP-LEU-LEU-GLN-LEU-VAL-GLU-PHE-HIS-GLN-LEU-ASN-ARG-GLY-ILE-LEU-PRO-CYS-LEU-LEU-ARG-HIS-CYS-CYS-THR-ARG-VAL-ALA-LEU,SER-PHE-GLU-GLY-TYR-ASP-ASN-SER-CYS,120,9,NC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@@H]([NH3+])C)C,Kd=4.93uM,5.307153,5.31,1,A,A,1,A,A,0,,L,A,,1,1,120,9,0,NC(=O)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,0.9964933395385742,0.8797228336334229,90.36832427978516,89.02731323242188,0.319623738527298,0.6164038777351379,0.9279217720031738,0.8842830061912537,0.9167370200157166,0.8212911486625671,SFEGYDNSC,Low,"(5.222, 5.31]",train
5D7E,protein-peptide,P35189 P61830,LGSMVATVKRTIRIKTQQHILPEVPPVENFPVRQWSIEIVLLDDEGKEIPATIFDKVIYHLHPTFANPNRTFTDPPFRIEEQGWGGFPLDISVFLLEKAGERKIPHDLNFLQESYEVEHVIQIPLNKPLLTEELAKSGST,AQTARKST,LEU-GLY-SER-MET-VAL-ALA-THR-VAL-LYS-ARG-THR-ILE-ARG-ILE-LYS-THR-GLN-GLN-HIS-ILE-LEU-PRO-GLU-VAL-PRO-PRO-VAL-GLU-ASN-PHE-PRO-VAL-ARG-GLN-TRP-SER-ILE-GLU-ILE-VAL-LEU-LEU-ASP-ASP-GLU-GLY-LYS-GLU-ILE-PRO-ALA-THR-ILE-PHE-ASP-LYS-VAL-ILE-TYR-HIS-LEU-HIS-PRO-THR-PHE-ALA-ASN-PRO-ASN-ARG-THR-PHE-THR-ASP-PRO-PRO-PHE-ARG-ILE-GLU-GLU-GLN-GLY-TRP-GLY-GLY-PHE-PRO-LEU-ASP-ILE-SER-VAL-PHE-LEU-LEU-GLU-LYS-ALA-GLY-GLU-ARG-LYS-ILE-PRO-HIS-ASP-LEU-ASN-PHE-LEU-GLN-GLU-SER-TYR-GLU-VAL-GLU-HIS-VAL-ILE-GLN-ILE-PRO-LEU-ASN-LYS-PRO-LEU-LEU-THR-GLU-GLU-LEU-ALA-LYS-SER-GLY-SER-THR,ALA-GLN-THR-ALA-ARG-ALY-SER-THR,140,8,OC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)C)CCC(=O)N)C)CCC[NH+]=C(N)N)CCCCNC(=O)C,Kd=150.6uM,3.822175,3.82,1,A,A,1,A,A,0,,C,A,,1,1,140,8,0,C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.8986030220985413,0.8275861740112305,95.21949768066406,93.49752807617188,0.3299021124839782,0.5713979005813599,0.927927792072296,0.8930124640464783,0.8574880361557007,0.8112295866012573,AQTARKST,Low,"(3.548, 3.924]",train
5DAH,protein-peptide,P55197 P68431,MVSSDRPVSLEDEVSHSMKEMIGGCCVCSDERGWAENPLVYCDGHGCSVAVHQACYGIVQVPTGPWFCRKCESQERAARVRCELCPHKDGALKRTDNGGWAHVVCALYIPEVQFANVSTMEPIVLQSVPHDRYNKTCYICDEQGRESKAATGACMTCNKHGCRQAFHVTCAQFAGLLCEEEGNGADNVQYCGYCKYHFSKLKKSKRGS,QLATKAARKSA,MET-VAL-SER-SER-ASP-ARG-PRO-VAL-SER-LEU-GLU-ASP-GLU-VAL-SER-HIS-SER-MET-LYS-GLU-MET-ILE-GLY-GLY-CYS-CYS-VAL-CYS-SER-ASP-GLU-ARG-GLY-TRP-ALA-GLU-ASN-PRO-LEU-VAL-TYR-CYS-ASP-GLY-HIS-GLY-CYS-SER-VAL-ALA-VAL-HIS-GLN-ALA-CYS-TYR-GLY-ILE-VAL-GLN-VAL-PRO-THR-GLY-PRO-TRP-PHE-CYS-ARG-LYS-CYS-GLU-SER-GLN-GLU-ARG-ALA-ALA-ARG-VAL-ARG-CYS-GLU-LEU-CYS-PRO-HIS-LYS-ASP-GLY-ALA-LEU-LYS-ARG-THR-ASP-ASN-GLY-GLY-TRP-ALA-HIS-VAL-VAL-CYS-ALA-LEU-TYR-ILE-PRO-GLU-VAL-GLN-PHE-ALA-ASN-VAL-SER-THR-MET-GLU-PRO-ILE-VAL-LEU-GLN-SER-VAL-PRO-HIS-ASP-ARG-TYR-ASN-LYS-THR-CYS-TYR-ILE-CYS-ASP-GLU-GLN-GLY-ARG-GLU-SER-LYS-ALA-ALA-THR-GLY-ALA-CYS-MET-THR-CYS-ASN-LYS-HIS-GLY-CYS-ARG-GLN-ALA-PHE-HIS-VAL-THR-CYS-ALA-GLN-PHE-ALA-GLY-LEU-LEU-CYS-GLU-GLU-GLU-GLY-ASN-GLY-ALA-ASP-ASN-VAL-GLN-TYR-CYS-GLY-TYR-CYS-LYS-TYR-HIS-PHE-SER-LYS-LEU-LYS-LYS-SER-LYS-ARG-GLY-SER,GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-LYS-SER-ALA,208,11,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCCC[NH3+])C)C)CCC[NH+]=C(N)N)CCCC[NH3+],Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,C,A,,0,1,208,11,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9907867908477784,0.8409709930419922,82.87532043457031,77.42461395263672,0.3988628089427948,0.7544839382171631,0.9000741839408875,0.8409001231193542,0.9307023882865906,0.786902129650116,QLATKAARKSA,Low,"(5.222, 5.31]",train
5DMS,protein-peptide,Q07832 Q8CDI2,NEAIECHLSDLLQQLTSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLNYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGTVQINFFQDHTKLILCPLMAAVTYINEKRDFQTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSRSASNRLKAS,FSQHKTSTI,ASN-GLU-ALA-ILE-GLU-CYS-HIS-LEU-SER-ASP-LEU-LEU-GLN-GLN-LEU-THR-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-ASN-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-THR-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASN-GLU-LYS-ARG-ASP-PHE-GLN-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG-SER-ALA-SER-ASN-ARG-LEU-LYS-ALA-SER,PHE-SER-GLN-HIS-LYS-THR-SER-TPO-ILE,237,9,OC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=29.58uM,4.529002,4.53,1,A,A,1,A,A,0,,B,A,,1,1,237,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)NC(C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O,CC[C@H](C)[C@H](N)C(=O)NC(C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O,0.9042732119560242,0.8388948440551758,87.35234069824219,88.70402526855469,0.383002758026123,0.6319389343261719,0.9216090440750122,0.8914210200309753,0.8770734071731567,0.8257632851600647,FSQHKTSTI,Low,"(4.456, 4.606]",train
5DXE,protein-peptide,P03372 Q15596,MDPMIKRSKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLSDLLLEMLDAHRLHAPTS,HKLLHRLLQDS,MET-ASP-PRO-MET-ILE-LYS-ARG-SER-LYS-LYS-ASN-SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-SCH-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-SCH-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-SCH-LYS-ASN-VAL-VAL-PRO-LEU-SER-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS-ARG-LEU-HIS-ALA-PRO-THR-SER,ACE-HIS-LYS-MK8-LEU-HIS-ARG-MK8-LEU-GLN-ASP-SER-NH2,261,13,[NH3+]CCCC[C@@H](C(=O)N[C@@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(C)C)Cc1[nH]cnc1)CCC[NH+]=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CC(=O)O)CCC(=O)N)CC(C)C)NC(=O)[C@H](Cc1[nH]cnc1)NC(=O)C,IC50=390nM,6.408935,6.41,1,A,A,1,A,A,0,,C,A,,1,1,261,13,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.9539469480514526,0.8312713503837585,85.46907043457031,83.94941711425781,0.4204539656639099,0.7339702844619751,0.9088716506958008,0.8749119639396667,0.9169620871543884,0.7940201759338379,HKLLHRLLQDS,Low,"(6.398, 6.523]",train
5E0L,protein-peptide,Q24117 Q9H4H8,MSDRKAVIKNADMSEEMQQDAVDCATQALEKYNIEKDIAAYIKKEFDKKYNPTWHCIVGRNFGSYVTHETRHFIYFYLGQVAILLFKSG,SYRKAIDAATQTEE,MET-SER-ASP-ARG-LYS-ALA-VAL-ILE-LYS-ASN-ALA-ASP-MET-SER-GLU-GLU-MET-GLN-GLN-ASP-ALA-VAL-ASP-CYS-ALA-THR-GLN-ALA-LEU-GLU-LYS-TYR-ASN-ILE-GLU-LYS-ASP-ILE-ALA-ALA-TYR-ILE-LYS-LYS-GLU-PHE-ASP-LYS-LYS-TYR-ASN-PRO-THR-TRP-HIS-CYS-ILE-VAL-GLY-ARG-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-THR-ARG-HIS-PHE-ILE-TYR-PHE-TYR-LEU-GLY-GLN-VAL-ALA-ILE-LEU-LEU-PHE-LYS-SER-GLY,SER-TYR-ARG-LYS-ALA-ILE-ASP-ALA-ALA-THR-GLN-THR-GLU-GLU,89,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCC(=O)O)[C@H](O)C)CCC(=O)N)[C@H](O)C)C)C)CC(=O)O)[C@H](CC)C)C)[NH3+],Kd=0.4uM,6.39794,6.4,1,A,A,1,A,A,0,,C,A,,1,1,89,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,0.9534475207328796,0.8926883935928345,96.29203033447266,91.34782409667967,0.3109160363674164,0.5039795637130737,0.9283949732780457,0.9181437492370604,0.8747591376304626,0.8863245248794556,SYRKAIDAATQTEE,Low,"(6.26, 6.398]",train
5E0M,protein-peptide,Q24117 Q9H4H8,MSDRKAVIKNADMSEEMQQDAVDCATQALEKYNIEKDIAAYIKKEFDKKYNPTWHCIVGRNFGSYVTHETRHFIYFYLGQVAILLFKSG,SYWSRSTTTQTDM,MET-SER-ASP-ARG-LYS-ALA-VAL-ILE-LYS-ASN-ALA-ASP-MET-SER-GLU-GLU-MET-GLN-GLN-ASP-ALA-VAL-ASP-CYS-ALA-THR-GLN-ALA-LEU-GLU-LYS-TYR-ASN-ILE-GLU-LYS-ASP-ILE-ALA-ALA-TYR-ILE-LYS-LYS-GLU-PHE-ASP-LYS-LYS-TYR-ASN-PRO-THR-TRP-HIS-CYS-ILE-VAL-GLY-ARG-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-THR-ARG-HIS-PHE-ILE-TYR-PHE-TYR-LEU-GLY-GLN-VAL-ALA-ILE-LEU-LEU-PHE-LYS-SER-GLY,SER-TYR-TRP-SER-ARG-SER-THR-THR-THR-GLN-THR-ASP-MET,89,13,CSCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO)CCC(=O)N)CC(=O)O,Kd=5.2uM,5.283997,5.28,1,A,A,1,A,A,0,,C,A,,1,1,89,13,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CSCC[C@H](N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CSCC[C@H](N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9607700109481812,0.894866943359375,96.92792510986328,92.86182403564452,0.3092376887798309,0.4861680567264557,0.932337760925293,0.9207216501235962,0.8882211446762085,0.8884032368659973,SYWSRSTTTQTDM,Low,"(5.222, 5.31]",train
5E1D,protein-peptide,Q9BV86 P18754,MGSSHHHHHHSSGLVPRGSTSEVIEDEKQFYSKAKTYWKQIPPTVDGMLGGYGHISSIDINSSRKFLQRFLREGPNKTGTSCALDCGAGIGRITKRLLLPLFREVDMVDITEDFLVQAKTYLGEEGKRVRNYFCCGLQDFTPEPDSYDVIWIQWVIGHLTDQHLAEFLRRCKGSLRPNGIIVIKDNMAQEGVILDDVDSSVCRDLDVVRRIICSAGLSLLAEERQENLPDEIYHVYSFALR,YPKRIA,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-THR-SER-GLU-VAL-ILE-GLU-ASP-GLU-LYS-GLN-PHE-TYR-SER-LYS-ALA-LYS-THR-TYR-TRP-LYS-GLN-ILE-PRO-PRO-THR-VAL-ASP-GLY-MET-LEU-GLY-GLY-TYR-GLY-HIS-ILE-SER-SER-ILE-ASP-ILE-ASN-SER-SER-ARG-LYS-PHE-LEU-GLN-ARG-PHE-LEU-ARG-GLU-GLY-PRO-ASN-LYS-THR-GLY-THR-SER-CYS-ALA-LEU-ASP-CYS-GLY-ALA-GLY-ILE-GLY-ARG-ILE-THR-LYS-ARG-LEU-LEU-LEU-PRO-LEU-PHE-ARG-GLU-VAL-ASP-MET-VAL-ASP-ILE-THR-GLU-ASP-PHE-LEU-VAL-GLN-ALA-LYS-THR-TYR-LEU-GLY-GLU-GLU-GLY-LYS-ARG-VAL-ARG-ASN-TYR-PHE-CYS-CYS-GLY-LEU-GLN-ASP-PHE-THR-PRO-GLU-PRO-ASP-SER-TYR-ASP-VAL-ILE-TRP-ILE-GLN-TRP-VAL-ILE-GLY-HIS-LEU-THR-ASP-GLN-HIS-LEU-ALA-GLU-PHE-LEU-ARG-ARG-CYS-LYS-GLY-SER-LEU-ARG-PRO-ASN-GLY-ILE-ILE-VAL-ILE-LYS-ASP-ASN-MET-ALA-GLN-GLU-GLY-VAL-ILE-LEU-ASP-ASP-VAL-ASP-SER-SER-VAL-CYS-ARG-ASP-LEU-ASP-VAL-VAL-ARG-ARG-ILE-ILE-CYS-SER-ALA-GLY-LEU-SER-LEU-LEU-ALA-GLU-GLU-ARG-GLN-GLU-ASN-LEU-PRO-ASP-GLU-ILE-TYR-HIS-VAL-TYR-SER-PHE-ALA-LEU-ARG,TYR-PRO-LYS-ARG-ILE-ALA,241,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)O)[NH3+],Kd=4.1uM,5.387216,5.39,1,A,A,1,A,A,0,,D,A,,1,1,241,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,0.9636714458465576,0.8906418085098267,87.97209167480469,85.8259048461914,0.3662328720092773,0.6024559140205383,0.906322181224823,0.886481761932373,0.9172800183296204,0.8450013399124146,YPKRIA,Low,"(5.31, 5.463]",train
5E1M,protein-peptide,Q9BV86 P18754,MGSSHHHHHHSSGLVPRGSTSEVIEDEKQFYSKAKTYWKQIPPTVDGMLGGYGHISSIDINSSRKFLQRFLREGPNKTGTSCALDCGAGIGRITKRLLLPLFREVDMVDITEDFLVQAKTYLGEEGKRVRNYFCCGLQDFTPEPDSYDVIWIQWVIGHLTDQHLAEFLRRCKGSLRPNGIIVIKDNMAQEGVILDDVDSSVCRDLDVVRRIICSAGLSLLAEERQENLPDEIYHVYSFALR,PPKRIA,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-THR-SER-GLU-VAL-ILE-GLU-ASP-GLU-LYS-GLN-PHE-TYR-SER-LYS-ALA-LYS-THR-TYR-TRP-LYS-GLN-ILE-PRO-PRO-THR-VAL-ASP-GLY-MET-LEU-GLY-GLY-TYR-GLY-HIS-ILE-SER-SER-ILE-ASP-ILE-ASN-SER-SER-ARG-LYS-PHE-LEU-GLN-ARG-PHE-LEU-ARG-GLU-GLY-PRO-ASN-LYS-THR-GLY-THR-SER-CYS-ALA-LEU-ASP-CYS-GLY-ALA-GLY-ILE-GLY-ARG-ILE-THR-LYS-ARG-LEU-LEU-LEU-PRO-LEU-PHE-ARG-GLU-VAL-ASP-MET-VAL-ASP-ILE-THR-GLU-ASP-PHE-LEU-VAL-GLN-ALA-LYS-THR-TYR-LEU-GLY-GLU-GLU-GLY-LYS-ARG-VAL-ARG-ASN-TYR-PHE-CYS-CYS-GLY-LEU-GLN-ASP-PHE-THR-PRO-GLU-PRO-ASP-SER-TYR-ASP-VAL-ILE-TRP-ILE-GLN-TRP-VAL-ILE-GLY-HIS-LEU-THR-ASP-GLN-HIS-LEU-ALA-GLU-PHE-LEU-ARG-ARG-CYS-LYS-GLY-SER-LEU-ARG-PRO-ASN-GLY-ILE-ILE-VAL-ILE-LYS-ASP-ASN-MET-ALA-GLN-GLU-GLY-VAL-ILE-LEU-ASP-ASP-VAL-ASP-SER-SER-VAL-CYS-ARG-ASP-LEU-ASP-VAL-VAL-ARG-ARG-ILE-ILE-CYS-SER-ALA-GLY-LEU-SER-LEU-LEU-ALA-GLU-GLU-ARG-GLN-GLU-ASN-LEU-PRO-ASP-GLU-ILE-TYR-HIS-VAL-TYR-SER-PHE-ALA-LEU-ARG,PRO-PRO-LYS-ARG-ILE-ALA,241,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]1[NH2+]CCC1,Kd=189nM,6.723538,6.72,1,A,A,1,A,A,0,,D,A,,1,1,241,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,0.966853678226471,0.9279094338417052,87.34427642822266,85.71635437011719,0.3546274602413177,0.5344921946525574,0.9104095101356506,0.8944829702377319,0.9202360510826112,0.8895854949951172,PPKRIA,Low,"(6.696, 6.824]",train
5E1O,protein-peptide,Q9BV86 P18754,MGSSHHHHHHSSGLVPRGSTSEVIEDEKQFYSKAKTYWKQIPPTVDGMLGGYGHISSIDINSSRKFLQRFLREGPNKTGTSCALDCGAGIGRITKRLLLPLFREVDMVDITEDFLVQAKTYLGEEGKRVRNYFCCGLQDFTPEPDSYDVIWIQWVIGHLTDQHLAEFLRRCKGSLRPNGIIVIKDNMAQEGVILDDVDSSVCRDLDVVRRIICSAGLSLLAEERQENLPDEIYHVYSFALR,RPKRIA,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-THR-SER-GLU-VAL-ILE-GLU-ASP-GLU-LYS-GLN-PHE-TYR-SER-LYS-ALA-LYS-THR-TYR-TRP-LYS-GLN-ILE-PRO-PRO-THR-VAL-ASP-GLY-MET-LEU-GLY-GLY-TYR-GLY-HIS-ILE-SER-SER-ILE-ASP-ILE-ASN-SER-SER-ARG-LYS-PHE-LEU-GLN-ARG-PHE-LEU-ARG-GLU-GLY-PRO-ASN-LYS-THR-GLY-THR-SER-CYS-ALA-LEU-ASP-CYS-GLY-ALA-GLY-ILE-GLY-ARG-ILE-THR-LYS-ARG-LEU-LEU-LEU-PRO-LEU-PHE-ARG-GLU-VAL-ASP-MET-VAL-ASP-ILE-THR-GLU-ASP-PHE-LEU-VAL-GLN-ALA-LYS-THR-TYR-LEU-GLY-GLU-GLU-GLY-LYS-ARG-VAL-ARG-ASN-TYR-PHE-CYS-CYS-GLY-LEU-GLN-ASP-PHE-THR-PRO-GLU-PRO-ASP-SER-TYR-ASP-VAL-ILE-TRP-ILE-GLN-TRP-VAL-ILE-GLY-HIS-LEU-THR-ASP-GLN-HIS-LEU-ALA-GLU-PHE-LEU-ARG-ARG-CYS-LYS-GLY-SER-LEU-ARG-PRO-ASN-GLY-ILE-ILE-VAL-ILE-LYS-ASP-ASN-MET-ALA-GLN-GLU-GLY-VAL-ILE-LEU-ASP-ASP-VAL-ASP-SER-SER-VAL-CYS-ARG-ASP-LEU-ASP-VAL-VAL-ARG-ARG-ILE-ILE-CYS-SER-ALA-GLY-LEU-SER-LEU-LEU-ALA-GLU-GLU-ARG-GLN-GLU-ASN-LEU-PRO-ASP-GLU-ILE-TYR-HIS-VAL-TYR-SER-PHE-ALA-LEU-ARG,ARG-PRO-LYS-ARG-ILE-ALA,241,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,D,A,,1,1,241,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,0.9691420197486876,0.8796710968017578,88.13031005859375,85.91707611083984,0.3648059666156769,0.6275026798248291,0.9058018326759338,0.8842396140098572,0.9242482781410216,0.8318484425544739,RPKRIA,Low,"(5.31, 5.463]",train
5E2Q,protein-peptide,Q9NY33 P01019,MADTQYILPNDIGVSSLDSREAFRLLSPTERLYAYHLSRAAWYGGLAVLLQTSPEAPYIYALLSRLFRAQDPDQLRQHALAEGLTEEEYQAFLVYAAGVYSNMGNYKSFGDTKFVPNLPKEKLERVILGSEAAQQHPEEVRGLWQTCGELMFSLEPRLRHLGLGKEGITTYFSGNCTMEDAKLAQDFLDSQNLSAYNTRLFKEVDGCGKPYYEVRLASVLGSEPSLDSEVTSKLKSYEFRGSPFQVTRGDYAPILQKVVEQLEKAKAYAANSHQGQMLAQYIESFTQGSIEAHKRGSRFWIQDKGPIVESYIGFIESYRDPFGSRGEFEGFVAVVNKAMSAKFERLVASAEQLLKELPWPPTFEKDKFLTPDFTSLDVLTFAGSGIPAGINIPNYDDLRQTEGFKNVSLGNVLAVAYATQREKLTFLEEDDKDLYILWKGPSFDVQVGLHALLGHGSGKLFVQDEKGAFNFDQETVINPETGEQIQSWYRCGETWDSKFSTIASSYEECRAESVGLYLSLHPQVLEIFGFEGADAEDVIYVNWLNMVRAGLLALEFYTPEAFNWRQAHMQARFVILRVLLEAGEGLVTITPTTGSDGRPDARVRLDRSKIRSVGKPALERFLRRLQVLKSTGDVAGGRALYEGYATVTDAPPESFLTLRDTVLLRKESRKLIVQPNTRLEGSDVQLLEYEASAAGLIRSFSERFPEDGPELEEILTQLATADARFW,DRVYIHPF,MET-ALA-ASP-THR-GLN-TYR-ILE-LEU-PRO-ASN-ASP-ILE-GLY-VAL-SER-SER-LEU-ASP-SER-ARG-GLU-ALA-PHE-ARG-LEU-LEU-SER-PRO-THR-GLU-ARG-LEU-TYR-ALA-TYR-HIS-LEU-SER-ARG-ALA-ALA-TRP-TYR-GLY-GLY-LEU-ALA-VAL-LEU-LEU-GLN-THR-SER-PRO-GLU-ALA-PRO-TYR-ILE-TYR-ALA-LEU-LEU-SER-ARG-LEU-PHE-ARG-ALA-GLN-ASP-PRO-ASP-GLN-LEU-ARG-GLN-HIS-ALA-LEU-ALA-GLU-GLY-LEU-THR-GLU-GLU-GLU-TYR-GLN-ALA-PHE-LEU-VAL-TYR-ALA-ALA-GLY-VAL-TYR-SER-ASN-MET-GLY-ASN-TYR-LYS-SER-PHE-GLY-ASP-THR-LYS-PHE-VAL-PRO-ASN-LEU-PRO-LYS-GLU-LYS-LEU-GLU-ARG-VAL-ILE-LEU-GLY-SER-GLU-ALA-ALA-GLN-GLN-HIS-PRO-GLU-GLU-VAL-ARG-GLY-LEU-TRP-GLN-THR-CYS-GLY-GLU-LEU-MET-PHE-SER-LEU-GLU-PRO-ARG-LEU-ARG-HIS-LEU-GLY-LEU-GLY-LYS-GLU-GLY-ILE-THR-THR-TYR-PHE-SER-GLY-ASN-CYS-THR-MET-GLU-ASP-ALA-LYS-LEU-ALA-GLN-ASP-PHE-LEU-ASP-SER-GLN-ASN-LEU-SER-ALA-TYR-ASN-THR-ARG-LEU-PHE-LYS-GLU-VAL-ASP-GLY-CYS-GLY-LYS-PRO-TYR-TYR-GLU-VAL-ARG-LEU-ALA-SER-VAL-LEU-GLY-SER-GLU-PRO-SER-LEU-ASP-SER-GLU-VAL-THR-SER-LYS-LEU-LYS-SER-TYR-GLU-PHE-ARG-GLY-SER-PRO-PHE-GLN-VAL-THR-ARG-GLY-ASP-TYR-ALA-PRO-ILE-LEU-GLN-LYS-VAL-VAL-GLU-GLN-LEU-GLU-LYS-ALA-LYS-ALA-TYR-ALA-ALA-ASN-SER-HIS-GLN-GLY-GLN-MET-LEU-ALA-GLN-TYR-ILE-GLU-SER-PHE-THR-GLN-GLY-SER-ILE-GLU-ALA-HIS-LYS-ARG-GLY-SER-ARG-PHE-TRP-ILE-GLN-ASP-LYS-GLY-PRO-ILE-VAL-GLU-SER-TYR-ILE-GLY-PHE-ILE-GLU-SER-TYR-ARG-ASP-PRO-PHE-GLY-SER-ARG-GLY-GLU-PHE-GLU-GLY-PHE-VAL-ALA-VAL-VAL-ASN-LYS-ALA-MET-SER-ALA-LYS-PHE-GLU-ARG-LEU-VAL-ALA-SER-ALA-GLU-GLN-LEU-LEU-LYS-GLU-LEU-PRO-TRP-PRO-PRO-THR-PHE-GLU-LYS-ASP-LYS-PHE-LEU-THR-PRO-ASP-PHE-THR-SER-LEU-ASP-VAL-LEU-THR-PHE-ALA-GLY-SER-GLY-ILE-PRO-ALA-GLY-ILE-ASN-ILE-PRO-ASN-TYR-ASP-ASP-LEU-ARG-GLN-THR-GLU-GLY-PHE-LYS-ASN-VAL-SER-LEU-GLY-ASN-VAL-LEU-ALA-VAL-ALA-TYR-ALA-THR-GLN-ARG-GLU-LYS-LEU-THR-PHE-LEU-GLU-GLU-ASP-ASP-LYS-ASP-LEU-TYR-ILE-LEU-TRP-LYS-GLY-PRO-SER-PHE-ASP-VAL-GLN-VAL-GLY-LEU-HIS-ALA-LEU-LEU-GLY-HIS-GLY-SER-GLY-LYS-LEU-PHE-VAL-GLN-ASP-GLU-LYS-GLY-ALA-PHE-ASN-PHE-ASP-GLN-GLU-THR-VAL-ILE-ASN-PRO-GLU-THR-GLY-GLU-GLN-ILE-GLN-SER-TRP-TYR-ARG-CYS-GLY-GLU-THR-TRP-ASP-SER-LYS-PHE-SER-THR-ILE-ALA-SER-SER-TYR-GLU-GLU-CYS-ARG-ALA-GLU-SER-VAL-GLY-LEU-TYR-LEU-SER-LEU-HIS-PRO-GLN-VAL-LEU-GLU-ILE-PHE-GLY-PHE-GLU-GLY-ALA-ASP-ALA-GLU-ASP-VAL-ILE-TYR-VAL-ASN-TRP-LEU-ASN-MET-VAL-ARG-ALA-GLY-LEU-LEU-ALA-LEU-GLU-PHE-TYR-THR-PRO-GLU-ALA-PHE-ASN-TRP-ARG-GLN-ALA-HIS-MET-GLN-ALA-ARG-PHE-VAL-ILE-LEU-ARG-VAL-LEU-LEU-GLU-ALA-GLY-GLU-GLY-LEU-VAL-THR-ILE-THR-PRO-THR-THR-GLY-SER-ASP-GLY-ARG-PRO-ASP-ALA-ARG-VAL-ARG-LEU-ASP-ARG-SER-LYS-ILE-ARG-SER-VAL-GLY-LYS-PRO-ALA-LEU-GLU-ARG-PHE-LEU-ARG-ARG-LEU-GLN-VAL-LEU-LYS-SER-THR-GLY-ASP-VAL-ALA-GLY-GLY-ARG-ALA-LEU-TYR-GLU-GLY-TYR-ALA-THR-VAL-THR-ASP-ALA-PRO-PRO-GLU-SER-PHE-LEU-THR-LEU-ARG-ASP-THR-VAL-LEU-LEU-ARG-LYS-GLU-SER-ARG-LYS-LEU-ILE-VAL-GLN-PRO-ASN-THR-ARG-LEU-GLU-GLY-SER-ASP-VAL-GLN-LEU-LEU-GLU-TYR-GLU-ALA-SER-ALA-ALA-GLY-LEU-ILE-ARG-SER-PHE-SER-GLU-ARG-PHE-PRO-GLU-ASP-GLY-PRO-GLU-LEU-GLU-GLU-ILE-LEU-THR-GLN-LEU-ALA-THR-ALA-ASP-ALA-ARG-PHE-TRP,ASP-ARG-VAL-TYR-ILE-HIS-PRO-PHE,726,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1nc[nH]c1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC[NH+]=C(N)N)Cc1ccc(cc1)O)C,Kd=1.64uM,5.785156,5.79,1,A,A,1,A,A,0,,B,A,,1,1,726,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.92459636926651,0.9042242169380188,88.35384368896484,86.58992767333984,0.376094788312912,0.5065798759460449,0.9260632991790771,0.92534738779068,0.917417585849762,0.8989433646202087,DRVYIHPF,Low,"(5.699, 5.821]",train
5E3A,protein-peptide,P01210 Q9NY33,MADTQYILPNDIGVSSLDSREAFRLLSPTERLYAYHLSRAAWYGGLAVLLQTSPEAPYIYALLSRLFRAQDPDQLRQHALAEGLTEEEYQAFLVYAAGVYSNMGNYKSFGDTKFVPNLPKEKLERVILGSEAAQQHPEEVRGLWQTCGELMFSLEPRLRHLGLGKEGITTYFSGNCTMEDAKLAQDFLDSQNLSAYNTRLFKEVDGCGKPYYEVRLASVLGSEPSLDSEVTSKLKSYEFRGSPFQVTRGDYAPILQKVVEQLEKAKAYAANSHQGQMLAQYIESFTQGSIEAHKRGSRFWIQDKGPIVESYIGFIESYRDPFGSRGEFEGFVAVVNKAMSAKFERLVASAEQLLKELPWPPTFEKDKFLTPDFTSLDVLTFAGSGIPAGINIPNYDDLRQTEGFKNVSLGNVLAVAYATQREKLTFLEEDDKDLYILWKGPSFDVQVGLHALLGHGSGKLFVQDEKGAFNFDQETVINPETGEQIQSWYRCGETWDSKFSTIASSYEECRAESVGLYLSLHPQVLEIFGFEGADAEDVIYVNWLNMVRAGLLALEFYTPEAFNWRQAHMQARFVILRVLLEAGEGLVTITPTTGSDGRPDARVRLDRSKIRSVGKPALERFLRRLQVLKSTGDVAGGRALYEGYATVTDAPPESFLTLRDTVLLRKESRKLIVQPNTRLEGSDVQLLEYEASAAGLIRSFSERFPEDGPELEEILTQLATADARFW,YGGFL,MET-ALA-ASP-THR-GLN-TYR-ILE-LEU-PRO-ASN-ASP-ILE-GLY-VAL-SER-SER-LEU-ASP-SER-ARG-GLU-ALA-PHE-ARG-LEU-LEU-SER-PRO-THR-GLU-ARG-LEU-TYR-ALA-TYR-HIS-LEU-SER-ARG-ALA-ALA-TRP-TYR-GLY-GLY-LEU-ALA-VAL-LEU-LEU-GLN-THR-SER-PRO-GLU-ALA-PRO-TYR-ILE-TYR-ALA-LEU-LEU-SER-ARG-LEU-PHE-ARG-ALA-GLN-ASP-PRO-ASP-GLN-LEU-ARG-GLN-HIS-ALA-LEU-ALA-GLU-GLY-LEU-THR-GLU-GLU-GLU-TYR-GLN-ALA-PHE-LEU-VAL-TYR-ALA-ALA-GLY-VAL-TYR-SER-ASN-MET-GLY-ASN-TYR-LYS-SER-PHE-GLY-ASP-THR-LYS-PHE-VAL-PRO-ASN-LEU-PRO-LYS-GLU-LYS-LEU-GLU-ARG-VAL-ILE-LEU-GLY-SER-GLU-ALA-ALA-GLN-GLN-HIS-PRO-GLU-GLU-VAL-ARG-GLY-LEU-TRP-GLN-THR-CYS-GLY-GLU-LEU-MET-PHE-SER-LEU-GLU-PRO-ARG-LEU-ARG-HIS-LEU-GLY-LEU-GLY-LYS-GLU-GLY-ILE-THR-THR-TYR-PHE-SER-GLY-ASN-CYS-THR-MET-GLU-ASP-ALA-LYS-LEU-ALA-GLN-ASP-PHE-LEU-ASP-SER-GLN-ASN-LEU-SER-ALA-TYR-ASN-THR-ARG-LEU-PHE-LYS-GLU-VAL-ASP-GLY-CYS-GLY-LYS-PRO-TYR-TYR-GLU-VAL-ARG-LEU-ALA-SER-VAL-LEU-GLY-SER-GLU-PRO-SER-LEU-ASP-SER-GLU-VAL-THR-SER-LYS-LEU-LYS-SER-TYR-GLU-PHE-ARG-GLY-SER-PRO-PHE-GLN-VAL-THR-ARG-GLY-ASP-TYR-ALA-PRO-ILE-LEU-GLN-LYS-VAL-VAL-GLU-GLN-LEU-GLU-LYS-ALA-LYS-ALA-TYR-ALA-ALA-ASN-SER-HIS-GLN-GLY-GLN-MET-LEU-ALA-GLN-TYR-ILE-GLU-SER-PHE-THR-GLN-GLY-SER-ILE-GLU-ALA-HIS-LYS-ARG-GLY-SER-ARG-PHE-TRP-ILE-GLN-ASP-LYS-GLY-PRO-ILE-VAL-GLU-SER-TYR-ILE-GLY-PHE-ILE-GLU-SER-TYR-ARG-ASP-PRO-PHE-GLY-SER-ARG-GLY-GLU-PHE-GLU-GLY-PHE-VAL-ALA-VAL-VAL-ASN-LYS-ALA-MET-SER-ALA-LYS-PHE-GLU-ARG-LEU-VAL-ALA-SER-ALA-GLU-GLN-LEU-LEU-LYS-GLU-LEU-PRO-TRP-PRO-PRO-THR-PHE-GLU-LYS-ASP-LYS-PHE-LEU-THR-PRO-ASP-PHE-THR-SER-LEU-ASP-VAL-LEU-THR-PHE-ALA-GLY-SER-GLY-ILE-PRO-ALA-GLY-ILE-ASN-ILE-PRO-ASN-TYR-ASP-ASP-LEU-ARG-GLN-THR-GLU-GLY-PHE-LYS-ASN-VAL-SER-LEU-GLY-ASN-VAL-LEU-ALA-VAL-ALA-TYR-ALA-THR-GLN-ARG-GLU-LYS-LEU-THR-PHE-LEU-GLU-GLU-ASP-ASP-LYS-ASP-LEU-TYR-ILE-LEU-TRP-LYS-GLY-PRO-SER-PHE-ASP-VAL-GLN-VAL-GLY-LEU-HIS-ALA-LEU-LEU-GLY-HIS-GLY-SER-GLY-LYS-LEU-PHE-VAL-GLN-ASP-GLU-LYS-GLY-ALA-PHE-ASN-PHE-ASP-GLN-GLU-THR-VAL-ILE-ASN-PRO-GLU-THR-GLY-GLU-GLN-ILE-GLN-SER-TRP-TYR-ARG-CYS-GLY-GLU-THR-TRP-ASP-SER-LYS-PHE-SER-THR-ILE-ALA-SER-SER-TYR-GLU-GLU-CYS-ARG-ALA-GLU-SER-VAL-GLY-LEU-TYR-LEU-SER-LEU-HIS-PRO-GLN-VAL-LEU-GLU-ILE-PHE-GLY-PHE-GLU-GLY-ALA-ASP-ALA-GLU-ASP-VAL-ILE-TYR-VAL-ASN-TRP-LEU-ASN-MET-VAL-ARG-ALA-GLY-LEU-LEU-ALA-LEU-GLU-PHE-TYR-THR-PRO-GLU-ALA-PHE-ASN-TRP-ARG-GLN-ALA-HIS-MET-GLN-ALA-ARG-PHE-VAL-ILE-LEU-ARG-VAL-LEU-LEU-GLU-ALA-GLY-GLU-GLY-LEU-VAL-THR-ILE-THR-PRO-THR-THR-GLY-SER-ASP-GLY-ARG-PRO-ASP-ALA-ARG-VAL-ARG-LEU-ASP-ARG-SER-LYS-ILE-ARG-SER-VAL-GLY-LYS-PRO-ALA-LEU-GLU-ARG-PHE-LEU-ARG-ARG-LEU-GLN-VAL-LEU-LYS-SER-THR-GLY-ASP-VAL-ALA-GLY-GLY-ARG-ALA-LEU-TYR-GLU-GLY-TYR-ALA-THR-VAL-THR-ASP-ALA-PRO-PRO-GLU-SER-PHE-LEU-THR-LEU-ARG-ASP-THR-VAL-LEU-LEU-ARG-LYS-GLU-SER-ARG-LYS-LEU-ILE-VAL-GLN-PRO-ASN-THR-ARG-LEU-GLU-GLY-SER-ASP-VAL-GLN-LEU-LEU-GLU-TYR-GLU-ALA-SER-ALA-ALA-GLY-LEU-ILE-ARG-SER-PHE-SER-GLU-ARG-PHE-PRO-GLU-ASP-GLY-PRO-GLU-LEU-GLU-GLU-ILE-LEU-THR-GLN-LEU-ALA-THR-ALA-ASP-ALA-ARG-PHE-TRP,TYR-GLY-GLY-PHE-LEU,726,5,O=C(CNC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1,Kd=3.6uM,5.443697,5.44,1,A,A,1,A,A,0,,B,A,,1,1,726,5,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9164061546325684,0.9015008211135864,89.08091735839844,86.77301025390625,0.3703683614730835,0.4499742090702057,0.9278128743171692,0.9217913150787354,0.909279465675354,0.896428108215332,YGGFL,Low,"(5.31, 5.463]",train
5E8F,protein-peptide,P51160 O43924,SAKDERAREILRGFKLNWMNLRDAETGKILWQGTEDLSVPGVEHEARVPKKILKCKAVSRELNFSSTEQMEKFRLEQKVYFKGQCLEEWFFEFGFVIPNSTNTWQSLIEAAPESQMMPASVLTGNVIIETKFFDDDLLVSTSRVRLFYV,KSKTC,SER-ALA-LYS-ASP-GLU-ARG-ALA-ARG-GLU-ILE-LEU-ARG-GLY-PHE-LYS-LEU-ASN-TRP-MET-ASN-LEU-ARG-ASP-ALA-GLU-THR-GLY-LYS-ILE-LEU-TRP-GLN-GLY-THR-GLU-ASP-LEU-SER-VAL-PRO-GLY-VAL-GLU-HIS-GLU-ALA-ARG-VAL-PRO-LYS-LYS-ILE-LEU-LYS-CYS-LYS-ALA-VAL-SER-ARG-GLU-LEU-ASN-PHE-SER-SER-THR-GLU-GLN-MET-GLU-LYS-PHE-ARG-LEU-GLU-GLN-LYS-VAL-TYR-PHE-LYS-GLY-GLN-CYS-LEU-GLU-GLU-TRP-PHE-PHE-GLU-PHE-GLY-PHE-VAL-ILE-PRO-ASN-SER-THR-ASN-THR-TRP-GLN-SER-LEU-ILE-GLU-ALA-ALA-PRO-GLU-SER-GLN-MET-MET-PRO-ALA-SER-VAL-LEU-THR-GLY-ASN-VAL-ILE-ILE-GLU-THR-LYS-PHE-PHE-ASP-ASP-ASP-LEU-LEU-VAL-SER-THR-SER-ARG-VAL-ARG-LEU-PHE-TYR-VAL,LYS-SER-LYS-THR-CMT,149,5,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)OC)CS)[C@H](O)C)CCCC[NH3+])NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=2.3nM,8.638272,8.64,1,A,A,1,A,A,0,,D,A,,1,1,149,5,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CS)C(=O)O,COC(=O)C(CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O,COC(=O)C(CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O,0.9346963167190552,0.8660507202148438,95.7943115234375,94.17010498046876,0.3177460432052612,0.5367485880851746,0.9234113097190856,0.8984471559524536,0.9172253608703612,0.8579516410827637,KSKTC,Moderate,"(8.383, 8.824]",train
5ELQ,protein-peptide,Q13574 Q8K4V4,GSHGGSPRVVRIVKSESGYGFNVRGQVSEGGQLRSINGELYAPLQHVSAVLPGGAADRAGVRKGDRILEVNGVNVEGATHKQVVDLIRAGEKELILTVLSV,REDQETAV,GLY-SER-HIS-GLY-GLY-SER-PRO-ARG-VAL-VAL-ARG-ILE-VAL-LYS-SER-GLU-SER-GLY-TYR-GLY-PHE-ASN-VAL-ARG-GLY-GLN-VAL-SER-GLU-GLY-GLY-GLN-LEU-ARG-SER-ILE-ASN-GLY-GLU-LEU-TYR-ALA-PRO-LEU-GLN-HIS-VAL-SER-ALA-VAL-LEU-PRO-GLY-GLY-ALA-ALA-ASP-ARG-ALA-GLY-VAL-ARG-LYS-GLY-ASP-ARG-ILE-LEU-GLU-VAL-ASN-GLY-VAL-ASN-VAL-GLU-GLY-ALA-THR-HIS-LYS-GLN-VAL-VAL-ASP-LEU-ILE-ARG-ALA-GLY-GLU-LYS-GLU-LEU-ILE-LEU-THR-VAL-LEU-SER-VAL,ARG-GLU-ASP-GLN-GLU-THR-ALA-VAL,101,8,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CCC(=O)N,Kd=2uM,5.69897,5.7,1,A,A,1,A,A,0,,C,A,,0,1,101,8,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,0.9712148308753968,0.8460187911987305,94.06182098388672,93.10504150390624,0.3154118359088897,0.5587173700332642,0.9304449558258056,0.8947999477386475,0.935535728931427,0.8338235020637512,REDQETAV,Low,"(5.6, 5.699]",val
5EM9,protein-peptide,Q13639 Q8K4V4,GSHGGSPRVVRIVKSESGYGFNVRGQVSEGGQLRSINGELYAPLQHVSAVLPGGAADRAGVRKGDRILEVNGVNVEGATHKQVVDLIRAGEKELILTVLSV,PESLESCF,GLY-SER-HIS-GLY-GLY-SER-PRO-ARG-VAL-VAL-ARG-ILE-VAL-LYS-SER-GLU-SER-GLY-TYR-GLY-PHE-ASN-VAL-ARG-GLY-GLN-VAL-SER-GLU-GLY-GLY-GLN-LEU-ARG-SER-ILE-ASN-GLY-GLU-LEU-TYR-ALA-PRO-LEU-GLN-HIS-VAL-SER-ALA-VAL-LEU-PRO-GLY-GLY-ALA-ALA-ASP-ARG-ALA-GLY-VAL-ARG-LYS-GLY-ASP-ARG-ILE-LEU-GLU-VAL-ASN-GLY-VAL-ASN-VAL-GLU-GLY-ALA-THR-HIS-LYS-GLN-VAL-VAL-ASP-LEU-ILE-ARG-ALA-GLY-GLU-LYS-GLU-LEU-ILE-LEU-THR-VAL-LEU-SER-VAL,PRO-GLU-SEP-LEU-GLU-SER-CYS-PHE,101,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CS)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](COP(O)(O)O)[NH3+])CC(C)C)CCC(=O)O,Kd=2.7uM,5.568636,5.57,1,A,A,1,A,A,0,,B,A,,1,1,101,8,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.98767352104187,0.9000248312950134,94.6884994506836,93.890625,0.3092187047004699,0.4631395936012268,0.9341166615486144,0.920516848564148,0.9322554469108582,0.8949018120765686,PESLESCF,Low,"(5.463, 5.6]",train
5EMA,protein-peptide,Q96PB8 Q8K4V4,GSHGGSPRVVRIVKSESGYGFNVRGQVSEGGQLRSINGELYAPLQHVSAVLPGGAADRAGVRKGDRILEVNGVNVEGATHKQVVDLIRAGEKELILTVLSV,PDDISTVV,GLY-SER-HIS-GLY-GLY-SER-PRO-ARG-VAL-VAL-ARG-ILE-VAL-LYS-SER-GLU-SER-GLY-TYR-GLY-PHE-ASN-VAL-ARG-GLY-GLN-VAL-SER-GLU-GLY-GLY-GLN-LEU-ARG-SER-ILE-ASN-GLY-GLU-LEU-TYR-ALA-PRO-LEU-GLN-HIS-VAL-SER-ALA-VAL-LEU-PRO-GLY-GLY-ALA-ALA-ASP-ARG-ALA-GLY-VAL-ARG-LYS-GLY-ASP-ARG-ILE-LEU-GLU-VAL-ASN-GLY-VAL-ASN-VAL-GLU-GLY-ALA-THR-HIS-LYS-GLN-VAL-VAL-ASP-LEU-ILE-ARG-ALA-GLY-GLU-LYS-GLU-LEU-ILE-LEU-THR-VAL-LEU-SER-VAL,PRO-ASP-ASP-ILE-SEP-THR-VAL-VAL,101,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)[C@H](O)C)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)C,Kd=5.9uM,5.229148,5.23,1,A,A,1,A,A,0,,B,A,,1,1,101,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O,0.9636659622192384,0.8459324240684509,95.55875396728516,93.3158721923828,0.3217720091342926,0.5279792547225952,0.9277965426445008,0.8954750299453735,0.9210277795791626,0.8335466980934143,PDDISTVV,Low,"(5.222, 5.31]",train
5EMB,protein-peptide,Q8K4V4 Q03431,GSHGGSPRVVRIVKSESGYGFNVRGQVSEGGQLRSINGELYAPLQHVSAVLPGGAADRAGVRKGDRILEVNGVNVEGATHKQVVDLIRAGEKELILTVLSV,QEEWSTVM,GLY-SER-HIS-GLY-GLY-SER-PRO-ARG-VAL-VAL-ARG-ILE-VAL-LYS-SER-GLU-SER-GLY-TYR-GLY-PHE-ASN-VAL-ARG-GLY-GLN-VAL-SER-GLU-GLY-GLY-GLN-LEU-ARG-SER-ILE-ASN-GLY-GLU-LEU-TYR-ALA-PRO-LEU-GLN-HIS-VAL-SER-ALA-VAL-LEU-PRO-GLY-GLY-ALA-ALA-ASP-ARG-ALA-GLY-VAL-ARG-LYS-GLY-ASP-ARG-ILE-LEU-GLU-VAL-ASN-GLY-VAL-ASN-VAL-GLU-GLY-ALA-THR-HIS-LYS-GLN-VAL-VAL-ASP-LEU-ILE-ARG-ALA-GLY-GLU-LYS-GLU-LEU-ILE-LEU-THR-VAL-LEU-SER-VAL,GLN-GLU-GLU-TRP-SEP-THR-VAL-MET,101,8,CSCC[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)COP(O)(O)O,Kd=6.3uM,5.200659,5.2,1,A,A,1,A,A,0,,B,A,,1,1,101,8,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(C)C)C(=O)O,CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](N)C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(C)C,0.9613108038902284,0.818199098110199,96.99546813964844,93.00049591064452,0.3248462080955505,0.6020979881286621,0.9300233125686646,0.8800027370452881,0.917527198791504,0.8027482032775879,QEEWSTVM,Low,"(5.105, 5.222]",train
5EOK,protein-peptide,P03951,CVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,HIYPDFPTD,CYS-VAL-THR-GLN-LEU-LEU-LYS-ASP-THR-CYS-PHE-GLU-GLY-GLY-ASP-ILE-THR-THR-VAL-PHE-THR-PRO-SER-ALA-LYS-TYR-CYS-GLN-VAL-VAL-CYS-THR-TYR-HIS-PRO-ARG-CYS-LEU-LEU-PHE-THR-PHE-THR-ALA-GLU-SER-PRO-SER-GLU-ASP-PRO-THR-ARG-TRP-PHE-THR-CYS-VAL-LEU-LYS-ASP-SER-VAL-THR-GLU-THR-LEU-PRO-ARG-VAL-ASN-ARG-THR-ALA-ALA-ILE-SER-GLY-TYR-SER-PHE-LYS-GLN-CYS-SER-HIS-GLN-ILE-SER-ALA-CYS-ASN-LYS-ASP-ILE-TYR-VAL-ASP-LEU-ASP-MET-LYS-GLY-ILE-ASN-TYR-ASN-SER-SER-VAL-ALA-LYS-SER-ALA-GLN-GLU-CYS-GLN-GLU-ARG-CYS-THR-ASP-ASP-VAL-HIS-CYS-HIS-PHE-PHE-THR-TYR-ALA-THR-ARG-GLN-PHE-PRO-SER-LEU-GLU-HIS-ARG-ASN-ILE-CYS-LEU-LEU-LYS-HIS-THR-GLN-THR-GLY-THR-PRO-THR-ARG-ILE-THR-LYS-LEU-ASP-LYS-VAL-VAL-SER-GLY-PHE-SER-LEU-LYS-SER-CYS-ALA-LEU-SER-ASN-LEU-ALA-CYS-ILE-ARG-ASP-ILE-PHE-PRO-ASN-THR-VAL-PHE-ALA-ASP-SER-ASN-ILE-ASP-SER-VAL-MET-ALA-PRO-ASP-ALA-PHE-VAL-CYS-GLY-ARG-ILE-CYS-THR-HIS-HIS-PRO-GLY-CYS-LEU-PHE-PHE-THR-PHE-PHE-SER-GLN-GLU-TRP-PRO-LYS-GLU-SER-GLN-ARG-ASN-LEU-CYS-LEU-LEU-LYS-THR-SER-GLU-SER-GLY-LEU-PRO-SER-THR-ARG-ILE-LYS-LYS-SER-LYS-ALA-LEU-SER-GLY-PHE-SER-LEU-GLN-SER-CYS-ARG-HIS-SER-ILE-PRO-VAL-PHE-CYS-HIS-SER-SER-PHE-TYR-HIS-ASP-THR-ASP-PHE-LEU-GLY-GLU-GLU-LEU-ASP-ILE-VAL-ALA-ALA-LYS-SER-HIS-GLU-ALA-CYS-GLN-LYS-LEU-CYS-THR-ASN-ALA-VAL-ARG-CYS-GLN-PHE-PHE-THR-TYR-THR-PRO-ALA-GLN-ALA-SER-CYS-ASN-GLU-GLY-LYS-GLY-LYS-CYS-TYR-LEU-LYS-LEU-SER-SER-ASN-GLY-SER-PRO-THR-LYS-ILE-LEU-HIS-GLY-ARG-GLY-GLY-ILE-SER-GLY-TYR-THR-LEU-ARG-LEU-CYS-LYS-MET-ASP-ASN-GLU-CYS-THR-THR-LYS-ILE-LYS-PRO-ARG-ILE-VAL-GLY-GLY-THR-ALA-SER-VAL-ARG-GLY-GLU-TRP-PRO-TRP-GLN-VAL-THR-LEU-HIS-THR-THR-SER-PRO-THR-GLN-ARG-HIS-LEU-CYS-GLY-GLY-SER-ILE-ILE-GLY-ASN-GLN-TRP-ILE-LEU-THR-ALA-ALA-HIS-CYS-PHE-TYR-GLY-VAL-GLU-SER-PRO-LYS-ILE-LEU-ARG-VAL-TYR-SER-GLY-ILE-LEU-ASN-GLN-SER-GLU-ILE-LYS-GLU-ASP-THR-SER-PHE-PHE-GLY-VAL-GLN-GLU-ILE-ILE-ILE-HIS-ASP-GLN-TYR-LYS-MET-ALA-GLU-SER-GLY-TYR-ASP-ILE-ALA-LEU-LEU-LYS-LEU-GLU-THR-THR-VAL-ASN-TYR-THR-ASP-SER-GLN-ARG-PRO-ILE-CYS-LEU-PRO-SER-LYS-GLY-ASP-ARG-ASN-VAL-ILE-TYR-THR-ASP-CYS-TRP-VAL-THR-GLY-TRP-GLY-TYR-ARG-LYS-LEU-ARG-ASP-LYS-ILE-GLN-ASN-THR-LEU-GLN-LYS-ALA-LYS-ILE-PRO-LEU-VAL-THR-ASN-GLU-GLU-CYS-GLN-LYS-ARG-TYR-ARG-GLY-HIS-LYS-ILE-THR-HIS-LYS-MET-ILE-CYS-ALA-GLY-TYR-ARG-GLU-GLY-GLY-LYS-ASP-ALA-CYS-LYS-GLY-ASP-SER-GLY-GLY-PRO-LEU-SER-CYS-LYS-HIS-ASN-GLU-VAL-TRP-HIS-LEU-VAL-GLY-ILE-THR-SER-TRP-GLY-GLU-GLY-CYS-ALA-GLN-ARG-GLU-ARG-PRO-GLY-VAL-TYR-THR-ASN-VAL-VAL-GLU-TYR-VAL-ASP-TRP-ILE-LEU-GLU-LYS-THR-GLN-ALA-VAL,HIS-ILE-TYR-PRO-ASP-PHE-PRO-THR-ASP,606,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)[C@H](O)C)Cc1ccccc1)CC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])C,Kd=320uM,3.49485,3.49,1,A,A,1,A,A,0,,K,A,,1,1,606,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.6151323318481445,0.7593865990638733,52.555511474609375,65.58255767822266,1.186699390411377,1.2254538536071775,0.5140839219093323,0.6542500853538513,0.6312481164932251,0.7856706976890564,HIYPDFPTD,Low,"(2.044, 3.548]",train
5EPP,protein-peptide,Q8TEB9 P55072,GAMGSNRPNRLIVDEAINEDNSVVSLSQPKMDELQLFRGDTVLLKGKKRREAVCIVLSDDTCSDEKIRMNRVVRNNLRVRLGDVISIQPCPDVKYGKRIHVLPIDDTVEGITGNLFEVYLKPYFLEAYRPIRKGDIFLVRGGMRAVEFKVVETDPSPYCIVAPDTVIHCEGEPIKREDEEESLN,SPEEMRRQRLHRFDS,GLY-ALA-MET-GLY-SER-ASN-ARG-PRO-ASN-ARG-LEU-ILE-VAL-ASP-GLU-ALA-ILE-ASN-GLU-ASP-ASN-SER-VAL-VAL-SER-LEU-SER-GLN-PRO-LYS-MET-ASP-GLU-LEU-GLN-LEU-PHE-ARG-GLY-ASP-THR-VAL-LEU-LEU-LYS-GLY-LYS-LYS-ARG-ARG-GLU-ALA-VAL-CYS-ILE-VAL-LEU-SER-ASP-ASP-THR-CYS-SER-ASP-GLU-LYS-ILE-ARG-MET-ASN-ARG-VAL-VAL-ARG-ASN-ASN-LEU-ARG-VAL-ARG-LEU-GLY-ASP-VAL-ILE-SER-ILE-GLN-PRO-CYS-PRO-ASP-VAL-LYS-TYR-GLY-LYS-ARG-ILE-HIS-VAL-LEU-PRO-ILE-ASP-ASP-THR-VAL-GLU-GLY-ILE-THR-GLY-ASN-LEU-PHE-GLU-VAL-TYR-LEU-LYS-PRO-TYR-PHE-LEU-GLU-ALA-TYR-ARG-PRO-ILE-ARG-LYS-GLY-ASP-ILE-PHE-LEU-VAL-ARG-GLY-GLY-MET-ARG-ALA-VAL-GLU-PHE-LYS-VAL-VAL-GLU-THR-ASP-PRO-SER-PRO-TYR-CYS-ILE-VAL-ALA-PRO-ASP-THR-VAL-ILE-HIS-CYS-GLU-GLY-GLU-PRO-ILE-LYS-ARG-GLU-ASP-GLU-GLU-GLU-SER-LEU-ASN,SER-PRO-GLU-GLU-MET-ARG-ARG-GLN-ARG-LEU-HIS-ARG-PHE-ASP-SER,184,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)O)Cc1ccccc1)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)[NH3+])CCC(=O)O)CCC(=O)O,Kd=68.9uM,4.161781,4.16,1,A,A,1,A,A,0,,B,A,,1,1,184,15,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9456197619438172,0.7775657773017883,91.10075378417967,86.2408218383789,0.3473212718963623,0.81328284740448,0.9202149510383606,0.841066837310791,0.9048604369163512,0.7345166206359863,SPEEMRRQRLHRFDS,Low,"(4.155, 4.319]",train
5ETF,protein-peptide,P52564 Q16539,MSQERPTFYRQELNKTIWEVPERYQNLSPVGSGAYGSVCAAFDTKTGLRVAVRKLSRPFQSIIHAKRTYRELRLLKHMKHENVIGLLDVFTPARSLEEFNDVYLVTHLMGADLNNIVKCQKLTDDHVQFLIYQILRGLKYIHSADIIHRDLKPSNLAVNEDCELKILDFGLARHTDDEMTGYVATRWYRAPEIMLNWMHYNQTVDIWSVGCIMAELLTGRTLFPGTDHIDQLKLILRLVGTPGAELLKKISSESARNYIQSLTQMPKMNFANVFIGANPLAVDLLEKMLVLDSDKRITAAQALAHAYFAQYHDPDDEPVADPYDQSFESRDLLIDEWKSLTYDEVISFVPPPLDQEEMES,SKGKKRNPGLKIPKA,MET-SER-GLN-GLU-ARG-PRO-THR-PHE-TYR-ARG-GLN-GLU-LEU-ASN-LYS-THR-ILE-TRP-GLU-VAL-PRO-GLU-ARG-TYR-GLN-ASN-LEU-SER-PRO-VAL-GLY-SER-GLY-ALA-TYR-GLY-SER-VAL-CYS-ALA-ALA-PHE-ASP-THR-LYS-THR-GLY-LEU-ARG-VAL-ALA-VAL-ARG-LYS-LEU-SER-ARG-PRO-PHE-GLN-SER-ILE-ILE-HIS-ALA-LYS-ARG-THR-TYR-ARG-GLU-LEU-ARG-LEU-LEU-LYS-HIS-MET-LYS-HIS-GLU-ASN-VAL-ILE-GLY-LEU-LEU-ASP-VAL-PHE-THR-PRO-ALA-ARG-SER-LEU-GLU-GLU-PHE-ASN-ASP-VAL-TYR-LEU-VAL-THR-HIS-LEU-MET-GLY-ALA-ASP-LEU-ASN-ASN-ILE-VAL-LYS-CYS-GLN-LYS-LEU-THR-ASP-ASP-HIS-VAL-GLN-PHE-LEU-ILE-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASP-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-ALA-VAL-ASN-GLU-ASP-CYS-GLU-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-HIS-THR-ASP-ASP-GLU-MET-THR-GLY-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-TRP-MET-HIS-TYR-ASN-GLN-THR-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-ALA-GLU-LEU-LEU-THR-GLY-ARG-THR-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-LEU-LYS-LEU-ILE-LEU-ARG-LEU-VAL-GLY-THR-PRO-GLY-ALA-GLU-LEU-LEU-LYS-LYS-ILE-SER-SER-GLU-SER-ALA-ARG-ASN-TYR-ILE-GLN-SER-LEU-THR-GLN-MET-PRO-LYS-MET-ASN-PHE-ALA-ASN-VAL-PHE-ILE-GLY-ALA-ASN-PRO-LEU-ALA-VAL-ASP-LEU-LEU-GLU-LYS-MET-LEU-VAL-LEU-ASP-SER-ASP-LYS-ARG-ILE-THR-ALA-ALA-GLN-ALA-LEU-ALA-HIS-ALA-TYR-PHE-ALA-GLN-TYR-HIS-ASP-PRO-ASP-ASP-GLU-PRO-VAL-ALA-ASP-PRO-TYR-ASP-GLN-SER-PHE-GLU-SER-ARG-ASP-LEU-LEU-ILE-ASP-GLU-TRP-LYS-SER-LEU-THR-TYR-ASP-GLU-VAL-ILE-SER-PHE-VAL-PRO-PRO-PRO-LEU-ASP-GLN-GLU-GLU-MET-GLU-SER,SER-LYS-GLY-LYS-LYS-ARG-ASN-PRO-GLY-LEU-LYS-ILE-PRO-LYS-ALA,360,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)CC(C)C,Kd=161.5uM,3.791827,3.79,1,A,A,1,A,A,0,,B,A,,1,1,360,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O,0.8114373087882996,0.7433521747589111,83.0511245727539,80.56653594970703,0.5129439234733582,0.9208635687828064,0.8730608820915222,0.863447368144989,0.761031448841095,0.7133283019065857,SKGKKRNPGLKIPKA,Low,"(3.548, 3.924]",val
5EYZ,protein-peptide,P29074,GSSPEKPTPNGGIPHDNLVLIRMKPDENGRFGFNVKGGYDQKMPVIVSRVAPGTPADLCVPRLNEGDQVVLINGRDIAEHTHDQVVLFIKASCERHSGELMLLVRPN,SWESHKSGRETEV,GLY-SER-SER-PRO-GLU-LYS-PRO-THR-PRO-ASN-GLY-GLY-ILE-PRO-HIS-ASP-ASN-LEU-VAL-LEU-ILE-ARG-MET-LYS-PRO-ASP-GLU-ASN-GLY-ARG-PHE-GLY-PHE-ASN-VAL-LYS-GLY-GLY-TYR-ASP-GLN-LYS-MET-PRO-VAL-ILE-VAL-SER-ARG-VAL-ALA-PRO-GLY-THR-PRO-ALA-ASP-LEU-CYS-VAL-PRO-ARG-LEU-ASN-GLU-GLY-ASP-GLN-VAL-VAL-LEU-ILE-ASN-GLY-ARG-ASP-ILE-ALA-GLU-HIS-THR-HIS-ASP-GLN-VAL-VAL-LEU-PHE-ILE-LYS-ALA-SER-CYS-GLU-ARG-HIS-SER-GLY-GLU-LEU-MET-LEU-LEU-VAL-ARG-PRO-ASN,SER-TRP-GLU-SER-HIS-LYS-SER-GLY-ARG-GLU-THR-GLU-VAL,107,13,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)O)[C@H](O)C)CCC(=O)O)CCC[NH+]=C(N)N,Kd=1uM,6.0,6.0,1,A,A,1,A,A,0,,E,A,,1,1,107,13,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9937282204627992,0.8498241901397705,94.08358764648438,88.85127258300781,0.3469287753105163,0.6588900089263916,0.9003431797027588,0.8542938828468323,0.88686603307724,0.7902955412864685,SWESHKSGRETEV,Low,"(5.959, 6.097]",train
5F2U,protein-peptide,O43924,SAKDERAREILRGFKLNWMNLRDAETGKILWQGTEDLSVPGVEHEARVPKKILKCKAVSRELNFSSTEQMEKFRLEQKVYFKGQCLEEWFFEFGFVIPNSTNTWQSLIEAAPESQMMPASVLTGNVIIETKFFDDDLLVSTSRVRLFYV,SSTIC,SER-ALA-LYS-ASP-GLU-ARG-ALA-ARG-GLU-ILE-LEU-ARG-GLY-PHE-LYS-LEU-ASN-TRP-MET-ASN-LEU-ARG-ASP-ALA-GLU-THR-GLY-LYS-ILE-LEU-TRP-GLN-GLY-THR-GLU-ASP-LEU-SER-VAL-PRO-GLY-VAL-GLU-HIS-GLU-ALA-ARG-VAL-PRO-LYS-LYS-ILE-LEU-LYS-CYS-LYS-ALA-VAL-SER-ARG-GLU-LEU-ASN-PHE-SER-SER-THR-GLU-GLN-MET-GLU-LYS-PHE-ARG-LEU-GLU-GLN-LYS-VAL-TYR-PHE-LYS-GLY-GLN-CYS-LEU-GLU-GLU-TRP-PHE-PHE-GLU-PHE-GLY-PHE-VAL-ILE-PRO-ASN-SER-THR-ASN-THR-TRP-GLN-SER-LEU-ILE-GLU-ALA-ALA-PRO-GLU-SER-GLN-MET-MET-PRO-ALA-SER-VAL-LEU-THR-GLY-ASN-VAL-ILE-ILE-GLU-THR-LYS-PHE-PHE-ASP-ASP-ASP-LEU-LEU-VAL-SER-THR-SER-ARG-VAL-ARG-LEU-PHE-TYR-VAL,SER-SER-THR-ILE-CMT,149,5,CC[C@@H]([C@@H](C(=O)N1O[C@]1(CSCC[C@H](CCC[C@@H](CCCC(C)C)C)C)C(=O)OC)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CO)C,Kd=3.7nM,8.431798,8.43,1,A,A,1,A,A,0,,C,A,,1,1,149,5,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NC(CS)C(=O)OC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NC(CS)C(=O)OC)[C@@H](C)O,0.9219457507133484,0.8625240325927734,94.2763900756836,93.6270751953125,0.3203693628311157,0.5250722169876099,0.9227820038795472,0.8935992121696472,0.9014444351196288,0.854755163192749,SSTIC,Moderate,"(8.383, 8.824]",train
5FB0,protein-peptide,P23497 P68431,SDPCPENSNICEVCNKWGRLFCCDTCPRSFHEHCHIPSVEANKNPWSCIFCRIKTIQERSPESQSGHQESEVLMRQMQPEEQLKCEFLLLKVYCDSKSSFFASEPYYNREGSQGPQKPMWLNKVKTSLNEQMYTRVEGFVQDMRLIFHNHKEFYREDKFTRLGIQVQDIFEKNFRNIFAIQETS,ARTKQTARKSTGGKA,SER-ASP-PRO-CYS-PRO-GLU-ASN-SER-ASN-ILE-CYS-GLU-VAL-CYS-ASN-LYS-TRP-GLY-ARG-LEU-PHE-CYS-CYS-ASP-THR-CYS-PRO-ARG-SER-PHE-HIS-GLU-HIS-CYS-HIS-ILE-PRO-SER-VAL-GLU-ALA-ASN-LYS-ASN-PRO-TRP-SER-CYS-ILE-PHE-CYS-ARG-ILE-LYS-THR-ILE-GLN-GLU-ARG-SER-PRO-GLU-SER-GLN-SER-GLY-HIS-GLN-GLU-SER-GLU-VAL-LEU-MET-ARG-GLN-MET-GLN-PRO-GLU-GLU-GLN-LEU-LYS-CYS-GLU-PHE-LEU-LEU-LEU-LYS-VAL-TYR-CYS-ASP-SER-LYS-SER-SER-PHE-PHE-ALA-SER-GLU-PRO-TYR-TYR-ASN-ARG-GLU-GLY-SER-GLN-GLY-PRO-GLN-LYS-PRO-MET-TRP-LEU-ASN-LYS-VAL-LYS-THR-SER-LEU-ASN-GLU-GLN-MET-TYR-THR-ARG-VAL-GLU-GLY-PHE-VAL-GLN-ASP-MET-ARG-LEU-ILE-PHE-HIS-ASN-HIS-LYS-GLU-PHE-TYR-ARG-GLU-ASP-LYS-PHE-THR-ARG-LEU-GLY-ILE-GLN-VAL-GLN-ASP-ILE-PHE-GLU-LYS-ASN-PHE-ARG-ASN-ILE-PHE-ALA-ILE-GLN-GLU-THR-SER,ALA-ARG-TPO-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,184,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=3.4uM,5.468521,5.47,1,A,A,1,A,A,0,,D,A,,1,1,184,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.7632712125778198,0.8113515377044678,85.06318664550781,86.46192932128906,0.4446069598197937,0.6472246050834656,0.8793207406997681,0.872934103012085,0.6871482729911804,0.7959558367729187,ARTKQTARKSTGGKA,Low,"(5.463, 5.6]",train
5FB1,protein-peptide,P23497 P68431,SDPCPENSNICEVCNKWGRLFCCDTCPRSFHEHCHIPSVEANKNPWSCIFCRIKTIQERCPESQSGHQESEVLMRQMLPEEQLKCEFLLLKVYCDSKSCFFASEPYYNREGPQKPMWLNKVKTSLNEQTYTRVEGFVQDMRLIFHNHKEFYREDKFTRLGIQVQDIFEKNFRNIFAIQETS,ARTKQTARKSTGGKA,SER-ASP-PRO-CYS-PRO-GLU-ASN-SER-ASN-ILE-CYS-GLU-VAL-CYS-ASN-LYS-TRP-GLY-ARG-LEU-PHE-CYS-CYS-ASP-THR-CYS-PRO-ARG-SER-PHE-HIS-GLU-HIS-CYS-HIS-ILE-PRO-SER-VAL-GLU-ALA-ASN-LYS-ASN-PRO-TRP-SER-CYS-ILE-PHE-CYS-ARG-ILE-LYS-THR-ILE-GLN-GLU-ARG-CYS-PRO-GLU-SER-GLN-SER-GLY-HIS-GLN-GLU-SER-GLU-VAL-LEU-MET-ARG-GLN-MET-LEU-PRO-GLU-GLU-GLN-LEU-LYS-CYS-GLU-PHE-LEU-LEU-LEU-LYS-VAL-TYR-CYS-ASP-SER-LYS-SER-CYS-PHE-PHE-ALA-SER-GLU-PRO-TYR-TYR-ASN-ARG-GLU-GLY-PRO-GLN-LYS-PRO-MET-TRP-LEU-ASN-LYS-VAL-LYS-THR-SER-LEU-ASN-GLU-GLN-THR-TYR-THR-ARG-VAL-GLU-GLY-PHE-VAL-GLN-ASP-MET-ARG-LEU-ILE-PHE-HIS-ASN-HIS-LYS-GLU-PHE-TYR-ARG-GLU-ASP-LYS-PHE-THR-ARG-LEU-GLY-ILE-GLN-VAL-GLN-ASP-ILE-PHE-GLU-LYS-ASN-PHE-ARG-ASN-ILE-PHE-ALA-ILE-GLN-GLU-THR-SER,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,181,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=1.2uM,5.920819,5.92,1,A,A,1,A,A,0,,C,A,,1,1,181,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.7580953240394592,0.8067293167114258,87.15570831298828,88.91050720214844,0.4327687323093414,0.6691093444824219,0.8795979022979736,0.8667259216308594,0.6798880696296692,0.7917301058769226,ARTKQTARKSTGGKA,Low,"(5.821, 5.959]",train
5FJX,protein-peptide,P35197 P43621,GPLGSEEDVPENNGILISIKEVINAEFSRDGTIHSSELKGVLELRINDHDLSHSNLKLADSIDVRDKSFQFKTHPNIDKQSFLSTKLISLRDKSKAFPANDQSLGVLRWRKVAPAEDDSLIPLTLTTAVSPSESQQGFDVIIEYESVLETELADVIFTIPVFPQEPVDINTESSTCSDAEVVNMDQEMGTSIKISKIAANDAGALAFTIEAPYEDALYPMTVSFQESTRDKLAKSFTGMAIQSVVMANDHDQELPYDVITSLKSDEYLVQ,DEDKWDDF,GLY-PRO-LEU-GLY-SER-GLU-GLU-ASP-VAL-PRO-GLU-ASN-ASN-GLY-ILE-LEU-ILE-SER-ILE-LYS-GLU-VAL-ILE-ASN-ALA-GLU-PHE-SER-ARG-ASP-GLY-THR-ILE-HIS-SER-SER-GLU-LEU-LYS-GLY-VAL-LEU-GLU-LEU-ARG-ILE-ASN-ASP-HIS-ASP-LEU-SER-HIS-SER-ASN-LEU-LYS-LEU-ALA-ASP-SER-ILE-ASP-VAL-ARG-ASP-LYS-SER-PHE-GLN-PHE-LYS-THR-HIS-PRO-ASN-ILE-ASP-LYS-GLN-SER-PHE-LEU-SER-THR-LYS-LEU-ILE-SER-LEU-ARG-ASP-LYS-SER-LYS-ALA-PHE-PRO-ALA-ASN-ASP-GLN-SER-LEU-GLY-VAL-LEU-ARG-TRP-ARG-LYS-VAL-ALA-PRO-ALA-GLU-ASP-ASP-SER-LEU-ILE-PRO-LEU-THR-LEU-THR-THR-ALA-VAL-SER-PRO-SER-GLU-SER-GLN-GLN-GLY-PHE-ASP-VAL-ILE-ILE-GLU-TYR-GLU-SER-VAL-LEU-GLU-THR-GLU-LEU-ALA-ASP-VAL-ILE-PHE-THR-ILE-PRO-VAL-PHE-PRO-GLN-GLU-PRO-VAL-ASP-ILE-ASN-THR-GLU-SER-SER-THR-CYS-SER-ASP-ALA-GLU-VAL-VAL-ASN-MSE-ASP-GLN-GLU-MSE-GLY-THR-SER-ILE-LYS-ILE-SER-LYS-ILE-ALA-ALA-ASN-ASP-ALA-GLY-ALA-LEU-ALA-PHE-THR-ILE-GLU-ALA-PRO-TYR-GLU-ASP-ALA-LEU-TYR-PRO-MSE-THR-VAL-SER-PHE-GLN-GLU-SER-THR-ARG-ASP-LYS-LEU-ALA-LYS-SER-PHE-THR-GLY-MSE-ALA-ILE-GLN-SER-VAL-VAL-MSE-ALA-ASN-ASP-HIS-ASP-GLN-GLU-LEU-PRO-TYR-ASP-VAL-ILE-THR-SER-LEU-LYS-SER-ASP-GLU-TYR-LEU-VAL-GLN,ASP-GLU-ASP-LYS-TRP-ASP-ASP-PHE,270,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)[NH3+],Kd=11uM,4.958607,4.96,1,A,A,1,A,A,0,,D,A,,0,1,270,8,0,NCCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8094313740730286,0.8517687320709229,85.68267059326172,84.9797134399414,0.4784790575504303,0.6759912967681885,0.8726804852485657,0.8691091537475586,0.7621442079544067,0.8335446119308472,DEDKWDDF,Low,"(4.866, 5.014]",val
5FOS,protein-peptide,O74036,MATIGRISTGSKSLDKLLGGGIETQAITEVFGEFGSGKTQLAHTLAVMVQLPPEEGGLNGSVMWIDTENTFRPERIREIAQNRGLDPDEVLKHIAYARAFNSNHQMLLVQQAEDMIKELLNTDRPVKLLIVDSLTSHFRSEYIGRGALAERQQKLAKHLADLHRLANLYDIAVFVTNQVQANGGHILAHSATLRVYLRKGKGGKRIARLIDAPHLPEGEAVFSITEKGIED,NLGTFMRADEYLKKRA,MET-ALA-THR-ILE-GLY-ARG-ILE-SER-THR-GLY-SER-LYS-SER-LEU-ASP-LYS-LEU-LEU-GLY-GLY-GLY-ILE-GLU-THR-GLN-ALA-ILE-THR-GLU-VAL-PHE-GLY-GLU-PHE-GLY-SER-GLY-LYS-THR-GLN-LEU-ALA-HIS-THR-LEU-ALA-VAL-MET-VAL-GLN-LEU-PRO-PRO-GLU-GLU-GLY-GLY-LEU-ASN-GLY-SER-VAL-MET-TRP-ILE-ASP-THR-GLU-ASN-THR-PHE-ARG-PRO-GLU-ARG-ILE-ARG-GLU-ILE-ALA-GLN-ASN-ARG-GLY-LEU-ASP-PRO-ASP-GLU-VAL-LEU-LYS-HIS-ILE-ALA-TYR-ALA-ARG-ALA-PHE-ASN-SER-ASN-HIS-GLN-MET-LEU-LEU-VAL-GLN-GLN-ALA-GLU-ASP-MET-ILE-LYS-GLU-LEU-LEU-ASN-THR-ASP-ARG-PRO-VAL-LYS-LEU-LEU-ILE-VAL-ASP-SER-LEU-THR-SER-HIS-PHE-ARG-SER-GLU-TYR-ILE-GLY-ARG-GLY-ALA-LEU-ALA-GLU-ARG-GLN-GLN-LYS-LEU-ALA-LYS-HIS-LEU-ALA-ASP-LEU-HIS-ARG-LEU-ALA-ASN-LEU-TYR-ASP-ILE-ALA-VAL-PHE-VAL-THR-ASN-GLN-VAL-GLN-ALA-ASN-GLY-GLY-HIS-ILE-LEU-ALA-HIS-SER-ALA-THR-LEU-ARG-VAL-TYR-LEU-ARG-LYS-GLY-LYS-GLY-GLY-LYS-ARG-ILE-ALA-ARG-LEU-ILE-ASP-ALA-PRO-HIS-LEU-PRO-GLU-GLY-GLU-ALA-VAL-PHE-SER-ILE-THR-GLU-LYS-GLY-ILE-GLU-ASP,ASN-LEU-GLY-THR-PHE-MET-ARG-ALA-ASP-GLU-TYR-LEU-LYS-LYS-ARG-ALA-NH2,231,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)CCC[NH+]=C(N)N)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCSC)CCC[NH+]=C(N)N)C)CC(=O)O)CCC(=O)O)Cc1ccc(cc1)O)CC(C)C,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,C,A,,1,1,231,17,0,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,0.9743090271949768,0.733668863773346,93.6288604736328,90.37987518310548,0.3552497029304504,0.9259544014930724,0.9428805112838744,0.8538359999656677,0.9416803121566772,0.7036270499229431,NLGTFMRADEYLKKRA,Low,"(5.699, 5.821]",train
5FPI,protein-peptide,P13612 P84092,MIGGLFIYNHKGEVLISRVYRDDIGRNAVDAFRVNVIHARQQVRSPVTNIARTSFFHVKRSNIWLAAVTKQNVNAAMVFEFLYKMCDVMAAYFGKISEENIKNNFVLIYELLDEILDFGYPQNSETGALKTFITQQGIKSQHQTKEEQSQITSQVTGQIGWRREGIKYRRNELFLDVLESVNLLMSPQGQVLSAHVSGRVVMKSYLSGMPECKFGMNDKIVIEKQGKGTADETSKSMEQKLISEEDLGKQSIAIDDCTFHQCVRLSKFDSERSISFIPPDGEFELMRYRTTKDIILPFRVIPLVREVGRTKLEVKVVIKSNFKPSLLAQKIEVRIPTPLNTSGVQVICMKGKAKYKASENAIVWKIKRMAGMKESQISAEIELLPTNDKKKWARPPISMNFEVPFAPSGLKVRYLKVFEPKLNYSDHDVIKWVRYIGRSGIYETRC,QYKSILQE,MET-ILE-GLY-GLY-LEU-PHE-ILE-TYR-ASN-HIS-LYS-GLY-GLU-VAL-LEU-ILE-SER-ARG-VAL-TYR-ARG-ASP-ASP-ILE-GLY-ARG-ASN-ALA-VAL-ASP-ALA-PHE-ARG-VAL-ASN-VAL-ILE-HIS-ALA-ARG-GLN-GLN-VAL-ARG-SER-PRO-VAL-THR-ASN-ILE-ALA-ARG-THR-SER-PHE-PHE-HIS-VAL-LYS-ARG-SER-ASN-ILE-TRP-LEU-ALA-ALA-VAL-THR-LYS-GLN-ASN-VAL-ASN-ALA-ALA-MET-VAL-PHE-GLU-PHE-LEU-TYR-LYS-MET-CYS-ASP-VAL-MET-ALA-ALA-TYR-PHE-GLY-LYS-ILE-SER-GLU-GLU-ASN-ILE-LYS-ASN-ASN-PHE-VAL-LEU-ILE-TYR-GLU-LEU-LEU-ASP-GLU-ILE-LEU-ASP-PHE-GLY-TYR-PRO-GLN-ASN-SER-GLU-THR-GLY-ALA-LEU-LYS-THR-PHE-ILE-THR-GLN-GLN-GLY-ILE-LYS-SER-GLN-HIS-GLN-THR-LYS-GLU-GLU-GLN-SER-GLN-ILE-THR-SER-GLN-VAL-THR-GLY-GLN-ILE-GLY-TRP-ARG-ARG-GLU-GLY-ILE-LYS-TYR-ARG-ARG-ASN-GLU-LEU-PHE-LEU-ASP-VAL-LEU-GLU-SER-VAL-ASN-LEU-LEU-MET-SER-PRO-GLN-GLY-GLN-VAL-LEU-SER-ALA-HIS-VAL-SER-GLY-ARG-VAL-VAL-MET-LYS-SER-TYR-LEU-SER-GLY-MET-PRO-GLU-CYS-LYS-PHE-GLY-MET-ASN-ASP-LYS-ILE-VAL-ILE-GLU-LYS-GLN-GLY-LYS-GLY-THR-ALA-ASP-GLU-THR-SER-LYS-SER-MET-GLU-GLN-LYS-LEU-ILE-SER-GLU-GLU-ASP-LEU-GLY-LYS-GLN-SER-ILE-ALA-ILE-ASP-ASP-CYS-THR-PHE-HIS-GLN-CYS-VAL-ARG-LEU-SER-LYS-PHE-ASP-SER-GLU-ARG-SER-ILE-SER-PHE-ILE-PRO-PRO-ASP-GLY-GLU-PHE-GLU-LEU-MET-ARG-TYR-ARG-THR-THR-LYS-ASP-ILE-ILE-LEU-PRO-PHE-ARG-VAL-ILE-PRO-LEU-VAL-ARG-GLU-VAL-GLY-ARG-THR-LYS-LEU-GLU-VAL-LYS-VAL-VAL-ILE-LYS-SER-ASN-PHE-LYS-PRO-SER-LEU-LEU-ALA-GLN-LYS-ILE-GLU-VAL-ARG-ILE-PRO-THR-PRO-LEU-ASN-THR-SER-GLY-VAL-GLN-VAL-ILE-CYS-MET-LYS-GLY-LYS-ALA-LYS-TYR-LYS-ALA-SER-GLU-ASN-ALA-ILE-VAL-TRP-LYS-ILE-LYS-ARG-MET-ALA-GLY-MET-LYS-GLU-SER-GLN-ILE-SER-ALA-GLU-ILE-GLU-LEU-LEU-PRO-THR-ASN-ASP-LYS-LYS-LYS-TRP-ALA-ARG-PRO-PRO-ILE-SER-MET-ASN-PHE-GLU-VAL-PRO-PHE-ALA-PRO-SER-GLY-LEU-LYS-VAL-ARG-TYR-LEU-LYS-VAL-PHE-GLU-PRO-LYS-LEU-ASN-TYR-SER-ASP-HIS-ASP-VAL-ILE-LYS-TRP-VAL-ARG-TYR-ILE-GLY-ARG-SER-GLY-ILE-TYR-GLU-THR-ARG-CYS,GLN-TYR-LYS-SER-ILE-LEU-GLN-GLU,446,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](CC)C)CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])Cc1ccc(cc1)O,Kd=72uM,4.142668,4.14,1,A,A,1,A,A,0,,B,A,,1,1,446,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8564016222953796,0.8419113755226135,67.82696533203125,61.6751823425293,0.685157060623169,0.8025612831115723,0.7315676808357239,0.7544323801994324,0.8490638136863708,0.8147339820861816,QYKSILQE,Low,"(3.924, 4.155]",train
5FYQ,protein-peptide,Q8IXJ6 P62826,GSGMMAEPDPSHPLETQAGKVQEAQDSDSDSEGGAAGGEADMDFLRNLFSQTLSLGSQKERLLDELTLEGVARYMQSERCRRVICLVGAGISTSAGIPDFRSPSTGLYDNLEKYHLPYPEAIFEISYFKKHPEPFFALAKELYPGQFKPTICHYFMRLLKDKGLLLRCYTQNIDTLERIAGLEQEDLVEAHGTFYTSHCVSASCRHEYPLSWMKEKIFSEVTPKCEDCQSLVKPDIVFFGESLPARFFSCMQSDFLKVDLLLVMGTSLQVQPFASLISKAPLSTPRLLINKEKAGQSDPFLGMIMGLGGGMDFDSKKAYRDVAWLGECDQGCLALAELLGWKKELEDLVRREHASIDAQS,LTGEFEKKYVATL,GLY-SER-GLY-MET-MET-ALA-GLU-PRO-ASP-PRO-SER-HIS-PRO-LEU-GLU-THR-GLN-ALA-GLY-LYS-VAL-GLN-GLU-ALA-GLN-ASP-SER-ASP-SER-ASP-SER-GLU-GLY-GLY-ALA-ALA-GLY-GLY-GLU-ALA-ASP-MET-ASP-PHE-LEU-ARG-ASN-LEU-PHE-SER-GLN-THR-LEU-SER-LEU-GLY-SER-GLN-LYS-GLU-ARG-LEU-LEU-ASP-GLU-LEU-THR-LEU-GLU-GLY-VAL-ALA-ARG-TYR-MET-GLN-SER-GLU-ARG-CYS-ARG-ARG-VAL-ILE-CYS-LEU-VAL-GLY-ALA-GLY-ILE-SER-THR-SER-ALA-GLY-ILE-PRO-ASP-PHE-ARG-SER-PRO-SER-THR-GLY-LEU-TYR-ASP-ASN-LEU-GLU-LYS-TYR-HIS-LEU-PRO-TYR-PRO-GLU-ALA-ILE-PHE-GLU-ILE-SER-TYR-PHE-LYS-LYS-HIS-PRO-GLU-PRO-PHE-PHE-ALA-LEU-ALA-LYS-GLU-LEU-TYR-PRO-GLY-GLN-PHE-LYS-PRO-THR-ILE-CYS-HIS-TYR-PHE-MET-ARG-LEU-LEU-LYS-ASP-LYS-GLY-LEU-LEU-LEU-ARG-CYS-TYR-THR-GLN-ASN-ILE-ASP-THR-LEU-GLU-ARG-ILE-ALA-GLY-LEU-GLU-GLN-GLU-ASP-LEU-VAL-GLU-ALA-HIS-GLY-THR-PHE-TYR-THR-SER-HIS-CYS-VAL-SER-ALA-SER-CYS-ARG-HIS-GLU-TYR-PRO-LEU-SER-TRP-MET-LYS-GLU-LYS-ILE-PHE-SER-GLU-VAL-THR-PRO-LYS-CYS-GLU-ASP-CYS-GLN-SER-LEU-VAL-LYS-PRO-ASP-ILE-VAL-PHE-PHE-GLY-GLU-SER-LEU-PRO-ALA-ARG-PHE-PHE-SER-CYS-MET-GLN-SER-ASP-PHE-LEU-LYS-VAL-ASP-LEU-LEU-LEU-VAL-MET-GLY-THR-SER-LEU-GLN-VAL-GLN-PRO-PHE-ALA-SER-LEU-ILE-SER-LYS-ALA-PRO-LEU-SER-THR-PRO-ARG-LEU-LEU-ILE-ASN-LYS-GLU-LYS-ALA-GLY-GLN-SER-ASP-PRO-PHE-LEU-GLY-MET-ILE-MET-GLY-LEU-GLY-GLY-GLY-MET-ASP-PHE-ASP-SER-LYS-LYS-ALA-TYR-ARG-ASP-VAL-ALA-TRP-LEU-GLY-GLU-CYS-ASP-GLN-GLY-CYS-LEU-ALA-LEU-ALA-GLU-LEU-LEU-GLY-TRP-LYS-LYS-GLU-LEU-GLU-ASP-LEU-VAL-ARG-ARG-GLU-HIS-ALA-SER-ILE-ASP-ALA-GLN-SER,LEU-THR-GLY-GLU-PHE-GLU-FAK-LYS-TYR-VAL-ALA-THR-LEU,360,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CCC(=O)O)Cc1ccccc1)CCC(=O)O)CCCCNC(=O)C(F)(F)F,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,C,A,,0,1,360,13,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C(CCCCNC(=O)C(F)(F)F)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C(CCCCNC(=O)C(F)(F)F)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.7971426844596863,0.8643620610237122,73.15251922607422,69.02101135253906,0.6038347482681274,0.7767136693000793,0.7758528590202332,0.803165078163147,0.7069557905197144,0.798064112663269,LTGEFEKKYVATL,Low,"(5.821, 5.959]",train
5GGP,protein-peptide,Q14118 Q8WZA1,GPLGSGSGPRRVLDVEVYSSRSKVYVAVDGTTVLEDEAREQGRGIHVIVLNQATGHVMAKRVFDTYSPHEDEAMVLFLNMVAPGRVLICTVKDEGSFHLKDTAKALLRSLGSQAGPALGWRDTWAFVGRKGGPVFGEKHSKSPALSSWGDPVLLKTDVPLSSAE,ATPTPVTAIG,GLY-PRO-LEU-GLY-SER-GLY-SER-GLY-PRO-ARG-ARG-VAL-LEU-ASP-VAL-GLU-VAL-TYR-SER-SER-ARG-SER-LYS-VAL-TYR-VAL-ALA-VAL-ASP-GLY-THR-THR-VAL-LEU-GLU-ASP-GLU-ALA-ARG-GLU-GLN-GLY-ARG-GLY-ILE-HIS-VAL-ILE-VAL-LEU-ASN-GLN-ALA-THR-GLY-HIS-VAL-MET-ALA-LYS-ARG-VAL-PHE-ASP-THR-TYR-SER-PRO-HIS-GLU-ASP-GLU-ALA-MET-VAL-LEU-PHE-LEU-ASN-MET-VAL-ALA-PRO-GLY-ARG-VAL-LEU-ILE-CYS-THR-VAL-LYS-ASP-GLU-GLY-SER-PHE-HIS-LEU-LYS-ASP-THR-ALA-LYS-ALA-LEU-LEU-ARG-SER-LEU-GLY-SER-GLN-ALA-GLY-PRO-ALA-LEU-GLY-TRP-ARG-ASP-THR-TRP-ALA-PHE-VAL-GLY-ARG-LYS-GLY-GLY-PRO-VAL-PHE-GLY-GLU-LYS-HIS-SER-LYS-SER-PRO-ALA-LEU-SER-SER-TRP-GLY-ASP-PRO-VAL-LEU-LEU-LYS-THR-ASP-VAL-PRO-LEU-SER-SER-ALA-GLU,ALA-THR-PRO-THR-PRO-VAL-THR-ALA-ILE-GLY,164,10,[NH3+][C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)[C@H](O)C)[C@H](O)C,Kd=0.5mM,3.30103,3.3,1,A,A,1,A,A,0,,C,A,,1,1,164,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)NCC(=O)O,0.909917950630188,0.8471900820732117,94.22180938720705,94.42808532714844,0.3310308754444122,0.4577080607414245,0.9307814836502076,0.9030331969261168,0.8472307324409485,0.8065524697303772,ATPTPVTAIG,Low,"(2.044, 3.548]",train
5GMI,protein-peptide,Q9D8B7 Q99JX3,MSYYHHHHHHLESTSLYKKAGFLVPRGSGSSQSVEIPGGGTEGYHVLRVQENSPGHRAGLEPFFDFIVSINGSRLNKDNDTLKDLLKANVEKPVKMLIYSSKTLELREASVTPSNLWGGQGLLGVSIRFCSFDGANENVWHVLEVESNSPAALAGLRPHSDYIIGADTVMNESEDLFSLIETHEAKPLKLYVYNTDTDNCREVIITPNSAWGGEGSLGCGIGYGYLHRIPTRPFE,NYIRTSEEGDFRHKSSFVI,MET-SER-TYR-TYR-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-SER-THR-SER-LEU-TYR-LYS-LYS-ALA-GLY-PHE-LEU-VAL-PRO-ARG-GLY-SER-GLY-SER-SER-GLN-SER-VAL-GLU-ILE-PRO-GLY-GLY-GLY-THR-GLU-GLY-TYR-HIS-VAL-LEU-ARG-VAL-GLN-GLU-ASN-SER-PRO-GLY-HIS-ARG-ALA-GLY-LEU-GLU-PRO-PHE-PHE-ASP-PHE-ILE-VAL-SER-ILE-ASN-GLY-SER-ARG-LEU-ASN-LYS-ASP-ASN-ASP-THR-LEU-LYS-ASP-LEU-LEU-LYS-ALA-ASN-VAL-GLU-LYS-PRO-VAL-LYS-MET-LEU-ILE-TYR-SER-SER-LYS-THR-LEU-GLU-LEU-ARG-GLU-ALA-SER-VAL-THR-PRO-SER-ASN-LEU-TRP-GLY-GLY-GLN-GLY-LEU-LEU-GLY-VAL-SER-ILE-ARG-PHE-CYS-SER-PHE-ASP-GLY-ALA-ASN-GLU-ASN-VAL-TRP-HIS-VAL-LEU-GLU-VAL-GLU-SER-ASN-SER-PRO-ALA-ALA-LEU-ALA-GLY-LEU-ARG-PRO-HIS-SER-ASP-TYR-ILE-ILE-GLY-ALA-ASP-THR-VAL-MET-ASN-GLU-SER-GLU-ASP-LEU-PHE-SER-LEU-ILE-GLU-THR-HIS-GLU-ALA-LYS-PRO-LEU-LYS-LEU-TYR-VAL-TYR-ASN-THR-ASP-THR-ASP-ASN-CYS-ARG-GLU-VAL-ILE-ILE-THR-PRO-ASN-SER-ALA-TRP-GLY-GLY-GLU-GLY-SER-LEU-GLY-CYS-GLY-ILE-GLY-TYR-GLY-TYR-LEU-HIS-ARG-ILE-PRO-THR-ARG-PRO-PHE-GLU,ASN-TYR-ILE-ARG-THR-SER-GLU-GLU-GLY-ASP-PHE-ARG-HIS-LYS-SER-SER-PHE-VAL-ILE,235,19,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C(C)C)Cc1ccccc1)NC(=O)[C@H](CO)[NH3+],IC50=12uM,4.920819,4.92,1,A,A,1,A,A,0,,C,A,,1,1,235,19,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,0.8864709734916687,0.7282646298408508,72.33238983154297,70.50482177734375,0.6239052414894104,1.21685791015625,0.7535566091537476,0.7186193466186523,0.7942073345184326,0.6429099440574646,NYIRTSEEGDFRHKSSFVI,Low,"(4.866, 5.014]",train
5GMJ,protein-peptide,Q9JI59 Q99JX3,MSYYHHHHHHLESTSLYKKAGFLVPRGSGSSQSVEIPGGGTEGYHVLRVQENSPGHRAGLEPFFDFIVSINGSRLNKDNDTLKDLLKANVEKPVKMLIYSSKTLELREASVTPSNLWGGQGLLGVSIRFCSFDGANENVWHVLEVESNSPAALAGLRPHSDYIIGADTVMNESEDLFSLIETHEAKPLKLYVYNTDTDNCREVIITPNSAWGGEGSLGCGIGYGYLHRIPTRPFE,SKVTTMSENDFKHTKSFII,MET-SER-TYR-TYR-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-SER-THR-SER-LEU-TYR-LYS-LYS-ALA-GLY-PHE-LEU-VAL-PRO-ARG-GLY-SER-GLY-SER-SER-GLN-SER-VAL-GLU-ILE-PRO-GLY-GLY-GLY-THR-GLU-GLY-TYR-HIS-VAL-LEU-ARG-VAL-GLN-GLU-ASN-SER-PRO-GLY-HIS-ARG-ALA-GLY-LEU-GLU-PRO-PHE-PHE-ASP-PHE-ILE-VAL-SER-ILE-ASN-GLY-SER-ARG-LEU-ASN-LYS-ASP-ASN-ASP-THR-LEU-LYS-ASP-LEU-LEU-LYS-ALA-ASN-VAL-GLU-LYS-PRO-VAL-LYS-MET-LEU-ILE-TYR-SER-SER-LYS-THR-LEU-GLU-LEU-ARG-GLU-ALA-SER-VAL-THR-PRO-SER-ASN-LEU-TRP-GLY-GLY-GLN-GLY-LEU-LEU-GLY-VAL-SER-ILE-ARG-PHE-CYS-SER-PHE-ASP-GLY-ALA-ASN-GLU-ASN-VAL-TRP-HIS-VAL-LEU-GLU-VAL-GLU-SER-ASN-SER-PRO-ALA-ALA-LEU-ALA-GLY-LEU-ARG-PRO-HIS-SER-ASP-TYR-ILE-ILE-GLY-ALA-ASP-THR-VAL-MET-ASN-GLU-SER-GLU-ASP-LEU-PHE-SER-LEU-ILE-GLU-THR-HIS-GLU-ALA-LYS-PRO-LEU-LYS-LEU-TYR-VAL-TYR-ASN-THR-ASP-THR-ASP-ASN-CYS-ARG-GLU-VAL-ILE-ILE-THR-PRO-ASN-SER-ALA-TRP-GLY-GLY-GLU-GLY-SER-LEU-GLY-CYS-GLY-ILE-GLY-TYR-GLY-TYR-LEU-HIS-ARG-ILE-PRO-THR-ARG-PRO-PHE-GLU,SER-LYS-VAL-THR-THR-MET-SER-GLU-ASN-ASP-PHE-LYS-HIS-THR-LYS-SER-PHE-ILE-ILE,235,19,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)[C@H](CC)C)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+],IC50=8.4uM,5.075721,5.08,1,A,A,1,A,A,0,,C,A,,0,1,235,19,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,0.7732507586479187,0.7411858439445496,71.90907287597656,72.77202606201172,0.7030037045478821,1.1452701091766355,0.7367560863494873,0.7243619561195374,0.6568822860717773,0.6576257944107056,SKVTTMSENDFKHTKSFII,Low,"(5.014, 5.105]",train
5GMV,protein-peptide,Q8IVP5 Q9GZQ8,MPSEKTFKQRRTFEQRVEDVRLIREQHPTKIPVIIERYKGEKQLPVLDKTKFLVPDHVNMSELIKIIRRRLQLNANQAFFLLVNGHSMVSVSTPISEVYESEKDEDGFLYMVYASQETFGMKLSV,DSYEVLDL,MET-PRO-SER-GLU-LYS-THR-PHE-LYS-GLN-ARG-ARG-THR-PHE-GLU-GLN-ARG-VAL-GLU-ASP-VAL-ARG-LEU-ILE-ARG-GLU-GLN-HIS-PRO-THR-LYS-ILE-PRO-VAL-ILE-ILE-GLU-ARG-TYR-LYS-GLY-GLU-LYS-GLN-LEU-PRO-VAL-LEU-ASP-LYS-THR-LYS-PHE-LEU-VAL-PRO-ASP-HIS-VAL-ASN-MET-SER-GLU-LEU-ILE-LYS-ILE-ILE-ARG-ARG-ARG-LEU-GLN-LEU-ASN-ALA-ASN-GLN-ALA-PHE-PHE-LEU-LEU-VAL-ASN-GLY-HIS-SER-MET-VAL-SER-VAL-SER-THR-PRO-ILE-SER-GLU-VAL-TYR-GLU-SER-GLU-LYS-ASP-GLU-ASP-GLY-PHE-LEU-TYR-MET-VAL-TYR-ALA-SER-GLN-GLU-THR-PHE-GLY-MET-LYS-LEU-SER-VAL,ASP-SEP-TYR-GLU-VAL-LEU-ASP-LEU,125,8,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])COP(O)(O)O)Cc1ccc(cc1)O)CCC(=O)O)C,Kd=0.59uM,6.229148,6.23,1,A,A,1,A,A,0,,C,A,,0,1,125,8,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C,0.862609326839447,0.8534603118896484,88.75738525390625,87.93890380859375,0.427673190832138,0.5580562353134155,0.8433070778846741,0.8861474990844727,0.829840898513794,0.8452884554862976,DSYEVLDL,Low,"(6.097, 6.26]",train
5GOW,protein-peptide,Q14186 P32780,GSMATSSEEVLLIVKKVRQKKQDGALYLMAERIAWAPEGKDRFTISHMYADIKCQKISPEGKAKIQLQLVLHAGDTTNFHFSNESTAVKERDAVKDLLQQLLPKFKRKAN,YVGEDDEEDDDFNENDEDD,GLY-SER-MET-ALA-THR-SER-SER-GLU-GLU-VAL-LEU-LEU-ILE-VAL-LYS-LYS-VAL-ARG-GLN-LYS-LYS-GLN-ASP-GLY-ALA-LEU-TYR-LEU-MET-ALA-GLU-ARG-ILE-ALA-TRP-ALA-PRO-GLU-GLY-LYS-ASP-ARG-PHE-THR-ILE-SER-HIS-MET-TYR-ALA-ASP-ILE-LYS-CYS-GLN-LYS-ILE-SER-PRO-GLU-GLY-LYS-ALA-LYS-ILE-GLN-LEU-GLN-LEU-VAL-LEU-HIS-ALA-GLY-ASP-THR-THR-ASN-PHE-HIS-PHE-SER-ASN-GLU-SER-THR-ALA-VAL-LYS-GLU-ARG-ASP-ALA-VAL-LYS-ASP-LEU-LEU-GLN-GLN-LEU-LEU-PRO-LYS-PHE-LYS-ARG-LYS-ALA-ASN,TYR-VAL-GLY-GLU-ASP-ASP-GLU-GLU-ASP-ASP-ASP-PHE-ASN-GLU-ASN-ASP-GLU-ASP-ASP,110,19,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CC(=O)N)CCC(=O)O)CC(=O)N)Cc1ccccc1)CC(=O)O)CC(=O)O)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCC(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O,Kd=35.3uM,4.452225,4.45,1,A,A,1,A,A,0,,A,B,,1,1,110,19,0,CC(C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.921023428440094,0.7395506501197815,91.0077896118164,88.05366516113281,0.3835768401622772,0.8492959141731262,0.8934379816055298,0.8099239468574524,0.8358654975891113,0.7219573259353638,YVGEDDEEDDDFNENDEDD,Low,"(4.319, 4.456]",train
5GP7,protein-peptide,Q9UHP3 O95271,GPGSDLLRGDAALLDAAKKGCLARVQKLCTPENINCRDTQGRNSTPLHLAAGYNNLEVAEYLLEHGADVNAQDKGGLIPLHNAASYGHVDIAALLIKYNTCVNATDKWAFTPLHEAAQKGRTQLCALLLAHGADPTMKNQEGQTPLDLATADDIRALLIDAMPENLYFQ,SLSRTPADGR,GLY-PRO-GLY-SER-ASP-LEU-LEU-ARG-GLY-ASP-ALA-ALA-LEU-LEU-ASP-ALA-ALA-LYS-LYS-GLY-CYS-LEU-ALA-ARG-VAL-GLN-LYS-LEU-CYS-THR-PRO-GLU-ASN-ILE-ASN-CYS-ARG-ASP-THR-GLN-GLY-ARG-ASN-SER-THR-PRO-LEU-HIS-LEU-ALA-ALA-GLY-TYR-ASN-ASN-LEU-GLU-VAL-ALA-GLU-TYR-LEU-LEU-GLU-HIS-GLY-ALA-ASP-VAL-ASN-ALA-GLN-ASP-LYS-GLY-GLY-LEU-ILE-PRO-LEU-HIS-ASN-ALA-ALA-SER-TYR-GLY-HIS-VAL-ASP-ILE-ALA-ALA-LEU-LEU-ILE-LYS-TYR-ASN-THR-CYS-VAL-ASN-ALA-THR-ASP-LYS-TRP-ALA-PHE-THR-PRO-LEU-HIS-GLU-ALA-ALA-GLN-LYS-GLY-ARG-THR-GLN-LEU-CYS-ALA-LEU-LEU-LEU-ALA-HIS-GLY-ALA-ASP-PRO-THR-MET-LYS-ASN-GLN-GLU-GLY-GLN-THR-PRO-LEU-ASP-LEU-ALA-THR-ALA-ASP-ASP-ILE-ARG-ALA-LEU-LEU-ILE-ASP-ALA-MET-PRO-GLU-ASN-LEU-TYR-PHE-GLN,SER-LEU-SER-ARG-THR-PRO-ALA-ASP-GLY-ARG,169,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(=O)O)C)[C@H](O)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=7.1uM,5.148742,5.15,1,A,A,1,A,A,0,,B,A,,1,1,169,10,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)NCC(=O)O,0.9516410231590272,0.8122178316116333,95.4380111694336,92.59061431884766,0.2951184511184692,0.6124321222305298,0.9506304860115052,0.8952639102935791,0.9169774055480956,0.7914563417434692,SLSRTPADGR,Low,"(5.105, 5.222]",train
5GR9,protein-peptide,Q84W98 Q9FII5,KFSPQLLSLLSLKTSLSGPPSAFQDWKVPVNGQNDAVWCSWSGVVCDNVTAQVISLDLSHRNLSGRIPIQIRYLSSLLYLNLSGNSLEGSFPTSIFDLTKLTTLDISRNSFDSSFPPGISKLKFLKVFNAFSNNFEGLLPSDVSRLRFLEELNFGGSYFEGEIPAAYGGLQRLKFIHLAGNVLGGKLPPRLGLLTELQHMEIGYNHFNGNIPSEFALLSNLKYFDVSNCSLSGSLPQELGNLSNLETLFLFQNGFTGEIPESYSNLKSLKLLDFSSNQLSGSIPSGFSTLKNLTWLSLISNNLSGEVPEGIGELPELTTLFLWNNNFTGVLPHKLGSNGKLETMDVSNNSFTGTIPSSLCHGNKLYKLILFSNMFEGELPKSLTRCESLWRFRSQNNRLNGTIPIGFGSLRNLTFVDLSNNRFTDQIPADFATAPVLQYLNLSTNFFHRKLPENIWKAPNLQIFSASFSNLIGEIPNYVGCKSFYRIELQGNSLNGTIPWDIGHCEKLLCLNLSQNHLNGIIPWEISTLPSIADVDLSHNLLTGTIPSDFGSSKTITTFNVSYNQLIGPIPSGSFAHLNPSFFSSNEGLCGDLVGKPCN,HEVPSGPNPISN,LYS-PHE-SER-PRO-GLN-LEU-LEU-SER-LEU-LEU-SER-LEU-LYS-THR-SER-LEU-SER-GLY-PRO-PRO-SER-ALA-PHE-GLN-ASP-TRP-LYS-VAL-PRO-VAL-ASN-GLY-GLN-ASN-ASP-ALA-VAL-TRP-CYS-SER-TRP-SER-GLY-VAL-VAL-CYS-ASP-ASN-VAL-THR-ALA-GLN-VAL-ILE-SER-LEU-ASP-LEU-SER-HIS-ARG-ASN-LEU-SER-GLY-ARG-ILE-PRO-ILE-GLN-ILE-ARG-TYR-LEU-SER-SER-LEU-LEU-TYR-LEU-ASN-LEU-SER-GLY-ASN-SER-LEU-GLU-GLY-SER-PHE-PRO-THR-SER-ILE-PHE-ASP-LEU-THR-LYS-LEU-THR-THR-LEU-ASP-ILE-SER-ARG-ASN-SER-PHE-ASP-SER-SER-PHE-PRO-PRO-GLY-ILE-SER-LYS-LEU-LYS-PHE-LEU-LYS-VAL-PHE-ASN-ALA-PHE-SER-ASN-ASN-PHE-GLU-GLY-LEU-LEU-PRO-SER-ASP-VAL-SER-ARG-LEU-ARG-PHE-LEU-GLU-GLU-LEU-ASN-PHE-GLY-GLY-SER-TYR-PHE-GLU-GLY-GLU-ILE-PRO-ALA-ALA-TYR-GLY-GLY-LEU-GLN-ARG-LEU-LYS-PHE-ILE-HIS-LEU-ALA-GLY-ASN-VAL-LEU-GLY-GLY-LYS-LEU-PRO-PRO-ARG-LEU-GLY-LEU-LEU-THR-GLU-LEU-GLN-HIS-MET-GLU-ILE-GLY-TYR-ASN-HIS-PHE-ASN-GLY-ASN-ILE-PRO-SER-GLU-PHE-ALA-LEU-LEU-SER-ASN-LEU-LYS-TYR-PHE-ASP-VAL-SER-ASN-CYS-SER-LEU-SER-GLY-SER-LEU-PRO-GLN-GLU-LEU-GLY-ASN-LEU-SER-ASN-LEU-GLU-THR-LEU-PHE-LEU-PHE-GLN-ASN-GLY-PHE-THR-GLY-GLU-ILE-PRO-GLU-SER-TYR-SER-ASN-LEU-LYS-SER-LEU-LYS-LEU-LEU-ASP-PHE-SER-SER-ASN-GLN-LEU-SER-GLY-SER-ILE-PRO-SER-GLY-PHE-SER-THR-LEU-LYS-ASN-LEU-THR-TRP-LEU-SER-LEU-ILE-SER-ASN-ASN-LEU-SER-GLY-GLU-VAL-PRO-GLU-GLY-ILE-GLY-GLU-LEU-PRO-GLU-LEU-THR-THR-LEU-PHE-LEU-TRP-ASN-ASN-ASN-PHE-THR-GLY-VAL-LEU-PRO-HIS-LYS-LEU-GLY-SER-ASN-GLY-LYS-LEU-GLU-THR-MET-ASP-VAL-SER-ASN-ASN-SER-PHE-THR-GLY-THR-ILE-PRO-SER-SER-LEU-CYS-HIS-GLY-ASN-LYS-LEU-TYR-LYS-LEU-ILE-LEU-PHE-SER-ASN-MET-PHE-GLU-GLY-GLU-LEU-PRO-LYS-SER-LEU-THR-ARG-CYS-GLU-SER-LEU-TRP-ARG-PHE-ARG-SER-GLN-ASN-ASN-ARG-LEU-ASN-GLY-THR-ILE-PRO-ILE-GLY-PHE-GLY-SER-LEU-ARG-ASN-LEU-THR-PHE-VAL-ASP-LEU-SER-ASN-ASN-ARG-PHE-THR-ASP-GLN-ILE-PRO-ALA-ASP-PHE-ALA-THR-ALA-PRO-VAL-LEU-GLN-TYR-LEU-ASN-LEU-SER-THR-ASN-PHE-PHE-HIS-ARG-LYS-LEU-PRO-GLU-ASN-ILE-TRP-LYS-ALA-PRO-ASN-LEU-GLN-ILE-PHE-SER-ALA-SER-PHE-SER-ASN-LEU-ILE-GLY-GLU-ILE-PRO-ASN-TYR-VAL-GLY-CYS-LYS-SER-PHE-TYR-ARG-ILE-GLU-LEU-GLN-GLY-ASN-SER-LEU-ASN-GLY-THR-ILE-PRO-TRP-ASP-ILE-GLY-HIS-CYS-GLU-LYS-LEU-LEU-CYS-LEU-ASN-LEU-SER-GLN-ASN-HIS-LEU-ASN-GLY-ILE-ILE-PRO-TRP-GLU-ILE-SER-THR-LEU-PRO-SER-ILE-ALA-ASP-VAL-ASP-LEU-SER-HIS-ASN-LEU-LEU-THR-GLY-THR-ILE-PRO-SER-ASP-PHE-GLY-SER-SER-LYS-THR-ILE-THR-THR-PHE-ASN-VAL-SER-TYR-ASN-GLN-LEU-ILE-GLY-PRO-ILE-PRO-SER-GLY-SER-PHE-ALA-HIS-LEU-ASN-PRO-SER-PHE-PHE-SER-SER-ASN-GLU-GLY-LEU-CYS-GLY-ASP-LEU-VAL-GLY-LYS-PRO-CYS-ASN,HIS-GLU-VAL-HYP-SER-GLY-HYP-ASN-PRO-ILE-SER-ASN,599,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1C[C@H](CN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC(=O)O)O)CO)O)CC(=O)N)C,Kd=33nM,7.481486,7.48,1,A,A,1,A,A,0,,C,B,,1,1,599,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C1CC(O)CN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C1CC(O)CN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8938573002815247,0.7853168249130249,80.3704833984375,79.42444610595703,0.4175662100315094,0.6592407822608948,0.879784107208252,0.8606188893318176,0.8851006031036377,0.7664912939071655,HEVPSGPNPISN,Moderate,"(7.268, 7.523]",train
5GS4,protein-peptide,P03372,SLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLLLEMLDAH,RDILARLLQ,SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-CYS-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-CYS-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-CYS-LYS-ASN-VAL-VAL-PRO-LEU-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS,ARG-IAS-ILE-LEU-DNP-ARG-LEU-LEU-GLN-NH2,243,10,CC[C@@H]([C@@H]1NC(=O)C[C@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C(=O)NC[C@H](NC(=O)[C@@H](NC1=O)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)C,Kd=85nM,7.070581,7.07,1,A,A,1,A,A,0,,B,A,,1,1,243,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C[NH3+])NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NC(CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(C[NH3+])NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NC(CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9539321064949036,0.8280935883522034,90.34309387207033,86.290283203125,0.3672554492950439,0.6503840088844299,0.9354999661445618,0.9019031524658204,0.9362186789512634,0.8096411824226379,RDILARLLQ,Moderate,"(7.049, 7.268]",train
5GU4,protein-peptide,P05387 P02879,MGSSHHHHHHSSGLVPRGSHMASMTGGQQMGRGSIFPKQYPIINFTTAGATVQSYTNFIRAVRGRLTTGADVRHEIPVLPNRVGLPINQRFILVELSNHAELSVTLALDVTNAYVVGYRAGNSAYFFHPDNQEDAEAITHLFTDVQNRYTFAFGGNYDRLEQLAGNLRENIELGNGPLEEAISALYYYSTGGTQLPTLARSFIICIQMISEAARFQYIEGEMRTRIRYNRRSAPDPSVITLENSWGRLSTAIQESNQGAFASPIQLQRRNGSKFSVYDVSILIPIIALMVYRCAPPPSSQF,DDMGFGLFD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-SER-MET-THR-GLY-GLY-GLN-GLN-MET-GLY-ARG-GLY-SER-ILE-PHE-PRO-LYS-GLN-TYR-PRO-ILE-ILE-ASN-PHE-THR-THR-ALA-GLY-ALA-THR-VAL-GLN-SER-TYR-THR-ASN-PHE-ILE-ARG-ALA-VAL-ARG-GLY-ARG-LEU-THR-THR-GLY-ALA-ASP-VAL-ARG-HIS-GLU-ILE-PRO-VAL-LEU-PRO-ASN-ARG-VAL-GLY-LEU-PRO-ILE-ASN-GLN-ARG-PHE-ILE-LEU-VAL-GLU-LEU-SER-ASN-HIS-ALA-GLU-LEU-SER-VAL-THR-LEU-ALA-LEU-ASP-VAL-THR-ASN-ALA-TYR-VAL-VAL-GLY-TYR-ARG-ALA-GLY-ASN-SER-ALA-TYR-PHE-PHE-HIS-PRO-ASP-ASN-GLN-GLU-ASP-ALA-GLU-ALA-ILE-THR-HIS-LEU-PHE-THR-ASP-VAL-GLN-ASN-ARG-TYR-THR-PHE-ALA-PHE-GLY-GLY-ASN-TYR-ASP-ARG-LEU-GLU-GLN-LEU-ALA-GLY-ASN-LEU-ARG-GLU-ASN-ILE-GLU-LEU-GLY-ASN-GLY-PRO-LEU-GLU-GLU-ALA-ILE-SER-ALA-LEU-TYR-TYR-TYR-SER-THR-GLY-GLY-THR-GLN-LEU-PRO-THR-LEU-ALA-ARG-SER-PHE-ILE-ILE-CYS-ILE-GLN-MET-ILE-SER-GLU-ALA-ALA-ARG-PHE-GLN-TYR-ILE-GLU-GLY-GLU-MET-ARG-THR-ARG-ILE-ARG-TYR-ASN-ARG-ARG-SER-ALA-PRO-ASP-PRO-SER-VAL-ILE-THR-LEU-GLU-ASN-SER-TRP-GLY-ARG-LEU-SER-THR-ALA-ILE-GLN-GLU-SER-ASN-GLN-GLY-ALA-PHE-ALA-SER-PRO-ILE-GLN-LEU-GLN-ARG-ARG-ASN-GLY-SER-LYS-PHE-SER-VAL-TYR-ASP-VAL-SER-ILE-LEU-ILE-PRO-ILE-ILE-ALA-LEU-MET-VAL-TYR-ARG-CYS-ALA-PRO-PRO-PRO-SER-SER-GLN-PHE,ASP-ASP-MET-GLY-PHE-GLY-LEU-PHE-ASP,301,9,[NH3+]CC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccccc1)CC(C)C)Cc1ccccc1,Kd=3.4uM,5.468521,5.47,1,A,A,1,A,A,0,,C,A,,1,1,301,9,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.8639100790023804,0.8868395686149597,80.55292510986328,81.39396667480469,0.4354092180728912,0.6562135815620422,0.8340946435928345,0.8338200449943542,0.7725736498832703,0.8149615526199341,DDMGFGLFD,Low,"(5.463, 5.6]",train
5H5Q,protein-peptide,P36969,SASRDDWRAARSMHEFSAKDIDGHMVNLDKYRGFVSIVTNVASQCGKTEVNYTQLVDLHARYAERGLRILAFPSNQFGKQEPGSNEEIKEFAAGYNVKFDMFSKIEVNGDDAHPLWKWMKIQPKGKGILGNAIKWNFTKFLIDKNGVVVKRYGPMEEPLVIEKDLPHYF,CRVDLQGWRRCRR,SER-ALA-SER-ARG-ASP-ASP-TRP-ARG-ALA-ALA-ARG-SER-MET-HIS-GLU-PHE-SER-ALA-LYS-ASP-ILE-ASP-GLY-HIS-MET-VAL-ASN-LEU-ASP-LYS-TYR-ARG-GLY-PHE-VAL-SER-ILE-VAL-THR-ASN-VAL-ALA-SER-GLN-OCS-GLY-LYS-THR-GLU-VAL-ASN-TYR-THR-GLN-LEU-VAL-ASP-LEU-HIS-ALA-ARG-TYR-ALA-GLU-ARG-GLY-LEU-ARG-ILE-LEU-ALA-PHE-PRO-SER-ASN-GLN-PHE-GLY-LYS-GLN-GLU-PRO-GLY-SER-ASN-GLU-GLU-ILE-LYS-GLU-PHE-ALA-ALA-GLY-TYR-ASN-VAL-LYS-PHE-ASP-MET-PHE-SER-LYS-ILE-GLU-VAL-ASN-GLY-ASP-ASP-ALA-HIS-PRO-LEU-TRP-LYS-TRP-MET-LYS-ILE-GLN-PRO-LYS-GLY-LYS-GLY-ILE-LEU-GLY-ASN-ALA-ILE-LYS-TRP-ASN-PHE-THR-LYS-PHE-LEU-ILE-ASP-LYS-ASN-GLY-VAL-VAL-VAL-LYS-ARG-TYR-GLY-PRO-MET-GLU-GLU-PRO-LEU-VAL-ILE-GLU-LYS-ASP-LEU-PRO-HIS-TYR-PHE,ACE-CYS-ARG-VAL-ASP-LEU-GLN-GLY-TRP-ARG-ARG-CYS-ARG-ARG-NH2,169,15,NC(=O)CC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC1=O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)C)C(C)C,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,B,A,,1,1,169,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8998032212257385,0.7349081635475159,92.53684997558594,90.32145690917967,0.3443774580955505,0.8421197533607483,0.9366875886917114,0.8487639427185059,0.8459392786026001,0.7064442038536072,CRVDLQGWRRCRR,Low,"(5.699, 5.821]",train
5H5R,protein-peptide,P36969,SASRDDWRAARSMHEFSAKDIDGHMVNLDKYRGFVSIVTNVASQCGKTEVNYTQLVDLHARYAERGLRILAFPSNQFGKQEPGSNEEIKEFAAGYNVKFDMFSKIEVNGDDAHPLWKWMKIQPKGKGILGNAIKWNFTKFLIDKNGVVVKRYGPMEEPLVIEKDLPHYF,CRAWYQNYCALRR,SER-ALA-SER-ARG-ASP-ASP-TRP-ARG-ALA-ALA-ARG-SER-MET-HIS-GLU-PHE-SER-ALA-LYS-ASP-ILE-ASP-GLY-HIS-MET-VAL-ASN-LEU-ASP-LYS-TYR-ARG-GLY-PHE-VAL-SER-ILE-VAL-THR-ASN-VAL-ALA-SER-GLN-OCS-GLY-LYS-THR-GLU-VAL-ASN-TYR-THR-GLN-LEU-VAL-ASP-LEU-HIS-ALA-ARG-TYR-ALA-GLU-ARG-GLY-LEU-ARG-ILE-LEU-ALA-PHE-PRO-SER-ASN-GLN-PHE-GLY-LYS-GLN-GLU-PRO-GLY-SER-ASN-GLU-GLU-ILE-LYS-GLU-PHE-ALA-ALA-GLY-TYR-ASN-VAL-LYS-PHE-ASP-MET-PHE-SER-LYS-ILE-GLU-VAL-ASN-GLY-ASP-ASP-ALA-HIS-PRO-LEU-TRP-LYS-TRP-MET-LYS-ILE-GLN-PRO-LYS-GLY-LYS-GLY-ILE-LEU-GLY-ASN-ALA-ILE-LYS-TRP-ASN-PHE-THR-LYS-PHE-LEU-ILE-ASP-LYS-ASN-GLY-VAL-VAL-VAL-LYS-ARG-TYR-GLY-PRO-MET-GLU-GLU-PRO-LEU-VAL-ILE-GLU-LYS-ASP-LEU-PRO-HIS-TYR-PHE,ACE-CYS-ARG-ALA-TRP-TYR-GLN-ASN-TYR-CYS-ALA-LEU-ARG-ARG-NH2,169,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)C)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)Cc1ccc(cc1)O)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2)C)C,Kd=0.61uM,6.21467,6.21,1,A,A,1,A,A,0,,B,A,,1,1,169,15,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8924946784973145,0.7422057390213013,93.23414611816406,90.8036117553711,0.3610412776470184,0.7878204584121704,0.9321483373641968,0.8517135977745056,0.8379384279251099,0.7148287296295166,CRAWYQNYCALRR,Low,"(6.097, 6.26]",train
5H5S,protein-peptide,P36969,SASRDDWRAARSMHEFSAKDIDGHMVNLDKYRGFVSIVTNVASQCGKTEVNYTQLVDLHARYAERGLRILAFPSNQFGKQEPGSNEEIKEFAAGYNVKFDMFSKIEVNGDDAHPLWKWMKIQPKGKGILGNAIKWNFTKFLIDKNGVVVKRYGPMEEPLVIEKDLPHYF,VPCPYLPLWNCAGK,SER-ALA-SER-ARG-ASP-ASP-TRP-ARG-ALA-ALA-ARG-SER-MET-HIS-GLU-PHE-SER-ALA-LYS-ASP-ILE-ASP-GLY-HIS-MET-VAL-ASN-LEU-ASP-LYS-TYR-ARG-GLY-PHE-VAL-SER-ILE-VAL-THR-ASN-VAL-ALA-SER-GLN-CSD-GLY-LYS-THR-GLU-VAL-ASN-TYR-THR-GLN-LEU-VAL-ASP-LEU-HIS-ALA-ARG-TYR-ALA-GLU-ARG-GLY-LEU-ARG-ILE-LEU-ALA-PHE-PRO-SER-ASN-GLN-PHE-GLY-LYS-GLN-GLU-PRO-GLY-SER-ASN-GLU-GLU-ILE-LYS-GLU-PHE-ALA-ALA-GLY-TYR-ASN-VAL-LYS-PHE-ASP-MET-PHE-SER-LYS-ILE-GLU-VAL-ASN-GLY-ASP-ASP-ALA-HIS-PRO-LEU-TRP-LYS-TRP-MET-LYS-ILE-GLN-PRO-LYS-GLY-LYS-GLY-ILE-LEU-GLY-ASN-ALA-ILE-LYS-TRP-ASN-PHE-THR-LYS-PHE-LEU-ILE-ASP-LYS-ASN-GLY-VAL-VAL-VAL-LYS-ARG-TYR-GLY-PRO-MET-GLU-GLU-PRO-LEU-VAL-ILE-GLU-LYS-ASP-LEU-PRO-HIS-TYR-PHE,VAL-PRO-CYS-PRO-TYR-LEU-PRO-LEU-TRP-ASN-CYS-ALA-GLY-LYS,169,14,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)[NH3+])C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N[C@H](C(=O)N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(=O)N)Cc1c[nH]c3c1cccc3)CC(C)C)CCC2)CC(C)C)C,Kd=8.2uM,5.086186,5.09,1,A,A,1,A,A,0,,B,A,,1,1,169,14,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,0.8556002378463745,0.7817350029945374,93.48513793945312,91.04802703857422,0.3466236591339111,0.6666878461837769,0.938696026802063,0.8742562532424927,0.7870121002197266,0.7586047053337097,VPCPYLPLWNCAGK,Low,"(5.014, 5.105]",val
5H7G,protein-peptide,P41182,LDYKDDDDKENLYFQGADSCIQFTRHASDVLLNLNRLRSRDILTDVVIVVSREQFRAHKTVLMACSGLFYSIFTDQLKCNLSVINLDPEINPEGFCILLDFMYTSRLNLREGNIMAVMATAMYLQMEHVVDTCRKFIKASE,LWYTDIRMSWRVP,LEU-ASP-TYR-LYS-ASP-ASP-ASP-ASP-LYS-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ALA-ASP-SER-CYS-ILE-GLN-PHE-THR-ARG-HIS-ALA-SER-ASP-VAL-LEU-LEU-ASN-LEU-ASN-ARG-LEU-ARG-SER-ARG-ASP-ILE-LEU-THR-ASP-VAL-VAL-ILE-VAL-VAL-SER-ARG-GLU-GLN-PHE-ARG-ALA-HIS-LYS-THR-VAL-LEU-MET-ALA-CYS-SER-GLY-LEU-PHE-TYR-SER-ILE-PHE-THR-ASP-GLN-LEU-LYS-CYS-ASN-LEU-SER-VAL-ILE-ASN-LEU-ASP-PRO-GLU-ILE-ASN-PRO-GLU-GLY-PHE-CYS-ILE-LEU-LEU-ASP-PHE-MET-TYR-THR-SER-ARG-LEU-ASN-LEU-ARG-GLU-GLY-ASN-ILE-MET-ALA-VAL-MET-ALA-THR-ALA-MET-TYR-LEU-GLN-MET-GLU-HIS-VAL-VAL-ASP-THR-CYS-ARG-LYS-PHE-ILE-LYS-ALA-SER-GLU,LEU-TRP-TYR-THR-ASP-ILE-ARG-MET-SER-TRP-ARG-VAL-PRO,141,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2)CO)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)CC(=O)O)CCC[NH+]=C(N)N,Kd=0.57nM,9.244125,9.24,1,A,A,1,A,A,0,,C,A,dimer,1,1,141,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O,0.7281262874603271,0.6288024187088013,84.4392318725586,88.01273345947266,0.5308500528335571,1.0170977115631104,0.8006523251533508,0.6996780037879944,0.5557739734649658,0.5312963128089905,LWYTDIRMSWRVP,High,"(8.824, 12.12]",train
5HDA,protein-peptide,P12978 Q15326,SDRMKSDHKRETERVVREALEKLRSEMEEEKRQAVNKAVANMQGEMDRKCKQVKEKCKEEFVEEIKKLATQHKQLISQTKKKQWCYNCEEEAMYHCCWNTSYCSIKCQQEHWHAEHKRTCRRKR,SMPELSPVL,SER-ASP-ARG-MET-LYS-SER-ASP-HIS-LYS-ARG-GLU-THR-GLU-ARG-VAL-VAL-ARG-GLU-ALA-LEU-GLU-LYS-LEU-ARG-SER-GLU-MET-GLU-GLU-GLU-LYS-ARG-GLN-ALA-VAL-ASN-LYS-ALA-VAL-ALA-ASN-MET-GLN-GLY-GLU-MET-ASP-ARG-LYS-CYS-LYS-GLN-VAL-LYS-GLU-LYS-CYS-LYS-GLU-GLU-PHE-VAL-GLU-GLU-ILE-LYS-LYS-LEU-ALA-THR-GLN-HIS-LYS-GLN-LEU-ILE-SER-GLN-THR-LYS-LYS-LYS-GLN-TRP-CYS-TYR-ASN-CYS-GLU-GLU-GLU-ALA-MET-TYR-HIS-CYS-CYS-TRP-ASN-THR-SER-TYR-CYS-SER-ILE-LYS-CYS-GLN-GLN-GLU-HIS-TRP-HIS-ALA-GLU-HIS-LYS-ARG-THR-CYS-ARG-ARG-LYS-ARG,SER-MET-PRO-GLU-LEU-SER-PRO-VAL-LEU,124,9,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)CO)CC(C)C)CCC(=O)O)NC(=O)[C@H](CO)[NH3+],Kd=7.4uM,5.130768,5.13,1,A,A,1,A,A,0,,B,A,dimer,1,1,124,9,0,CSCC[C@H](NC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C,0.8277164697647095,0.7877137064933777,78.79682922363281,72.67227935791016,0.4257213771343231,0.641370952129364,0.5728238821029663,0.6162991523742676,0.7833569049835205,0.7247205972671509,SMPELSPVL,Low,"(5.105, 5.222]",train
5HEB,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGGEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASHEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQTSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-GLY-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-HIS-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-THR-SER-VAL,119,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)[C@H](O)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=0.8uM,6.09691,6.1,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9654986262321472,0.9085351824760436,95.134765625,89.81777954101562,0.3624142706394195,0.5421765446662903,0.8911991119384766,0.8969212174415588,0.905948519706726,0.864169716835022,TKNYKQTSV,Low,"(5.959, 6.097]",train
5HED,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGGEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASHEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQFSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-GLY-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-HIS-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-PHE-SER-VAL,119,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)Cc1ccccc1)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)N)Cc1ccc(cc1)O,Kd=36uM,4.443697,4.44,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9692752957344056,0.9191716909408568,95.40464782714844,91.65242004394533,0.3504158854484558,0.551231861114502,0.8984982967376709,0.9018909335136414,0.908844530582428,0.8762229084968567,TKNYKQFSV,Low,"(4.319, 4.456]",val
5HEY,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGTEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASHEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQTSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-THR-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-HIS-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-THR-SER-VAL,119,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)[C@H](O)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(=O)N)Cc1ccc(cc1)O,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9720615148544312,0.8831392526626587,95.20511627197266,89.83370971679688,0.3617342114448547,0.6054322123527527,0.8931508660316467,0.8832441568374634,0.913664162158966,0.8358440399169922,TKNYKQTSV,Low,"(5.6, 5.699]",val
5HF1,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGTEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASHEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQFSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-THR-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-HIS-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-PHE-SER-VAL,119,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)Cc1ccccc1)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccc(cc1)O,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.966109812259674,0.9400383234024048,95.41510009765624,89.44686889648438,0.3629724085330963,0.5323408246040344,0.8926582336425781,0.8966392874717712,0.9112305045127868,0.8826107382774353,TKNYKQFSV,Low,"(5.699, 5.821]",train
5HFB,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGGEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASAEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQTSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-GLY-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-ALA-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-THR-SER-VAL,119,9,OC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])C)CCC(=O)N,Kd=26.9uM,4.570248,4.57,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9598466157913208,0.947044312953949,95.7328109741211,91.24304962158205,0.3647948801517486,0.4897908568382263,0.8933572769165039,0.9179811477661132,0.8983439207077026,0.9070411324501038,TKNYKQTSV,Low,"(4.456, 4.606]",train
5HFC,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGGEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASAEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQFSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-GLY-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-ALA-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-PHE-SER-VAL,119,9,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)Cc1ccccc1)CCC(=O)N)[NH2+][C@H]([C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1ccc(cc1)O)O,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9571956396102904,0.9393297433853148,95.76887512207033,91.08739471435548,0.3700135350227356,0.5103926658630371,0.8917018175125122,0.9133440852165222,0.8954440355300903,0.8985572457313538,TKNYKQFSV,Low,"(5.699, 5.821]",train
5HFF,protein-peptide,Q792Q4 P31016,GSPEFLGEEDIPREPRRIVIHRGSTGLGFNIVGTEDGEGIFISFILAGGPADLSGELRKGDQILSVNGVDLRNASAEQAAIALKNAGQTVTIIAQYKPEEYSRFEANSRVDSSGRIVTD,TKNYKQFSV,GLY-SER-PRO-GLU-PHE-LEU-GLY-GLU-GLU-ASP-ILE-PRO-ARG-GLU-PRO-ARG-ARG-ILE-VAL-ILE-HIS-ARG-GLY-SER-THR-GLY-LEU-GLY-PHE-ASN-ILE-VAL-GLY-THR-GLU-ASP-GLY-GLU-GLY-ILE-PHE-ILE-SER-PHE-ILE-LEU-ALA-GLY-GLY-PRO-ALA-ASP-LEU-SER-GLY-GLU-LEU-ARG-LYS-GLY-ASP-GLN-ILE-LEU-SER-VAL-ASN-GLY-VAL-ASP-LEU-ARG-ASN-ALA-SER-ALA-GLU-GLN-ALA-ALA-ILE-ALA-LEU-LYS-ASN-ALA-GLY-GLN-THR-VAL-THR-ILE-ILE-ALA-GLN-TYR-LYS-PRO-GLU-GLU-TYR-SER-ARG-PHE-GLU-ALA-ASN-SER-ARG-VAL-ASP-SER-SER-GLY-ARG-ILE-VAL-THR-ASP,THR-LYS-ASN-TYR-LYS-GLN-PHE-SER-VAL,119,9,CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CO)Cc1ccccc1)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)Cc1ccc(cc1)O,Kd=0.5uM,6.30103,6.3,1,A,A,1,A,A,0,,B,A,,1,1,119,9,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.982488751411438,0.9201951622962952,95.79500579833984,91.6499481201172,0.3578028380870819,0.5782691240310669,0.8949145078659058,0.8970668315887451,0.9164916276931764,0.8734561800956726,TKNYKQFSV,Low,"(6.26, 6.398]",val
5HJC,protein-peptide,Q15059 P68431,KLSEHLRYCDSILREMLSKKHAAYAWPFYKPVDAEALELHDYHDIIKHPMDLSTVKRKMDGREYPDAQGFAADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMP,APRKQLATK,LYS-LEU-SER-GLU-HIS-LEU-ARG-TYR-CYS-ASP-SER-ILE-LEU-ARG-GLU-MET-LEU-SER-LYS-LYS-HIS-ALA-ALA-TYR-ALA-TRP-PRO-PHE-TYR-LYS-PRO-VAL-ASP-ALA-GLU-ALA-LEU-GLU-LEU-HIS-ASP-TYR-HIS-ASP-ILE-ILE-LYS-HIS-PRO-MET-ASP-LEU-SER-THR-VAL-LYS-ARG-LYS-MET-ASP-GLY-ARG-GLU-TYR-PRO-ASP-ALA-GLN-GLY-PHE-ALA-ALA-ASP-VAL-ARG-LEU-MET-PHE-SER-ASN-CYS-TYR-LYS-TYR-ASN-PRO-PRO-ASP-HIS-GLU-VAL-VAL-ALA-MET-ALA-ARG-LYS-LEU-GLN-ASP-VAL-PHE-GLU-MET-ARG-PHE-ALA-LYS-MET-PRO,ALA-PRO-ARG-ALY-GLN-LEU-ALA-THR-LYS,110,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCCNC(=O)C)CCC(=O)N)CC(C)C)C,Kd=45uM,4.346787,4.35,1,A,A,1,A,A,0,,B,A,,1,1,110,9,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.8954530954360962,0.7699389457702637,93.95379638671876,94.52632904052734,0.3186266422271728,0.6490727663040161,0.9198079109191896,0.8613230586051941,0.8420954346656799,0.7470929026603699,APRKQLATK,Low,"(4.319, 4.456]",val
5HKH,protein-peptide,P61960 Q9GZZ9,GAMESKVSFKITLTSDPRLPYKVLSVPESTPFTAVLKFAAEEFKVPAATSAIITNDGIGINPAQTAGNVFLKHGSELRIIPRDRVG,DNEWGIELV,GLY-ALA-MET-GLU-SER-LYS-VAL-SER-PHE-LYS-ILE-THR-LEU-THR-SER-ASP-PRO-ARG-LEU-PRO-TYR-LYS-VAL-LEU-SER-VAL-PRO-GLU-SER-THR-PRO-PHE-THR-ALA-VAL-LEU-LYS-PHE-ALA-ALA-GLU-GLU-PHE-LYS-VAL-PRO-ALA-ALA-THR-SER-ALA-ILE-ILE-THR-ASN-ASP-GLY-ILE-GLY-ILE-ASN-PRO-ALA-GLN-THR-ALA-GLY-ASN-VAL-PHE-LEU-LYS-HIS-GLY-SER-GLU-LEU-ARG-ILE-ILE-PRO-ARG-ASP-ARG-VAL-GLY,ASP-ASN-GLU-TRP-GLY-ILE-GLU-LEU-VAL,86,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)CCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)N)CCC(=O)O)C,Kd=8.1uM,5.091515,5.09,1,A,A,1,A,A,0,,B,A,dimer,1,1,86,9,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.948986828327179,0.6996422410011292,64.1968994140625,80.13976287841797,0.6272209882736206,0.7977051734924316,0.742575466632843,0.7661803364753723,0.7966423034667969,0.6830076575279236,DNEWGIELV,Low,"(5.014, 5.105]",train
5HOG,protein-peptide,P38859 Q01454,MGSSHHHHHHSQDPENLYFQGTGKFRYMPFSPAGTPFGFTDRRYLTMNEVGYVSTVKNSEQYSITVSFFDVGRFREYHFEDLFGYDLCFLNEKGTLFGQSKTGQIQYRPHDSIHSNWTKIIPLQAGERITSVAATPVRVIVGTSLGYFRSFNQFGVPFAVEKTSPIVALTAQNYRVFSVHYSQFHGLSYSLSELGTSSKRYYKRECPLPMSLPNINSDMKKDANLDYYNFNPMGIKSLFFSSYGDPCIFGSDNTLLLLSKWRSPEESKWLPILDSNMEIWKMSGGKETTDIHVWPLALAYDTLNCILVKGKHIWPEFPLPLPSEMEIRMPVFVKSKLLEENKAILNKKNEIGADTEAEEGEEDKEIQIPVSMAAEEEYLRSKVLSELLTDTLENDGEMYGNENEVLAALNGAYDKALLRLFASACSDQNVEKALSLAHELKQDRALTAAVKISERAELPSLVKKINNIREARYEQQLK,SLRNIDDILDDIEGDLT,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-GLU-ASN-LEU-TYR-PHE-GLN-GLY-THR-GLY-LYS-PHE-ARG-TYR-MET-PRO-PHE-SER-PRO-ALA-GLY-THR-PRO-PHE-GLY-PHE-THR-ASP-ARG-ARG-TYR-LEU-THR-MET-ASN-GLU-VAL-GLY-TYR-VAL-SER-THR-VAL-LYS-ASN-SER-GLU-GLN-TYR-SER-ILE-THR-VAL-SER-PHE-PHE-ASP-VAL-GLY-ARG-PHE-ARG-GLU-TYR-HIS-PHE-GLU-ASP-LEU-PHE-GLY-TYR-ASP-LEU-CYS-PHE-LEU-ASN-GLU-LYS-GLY-THR-LEU-PHE-GLY-GLN-SER-LYS-THR-GLY-GLN-ILE-GLN-TYR-ARG-PRO-HIS-ASP-SER-ILE-HIS-SER-ASN-TRP-THR-LYS-ILE-ILE-PRO-LEU-GLN-ALA-GLY-GLU-ARG-ILE-THR-SER-VAL-ALA-ALA-THR-PRO-VAL-ARG-VAL-ILE-VAL-GLY-THR-SER-LEU-GLY-TYR-PHE-ARG-SER-PHE-ASN-GLN-PHE-GLY-VAL-PRO-PHE-ALA-VAL-GLU-LYS-THR-SER-PRO-ILE-VAL-ALA-LEU-THR-ALA-GLN-ASN-TYR-ARG-VAL-PHE-SER-VAL-HIS-TYR-SER-GLN-PHE-HIS-GLY-LEU-SER-TYR-SER-LEU-SER-GLU-LEU-GLY-THR-SER-SER-LYS-ARG-TYR-TYR-LYS-ARG-GLU-CYS-PRO-LEU-PRO-MET-SER-LEU-PRO-ASN-ILE-ASN-SER-ASP-MET-LYS-LYS-ASP-ALA-ASN-LEU-ASP-TYR-TYR-ASN-PHE-ASN-PRO-MET-GLY-ILE-LYS-SER-LEU-PHE-PHE-SER-SER-TYR-GLY-ASP-PRO-CYS-ILE-PHE-GLY-SER-ASP-ASN-THR-LEU-LEU-LEU-LEU-SER-LYS-TRP-ARG-SER-PRO-GLU-GLU-SER-LYS-TRP-LEU-PRO-ILE-LEU-ASP-SER-ASN-MET-GLU-ILE-TRP-LYS-MET-SER-GLY-GLY-LYS-GLU-THR-THR-ASP-ILE-HIS-VAL-TRP-PRO-LEU-ALA-LEU-ALA-TYR-ASP-THR-LEU-ASN-CYS-ILE-LEU-VAL-LYS-GLY-LYS-HIS-ILE-TRP-PRO-GLU-PHE-PRO-LEU-PRO-LEU-PRO-SER-GLU-MET-GLU-ILE-ARG-MET-PRO-VAL-PHE-VAL-LYS-SER-LYS-LEU-LEU-GLU-GLU-ASN-LYS-ALA-ILE-LEU-ASN-LYS-LYS-ASN-GLU-ILE-GLY-ALA-ASP-THR-GLU-ALA-GLU-GLU-GLY-GLU-GLU-ASP-LYS-GLU-ILE-GLN-ILE-PRO-VAL-SER-MET-ALA-ALA-GLU-GLU-GLU-TYR-LEU-ARG-SER-LYS-VAL-LEU-SER-GLU-LEU-LEU-THR-ASP-THR-LEU-GLU-ASN-ASP-GLY-GLU-MET-TYR-GLY-ASN-GLU-ASN-GLU-VAL-LEU-ALA-ALA-LEU-ASN-GLY-ALA-TYR-ASP-LYS-ALA-LEU-LEU-ARG-LEU-PHE-ALA-SER-ALA-CYS-SER-ASP-GLN-ASN-VAL-GLU-LYS-ALA-LEU-SER-LEU-ALA-HIS-GLU-LEU-LYS-GLN-ASP-ARG-ALA-LEU-THR-ALA-ALA-VAL-LYS-ILE-SER-GLU-ARG-ALA-GLU-LEU-PRO-SER-LEU-VAL-LYS-LYS-ILE-ASN-ASN-ILE-ARG-GLU-ALA-ARG-TYR-GLU-GLN-GLN-LEU-LYS,SER-LEU-ARG-ASN-ILE-ASP-ASP-ILE-LEU-ASP-ASP-ILE-GLU-GLY-ASP-LEU-THR,478,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](CC)C)CC(=O)O)CC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CCC[NH+]=C(N)N)CC(=O)N)CC(=O)O)CC(=O)O)C,Kd=230uM,3.638272,3.64,1,A,A,1,A,A,0,,D,A,,1,1,478,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,0.7334848642349243,0.6466946601867676,76.78470611572266,74.24501037597656,0.60441654920578,1.2346701622009275,0.8139548301696777,0.7445456385612488,0.6514987349510193,0.5777758359909058,SLRNIDDILDDIEGDLT,Low,"(3.548, 3.924]",train
5HYX,protein-peptide,C0LGR3 Q3E880,CNWTGVKCNRRGEVSEIQLKEKQLQGSLPVTSLRSLKSLTSLTLSSLQLTGVIPKEIGDFTELELLDLSDNSLSGDIPVEIFRLKKLKTLSLNTNNLEGHIPMEIGNLSGLVELMLFDNKLSGEIPRSIGELKNLQVLRAGGNKNLRGELPWEIGNCENLVMLGLAETSLSGKLPASIGNLKRVQTIAIYTSLLSGPIPDEIGYCTELQNLYLYQNSISGSIPTTIGGLKKLQSLLLWQNNLVGKIPTELGNCPELWLIDFSENLLTGTIPRSFGKLENLQELQLSVNQISGTIPEELTNCTKLTHLEIDNNLITGEIPSLMSNLRSLTMFFAWQNKLTGNIPQSLSQCRELQAIDLSYNSLSGSIPKEIFGLRNLTKLLLLSNDLSGFIPPDIGNCTNLYRLRLNGNRLAGSIPSEIGNLKNLNFVDISENRLVGSIPPAISGCESLEFLDLHTNSLSGSLLGTTLPKSLKFIDFSDNALSSTLPPGIGLLTELTKLNLAKNRLSGEIPREISTCRSLQLLNLGENDFSGEIPDELGQIPSLAISLNLSCNRFVGEIPSRFSDLKNLGVLDVSHNQLTGNLNVLTDLQNLVSLNISYNDFSGDLPNTPFFRRLPLSDLASNRGLYISNAIST,DYSNPGHHPPRHN,CYS-ASN-TRP-THR-GLY-VAL-LYS-CYS-ASN-ARG-ARG-GLY-GLU-VAL-SER-GLU-ILE-GLN-LEU-LYS-GLU-LYS-GLN-LEU-GLN-GLY-SER-LEU-PRO-VAL-THR-SER-LEU-ARG-SER-LEU-LYS-SER-LEU-THR-SER-LEU-THR-LEU-SER-SER-LEU-GLN-LEU-THR-GLY-VAL-ILE-PRO-LYS-GLU-ILE-GLY-ASP-PHE-THR-GLU-LEU-GLU-LEU-LEU-ASP-LEU-SER-ASP-ASN-SER-LEU-SER-GLY-ASP-ILE-PRO-VAL-GLU-ILE-PHE-ARG-LEU-LYS-LYS-LEU-LYS-THR-LEU-SER-LEU-ASN-THR-ASN-ASN-LEU-GLU-GLY-HIS-ILE-PRO-MET-GLU-ILE-GLY-ASN-LEU-SER-GLY-LEU-VAL-GLU-LEU-MET-LEU-PHE-ASP-ASN-LYS-LEU-SER-GLY-GLU-ILE-PRO-ARG-SER-ILE-GLY-GLU-LEU-LYS-ASN-LEU-GLN-VAL-LEU-ARG-ALA-GLY-GLY-ASN-LYS-ASN-LEU-ARG-GLY-GLU-LEU-PRO-TRP-GLU-ILE-GLY-ASN-CYS-GLU-ASN-LEU-VAL-MET-LEU-GLY-LEU-ALA-GLU-THR-SER-LEU-SER-GLY-LYS-LEU-PRO-ALA-SER-ILE-GLY-ASN-LEU-LYS-ARG-VAL-GLN-THR-ILE-ALA-ILE-TYR-THR-SER-LEU-LEU-SER-GLY-PRO-ILE-PRO-ASP-GLU-ILE-GLY-TYR-CYS-THR-GLU-LEU-GLN-ASN-LEU-TYR-LEU-TYR-GLN-ASN-SER-ILE-SER-GLY-SER-ILE-PRO-THR-THR-ILE-GLY-GLY-LEU-LYS-LYS-LEU-GLN-SER-LEU-LEU-LEU-TRP-GLN-ASN-ASN-LEU-VAL-GLY-LYS-ILE-PRO-THR-GLU-LEU-GLY-ASN-CYS-PRO-GLU-LEU-TRP-LEU-ILE-ASP-PHE-SER-GLU-ASN-LEU-LEU-THR-GLY-THR-ILE-PRO-ARG-SER-PHE-GLY-LYS-LEU-GLU-ASN-LEU-GLN-GLU-LEU-GLN-LEU-SER-VAL-ASN-GLN-ILE-SER-GLY-THR-ILE-PRO-GLU-GLU-LEU-THR-ASN-CYS-THR-LYS-LEU-THR-HIS-LEU-GLU-ILE-ASP-ASN-ASN-LEU-ILE-THR-GLY-GLU-ILE-PRO-SER-LEU-MET-SER-ASN-LEU-ARG-SER-LEU-THR-MET-PHE-PHE-ALA-TRP-GLN-ASN-LYS-LEU-THR-GLY-ASN-ILE-PRO-GLN-SER-LEU-SER-GLN-CYS-ARG-GLU-LEU-GLN-ALA-ILE-ASP-LEU-SER-TYR-ASN-SER-LEU-SER-GLY-SER-ILE-PRO-LYS-GLU-ILE-PHE-GLY-LEU-ARG-ASN-LEU-THR-LYS-LEU-LEU-LEU-LEU-SER-ASN-ASP-LEU-SER-GLY-PHE-ILE-PRO-PRO-ASP-ILE-GLY-ASN-CYS-THR-ASN-LEU-TYR-ARG-LEU-ARG-LEU-ASN-GLY-ASN-ARG-LEU-ALA-GLY-SER-ILE-PRO-SER-GLU-ILE-GLY-ASN-LEU-LYS-ASN-LEU-ASN-PHE-VAL-ASP-ILE-SER-GLU-ASN-ARG-LEU-VAL-GLY-SER-ILE-PRO-PRO-ALA-ILE-SER-GLY-CYS-GLU-SER-LEU-GLU-PHE-LEU-ASP-LEU-HIS-THR-ASN-SER-LEU-SER-GLY-SER-LEU-LEU-GLY-THR-THR-LEU-PRO-LYS-SER-LEU-LYS-PHE-ILE-ASP-PHE-SER-ASP-ASN-ALA-LEU-SER-SER-THR-LEU-PRO-PRO-GLY-ILE-GLY-LEU-LEU-THR-GLU-LEU-THR-LYS-LEU-ASN-LEU-ALA-LYS-ASN-ARG-LEU-SER-GLY-GLU-ILE-PRO-ARG-GLU-ILE-SER-THR-CYS-ARG-SER-LEU-GLN-LEU-LEU-ASN-LEU-GLY-GLU-ASN-ASP-PHE-SER-GLY-GLU-ILE-PRO-ASP-GLU-LEU-GLY-GLN-ILE-PRO-SER-LEU-ALA-ILE-SER-LEU-ASN-LEU-SER-CYS-ASN-ARG-PHE-VAL-GLY-GLU-ILE-PRO-SER-ARG-PHE-SER-ASP-LEU-LYS-ASN-LEU-GLY-VAL-LEU-ASP-VAL-SER-HIS-ASN-GLN-LEU-THR-GLY-ASN-LEU-ASN-VAL-LEU-THR-ASP-LEU-GLN-ASN-LEU-VAL-SER-LEU-ASN-ILE-SER-TYR-ASN-ASP-PHE-SER-GLY-ASP-LEU-PRO-ASN-THR-PRO-PHE-PHE-ARG-ARG-LEU-PRO-LEU-SER-ASP-LEU-ALA-SER-ASN-ARG-GLY-LEU-TYR-ILE-SER-ASN-ALA-ILE-SER-THR,ASP-PTR-SER-ASN-PRO-GLY-HIS-HIS-PRO-HZP-ARG-HIS-ASN,633,13,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1C[C@H](C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N)O)Cc1nc[nH]c1)Cc1nc[nH]c1)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1ccc(cc1)OP(O)(O)O,Kd=280nM,6.552842,6.55,1,A,A,1,A,A,0,,A,B,,1,1,633,13,0,N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8064461350440979,0.713205099105835,81.30906677246094,79.1883773803711,0.4595172107219696,0.906758427619934,0.8597080707550049,0.8391095995903015,0.7786182165145874,0.6797542572021484,DYSNPGHHPPRHN,Low,"(6.523, 6.696]",train
5I22,protein-peptide,O00499 Q8JUX6,GRLDLPPGFMFKVQAQHDYTATDTDELQLKAGDVVLVIPFQNPEEQDEGWLMGVKESDWNQHKELEKCRGVFPENFTERVP,STVPVAPPRRRRGRNLT,GLY-ARG-LEU-ASP-LEU-PRO-PRO-GLY-PHE-MET-PHE-LYS-VAL-GLN-ALA-GLN-HIS-ASP-TYR-THR-ALA-THR-ASP-THR-ASP-GLU-LEU-GLN-LEU-LYS-ALA-GLY-ASP-VAL-VAL-LEU-VAL-ILE-PRO-PHE-GLN-ASN-PRO-GLU-GLU-GLN-ASP-GLU-GLY-TRP-LEU-MET-GLY-VAL-LYS-GLU-SER-ASP-TRP-ASN-GLN-HIS-LYS-GLU-LEU-GLU-LYS-CYS-ARG-GLY-VAL-PHE-PRO-GLU-ASN-PHE-THR-GLU-ARG-VAL-PRO,SER-THR-VAL-PRO-VAL-ALA-PRO-PRO-ARG-ARG-ARG-ARG-GLY-ARG-ASN-LEU-THR,81,17,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(C)C)CC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)C(C)C)C(C)C)[C@H](O)C)[NH3+],Kd=0.024uM,7.619789,7.62,1,A,A,1,A,A,0,,B,A,,1,1,81,17,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9317435622215272,0.7696435451507568,91.97821807861328,86.71341705322266,0.3289932906627655,0.688971757888794,0.9041704535484314,0.8266335725784302,0.8302184343338013,0.7553960084915161,STVPVAPPRRRRGRNLT,Moderate,"(7.523, 7.921]",train
5I25,protein-peptide,P01042 P03951,ECVTQLLKDTCFEGGDITTVFTPSAKYCQVVCTYHPRCLLFTFTAESPSEDPTRWFTCVLKDSVTETLPRVNRTAAISGYSFKQCSHQISACNKDIYVDLDMKGINYNSSVAKSAQECQERCTDDVHCHFFTYATRQFPSLEHRNICLLKHTQTGTPTRITKLDKVVSGFSLKSCALSNLACIRDIFPNTVFADSNIDSVMAPDAFVCGRICTHHPGCLFFTFFSQEWPKESQRNLCLLKTSESGLPSTRIKKSKALSGFSLQSCRHSIPVFCHSSFYHDTDFLGEELDIVAAKSHEACQKLCTNAVRCQFFTYTPAQASCNEGKGKCYLKLSSNGSPTKILHGRGGISGYTLRLCKMDNECTTKIKPRIVGGTASVRGEWPWQVTLHTTSPTQRHLCGGSIIGNQWILTAAHCFYGVESPKILRVYSGILNQSEIKEDTSFFGVQEIIIHDQYKMAESGYDIALLKLETTVNYTDSQRPICLPSKGDRNVIYTDCWVTGWGYRKLRDKIQNTLQKAKIPLVTNEECQKRYRGHKITHKMICAGYREGGKDACKGDSGGPLSCKHNEVWHLVGITSWGEGCAQRERPGVYTNVVEYVDWILEKTQAV,NPISDFPD,GLU-CYS-VAL-THR-GLN-LEU-LEU-LYS-ASP-THR-CYS-PHE-GLU-GLY-GLY-ASP-ILE-THR-THR-VAL-PHE-THR-PRO-SER-ALA-LYS-TYR-CYS-GLN-VAL-VAL-CYS-THR-TYR-HIS-PRO-ARG-CYS-LEU-LEU-PHE-THR-PHE-THR-ALA-GLU-SER-PRO-SER-GLU-ASP-PRO-THR-ARG-TRP-PHE-THR-CYS-VAL-LEU-LYS-ASP-SER-VAL-THR-GLU-THR-LEU-PRO-ARG-VAL-ASN-ARG-THR-ALA-ALA-ILE-SER-GLY-TYR-SER-PHE-LYS-GLN-CYS-SER-HIS-GLN-ILE-SER-ALA-CYS-ASN-LYS-ASP-ILE-TYR-VAL-ASP-LEU-ASP-MET-LYS-GLY-ILE-ASN-TYR-ASN-SER-SER-VAL-ALA-LYS-SER-ALA-GLN-GLU-CYS-GLN-GLU-ARG-CYS-THR-ASP-ASP-VAL-HIS-CYS-HIS-PHE-PHE-THR-TYR-ALA-THR-ARG-GLN-PHE-PRO-SER-LEU-GLU-HIS-ARG-ASN-ILE-CYS-LEU-LEU-LYS-HIS-THR-GLN-THR-GLY-THR-PRO-THR-ARG-ILE-THR-LYS-LEU-ASP-LYS-VAL-VAL-SER-GLY-PHE-SER-LEU-LYS-SER-CYS-ALA-LEU-SER-ASN-LEU-ALA-CYS-ILE-ARG-ASP-ILE-PHE-PRO-ASN-THR-VAL-PHE-ALA-ASP-SER-ASN-ILE-ASP-SER-VAL-MET-ALA-PRO-ASP-ALA-PHE-VAL-CYS-GLY-ARG-ILE-CYS-THR-HIS-HIS-PRO-GLY-CYS-LEU-PHE-PHE-THR-PHE-PHE-SER-GLN-GLU-TRP-PRO-LYS-GLU-SER-GLN-ARG-ASN-LEU-CYS-LEU-LEU-LYS-THR-SER-GLU-SER-GLY-LEU-PRO-SER-THR-ARG-ILE-LYS-LYS-SER-LYS-ALA-LEU-SER-GLY-PHE-SER-LEU-GLN-SER-CYS-ARG-HIS-SER-ILE-PRO-VAL-PHE-CYS-HIS-SER-SER-PHE-TYR-HIS-ASP-THR-ASP-PHE-LEU-GLY-GLU-GLU-LEU-ASP-ILE-VAL-ALA-ALA-LYS-SER-HIS-GLU-ALA-CYS-GLN-LYS-LEU-CYS-THR-ASN-ALA-VAL-ARG-CYS-GLN-PHE-PHE-THR-TYR-THR-PRO-ALA-GLN-ALA-SER-CYS-ASN-GLU-GLY-LYS-GLY-LYS-CYS-TYR-LEU-LYS-LEU-SER-SER-ASN-GLY-SER-PRO-THR-LYS-ILE-LEU-HIS-GLY-ARG-GLY-GLY-ILE-SER-GLY-TYR-THR-LEU-ARG-LEU-CYS-LYS-MET-ASP-ASN-GLU-CYS-THR-THR-LYS-ILE-LYS-PRO-ARG-ILE-VAL-GLY-GLY-THR-ALA-SER-VAL-ARG-GLY-GLU-TRP-PRO-TRP-GLN-VAL-THR-LEU-HIS-THR-THR-SER-PRO-THR-GLN-ARG-HIS-LEU-CYS-GLY-GLY-SER-ILE-ILE-GLY-ASN-GLN-TRP-ILE-LEU-THR-ALA-ALA-HIS-CYS-PHE-TYR-GLY-VAL-GLU-SER-PRO-LYS-ILE-LEU-ARG-VAL-TYR-SER-GLY-ILE-LEU-ASN-GLN-SER-GLU-ILE-LYS-GLU-ASP-THR-SER-PHE-PHE-GLY-VAL-GLN-GLU-ILE-ILE-ILE-HIS-ASP-GLN-TYR-LYS-MET-ALA-GLU-SER-GLY-TYR-ASP-ILE-ALA-LEU-LEU-LYS-LEU-GLU-THR-THR-VAL-ASN-TYR-THR-ASP-SER-GLN-ARG-PRO-ILE-CYS-LEU-PRO-SER-LYS-GLY-ASP-ARG-ASN-VAL-ILE-TYR-THR-ASP-CYS-TRP-VAL-THR-GLY-TRP-GLY-TYR-ARG-LYS-LEU-ARG-ASP-LYS-ILE-GLN-ASN-THR-LEU-GLN-LYS-ALA-LYS-ILE-PRO-LEU-VAL-THR-ASN-GLU-GLU-CYS-GLN-LYS-ARG-TYR-ARG-GLY-HIS-LYS-ILE-THR-HIS-LYS-MET-ILE-CYS-ALA-GLY-TYR-ARG-GLU-GLY-GLY-LYS-ASP-ALA-CYS-LYS-GLY-ASP-SER-GLY-GLY-PRO-LEU-SER-CYS-LYS-HIS-ASN-GLU-VAL-TRP-HIS-LEU-VAL-GLY-ILE-THR-SER-TRP-GLY-GLU-GLY-CYS-ALA-GLN-ARG-GLU-ARG-PRO-GLY-VAL-TYR-THR-ASN-VAL-VAL-GLU-TYR-VAL-ASP-TRP-ILE-LEU-GLU-LYS-THR-GLN-ALA-VAL,ASN-PRO-ILE-SER-ASP-PHE-PRO-ASP,607,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccccc1)CC(=O)O)CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)[NH3+])C,Kd=324uM,3.489455,3.49,1,A,A,1,A,A,0,,B,A,,1,1,607,8,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.5667309761047363,0.7036952376365662,44.70905685424805,62.31265640258789,1.1363842487335205,1.3078328371047974,0.5734379887580872,0.6242042779922485,0.5569241046905518,0.7235679626464844,NPISDFPD,Low,"(2.044, 3.548]",train
5IAW,protein-peptide,Q96RI1 Q15596,LTPDQQTLLHFIMDSYNKQRMPQEITNKILKEEFSAEENFLILTEMATNHVQVLVEFTKKLPGFQTLDHEDQIALLKGSAVEAMFLRSAEIFNKKLPSGHSDLLEERIRNSGISDEYITPMFSFYKSIGELKMTQEEYALLTAIVILSPDRQYIKDREAVEKLQEPLLDVLQKLCKIHQPENPQHFACLLGRLTELRTFNHHHAEMLMSWRVNDHKFTPLLCEIWDVQ,NALLRYLLDK,LEU-THR-PRO-ASP-GLN-GLN-THR-LEU-LEU-HIS-PHE-ILE-MET-ASP-SER-TYR-ASN-LYS-GLN-ARG-MET-PRO-GLN-GLU-ILE-THR-ASN-LYS-ILE-LEU-LYS-GLU-GLU-PHE-SER-ALA-GLU-GLU-ASN-PHE-LEU-ILE-LEU-THR-GLU-MET-ALA-THR-ASN-HIS-VAL-GLN-VAL-LEU-VAL-GLU-PHE-THR-LYS-LYS-LEU-PRO-GLY-PHE-GLN-THR-LEU-ASP-HIS-GLU-ASP-GLN-ILE-ALA-LEU-LEU-LYS-GLY-SER-ALA-VAL-GLU-ALA-MET-PHE-LEU-ARG-SER-ALA-GLU-ILE-PHE-ASN-LYS-LYS-LEU-PRO-SER-GLY-HIS-SER-ASP-LEU-LEU-GLU-GLU-ARG-ILE-ARG-ASN-SER-GLY-ILE-SER-ASP-GLU-TYR-ILE-THR-PRO-MET-PHE-SER-PHE-TYR-LYS-SER-ILE-GLY-GLU-LEU-LYS-MET-THR-GLN-GLU-GLU-TYR-ALA-LEU-LEU-THR-ALA-ILE-VAL-ILE-LEU-SER-PRO-ASP-ARG-GLN-TYR-ILE-LYS-ASP-ARG-GLU-ALA-VAL-GLU-LYS-LEU-GLN-GLU-PRO-LEU-LEU-ASP-VAL-LEU-GLN-LYS-LEU-CYS-LYS-ILE-HIS-GLN-PRO-GLU-ASN-PRO-GLN-HIS-PHE-ALA-CYS-LEU-LEU-GLY-ARG-LEU-THR-GLU-LEU-ARG-THR-PHE-ASN-HIS-HIS-HIS-ALA-GLU-MET-LEU-MET-SER-TRP-ARG-VAL-ASN-ASP-HIS-LYS-PHE-THR-PRO-LEU-LEU-CYS-GLU-ILE-TRP-ASP-VAL-GLN,ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP-LYS,228,10,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])C)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CC(C)C)CC(C)C)CC(=O)O,IC50=15.44uM,4.811353,4.81,1,A,A,1,A,A,0,,C,A,,1,1,228,10,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9371535778045654,0.81058669090271,89.79972839355469,74.117431640625,0.3821595013141632,0.7703624963760376,0.9111676216125488,0.8644799590110779,0.9173895120620728,0.797113299369812,NALLRYLLDK,Low,"(4.745, 4.866]",train
5IAY,protein-peptide,Q96T88,LYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRDEPCSSTSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGE,TGKGKWKRKSAGGGPS,LEU-TYR-LYS-VAL-ASN-GLU-TYR-VAL-ASP-ALA-ARG-ASP-THR-ASN-MET-GLY-ALA-TRP-PHE-GLU-ALA-GLN-VAL-VAL-ARG-VAL-THR-ARG-LYS-ALA-PRO-SER-ARG-ASP-GLU-PRO-CYS-SER-SER-THR-SER-ARG-PRO-ALA-LEU-GLU-GLU-ASP-VAL-ILE-TYR-HIS-VAL-LYS-TYR-ASP-ASP-TYR-PRO-GLU-ASN-GLY-VAL-VAL-GLN-MET-ASN-SER-ARG-ASP-VAL-ARG-ALA-ARG-ALA-ARG-THR-ILE-ILE-LYS-TRP-GLN-ASP-LEU-GLU-VAL-GLY-GLN-VAL-VAL-MET-LEU-ASN-TYR-ASN-PRO-ASP-ASN-PRO-LYS-GLU-ARG-GLY-PHE-TRP-TYR-ASP-ALA-GLU-ILE-SER-ARG-LYS-ARG-GLU-THR-ARG-THR-ALA-ARG-GLU-LEU-TYR-ALA-ASN-VAL-VAL-LEU-GLY-ASP-ASP-SER-LEU-ASN-ASP-CYS-ARG-ILE-ILE-PHE-VAL-ASP-GLU-VAL-PHE-LYS-ILE-GLU-ARG-PRO-GLY-GLU,THR-GLY-LYS-GLY-LYS-TRP-LYS-ARG-LYS-SER-ALA-GLY-GLY-GLY-PRO-SER,152,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[NH3+])CCCC[NH3+])CCCC[NH3+])CCC[NH+]=C(N)N,Kd=1.59uM,5.798603,5.8,1,A,A,1,A,A,0,,B,A,,1,1,152,16,0,C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.8469719290733337,0.815766453742981,71.89984130859375,79.55265808105469,0.4158158004283905,0.7151275873184204,0.8668301701545715,0.8549364805221558,0.7824835181236267,0.7895265221595764,TGKGKWKRKSAGGGPS,Low,"(5.699, 5.821]",train
5ICK,protein-peptide,Q96RI1 Q15596,ELTPDQQTLLHFIMDSYNKQRMPQEITNKILKEEFSAEENFLILTEMATNHVQVLVEFTKKLPGFQTLDHEDQIALLKGSAVEAMFLRSAEIFNKKLPSGHSDLLEERIRNSGISDEYITPMFSFYKSIGELKMTQEEYALLTAIVILSPDRQYIKDREAVEKLQEPLLDVLQKLCKIHQPENPQHFACLLGRLTELRTFNHHHAEMLMSWRVNDHKFTPLLCEIWDVQ,NALLRYLLDKD,GLU-LEU-THR-PRO-ASP-GLN-GLN-THR-LEU-LEU-HIS-PHE-ILE-MET-ASP-SER-TYR-ASN-LYS-GLN-ARG-MET-PRO-GLN-GLU-ILE-THR-ASN-LYS-ILE-LEU-LYS-GLU-GLU-PHE-SER-ALA-GLU-GLU-ASN-PHE-LEU-ILE-LEU-THR-GLU-MET-ALA-THR-ASN-HIS-VAL-GLN-VAL-LEU-VAL-GLU-PHE-THR-LYS-LYS-LEU-PRO-GLY-PHE-GLN-THR-LEU-ASP-HIS-GLU-ASP-GLN-ILE-ALA-LEU-LEU-LYS-GLY-SER-ALA-VAL-GLU-ALA-MET-PHE-LEU-ARG-SER-ALA-GLU-ILE-PHE-ASN-LYS-LYS-LEU-PRO-SER-GLY-HIS-SER-ASP-LEU-LEU-GLU-GLU-ARG-ILE-ARG-ASN-SER-GLY-ILE-SER-ASP-GLU-TYR-ILE-THR-PRO-MET-PHE-SER-PHE-TYR-LYS-SER-ILE-GLY-GLU-LEU-LYS-MET-THR-GLN-GLU-GLU-TYR-ALA-LEU-LEU-THR-ALA-ILE-VAL-ILE-LEU-SER-PRO-ASP-ARG-GLN-TYR-ILE-LYS-ASP-ARG-GLU-ALA-VAL-GLU-LYS-LEU-GLN-GLU-PRO-LEU-LEU-ASP-VAL-LEU-GLN-LYS-LEU-CYS-LYS-ILE-HIS-GLN-PRO-GLU-ASN-PRO-GLN-HIS-PHE-ALA-CYS-LEU-LEU-GLY-ARG-LEU-THR-GLU-LEU-ARG-THR-PHE-ASN-HIS-HIS-HIS-ALA-GLU-MET-LEU-MET-SER-TRP-ARG-VAL-ASN-ASP-HIS-LYS-PHE-THR-PRO-LEU-LEU-CYS-GLU-ILE-TRP-ASP-VAL-GLN,ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP-LYS-ASP,229,11,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])C)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CC(C)C)CC(C)C)CC(=O)O,IC50=9.786uM,5.009395,5.01,1,A,A,1,A,A,0,,C,A,,0,1,229,11,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9334078431129456,0.7978019118309021,90.45281219482422,76.41287994384766,0.3815390169620514,0.7999616861343384,0.913817822933197,0.8672099709510803,0.9096594452857972,0.7804498672485352,NALLRYLLDKD,Low,"(4.866, 5.014]",val
5IH2,protein-peptide,Q64010 P00520,AEYVRALFDFNGNDEEDLPFKKGDILRIRDKPEEQWWNAEDSEGKRGMIPVPYVEKYR,YEKPALPRKR,ALA-GLU-TYR-VAL-ARG-ALA-LEU-PHE-ASP-PHE-ASN-GLY-ASN-ASP-GLU-GLU-ASP-LEU-PRO-PHE-LYS-LYS-GLY-ASP-ILE-LEU-ARG-ILE-ARG-ASP-LYS-PRO-GLU-GLU-GLN-TRP-TRP-ASN-ALA-GLU-ASP-SER-GLU-GLY-LYS-ARG-GLY-MET-ILE-PRO-VAL-PRO-TYR-VAL-GLU-LYS-TYR-ARG,ACE-TYR-GLU-LYS-PRO-ALA-LEU-PRO-ARG-LYS-ARG-NH2,58,12,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CCCC[NH3+])CCC[NH+]=C(N)N)CC(C)C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)C)CCC(=O)O,Kd=1.72uM,5.764472,5.76,1,A,A,1,A,A,0,,M,A,,1,1,58,12,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9459707736968994,0.7846696376800537,97.86859130859376,95.32286834716795,0.2911235392093658,0.5829635262489319,0.9087358713150024,0.8403351902961731,0.8633676767349243,0.7707532644271851,YEKPALPRKR,Low,"(5.699, 5.821]",train
5IX1,protein-peptide,F7BJB9 P68433,STGIRLSALCPKFLHTNSTSHTWPFSAVAELIDNAYDPDVNAKQIWIDKTVISDHICLTFTDNGNGMTADKLHKMLSFGFSDKVTMNGHVPVGLYGNGFKSGSMRLGKDAMVFTKNGETMSVGFLSQTYLEVIKAEHVVVPIVTFNKHRQMINLTESKASLAAILEHSLFSTEQKLLAELNAIMGKKGTRIIIWNLRSYKNATEFDFEKDKYDIRIPEDLDETAGRKGYKKQERMDQIAPESDYSLRAYCSILYLKPRMQIIIRGQKVKTQLVSKSLAYIERDVYRPKFLTRTVRITFGFNCRNKDHYGIMMYHKNRLIKAYEKVGCQLKANNMGVGVVGIIECNFLKPTHNKQDFDYTNEYRLTILALGEKLNDYWNEMKVKKNAEYPVNLPVEDIQKRPDQTWVQCDACLKWRKLPDGIDQLPEKWYCSNNPDPQFRNCEVPEEPEDED,ARTKQTARKSTGGKA,SER-THR-GLY-ILE-ARG-LEU-SER-ALA-LEU-CYS-PRO-LYS-PHE-LEU-HIS-THR-ASN-SER-THR-SER-HIS-THR-TRP-PRO-PHE-SER-ALA-VAL-ALA-GLU-LEU-ILE-ASP-ASN-ALA-TYR-ASP-PRO-ASP-VAL-ASN-ALA-LYS-GLN-ILE-TRP-ILE-ASP-LYS-THR-VAL-ILE-SER-ASP-HIS-ILE-CYS-LEU-THR-PHE-THR-ASP-ASN-GLY-ASN-GLY-MET-THR-ALA-ASP-LYS-LEU-HIS-LYS-MET-LEU-SER-PHE-GLY-PHE-SER-ASP-LYS-VAL-THR-MET-ASN-GLY-HIS-VAL-PRO-VAL-GLY-LEU-TYR-GLY-ASN-GLY-PHE-LYS-SER-GLY-SER-MET-ARG-LEU-GLY-LYS-ASP-ALA-MET-VAL-PHE-THR-LYS-ASN-GLY-GLU-THR-MET-SER-VAL-GLY-PHE-LEU-SER-GLN-THR-TYR-LEU-GLU-VAL-ILE-LYS-ALA-GLU-HIS-VAL-VAL-VAL-PRO-ILE-VAL-THR-PHE-ASN-LYS-HIS-ARG-GLN-MET-ILE-ASN-LEU-THR-GLU-SER-LYS-ALA-SER-LEU-ALA-ALA-ILE-LEU-GLU-HIS-SER-LEU-PHE-SER-THR-GLU-GLN-LYS-LEU-LEU-ALA-GLU-LEU-ASN-ALA-ILE-MET-GLY-LYS-LYS-GLY-THR-ARG-ILE-ILE-ILE-TRP-ASN-LEU-ARG-SER-TYR-LYS-ASN-ALA-THR-GLU-PHE-ASP-PHE-GLU-LYS-ASP-LYS-TYR-ASP-ILE-ARG-ILE-PRO-GLU-ASP-LEU-ASP-GLU-THR-ALA-GLY-ARG-LYS-GLY-TYR-LYS-LYS-GLN-GLU-ARG-MET-ASP-GLN-ILE-ALA-PRO-GLU-SER-ASP-TYR-SER-LEU-ARG-ALA-TYR-CYS-SER-ILE-LEU-TYR-LEU-LYS-PRO-ARG-MET-GLN-ILE-ILE-ILE-ARG-GLY-GLN-LYS-VAL-LYS-THR-GLN-LEU-VAL-SER-LYS-SER-LEU-ALA-TYR-ILE-GLU-ARG-ASP-VAL-TYR-ARG-PRO-LYS-PHE-LEU-THR-ARG-THR-VAL-ARG-ILE-THR-PHE-GLY-PHE-ASN-CYS-ARG-ASN-LYS-ASP-HIS-TYR-GLY-ILE-MET-MET-TYR-HIS-LYS-ASN-ARG-LEU-ILE-LYS-ALA-TYR-GLU-LYS-VAL-GLY-CYS-GLN-LEU-LYS-ALA-ASN-ASN-MET-GLY-VAL-GLY-VAL-VAL-GLY-ILE-ILE-GLU-CYS-ASN-PHE-LEU-LYS-PRO-THR-HIS-ASN-LYS-GLN-ASP-PHE-ASP-TYR-THR-ASN-GLU-TYR-ARG-LEU-THR-ILE-LEU-ALA-LEU-GLY-GLU-LYS-LEU-ASN-ASP-TYR-TRP-ASN-GLU-MET-LYS-VAL-LYS-LYS-ASN-ALA-GLU-TYR-PRO-VAL-ASN-LEU-PRO-VAL-GLU-ASP-ILE-GLN-LYS-ARG-PRO-ASP-GLN-THR-TRP-VAL-GLN-CYS-ASP-ALA-CYS-LEU-LYS-TRP-ARG-LYS-LEU-PRO-ASP-GLY-ILE-ASP-GLN-LEU-PRO-GLU-LYS-TRP-TYR-CYS-SER-ASN-ASN-PRO-ASP-PRO-GLN-PHE-ARG-ASN-CYS-GLU-VAL-PRO-GLU-GLU-PRO-GLU-ASP-GLU-ASP,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,451,15,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=0.49uM,6.309804,6.31,1,A,A,1,A,A,0,,P,A,,1,1,451,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.6426814794540405,0.6011033058166504,74.63719177246094,69.77510833740234,0.7655754089355469,1.3118542432785034,0.8332752585411072,0.7919443249702454,0.5749149918556213,0.5533930659294128,ARTKQTARKSTGGKA,Low,"(6.26, 6.398]",val
5IXF,protein-peptide,O75886 O95630,GAMGMNKNKEDEDIAKAIELSLQEQKQQHTETKSLYPSSEIQLNNKVARKVRALYDFEAVEDNELTFKHGEIIIVLDDSDANWWKGENHRGIGLFPSDFVTTNLNIETE,AKPPVVDRSLKPGA,GLY-ALA-MET-GLY-MET-ASN-LYS-ASN-LYS-GLU-ASP-GLU-ASP-ILE-ALA-LYS-ALA-ILE-GLU-LEU-SER-LEU-GLN-GLU-GLN-LYS-GLN-GLN-HIS-THR-GLU-THR-LYS-SER-LEU-TYR-PRO-SER-SER-GLU-ILE-GLN-LEU-ASN-ASN-LYS-VAL-ALA-ARG-LYS-VAL-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-VAL-GLU-ASP-ASN-GLU-LEU-THR-PHE-LYS-HIS-GLY-GLU-ILE-ILE-ILE-VAL-LEU-ASP-ASP-SER-ASP-ALA-ASN-TRP-TRP-LYS-GLY-GLU-ASN-HIS-ARG-GLY-ILE-GLY-LEU-PHE-PRO-SER-ASP-PHE-VAL-THR-THR-ASN-LEU-ASN-ILE-GLU-THR-GLU,ALA-LYS-PRO-PRO-VAL-VAL-ASP-ARG-SER-LEU-LYS-PRO-GLY-ALA,109,14,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCCC[NH3+])CC(=O)O)CCC[NH+]=C(N)N)CO)CC(C)C,Kd=3uM,5.522879,5.52,1,A,A,1,A,A,0,,B,A,,1,1,109,14,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(C)C)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)NCC(=O)O,0.9951767325401306,1.0094281435012815,60.68368148803711,68.28463745117188,0.5273768305778503,0.6163251399993896,0.6188188195228577,0.7290918231010437,0.7945507764816284,0.815750777721405,AKPPVVDRSLKPGA,Low,"(5.463, 5.6]",train
5IY4,protein-peptide,Q9H040 P12004,MFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGSLEHHHHHHH,SNSHQNVLSNYFPRVS,MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS-HIS,SER-ASN-SER-HIS-GLN-ASN-VAL-LEU-SER-ASN-TYR-PHE-PRO-ARG-VAL-SER,270,16,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)C(C)C)CCC[NH+]=C(N)N)Cc1ccccc1)Cc1ccc(cc1)O)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1c[nH]cn1)CCC(=O)N)CC(=O)N)CC(C)C,Kd=15.55uM,4.80827,4.81,1,A,A,1,A,A,0,,B,A,,1,1,270,16,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(C)C,0.828062891960144,0.7757478356361389,85.88509368896484,80.8311767578125,0.5004215836524963,0.8576297163963318,0.8610779047012329,0.8381297588348389,0.7564350366592407,0.7323745489120483,SNSHQNVLSNYFPRVS,Low,"(4.745, 4.866]",train
5IYV,protein-peptide,Q29PV4 P47735,GSSMGSLNQDATILRQAKLGLSDPAQSLSSWSDNNDVTPCKWLGVSCDATSNVVSVDLSSFMLVGPFPSILCHLPSLHSLSLYNNSINGSLSADDFDTCHNLISLDLSENLLVGSIPKSLPFNLPNLKFLEISGNNLSDTIPSSFGEFRKLESLNLAGNFLSGTIPASLGNVTTLKELKLAYNLFSPSQIPSQLGNLTELQVLWLAGCNLVGPIPPSLSRLTSLVNLDLTFNQLTGSIPSWITQLKTVEQIELFNNSFSGELPESMGNMTTLKRFDASMNKLTGKIPDNLNLLNLESLNLFENMLEGPLPESITRSKTLSELKLFNNRLTGVLPSQLGANSPLQYVDLSYNRFSGEIPANVCGEGKLEYLILIDNSFSGEISNNLGKCKSLTRVRLSNNKLSGQIPHGFWGLPRLSLLELSDNSFTGSIPKTIIGAKNLSNLRISKNRFSGSIPNEIGSLNGIIEISGAENDFSGEIPESLVKLKQLSRLDLSKNQLSGEIPRELRGWKNLNELNLANNHLSGEIPKEVGILPVLNYLDLSSNQFSGEIPLELQNLKLNVLNLSYNHLSGKIPPLYANKIYAHDFIGNPGLCVDLDGLCRKITRSKLEGSENLYFQ,LVPPSGPSMRHN,GLY-SER-SER-MET-GLY-SER-LEU-ASN-GLN-ASP-ALA-THR-ILE-LEU-ARG-GLN-ALA-LYS-LEU-GLY-LEU-SER-ASP-PRO-ALA-GLN-SER-LEU-SER-SER-TRP-SER-ASP-ASN-ASN-ASP-VAL-THR-PRO-CYS-LYS-TRP-LEU-GLY-VAL-SER-CYS-ASP-ALA-THR-SER-ASN-VAL-VAL-SER-VAL-ASP-LEU-SER-SER-PHE-MET-LEU-VAL-GLY-PRO-PHE-PRO-SER-ILE-LEU-CYS-HIS-LEU-PRO-SER-LEU-HIS-SER-LEU-SER-LEU-TYR-ASN-ASN-SER-ILE-ASN-GLY-SER-LEU-SER-ALA-ASP-ASP-PHE-ASP-THR-CYS-HIS-ASN-LEU-ILE-SER-LEU-ASP-LEU-SER-GLU-ASN-LEU-LEU-VAL-GLY-SER-ILE-PRO-LYS-SER-LEU-PRO-PHE-ASN-LEU-PRO-ASN-LEU-LYS-PHE-LEU-GLU-ILE-SER-GLY-ASN-ASN-LEU-SER-ASP-THR-ILE-PRO-SER-SER-PHE-GLY-GLU-PHE-ARG-LYS-LEU-GLU-SER-LEU-ASN-LEU-ALA-GLY-ASN-PHE-LEU-SER-GLY-THR-ILE-PRO-ALA-SER-LEU-GLY-ASN-VAL-THR-THR-LEU-LYS-GLU-LEU-LYS-LEU-ALA-TYR-ASN-LEU-PHE-SER-PRO-SER-GLN-ILE-PRO-SER-GLN-LEU-GLY-ASN-LEU-THR-GLU-LEU-GLN-VAL-LEU-TRP-LEU-ALA-GLY-CYS-ASN-LEU-VAL-GLY-PRO-ILE-PRO-PRO-SER-LEU-SER-ARG-LEU-THR-SER-LEU-VAL-ASN-LEU-ASP-LEU-THR-PHE-ASN-GLN-LEU-THR-GLY-SER-ILE-PRO-SER-TRP-ILE-THR-GLN-LEU-LYS-THR-VAL-GLU-GLN-ILE-GLU-LEU-PHE-ASN-ASN-SER-PHE-SER-GLY-GLU-LEU-PRO-GLU-SER-MET-GLY-ASN-MET-THR-THR-LEU-LYS-ARG-PHE-ASP-ALA-SER-MET-ASN-LYS-LEU-THR-GLY-LYS-ILE-PRO-ASP-ASN-LEU-ASN-LEU-LEU-ASN-LEU-GLU-SER-LEU-ASN-LEU-PHE-GLU-ASN-MET-LEU-GLU-GLY-PRO-LEU-PRO-GLU-SER-ILE-THR-ARG-SER-LYS-THR-LEU-SER-GLU-LEU-LYS-LEU-PHE-ASN-ASN-ARG-LEU-THR-GLY-VAL-LEU-PRO-SER-GLN-LEU-GLY-ALA-ASN-SER-PRO-LEU-GLN-TYR-VAL-ASP-LEU-SER-TYR-ASN-ARG-PHE-SER-GLY-GLU-ILE-PRO-ALA-ASN-VAL-CYS-GLY-GLU-GLY-LYS-LEU-GLU-TYR-LEU-ILE-LEU-ILE-ASP-ASN-SER-PHE-SER-GLY-GLU-ILE-SER-ASN-ASN-LEU-GLY-LYS-CYS-LYS-SER-LEU-THR-ARG-VAL-ARG-LEU-SER-ASN-ASN-LYS-LEU-SER-GLY-GLN-ILE-PRO-HIS-GLY-PHE-TRP-GLY-LEU-PRO-ARG-LEU-SER-LEU-LEU-GLU-LEU-SER-ASP-ASN-SER-PHE-THR-GLY-SER-ILE-PRO-LYS-THR-ILE-ILE-GLY-ALA-LYS-ASN-LEU-SER-ASN-LEU-ARG-ILE-SER-LYS-ASN-ARG-PHE-SER-GLY-SER-ILE-PRO-ASN-GLU-ILE-GLY-SER-LEU-ASN-GLY-ILE-ILE-GLU-ILE-SER-GLY-ALA-GLU-ASN-ASP-PHE-SER-GLY-GLU-ILE-PRO-GLU-SER-LEU-VAL-LYS-LEU-LYS-GLN-LEU-SER-ARG-LEU-ASP-LEU-SER-LYS-ASN-GLN-LEU-SER-GLY-GLU-ILE-PRO-ARG-GLU-LEU-ARG-GLY-TRP-LYS-ASN-LEU-ASN-GLU-LEU-ASN-LEU-ALA-ASN-ASN-HIS-LEU-SER-GLY-GLU-ILE-PRO-LYS-GLU-VAL-GLY-ILE-LEU-PRO-VAL-LEU-ASN-TYR-LEU-ASP-LEU-SER-SER-ASN-GLN-PHE-SER-GLY-GLU-ILE-PRO-LEU-GLU-LEU-GLN-ASN-LEU-LYS-LEU-ASN-VAL-LEU-ASN-LEU-SER-TYR-ASN-HIS-LEU-SER-GLY-LYS-ILE-PRO-PRO-LEU-TYR-ALA-ASN-LYS-ILE-TYR-ALA-HIS-ASP-PHE-ILE-GLY-ASN-PRO-GLY-LEU-CYS-VAL-ASP-LEU-ASP-GLY-LEU-CYS-ARG-LYS-ILE-THR-ARG-SER-LYS-LEU-GLU-GLY-SER-GLU-ASN-LEU-TYR-PHE-GLN,LEU-VAL-PRO-PRO-SER-GLY-HYP-SER-MET-ARG-HIS-ASN,616,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]1C[C@H](CN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)C[NH3+])CO)O)CO,Kd=135uM,3.869666,3.87,1,A,A,1,A,A,0,,B,A,,1,1,616,12,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8685399889945984,0.6687273979187012,79.5181655883789,79.60392761230469,0.445029079914093,0.8614069819450378,0.8618028163909912,0.8248892426490784,0.8453436493873596,0.613453209400177,LVPPSGPSMRHN,Low,"(3.548, 3.924]",val
5IZU,protein-peptide,Q4ACU6 Q6PFD5,GPGSEFDTRHETREDRTKRLFRHYTVGSYDSLTSHSDYVIDDKVAILQKRDHEGFGFVLRGAKAETPIEEFTPTPAFPALQYLESVDVEGVAWRAGLRTGDFLIEVNGVNVVKVGHKQVVGLIRQGGNRLVMKVVSVTR,ADSIEIYIPEAQTRL,GLY-PRO-GLY-SER-GLU-PHE-ASP-THR-ARG-HIS-GLU-THR-ARG-GLU-ASP-ARG-THR-LYS-ARG-LEU-PHE-ARG-HIS-TYR-THR-VAL-GLY-SER-TYR-ASP-SER-LEU-THR-SER-HIS-SER-ASP-TYR-VAL-ILE-ASP-ASP-LYS-VAL-ALA-ILE-LEU-GLN-LYS-ARG-ASP-HIS-GLU-GLY-PHE-GLY-PHE-VAL-LEU-ARG-GLY-ALA-LYS-ALA-GLU-THR-PRO-ILE-GLU-GLU-PHE-THR-PRO-THR-PRO-ALA-PHE-PRO-ALA-LEU-GLN-TYR-LEU-GLU-SER-VAL-ASP-VAL-GLU-GLY-VAL-ALA-TRP-ARG-ALA-GLY-LEU-ARG-THR-GLY-ASP-PHE-LEU-ILE-GLU-VAL-ASN-GLY-VAL-ASN-VAL-VAL-LYS-VAL-GLY-HIS-LYS-GLN-VAL-VAL-GLY-LEU-ILE-ARG-GLN-GLY-GLY-ASN-ARG-LEU-VAL-MET-LYS-VAL-VAL-SER-VAL-THR-ARG,ALA-ASP-SER-ILE-GLU-ILE-TYR-ILE-PRO-GLU-ALA-GLN-THR-ARG-LEU,139,15,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)[C@H](O)C)CCC(=O)N)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)O)CO)CCC(=O)O)Cc1ccc(cc1)O)C,Kd=0.054uM,7.267606,7.27,1,A,A,1,A,A,0,,B,A,dimer,1,1,139,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.9872432947158812,0.8620370030403137,86.26854705810547,74.6072998046875,0.4668366312980652,0.6558143496513367,0.8410820960998535,0.8317855000495911,0.8330367803573608,0.81114661693573,ADSIEIYIPEAQTRL,Moderate,"(7.049, 7.268]",train
5J3V,protein-peptide,Q92973 P68431,MEYEWKPDEQGLQQILQLLKESQSPDTTIQRTVQQKLEQLNQYPDFNNYLIFVLTKLKSEDEPTRSLSGLILKNNVKAHFQNFPNGVTDFIKSECLNNIGDSSPLIRATVGILITTIASKGELQNWPDLLPKLCSLLDSEDYNTCEGAFGALQKICEDSAEILDSDVLDRPLNIMIPKFLQFFKHSSPKIRSHAVACVNQFIISRTQALMLHIDSFIENLFALAGDEEPEVRKNVCRALVMLLEVRMDRLLPHMHNIVEYMLQRTQDQDENVALEACEFWLTLAEQPICKDVLVRHLPKLIPVLVNGMKYSDIDIILLKGDVEGGSGGSGDDTISDWNLRKCSAAALDVLANVYRDELLPHILPLLKELLFHHEWVVKESGILVLGAIAEGCMQGMIPYLPELIPHLIQCLSDKKALVRSITCWTLSRYAHWVVSQPPDTYLKPLMTELLKRILDSNKRVQEAACSAFATLEEEACTELVPYLAYILDTLVFAFSKYQHKNLLILYDAIGTLADSVGHHLNKPEYIQMLMPPLIQKWNMLKDEDKDLFPLLECLSSVATALQSGFLPYCEPVYQRCVNLVQKTLAQAMLNNAQPDQYEAPDKDFMIVALDLLSGLAEGLGGNIEQLVARSNILTLMYQCMQDKMPEVRQSSFALLGDLTKACFQHVKPCIADFMPILGTNLNPEFISVCNNATWAIGEISIQMGIEMQPYIPMVLHQLVEIINRPNTPKTLLENTAITIGRLGYVCPQEVAPMLQQFIRPWCTSLRNIRDNEEKDSAFRGICTMISVNPSGVIQDFIFFCDAVASWINPKDDLRDMFCKILHGFKNQVGDENWRRFSDQFPLPLKERLAAFYGV,TGGKAPRKQLATKAARK,MET-GLU-TYR-GLU-TRP-LYS-PRO-ASP-GLU-GLN-GLY-LEU-GLN-GLN-ILE-LEU-GLN-LEU-LEU-LYS-GLU-SER-GLN-SER-PRO-ASP-THR-THR-ILE-GLN-ARG-THR-VAL-GLN-GLN-LYS-LEU-GLU-GLN-LEU-ASN-GLN-TYR-PRO-ASP-PHE-ASN-ASN-TYR-LEU-ILE-PHE-VAL-LEU-THR-LYS-LEU-LYS-SER-GLU-ASP-GLU-PRO-THR-ARG-SER-LEU-SER-GLY-LEU-ILE-LEU-LYS-ASN-ASN-VAL-LYS-ALA-HIS-PHE-GLN-ASN-PHE-PRO-ASN-GLY-VAL-THR-ASP-PHE-ILE-LYS-SER-GLU-CYS-LEU-ASN-ASN-ILE-GLY-ASP-SER-SER-PRO-LEU-ILE-ARG-ALA-THR-VAL-GLY-ILE-LEU-ILE-THR-THR-ILE-ALA-SER-LYS-GLY-GLU-LEU-GLN-ASN-TRP-PRO-ASP-LEU-LEU-PRO-LYS-LEU-CYS-SER-LEU-LEU-ASP-SER-GLU-ASP-TYR-ASN-THR-CYS-GLU-GLY-ALA-PHE-GLY-ALA-LEU-GLN-LYS-ILE-CYS-GLU-ASP-SER-ALA-GLU-ILE-LEU-ASP-SER-ASP-VAL-LEU-ASP-ARG-PRO-LEU-ASN-ILE-MET-ILE-PRO-LYS-PHE-LEU-GLN-PHE-PHE-LYS-HIS-SER-SER-PRO-LYS-ILE-ARG-SER-HIS-ALA-VAL-ALA-CYS-VAL-ASN-GLN-PHE-ILE-ILE-SER-ARG-THR-GLN-ALA-LEU-MET-LEU-HIS-ILE-ASP-SER-PHE-ILE-GLU-ASN-LEU-PHE-ALA-LEU-ALA-GLY-ASP-GLU-GLU-PRO-GLU-VAL-ARG-LYS-ASN-VAL-CYS-ARG-ALA-LEU-VAL-MET-LEU-LEU-GLU-VAL-ARG-MET-ASP-ARG-LEU-LEU-PRO-HIS-MET-HIS-ASN-ILE-VAL-GLU-TYR-MET-LEU-GLN-ARG-THR-GLN-ASP-GLN-ASP-GLU-ASN-VAL-ALA-LEU-GLU-ALA-CYS-GLU-PHE-TRP-LEU-THR-LEU-ALA-GLU-GLN-PRO-ILE-CYS-LYS-ASP-VAL-LEU-VAL-ARG-HIS-LEU-PRO-LYS-LEU-ILE-PRO-VAL-LEU-VAL-ASN-GLY-MET-LYS-TYR-SER-ASP-ILE-ASP-ILE-ILE-LEU-LEU-LYS-GLY-ASP-VAL-GLU-GLY-GLY-SER-GLY-GLY-SER-GLY-ASP-ASP-THR-ILE-SER-ASP-TRP-ASN-LEU-ARG-LYS-CYS-SER-ALA-ALA-ALA-LEU-ASP-VAL-LEU-ALA-ASN-VAL-TYR-ARG-ASP-GLU-LEU-LEU-PRO-HIS-ILE-LEU-PRO-LEU-LEU-LYS-GLU-LEU-LEU-PHE-HIS-HIS-GLU-TRP-VAL-VAL-LYS-GLU-SER-GLY-ILE-LEU-VAL-LEU-GLY-ALA-ILE-ALA-GLU-GLY-CYS-MET-GLN-GLY-MET-ILE-PRO-TYR-LEU-PRO-GLU-LEU-ILE-PRO-HIS-LEU-ILE-GLN-CYS-LEU-SER-ASP-LYS-LYS-ALA-LEU-VAL-ARG-SER-ILE-THR-CYS-TRP-THR-LEU-SER-ARG-TYR-ALA-HIS-TRP-VAL-VAL-SER-GLN-PRO-PRO-ASP-THR-TYR-LEU-LYS-PRO-LEU-MET-THR-GLU-LEU-LEU-LYS-ARG-ILE-LEU-ASP-SER-ASN-LYS-ARG-VAL-GLN-GLU-ALA-ALA-CYS-SER-ALA-PHE-ALA-THR-LEU-GLU-GLU-GLU-ALA-CYS-THR-GLU-LEU-VAL-PRO-TYR-LEU-ALA-TYR-ILE-LEU-ASP-THR-LEU-VAL-PHE-ALA-PHE-SER-LYS-TYR-GLN-HIS-LYS-ASN-LEU-LEU-ILE-LEU-TYR-ASP-ALA-ILE-GLY-THR-LEU-ALA-ASP-SER-VAL-GLY-HIS-HIS-LEU-ASN-LYS-PRO-GLU-TYR-ILE-GLN-MET-LEU-MET-PRO-PRO-LEU-ILE-GLN-LYS-TRP-ASN-MET-LEU-LYS-ASP-GLU-ASP-LYS-ASP-LEU-PHE-PRO-LEU-LEU-GLU-CYS-LEU-SER-SER-VAL-ALA-THR-ALA-LEU-GLN-SER-GLY-PHE-LEU-PRO-TYR-CYS-GLU-PRO-VAL-TYR-GLN-ARG-CYS-VAL-ASN-LEU-VAL-GLN-LYS-THR-LEU-ALA-GLN-ALA-MET-LEU-ASN-ASN-ALA-GLN-PRO-ASP-GLN-TYR-GLU-ALA-PRO-ASP-LYS-ASP-PHE-MET-ILE-VAL-ALA-LEU-ASP-LEU-LEU-SER-GLY-LEU-ALA-GLU-GLY-LEU-GLY-GLY-ASN-ILE-GLU-GLN-LEU-VAL-ALA-ARG-SER-ASN-ILE-LEU-THR-LEU-MET-TYR-GLN-CYS-MET-GLN-ASP-LYS-MET-PRO-GLU-VAL-ARG-GLN-SER-SER-PHE-ALA-LEU-LEU-GLY-ASP-LEU-THR-LYS-ALA-CYS-PHE-GLN-HIS-VAL-LYS-PRO-CYS-ILE-ALA-ASP-PHE-MET-PRO-ILE-LEU-GLY-THR-ASN-LEU-ASN-PRO-GLU-PHE-ILE-SER-VAL-CYS-ASN-ASN-ALA-THR-TRP-ALA-ILE-GLY-GLU-ILE-SER-ILE-GLN-MET-GLY-ILE-GLU-MET-GLN-PRO-TYR-ILE-PRO-MET-VAL-LEU-HIS-GLN-LEU-VAL-GLU-ILE-ILE-ASN-ARG-PRO-ASN-THR-PRO-LYS-THR-LEU-LEU-GLU-ASN-THR-ALA-ILE-THR-ILE-GLY-ARG-LEU-GLY-TYR-VAL-CYS-PRO-GLN-GLU-VAL-ALA-PRO-MET-LEU-GLN-GLN-PHE-ILE-ARG-PRO-TRP-CYS-THR-SER-LEU-ARG-ASN-ILE-ARG-ASP-ASN-GLU-GLU-LYS-ASP-SER-ALA-PHE-ARG-GLY-ILE-CYS-THR-MET-ILE-SER-VAL-ASN-PRO-SER-GLY-VAL-ILE-GLN-ASP-PHE-ILE-PHE-PHE-CYS-ASP-ALA-VAL-ALA-SER-TRP-ILE-ASN-PRO-LYS-ASP-ASP-LEU-ARG-ASP-MET-PHE-CYS-LYS-ILE-LEU-HIS-GLY-PHE-LYS-ASN-GLN-VAL-GLY-ASP-GLU-ASN-TRP-ARG-ARG-PHE-SER-ASP-GLN-PHE-PRO-LEU-PRO-LEU-LYS-GLU-ARG-LEU-ALA-ALA-PHE-TYR-GLY-VAL,THR-GLY-GLY-LYS-ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-LYS,854,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)C)C)CCCC[NH3+])[C@H](O)C)C)CC(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[NH3+])C)CCC[NH+]=C(N)N,Kd=104.5nM,6.980884,6.98,1,A,A,1,A,A,0,,C,A,,1,1,854,17,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.7640686631202698,0.6816952228546143,60.840457916259766,60.66133117675781,0.4975627362728119,1.0077258348464966,0.7722598910331726,0.7799198031425476,0.7498222589492798,0.6571390628814697,TGGKAPRKQLATKAARK,Low,"(6.824, 7.049]",train
5J9K,protein-peptide,Q2RBP2 Q5NBT9,MSSLSRELVFLILQFLDEEKFKETVHKLEQESGFFFNMKYFEEKVHAGEWDEVEKYLSGFTKVDDNRYSMKIFFEIRKQKYLEALDRHDRAKAVDILVKDLKVFSTFNEELYKEITQLLTLENFRENEQLSKYGDTKSARSIMLIELKKLIEANPLFREKLVFPTLKASRLRTLINQSLNWQHQLCKNPRPNPDIKTLFTDHTCTPPNG,DNLIYLDLNLQDWDD,MET-SER-SER-LEU-SER-ARG-GLU-LEU-VAL-PHE-LEU-ILE-LEU-GLN-PHE-LEU-ASP-GLU-GLU-LYS-PHE-LYS-GLU-THR-VAL-HIS-LYS-LEU-GLU-GLN-GLU-SER-GLY-PHE-PHE-PHE-ASN-MET-LYS-TYR-PHE-GLU-GLU-LYS-VAL-HIS-ALA-GLY-GLU-TRP-ASP-GLU-VAL-GLU-LYS-TYR-LEU-SER-GLY-PHE-THR-LYS-VAL-ASP-ASP-ASN-ARG-TYR-SER-MET-LYS-ILE-PHE-PHE-GLU-ILE-ARG-LYS-GLN-LYS-TYR-LEU-GLU-ALA-LEU-ASP-ARG-HIS-ASP-ARG-ALA-LYS-ALA-VAL-ASP-ILE-LEU-VAL-LYS-ASP-LEU-LYS-VAL-PHE-SER-THR-PHE-ASN-GLU-GLU-LEU-TYR-LYS-GLU-ILE-THR-GLN-LEU-LEU-THR-LEU-GLU-ASN-PHE-ARG-GLU-ASN-GLU-GLN-LEU-SER-LYS-TYR-GLY-ASP-THR-LYS-SER-ALA-ARG-SER-ILE-MET-LEU-ILE-GLU-LEU-LYS-LYS-LEU-ILE-GLU-ALA-ASN-PRO-LEU-PHE-ARG-GLU-LYS-LEU-VAL-PHE-PRO-THR-LEU-LYS-ALA-SER-ARG-LEU-ARG-THR-LEU-ILE-ASN-GLN-SER-LEU-ASN-TRP-GLN-HIS-GLN-LEU-CYS-LYS-ASN-PRO-ARG-PRO-ASN-PRO-ASP-ILE-LYS-THR-LEU-PHE-THR-ASP-HIS-THR-CYS-THR-PRO-PRO-ASN-GLY,ASP-ASN-LEU-ILE-TYR-LEU-ASP-LEU-ASN-LEU-GLN-ASP-TRP-ASP-ASP,209,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)CC(C)C)CC(=O)O)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(C)C)C,IC50=1.4uM,5.853872,5.85,1,A,A,1,A,A,0,,C,A,,1,1,209,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8395456075668335,0.7540111541748047,87.67696380615234,82.9923095703125,0.5057780146598816,0.9760296940803528,0.8178205490112305,0.8011741042137146,0.7529009580612183,0.6913831233978271,DNLIYLDLNLQDWDD,Low,"(5.821, 5.959]",train
5JEK,protein-peptide,Q7Z434 Q14653,SEFENPLKRLLVPGEEWEFEVTAFYRGRQVFQQTISCPEGLRLVGSEVGDRTLPGWPVTLPDPGMSLTDRGVMSYVRHVLSCLGGGLALWRAGQWLWAQRLGHCHTYWAVSEELLPNSGHGPDGEVPKDKEGGVFDLGPFIVDLITFTEGSGRSPRYALWFCVGESWPQDQPWTKRLVMVKVVPTCLRALVEMARVGGASSLENTVDLHISNSHPLSLTSDQYKAYLQDLVEGMDFQGPGES,SGCFEDLAISASTSLGWG,SER-GLU-PHE-GLU-ASN-PRO-LEU-LYS-ARG-LEU-LEU-VAL-PRO-GLY-GLU-GLU-TRP-GLU-PHE-GLU-VAL-THR-ALA-PHE-TYR-ARG-GLY-ARG-GLN-VAL-PHE-GLN-GLN-THR-ILE-SER-CYS-PRO-GLU-GLY-LEU-ARG-LEU-VAL-GLY-SER-GLU-VAL-GLY-ASP-ARG-THR-LEU-PRO-GLY-TRP-PRO-VAL-THR-LEU-PRO-ASP-PRO-GLY-MET-SER-LEU-THR-ASP-ARG-GLY-VAL-MET-SER-TYR-VAL-ARG-HIS-VAL-LEU-SER-CYS-LEU-GLY-GLY-GLY-LEU-ALA-LEU-TRP-ARG-ALA-GLY-GLN-TRP-LEU-TRP-ALA-GLN-ARG-LEU-GLY-HIS-CYS-HIS-THR-TYR-TRP-ALA-VAL-SER-GLU-GLU-LEU-LEU-PRO-ASN-SER-GLY-HIS-GLY-PRO-ASP-GLY-GLU-VAL-PRO-LYS-ASP-LYS-GLU-GLY-GLY-VAL-PHE-ASP-LEU-GLY-PRO-PHE-ILE-VAL-ASP-LEU-ILE-THR-PHE-THR-GLU-GLY-SER-GLY-ARG-SER-PRO-ARG-TYR-ALA-LEU-TRP-PHE-CYS-VAL-GLY-GLU-SER-TRP-PRO-GLN-ASP-GLN-PRO-TRP-THR-LYS-ARG-LEU-VAL-MET-VAL-LYS-VAL-VAL-PRO-THR-CYS-LEU-ARG-ALA-LEU-VAL-GLU-MET-ALA-ARG-VAL-GLY-GLY-ALA-SER-SER-LEU-GLU-ASN-THR-VAL-ASP-LEU-HIS-ILE-SER-ASN-SER-HIS-PRO-LEU-SER-LEU-THR-SER-ASP-GLN-TYR-LYS-ALA-TYR-LEU-GLN-ASP-LEU-VAL-GLU-GLY-MET-ASP-PHE-GLN-GLY-PRO-GLY-GLU-SER,SER-GLY-CYS-PHE-GLU-ASP-LEU-ALA-ILE-SEP-ALA-SER-THR-SER-LEU-GLY-TRP-GLY,242,18,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@H](O)C)CO)C)COP(O)(O)O)[C@H](CC)C)C)CC(C)C)CC(=O)O)CCC(=O)O)Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)[NH3+],Kd=104uM,3.982967,3.98,1,A,A,1,A,A,0,,C,A,,1,1,242,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,0.816006064414978,0.7305787205696106,84.1352310180664,78.22147369384766,0.4932099282741546,0.9696672558784484,0.8943362236022949,0.8237862586975098,0.7531542181968689,0.7072768211364746,SGCFEDLAISASTSLGWG,Low,"(3.924, 4.155]",train
5JIN,protein-peptide,Q96KQ7 P68431,IRTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKDGEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRL,TKQTARMSTGG,ILE-ARG-THR-GLU-LYS-ILE-ILE-CYS-ARG-ASP-VAL-ALA-ARG-GLY-TYR-GLU-ASN-VAL-PRO-ILE-PRO-CYS-VAL-ASN-GLY-VAL-ASP-GLY-GLU-PRO-CYS-PRO-GLU-ASP-TYR-LYS-TYR-ILE-SER-GLU-ASN-CYS-GLU-THR-SER-THR-MET-ASN-ILE-ASP-ARG-ASN-ILE-THR-HIS-LEU-GLN-HIS-CYS-THR-CYS-VAL-ASP-ASP-CYS-SER-SER-SER-ASN-CYS-LEU-CYS-GLY-GLN-LEU-SER-ILE-ARG-CYS-TRP-TYR-ASP-LYS-ASP-GLY-ARG-LEU-LEU-GLN-GLU-PHE-ASN-LYS-ILE-GLU-PRO-PRO-LEU-ILE-PHE-GLU-CYS-ASN-GLN-ALA-CYS-SER-CYS-TRP-ARG-ASN-CYS-LYS-ASN-ARG-VAL-VAL-GLN-SER-GLY-ILE-LYS-VAL-ARG-LEU-GLN-LEU-TYR-ARG-THR-ALA-LYS-MET-GLY-TRP-GLY-VAL-ARG-ALA-LEU-GLN-THR-ILE-PRO-GLN-GLY-THR-PHE-ILE-CYS-GLU-TYR-VAL-GLY-GLU-LEU-ILE-SER-ASP-ALA-GLU-ALA-ASP-VAL-ARG-GLU-ASP-ASP-SER-TYR-LEU-PHE-ASP-LEU-ASP-ASN-LYS-ASP-GLY-GLU-VAL-TYR-CYS-ILE-ASP-ALA-ARG-TYR-TYR-GLY-ASN-ILE-SER-ARG-PHE-ILE-ASN-HIS-LEU-CYS-ASP-PRO-ASN-ILE-ILE-PRO-VAL-ARG-VAL-PHE-MET-LEU-HIS-GLN-ASP-LEU-ARG-PHE-PRO-ARG-ILE-ALA-PHE-PHE-SER-SER-ARG-ASP-ILE-ARG-THR-GLY-GLU-GLU-LEU-GLY-PHE-ASP-TYR-GLY-ASP-ARG-PHE-TRP-ASP-ILE-LYS-SER-LYS-TYR-PHE-THR-CYS-GLN-CYS-GLY-SER-GLU-LYS-CYS-LYS-HIS-SER-ALA-GLU-ALA-ILE-ALA-LEU-GLU-GLN-SER-ARG-LEU,THR-LYS-GLN-THR-ALA-ARG-MET-SER-THR-GLY-GLY,274,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCSC)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)[NH3+],IC50=2.3uM,5.638272,5.64,1,A,A,1,A,A,0,,F,A,,1,1,274,11,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.91465026140213,0.8249358534812927,89.63848114013672,88.23904418945312,0.4045193791389465,0.6824966073036194,0.9254578948020936,0.905647337436676,0.8878255486488342,0.8047579526901245,TKQTARMSTGG,Low,"(5.6, 5.699]",train
5JIY,protein-peptide,Q96KQ7 P68431,IRTEKIICRDVARGYENVPIPCVNGVDGEPCPEDYKYISENCETSTMNIDRNITHLQHCTCVDDCSSSNCLCGQLSIRCWYDKDGRLLQEFNKIEPPLIFECNQACSCWRNCKNRVVQSGIKVRLQLYRTAKMGWGVRALQTIPQGTFICEYVGELISDAEADVREDDSYLFDLDNKDGEVYCIDARYYGNISRFINHLCDPNIIPVRVFMLHQDLRFPRIAFFSSRDIRTGEELGFDYGDRFWDIKSKYFTCQCGSEKCKHSAEAIALEQSRL,TKQTARLSTGG,ILE-ARG-THR-GLU-LYS-ILE-ILE-CYS-ARG-ASP-VAL-ALA-ARG-GLY-TYR-GLU-ASN-VAL-PRO-ILE-PRO-CYS-VAL-ASN-GLY-VAL-ASP-GLY-GLU-PRO-CYS-PRO-GLU-ASP-TYR-LYS-TYR-ILE-SER-GLU-ASN-CYS-GLU-THR-SER-THR-MET-ASN-ILE-ASP-ARG-ASN-ILE-THR-HIS-LEU-GLN-HIS-CYS-THR-CYS-VAL-ASP-ASP-CYS-SER-SER-SER-ASN-CYS-LEU-CYS-GLY-GLN-LEU-SER-ILE-ARG-CYS-TRP-TYR-ASP-LYS-ASP-GLY-ARG-LEU-LEU-GLN-GLU-PHE-ASN-LYS-ILE-GLU-PRO-PRO-LEU-ILE-PHE-GLU-CYS-ASN-GLN-ALA-CYS-SER-CYS-TRP-ARG-ASN-CYS-LYS-ASN-ARG-VAL-VAL-GLN-SER-GLY-ILE-LYS-VAL-ARG-LEU-GLN-LEU-TYR-ARG-THR-ALA-LYS-MET-GLY-TRP-GLY-VAL-ARG-ALA-LEU-GLN-THR-ILE-PRO-GLN-GLY-THR-PHE-ILE-CYS-GLU-TYR-VAL-GLY-GLU-LEU-ILE-SER-ASP-ALA-GLU-ALA-ASP-VAL-ARG-GLU-ASP-ASP-SER-TYR-LEU-PHE-ASP-LEU-ASP-ASN-LYS-ASP-GLY-GLU-VAL-TYR-CYS-ILE-ASP-ALA-ARG-TYR-TYR-GLY-ASN-ILE-SER-ARG-PHE-ILE-ASN-HIS-LEU-CYS-ASP-PRO-ASN-ILE-ILE-PRO-VAL-ARG-VAL-PHE-MET-LEU-HIS-GLN-ASP-LEU-ARG-PHE-PRO-ARG-ILE-ALA-PHE-PHE-SER-SER-ARG-ASP-ILE-ARG-THR-GLY-GLU-GLU-LEU-GLY-PHE-ASP-TYR-GLY-ASP-ARG-PHE-TRP-ASP-ILE-LYS-SER-LYS-TYR-PHE-THR-CYS-GLN-CYS-GLY-SER-GLU-LYS-CYS-LYS-HIS-SER-ALA-GLU-ALA-ILE-ALA-LEU-GLU-GLN-SER-ARG-LEU,THR-LYS-GLN-THR-ALA-ARG-NLE-SER-THR-GLY-GLY,274,11,CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)N)C)CCC[NH+]=C(N)N,IC50=0.54uM,6.267606,6.27,1,A,A,1,A,A,0,,F,A,,1,1,274,11,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O,CCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9020463824272156,0.8275298476219177,90.40729522705078,87.12140655517578,0.4222976863384247,0.6807116866111755,0.9193205237388612,0.9073280096054076,0.8736050128936768,0.807580292224884,TKQTARLSTGG,Low,"(6.26, 6.398]",train
5K6S,protein-peptide,O60566 Q13362,GHMGSRDVPPADQEKLFIQKLRQCCVLFDFVSDPLSDLKWKEVKRAALSEMVEYITHNRNVITEPIYPEVVHMFAVNMFRTLPPSSNPTGAEFDPEEDEPTLEAAWPHLQLVYEFFLRFLESPDFQPNIAKKYIDQKFVLQLLELFDSEDPRERDFLKTTLHRIYGKFLGLRAYIRKQINNIFYRFIYETEHHNGIAELLEILGSIINGFALPLKEEHKIFLLKVLLPLHKVKSLSVYHPQLAYCVVQFLEKDSTLTEPVVMALLKYWPKTHSPKEVMFLNELEEILDVIEPSEFVKIMEPLFRQLAKCVSSPHFQVAERALYYWNNEYIMSLISDNAAKILPIMFPSLYRNSKT,TLSIKKLSPIIEDDREADH,GLY-HIS-MET-GLY-SER-ARG-ASP-VAL-PRO-PRO-ALA-ASP-GLN-GLU-LYS-LEU-PHE-ILE-GLN-LYS-LEU-ARG-GLN-CYS-CYS-VAL-LEU-PHE-ASP-PHE-VAL-SER-ASP-PRO-LEU-SER-ASP-LEU-LYS-TRP-LYS-GLU-VAL-LYS-ARG-ALA-ALA-LEU-SER-GLU-MET-VAL-GLU-TYR-ILE-THR-HIS-ASN-ARG-ASN-VAL-ILE-THR-GLU-PRO-ILE-TYR-PRO-GLU-VAL-VAL-HIS-MET-PHE-ALA-VAL-ASN-MET-PHE-ARG-THR-LEU-PRO-PRO-SER-SER-ASN-PRO-THR-GLY-ALA-GLU-PHE-ASP-PRO-GLU-GLU-ASP-GLU-PRO-THR-LEU-GLU-ALA-ALA-TRP-PRO-HIS-LEU-GLN-LEU-VAL-TYR-GLU-PHE-PHE-LEU-ARG-PHE-LEU-GLU-SER-PRO-ASP-PHE-GLN-PRO-ASN-ILE-ALA-LYS-LYS-TYR-ILE-ASP-GLN-LYS-PHE-VAL-LEU-GLN-LEU-LEU-GLU-LEU-PHE-ASP-SER-GLU-ASP-PRO-ARG-GLU-ARG-ASP-PHE-LEU-LYS-THR-THR-LEU-HIS-ARG-ILE-TYR-GLY-LYS-PHE-LEU-GLY-LEU-ARG-ALA-TYR-ILE-ARG-LYS-GLN-ILE-ASN-ASN-ILE-PHE-TYR-ARG-PHE-ILE-TYR-GLU-THR-GLU-HIS-HIS-ASN-GLY-ILE-ALA-GLU-LEU-LEU-GLU-ILE-LEU-GLY-SER-ILE-ILE-ASN-GLY-PHE-ALA-LEU-PRO-LEU-LYS-GLU-GLU-HIS-LYS-ILE-PHE-LEU-LEU-LYS-VAL-LEU-LEU-PRO-LEU-HIS-LYS-VAL-LYS-SER-LEU-SER-VAL-TYR-HIS-PRO-GLN-LEU-ALA-TYR-CYS-VAL-VAL-GLN-PHE-LEU-GLU-LYS-ASP-SER-THR-LEU-THR-GLU-PRO-VAL-VAL-MET-ALA-LEU-LEU-LYS-TYR-TRP-PRO-LYS-THR-HIS-SER-PRO-LYS-GLU-VAL-MET-PHE-LEU-ASN-GLU-LEU-GLU-GLU-ILE-LEU-ASP-VAL-ILE-GLU-PRO-SER-GLU-PHE-VAL-LYS-ILE-MET-GLU-PRO-LEU-PHE-ARG-GLN-LEU-ALA-LYS-CYS-VAL-SER-SER-PRO-HIS-PHE-GLN-VAL-ALA-GLU-ARG-ALA-LEU-TYR-TYR-TRP-ASN-ASN-GLU-TYR-ILE-MET-SER-LEU-ILE-SER-ASP-ASN-ALA-ALA-LYS-ILE-LEU-PRO-ILE-MET-PHE-PRO-SER-LEU-TYR-ARG-ASN-SER-LYS-THR,THR-LEU-SER-ILE-LYS-LYS-LEU-SEP-PRO-ILE-ILE-GLU-ASP-ASP-ARG-GLU-ALA-ASP-HIS,355,19,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(=O)O)CC(=O)O)CCC(=O)O)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC)CC(C)C)COP(O)(O)O)C,Kd=0.55uM,6.259637,6.26,1,A,A,1,A,A,0,,B,A,,1,1,355,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,0.8067322969436646,0.813334047794342,83.0394058227539,80.91657257080078,0.4440372288227081,0.7109282612800598,0.8980932235717773,0.8863148093223572,0.7521407008171082,0.7950888276100159,TLSIKKLSPIIEDDREADH,Low,"(6.097, 6.26]",train
5KEZ,protein-peptide,P04746,EYSPNTQQGRTSIVHLFEWRWVDIALECERYLAPKGFGGVQVSPPNENVAIYNPFRPWWERYQPVSYKLCTRSGNEDEFRNMVTRCNNVGVRIYVDAVINHMCGNAVSAGTSSTCGSYFNPGSRDFPAVPYSGWDFNDGKCKTGSGDIENYNDATQVRDCRLTGLLDLALEKDYVRSKIAEYMNHLIDIGVAGFRLDASKHMWPGDIKAILDKLHNLNSNWFPAGSKPFIYQEVIDLGGEPIKSSDYFGNGRVTEFKYGAKLGTVIRKWNGEKMSYLKNWGEGWGFVPSDRALVFVDNHDNQRGHGAGGASILTFWDARLYKMAVGFMLAHPYGFTRVMSSYRWPRQFQNGNDVNDWVGPPNNNGVIKEVTINPDTTCGNDWVCEHRWRQIRNMVIFRNVVDGQPFTNWYDNGSNQVAFGRGNRGFIVFNNDDWSFSLTLQTGLPAGTYCDVISGDKINGNCTGIKIYVSDDGKAHFSISNSAEDPFIAIHAESKL,YPYSCWVRH,PCA-TYR-SER-PRO-ASN-THR-GLN-GLN-GLY-ARG-THR-SER-ILE-VAL-HIS-LEU-PHE-GLU-TRP-ARG-TRP-VAL-ASP-ILE-ALA-LEU-GLU-CYS-GLU-ARG-TYR-LEU-ALA-PRO-LYS-GLY-PHE-GLY-GLY-VAL-GLN-VAL-SER-PRO-PRO-ASN-GLU-ASN-VAL-ALA-ILE-TYR-ASN-PRO-PHE-ARG-PRO-TRP-TRP-GLU-ARG-TYR-GLN-PRO-VAL-SER-TYR-LYS-LEU-CYS-THR-ARG-SER-GLY-ASN-GLU-ASP-GLU-PHE-ARG-ASN-MET-VAL-THR-ARG-CYS-ASN-ASN-VAL-GLY-VAL-ARG-ILE-TYR-VAL-ASP-ALA-VAL-ILE-ASN-HIS-MET-CYS-GLY-ASN-ALA-VAL-SER-ALA-GLY-THR-SER-SER-THR-CYS-GLY-SER-TYR-PHE-ASN-PRO-GLY-SER-ARG-ASP-PHE-PRO-ALA-VAL-PRO-TYR-SER-GLY-TRP-ASP-PHE-ASN-ASP-GLY-LYS-CYS-LYS-THR-GLY-SER-GLY-ASP-ILE-GLU-ASN-TYR-ASN-ASP-ALA-THR-GLN-VAL-ARG-ASP-CYS-ARG-LEU-THR-GLY-LEU-LEU-ASP-LEU-ALA-LEU-GLU-LYS-ASP-TYR-VAL-ARG-SER-LYS-ILE-ALA-GLU-TYR-MET-ASN-HIS-LEU-ILE-ASP-ILE-GLY-VAL-ALA-GLY-PHE-ARG-LEU-ASP-ALA-SER-LYS-HIS-MET-TRP-PRO-GLY-ASP-ILE-LYS-ALA-ILE-LEU-ASP-LYS-LEU-HIS-ASN-LEU-ASN-SER-ASN-TRP-PHE-PRO-ALA-GLY-SER-LYS-PRO-PHE-ILE-TYR-GLN-GLU-VAL-ILE-ASP-LEU-GLY-GLY-GLU-PRO-ILE-LYS-SER-SER-ASP-TYR-PHE-GLY-ASN-GLY-ARG-VAL-THR-GLU-PHE-LYS-TYR-GLY-ALA-LYS-LEU-GLY-THR-VAL-ILE-ARG-LYS-TRP-ASN-GLY-GLU-LYS-MET-SER-TYR-LEU-LYS-ASN-TRP-GLY-GLU-GLY-TRP-GLY-PHE-VAL-PRO-SER-ASP-ARG-ALA-LEU-VAL-PHE-VAL-ASP-ASN-HIS-ASP-ASN-GLN-ARG-GLY-HIS-GLY-ALA-GLY-GLY-ALA-SER-ILE-LEU-THR-PHE-TRP-ASP-ALA-ARG-LEU-TYR-LYS-MET-ALA-VAL-GLY-PHE-MET-LEU-ALA-HIS-PRO-TYR-GLY-PHE-THR-ARG-VAL-MET-SER-SER-TYR-ARG-TRP-PRO-ARG-GLN-PHE-GLN-ASN-GLY-ASN-ASP-VAL-ASN-ASP-TRP-VAL-GLY-PRO-PRO-ASN-ASN-ASN-GLY-VAL-ILE-LYS-GLU-VAL-THR-ILE-ASN-PRO-ASP-THR-THR-CYS-GLY-ASN-ASP-TRP-VAL-CYS-GLU-HIS-ARG-TRP-ARG-GLN-ILE-ARG-ASN-MET-VAL-ILE-PHE-ARG-ASN-VAL-VAL-ASP-GLY-GLN-PRO-PHE-THR-ASN-TRP-TYR-ASP-ASN-GLY-SER-ASN-GLN-VAL-ALA-PHE-GLY-ARG-GLY-ASN-ARG-GLY-PHE-ILE-VAL-PHE-ASN-ASN-ASP-ASP-TRP-SER-PHE-SER-LEU-THR-LEU-GLN-THR-GLY-LEU-PRO-ALA-GLY-THR-TYR-CYS-ASP-VAL-ILE-SER-GLY-ASP-LYS-ILE-ASN-GLY-ASN-CYS-THR-GLY-ILE-LYS-ILE-TYR-VAL-SER-ASP-ASP-GLY-LYS-ALA-HIS-PHE-SER-ILE-SER-ASN-SER-ALA-GLU-ASP-PRO-PHE-ILE-ALA-ILE-HIS-ALA-GLU-SER-LYS-LEU,ACE-DTY-PRO-TYR-SER-CYS-TRP-VAL-ARG-HIS-NH2,496,11,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)CSC[C@H](NC1=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]cn1)CCC[NH+]=C(N)N)C(C)C)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O,Ki=7nM,8.154902,8.15,1,A,A,1,A,A,0,,B,A,,1,1,496,11,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.91404128074646,0.8437446355819702,94.18669128417967,94.4017333984375,0.327320784330368,0.6309385299682617,0.9592254757881165,0.9361786246299744,0.8916065692901611,0.8206361532211304,YPYSCWVRH,Moderate,"(7.921, 8.383]",train
5KGN,protein-peptide,G5EFZ1,MAMANNSSVANKVCLIVIDGWGVSEDPYGNAILNAQTPVMDKLCSGNWAQIEAHGLHVGLPEGLMGNSEVGHLNIGAGRVIYQDIVRINLAVKNNKFVTNESLVDACDRAKNGNGRLHLAGLVSDGGVHSHIDHMFALVKAIKELGVPELYLHFYGDGRDTSPNSGVGFLEQTLEFLEKTTGYGKLATVVGRYYAMDRDNRWERINVAYEAMIGGVGETSDEAGVVEVVRKRYAADETDEFLKPIILQGEKGRVQNDDTIIFFDYRADRMREISAAMGMDRYKDCNSKLAHPSNLQVYGMTQYKAEFPFKSLFPPASNKNVLAEWLAEQKVSQFHCAETEKYAHVTFFFNGGLEKQFEGEERCLVPSPKVATYDLQPEMSAAGVADKMIEQLEAGTHPFIMCNFAPPDMVGHTGVYEAAVKACEATDIAIGRIYEATQKHGYSLMVTADHGNAEKMKAPDGGKHTAHTCYRVPLTLSHPGFKFVDPADRHPALCDVAPTVLAIMGLPQPAEMTGVSIVQKIKLAAALEHHHHHH,YDYPGDYCYLY,MET-ALA-MET-ALA-ASN-ASN-SER-SER-VAL-ALA-ASN-LYS-VAL-CYS-LEU-ILE-VAL-ILE-ASP-GLY-TRP-GLY-VAL-SER-GLU-ASP-PRO-TYR-GLY-ASN-ALA-ILE-LEU-ASN-ALA-GLN-THR-PRO-VAL-MET-ASP-LYS-LEU-CYS-SER-GLY-ASN-TRP-ALA-GLN-ILE-GLU-ALA-HIS-GLY-LEU-HIS-VAL-GLY-LEU-PRO-GLU-GLY-LEU-MET-GLY-ASN-SER-GLU-VAL-GLY-HIS-LEU-ASN-ILE-GLY-ALA-GLY-ARG-VAL-ILE-TYR-GLN-ASP-ILE-VAL-ARG-ILE-ASN-LEU-ALA-VAL-LYS-ASN-ASN-LYS-PHE-VAL-THR-ASN-GLU-SER-LEU-VAL-ASP-ALA-CYS-ASP-ARG-ALA-LYS-ASN-GLY-ASN-GLY-ARG-LEU-HIS-LEU-ALA-GLY-LEU-VAL-SER-ASP-GLY-GLY-VAL-HIS-SER-HIS-ILE-ASP-HIS-MET-PHE-ALA-LEU-VAL-LYS-ALA-ILE-LYS-GLU-LEU-GLY-VAL-PRO-GLU-LEU-TYR-LEU-HIS-PHE-TYR-GLY-ASP-GLY-ARG-ASP-THR-SER-PRO-ASN-SER-GLY-VAL-GLY-PHE-LEU-GLU-GLN-THR-LEU-GLU-PHE-LEU-GLU-LYS-THR-THR-GLY-TYR-GLY-LYS-LEU-ALA-THR-VAL-VAL-GLY-ARG-TYR-TYR-ALA-MET-ASP-ARG-ASP-ASN-ARG-TRP-GLU-ARG-ILE-ASN-VAL-ALA-TYR-GLU-ALA-MET-ILE-GLY-GLY-VAL-GLY-GLU-THR-SER-ASP-GLU-ALA-GLY-VAL-VAL-GLU-VAL-VAL-ARG-LYS-ARG-TYR-ALA-ALA-ASP-GLU-THR-ASP-GLU-PHE-LEU-LYS-PRO-ILE-ILE-LEU-GLN-GLY-GLU-LYS-GLY-ARG-VAL-GLN-ASN-ASP-ASP-THR-ILE-ILE-PHE-PHE-ASP-TYR-ARG-ALA-ASP-ARG-MET-ARG-GLU-ILE-SER-ALA-ALA-MET-GLY-MET-ASP-ARG-TYR-LYS-ASP-CYS-ASN-SER-LYS-LEU-ALA-HIS-PRO-SER-ASN-LEU-GLN-VAL-TYR-GLY-MET-THR-GLN-TYR-LYS-ALA-GLU-PHE-PRO-PHE-LYS-SER-LEU-PHE-PRO-PRO-ALA-SER-ASN-LYS-ASN-VAL-LEU-ALA-GLU-TRP-LEU-ALA-GLU-GLN-LYS-VAL-SER-GLN-PHE-HIS-CYS-ALA-GLU-THR-GLU-LYS-TYR-ALA-HIS-VAL-THR-PHE-PHE-PHE-ASN-GLY-GLY-LEU-GLU-LYS-GLN-PHE-GLU-GLY-GLU-GLU-ARG-CYS-LEU-VAL-PRO-SER-PRO-LYS-VAL-ALA-THR-TYR-ASP-LEU-GLN-PRO-GLU-MET-SER-ALA-ALA-GLY-VAL-ALA-ASP-LYS-MET-ILE-GLU-GLN-LEU-GLU-ALA-GLY-THR-HIS-PRO-PHE-ILE-MET-CYS-ASN-PHE-ALA-PRO-PRO-ASP-MET-VAL-GLY-HIS-THR-GLY-VAL-TYR-GLU-ALA-ALA-VAL-LYS-ALA-CYS-GLU-ALA-THR-ASP-ILE-ALA-ILE-GLY-ARG-ILE-TYR-GLU-ALA-THR-GLN-LYS-HIS-GLY-TYR-SER-LEU-MET-VAL-THR-ALA-ASP-HIS-GLY-ASN-ALA-GLU-LYS-MET-LYS-ALA-PRO-ASP-GLY-GLY-LYS-HIS-THR-ALA-HIS-THR-CYS-TYR-ARG-VAL-PRO-LEU-THR-LEU-SER-HIS-PRO-GLY-PHE-LYS-PHE-VAL-ASP-PRO-ALA-ASP-ARG-HIS-PRO-ALA-LEU-CYS-ASP-VAL-ALA-PRO-THR-VAL-LEU-ALA-ILE-MET-GLY-LEU-PRO-GLN-PRO-ALA-GLU-MET-THR-GLY-VAL-SER-ILE-VAL-GLN-LYS-ILE-LYS-LEU-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ACE-DTY-ASP-TYR-PRO-GLY-ASP-TYR-CYS-TYR-LEU-TYR-NH2,534,13,Oc1ccc(cc1)C[C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CSC[C@H](NC1=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)CC(C)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(=O)O,IC50=0.933nM,9.030118,9.03,1,A,A,1,A,A,0,,C,A,,1,1,534,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.7420459389686584,0.701388955116272,78.9794921875,76.42772674560547,0.4272934794425964,0.8764033317565918,0.8248980045318604,0.8003294467926025,0.6926631331443787,0.6637793183326721,YDYPGDYCYLY,High,"(8.824, 12.12]",train
5KLR,protein-peptide,P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,SKKAGFPAKKRKVEAA,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,SER-LYS-LYS-ALA-GLY-PHE-PRO-ALA-LYS-LYS-ARG-LYS-VAL-GLU-ALA-ALA,510,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCCC[NH3+])CCC[NH+]=C(N)N)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)[NH3+])C,Kd=19nM,7.721246,7.72,1,A,A,1,A,A,0,,A,B,,1,1,510,16,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)O,0.8938443660736084,0.7661941051483154,80.16902923583984,81.53706359863281,0.5095597505569458,1.157892107963562,0.818177342414856,0.791238009929657,0.799880862236023,0.664344847202301,SKKAGFPAKKRKVEAA,Moderate,"(7.523, 7.921]",train
5KLT,protein-peptide,P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,SKKAGFPAKKMKVEAA,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,SER-LYS-LYS-ALA-GLY-PHE-PRO-ALA-LYS-LYS-MET-LYS-VAL-GLU-ALA-ALA,510,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)[NH3+])C)CCCC[NH3+])CCCC[NH3+],Kd=175nM,6.756962,6.76,1,A,A,1,A,A,0,,A,B,,1,1,510,16,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](C)C(=O)O)C(C)C,0.8860039710998535,0.8174149990081787,80.15139770507812,82.14093017578125,0.5228958129882812,1.0303629636764526,0.8133568167686462,0.8052031993865967,0.7924736738204956,0.7236541509628296,SKKAGFPAKKMKVEAA,Low,"(6.696, 6.824]",train
5L7K,protein-peptide,Q13432 Q7Z494,QPIGPEDVLGLQRITGDYLCSPEENIYKIDFVRFKIRDMDSGTVLFEIKKPPVSERLPINRRDLDPNAGRFVRYQFTPAFLRLRQVGATVEFTVGDKPVNNFRMIERHYFRNQLLKSFDFHFGFCIPSSKNTCEHIYDFPPLSEELISEMIRHPYETQSDSFYFVDDRLVMHNKADYSYS,GTASSL,GLN-PRO-ILE-GLY-PRO-GLU-ASP-VAL-LEU-GLY-LEU-GLN-ARG-ILE-THR-GLY-ASP-TYR-LEU-CYS-SER-PRO-GLU-GLU-ASN-ILE-TYR-LYS-ILE-ASP-PHE-VAL-ARG-PHE-LYS-ILE-ARG-ASP-MET-ASP-SER-GLY-THR-VAL-LEU-PHE-GLU-ILE-LYS-LYS-PRO-PRO-VAL-SER-GLU-ARG-LEU-PRO-ILE-ASN-ARG-ARG-ASP-LEU-ASP-PRO-ASN-ALA-GLY-ARG-PHE-VAL-ARG-TYR-GLN-PHE-THR-PRO-ALA-PHE-LEU-ARG-LEU-ARG-GLN-VAL-GLY-ALA-THR-VAL-GLU-PHE-THR-VAL-GLY-ASP-LYS-PRO-VAL-ASN-ASN-PHE-ARG-MET-ILE-GLU-ARG-HIS-TYR-PHE-ARG-ASN-GLN-LEU-LEU-LYS-SER-PHE-ASP-PHE-HIS-PHE-GLY-PHE-CYS-ILE-PRO-SER-SER-LYS-ASN-THR-CYS-GLU-HIS-ILE-TYR-ASP-PHE-PRO-PRO-LEU-SER-GLU-GLU-LEU-ILE-SER-GLU-MET-ILE-ARG-HIS-PRO-TYR-GLU-THR-GLN-SER-ASP-SER-PHE-TYR-PHE-VAL-ASP-ASP-ARG-LEU-VAL-MET-HIS-ASN-LYS-ALA-ASP-TYR-SER-TYR-SER,GLY-THR-ALA-SER-SER-LEU,180,6,CCCCCCCCCCCCC[C@@H]([NH2+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)CO)C)[C@H](O)C)O,Kd=0.043nM,10.366532,10.37,1,A,A,1,A,A,0,,B,A,,1,1,180,6,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.9304149746894836,0.9033430218696594,87.6788101196289,87.92923736572266,0.3495709002017975,0.5219087600708008,0.9200446009635924,0.8935562372207642,0.8725236058235168,0.8814841508865356,GTASSL,High,"(8.824, 12.12]",train
5LSO,protein-peptide,Q96I25,AMGKCPTKVVLLRNMVGAGEVDEDLEVETKEECEKYGKVGKCVIFEIPGAPDDEAVRIFLEFERVESAIKAVVDLNGRYFGGRVVKACFYNLDKFRVLDLAEQ,KSRWDE,ALA-MET-GLY-LYS-CYS-PRO-THR-LYS-VAL-VAL-LEU-LEU-ARG-ASN-MET-VAL-GLY-ALA-GLY-GLU-VAL-ASP-GLU-ASP-LEU-GLU-VAL-GLU-THR-LYS-GLU-GLU-CYS-GLU-LYS-TYR-GLY-LYS-VAL-GLY-LYS-CYS-VAL-ILE-PHE-GLU-ILE-PRO-GLY-ALA-PRO-ASP-ASP-GLU-ALA-VAL-ARG-ILE-PHE-LEU-GLU-PHE-GLU-ARG-VAL-GLU-SER-ALA-ILE-LYS-ALA-VAL-VAL-ASP-LEU-ASN-GLY-ARG-TYR-PHE-GLY-GLY-ARG-VAL-VAL-LYS-ALA-CYS-PHE-TYR-ASN-LEU-ASP-LYS-PHE-ARG-VAL-LEU-ASP-LEU-ALA-GLU-GLN,LYS-SER-ARG-TRP-ASP-GLU,103,6,OC[C@@H]1NC(=O)[C@@H]([NH3+])CCCCNC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2)CC(=O)O)C(=O)O,Kd=1.4uM,5.853872,5.85,1,A,A,1,A,A,0,,C,A,,1,1,103,6,0,N=C(N)NCCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,0.937108278274536,0.8775310516357422,97.71842193603516,94.34046173095705,0.3035291135311126,0.5061310529708862,0.9370694160461426,0.9168956875801086,0.9027143120765686,0.867689847946167,KSRWDE,Low,"(5.821, 5.959]",train
5LU2,protein-peptide,O14558 P31947,MERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,WLRRASAPLPGLK,MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,TRP-LEU-ARG-ARG-ALA-SEP-ALA-PRO-LEU-PRO-GLY-LEU-LYS,231,13,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)C)COP(O)(O)O)C)C,Kd=6.3uM,5.200659,5.2,1,A,A,1,A,A,0,,C,A,,0,1,231,13,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,0.92720365524292,0.8770105838775635,86.45349884033203,90.29605865478516,0.3403619825839996,0.536149263381958,0.9374655485153198,0.9221945405006408,0.8913390040397644,0.8657146096229553,WLRRASAPLPGLK,Low,"(5.105, 5.222]",val
5LVF,protein-peptide,P04050,MAFSSEQFTTKLNTLEDSQESISSASKWLLLQYRDAPKVAEMWKEYMLRPSVNTRRKLLGLYLMNHVVQQAKGQKIIQFQDSFGKVAAEVLGRINQEFPRDLKKKLSRVVNILKERNIFSKQVVNDIERSLAAALEHHHHHH,PSYSPTSPSYSPTSPS,MET-ALA-PHE-SER-SER-GLU-GLN-PHE-THR-THR-LYS-LEU-ASN-THR-LEU-GLU-ASP-SER-GLN-GLU-SER-ILE-SER-SER-ALA-SER-LYS-TRP-LEU-LEU-LEU-GLN-TYR-ARG-ASP-ALA-PRO-LYS-VAL-ALA-GLU-MET-TRP-LYS-GLU-TYR-MET-LEU-ARG-PRO-SER-VAL-ASN-THR-ARG-ARG-LYS-LEU-LEU-GLY-LEU-TYR-LEU-MET-ASN-HIS-VAL-VAL-GLN-GLN-ALA-LYS-GLY-GLN-LYS-ILE-ILE-GLN-PHE-GLN-ASP-SER-PHE-GLY-LYS-VAL-ALA-ALA-GLU-VAL-LEU-GLY-ARG-ILE-ASN-GLN-GLU-PHE-PRO-ARG-ASP-LEU-LYS-LYS-LYS-LEU-SER-ARG-VAL-VAL-ASN-ILE-LEU-LYS-GLU-ARG-ASN-ILE-PHE-SER-LYS-GLN-VAL-VAL-ASN-ASP-ILE-GLU-ARG-SER-LEU-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,PRO-SER-TYR-SER-PRO-TPO-SER-PRO-SER-TYR-SER-PRO-THR-SER-PRO-SER,142,16,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)CO)[C@H](O)C)CO)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CO)CO)CO,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,B,A,,1,1,142,16,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9374579191207886,0.759330689907074,88.82069396972656,87.28981018066406,0.3346817791461944,0.7062759399414062,0.9257445335388184,0.8445882201194763,0.8770951628684998,0.7380163073539734,PSYSPTSPSYSPTSPS,Low,"(4.745, 4.866]",train
5LY3,protein-peptide,A3MWN5 A3MWN6,MGVISDAYRLKYTFGVDFGTSYVKYGPITLNEPKMVQTRGLFLRDLPESVKMRIPPDVLARGLVVGDEEVRKYLSSVRDVQRNLKYPLKDGVARRDDEEAWRVLKELARYTLAQFPVSDPEFAGWLVAVALSALAPDYMYKAIFDIYDELASEFKIYAVTILPQPLAVAIAENAVNCVIVEGGHGNIQVAPISFALIREGLVALNRGGAEANAITREILKDIGYSDIAREEYAVEVVKRAVGLVPRRLKEAIRAAKSDPDRFVTKVRLSPVVEVEIPREYAWTRFLIGEIVFDPNHEEIKSYIEQSRLRIENAVIGDVTLYGEMDVASAIITSLRNVSVEIQERVASQIILSGGAFSWRVPPGMEDVAADSVTRVKIALEEKSPALASKVEVRLVSEPQYSVWRGAVIYGYALPLSLEWSDTTREGWRFPRR,GGIGENEWVKILRSKR,MET-GLY-VAL-ILE-SER-ASP-ALA-TYR-ARG-LEU-LYS-TYR-THR-PHE-GLY-VAL-ASP-PHE-GLY-THR-SER-TYR-VAL-LYS-TYR-GLY-PRO-ILE-THR-LEU-ASN-GLU-PRO-LYS-MET-VAL-GLN-THR-ARG-GLY-LEU-PHE-LEU-ARG-ASP-LEU-PRO-GLU-SER-VAL-LYS-MET-ARG-ILE-PRO-PRO-ASP-VAL-LEU-ALA-ARG-GLY-LEU-VAL-VAL-GLY-ASP-GLU-GLU-VAL-ARG-LYS-TYR-LEU-SER-SER-VAL-ARG-ASP-VAL-GLN-ARG-ASN-LEU-LYS-TYR-PRO-LEU-LYS-ASP-GLY-VAL-ALA-ARG-ARG-ASP-ASP-GLU-GLU-ALA-TRP-ARG-VAL-LEU-LYS-GLU-LEU-ALA-ARG-TYR-THR-LEU-ALA-GLN-PHE-PRO-VAL-SER-ASP-PRO-GLU-PHE-ALA-GLY-TRP-LEU-VAL-ALA-VAL-ALA-LEU-SER-ALA-LEU-ALA-PRO-ASP-TYR-MET-TYR-LYS-ALA-ILE-PHE-ASP-ILE-TYR-ASP-GLU-LEU-ALA-SER-GLU-PHE-LYS-ILE-TYR-ALA-VAL-THR-ILE-LEU-PRO-GLN-PRO-LEU-ALA-VAL-ALA-ILE-ALA-GLU-ASN-ALA-VAL-ASN-CYS-VAL-ILE-VAL-GLU-GLY-GLY-HIS-GLY-ASN-ILE-GLN-VAL-ALA-PRO-ILE-SER-PHE-ALA-LEU-ILE-ARG-GLU-GLY-LEU-VAL-ALA-LEU-ASN-ARG-GLY-GLY-ALA-GLU-ALA-ASN-ALA-ILE-THR-ARG-GLU-ILE-LEU-LYS-ASP-ILE-GLY-TYR-SER-ASP-ILE-ALA-ARG-GLU-GLU-TYR-ALA-VAL-GLU-VAL-VAL-LYS-ARG-ALA-VAL-GLY-LEU-VAL-PRO-ARG-ARG-LEU-LYS-GLU-ALA-ILE-ARG-ALA-ALA-LYS-SER-ASP-PRO-ASP-ARG-PHE-VAL-THR-LYS-VAL-ARG-LEU-SER-PRO-VAL-VAL-GLU-VAL-GLU-ILE-PRO-ARG-GLU-TYR-ALA-TRP-THR-ARG-PHE-LEU-ILE-GLY-GLU-ILE-VAL-PHE-ASP-PRO-ASN-HIS-GLU-GLU-ILE-LYS-SER-TYR-ILE-GLU-GLN-SER-ARG-LEU-ARG-ILE-GLU-ASN-ALA-VAL-ILE-GLY-ASP-VAL-THR-LEU-TYR-GLY-GLU-MET-ASP-VAL-ALA-SER-ALA-ILE-ILE-THR-SER-LEU-ARG-ASN-VAL-SER-VAL-GLU-ILE-GLN-GLU-ARG-VAL-ALA-SER-GLN-ILE-ILE-LEU-SER-GLY-GLY-ALA-PHE-SER-TRP-ARG-VAL-PRO-PRO-GLY-MET-GLU-ASP-VAL-ALA-ALA-ASP-SER-VAL-THR-ARG-VAL-LYS-ILE-ALA-LEU-GLU-GLU-LYS-SER-PRO-ALA-LEU-ALA-SER-LYS-VAL-GLU-VAL-ARG-LEU-VAL-SER-GLU-PRO-GLN-TYR-SER-VAL-TRP-ARG-GLY-ALA-VAL-ILE-TYR-GLY-TYR-ALA-LEU-PRO-LEU-SER-LEU-GLU-TRP-SER-ASP-THR-THR-ARG-GLU-GLY-TRP-ARG-PHE-PRO-ARG-ARG,GLY-GLY-ILE-GLY-GLU-ASN-GLU-TRP-VAL-LYS-ILE-LEU-ARG-SER-LYS-ARG,432,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCCC[NH3+])CO)CCC[NH+]=C(N)N)CC(C)C)[C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](CC)C)NC(=O)CNC(=O)C[NH3+])CCC(=O)O)CC(=O)N)CCC(=O)O,Kd=31nM,7.508638,7.51,1,A,A,1,A,A,0,,B,A,,1,1,432,16,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)CN)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(=O)NCC(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)O)C(=O)NCC(=O)NCC(=O)O,0.528948187828064,0.5183837413787842,38.39328384399414,26.862762451171875,1.500275731086731,2.1345155239105225,0.6476605534553528,0.5374395251274109,0.4769486784934997,0.5136197805404663,GGIGENEWVKILRSKR,Moderate,"(7.268, 7.523]",train
5M9D,protein-peptide,P04050,MAFSSEQFTTKLNTLEDSQESISSASKWLLLQYRDAPKVAEMWKEYMLRPSVNTRRKLLGLYLMNHVVQQAKGQKIIQFQDSFGKVAAEVLGRINQEFPRDLKKKLSRVVNILKERNIFSKQVVNDIERSLAAALEHHHHHH,TSPSYSPTSPSYSPTS,MET-ALA-PHE-SER-SER-GLU-GLN-PHE-THR-THR-LYS-LEU-ASN-THR-LEU-GLU-ASP-SER-GLN-GLU-SER-ILE-SER-SER-ALA-SER-LYS-TRP-LEU-LEU-LEU-GLN-TYR-ARG-ASP-ALA-PRO-LYS-VAL-ALA-GLU-MET-TRP-LYS-GLU-TYR-MET-LEU-ARG-PRO-SER-VAL-ASN-THR-ARG-ARG-LYS-LEU-LEU-GLY-LEU-TYR-LEU-MET-ASN-HIS-VAL-VAL-GLN-GLN-ALA-LYS-GLY-GLN-LYS-ILE-ILE-GLN-PHE-GLN-ASP-SER-PHE-GLY-LYS-VAL-ALA-ALA-GLU-VAL-LEU-GLY-ARG-ILE-ASN-GLN-GLU-PHE-PRO-ARG-ASP-LEU-LYS-LYS-LYS-LEU-SER-ARG-VAL-VAL-ASN-ILE-LEU-LYS-GLU-ARG-ASN-ILE-PHE-SER-LYS-GLN-VAL-VAL-ASN-ASP-ILE-GLU-ARG-SER-LEU-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,THR-SER-PRO-SEP-TYR-SEP-PRO-THR-SER-PRO-SEP-TYR-SEP-PRO-THR-SER,142,16,OC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CO)COP(O)(O)O)Cc1ccc(cc1)O)COP(O)(O)O)CO)COP(O)(O)O)Cc1ccc(cc1)O)COP(O)(O)O,Kd=1.6uM,5.79588,5.8,1,A,A,1,A,A,0,,B,A,,1,1,142,16,0,C[C@@H](O)[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,0.8949481248855591,0.7309263348579407,85.43760681152344,88.08984375,0.3623653054237366,0.71660315990448,0.9119332432746888,0.8308941721916199,0.8274106979370117,0.7059343457221985,TSPSYSPTSPSYSPTS,Low,"(5.699, 5.821]",train
5MAV,protein-peptide,Q0MQR4 P12004,GPAMFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,QHGKKDSKITDHFMRLPKA,GLY-PRO-ALA-MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,GLN-HIS-GLY-LYS-LYS-ASP-SER-LYS-ILE-THR-ASP-HIS-PHE-MET-ARG-LEU-PRO-LYS-ALA,264,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCCC[NH3+])CC(C)C)CCC[NH+]=C(N)N)CCSC)Cc1ccccc1)Cc1nc[nH]c1)CC(=O)O)[C@H](O)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(=O)O)CO,Kd=3.3uM,5.481486,5.48,1,A,A,1,A,A,0,,G,A,,0,1,264,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](C)C(=O)O,0.7782312631607056,0.7090262770652771,84.72029876708984,84.89921569824219,0.4965671598911285,0.9707334637641908,0.8760694265365601,0.8289971351623535,0.7118105888366699,0.6790335178375244,QHGKKDSKITDHFMRLPKA,Low,"(5.463, 5.6]",val
5MGX,protein-peptide,Q14318 P02829,EEWLDILGNGLLRKKTLVPGPPGSSRPVKGQVVTVHLQTSLENGTRVQEEPELVFTLGDCDVIQALDLSVPLMDVGETAMVTADSKYCYGPQGRSPYIPPHAALCLEVTLKTAVDGPDLEMLTGQERVALANRKRECGNAHYQRADFVLAANSYDLAIKAITSSAKVDMTFEEEAQLLQLKVKCLNNLAASQLKLDHYRAALRSCSLVLEHQPDNIKALFRKGKVLAQQGEYSEAIPILRAALKLEPSNKTIHAELSKLVKKHAAQRSTETALYRKMLGNPSRLPAKCPG,DTEMEEVD,GLU-GLU-TRP-LEU-ASP-ILE-LEU-GLY-ASN-GLY-LEU-LEU-ARG-LYS-LYS-THR-LEU-VAL-PRO-GLY-PRO-PRO-GLY-SER-SER-ARG-PRO-VAL-LYS-GLY-GLN-VAL-VAL-THR-VAL-HIS-LEU-GLN-THR-SER-LEU-GLU-ASN-GLY-THR-ARG-VAL-GLN-GLU-GLU-PRO-GLU-LEU-VAL-PHE-THR-LEU-GLY-ASP-CYS-ASP-VAL-ILE-GLN-ALA-LEU-ASP-LEU-SER-VAL-PRO-LEU-MET-ASP-VAL-GLY-GLU-THR-ALA-MET-VAL-THR-ALA-ASP-SER-LYS-TYR-CYS-TYR-GLY-PRO-GLN-GLY-ARG-SER-PRO-TYR-ILE-PRO-PRO-HIS-ALA-ALA-LEU-CYS-LEU-GLU-VAL-THR-LEU-LYS-THR-ALA-VAL-ASP-GLY-PRO-ASP-LEU-GLU-MET-LEU-THR-GLY-GLN-GLU-ARG-VAL-ALA-LEU-ALA-ASN-ARG-LYS-ARG-GLU-CYS-GLY-ASN-ALA-HIS-TYR-GLN-ARG-ALA-ASP-PHE-VAL-LEU-ALA-ALA-ASN-SER-TYR-ASP-LEU-ALA-ILE-LYS-ALA-ILE-THR-SER-SER-ALA-LYS-VAL-ASP-MET-THR-PHE-GLU-GLU-GLU-ALA-GLN-LEU-LEU-GLN-LEU-LYS-VAL-LYS-CYS-LEU-ASN-ASN-LEU-ALA-ALA-SER-GLN-LEU-LYS-LEU-ASP-HIS-TYR-ARG-ALA-ALA-LEU-ARG-SER-CYS-SER-LEU-VAL-LEU-GLU-HIS-GLN-PRO-ASP-ASN-ILE-LYS-ALA-LEU-PHE-ARG-LYS-GLY-LYS-VAL-LEU-ALA-GLN-GLN-GLY-GLU-TYR-SER-GLU-ALA-ILE-PRO-ILE-LEU-ARG-ALA-ALA-LEU-LYS-LEU-GLU-PRO-SER-ASN-LYS-THR-ILE-HIS-ALA-GLU-LEU-SER-LYS-LEU-VAL-LYS-LYS-HIS-ALA-ALA-GLN-ARG-SER-THR-GLU-THR-ALA-LEU-TYR-ARG-LYS-MET-LEU-GLY-ASN-PRO-SER-ARG-LEU-PRO-ALA-LYS-CYS-PRO-GLY,ASP-THR-GLU-MET-GLU-GLU-VAL-ASP,290,8,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=2.6uM,5.585027,5.59,1,A,A,1,A,A,0,,A,E,,0,1,290,8,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9388946890830994,0.8902565240859985,80.03601837158203,75.85962677001953,0.382777988910675,0.5824524164199829,0.8543347120285034,0.8428647518157959,0.903407096862793,0.8611562252044678,DTEMEEVD,Low,"(5.463, 5.6]",train
5MK3,protein-peptide,Q96CF2 Q9H3S7,MEAVPRMPMIWLDLKEAGDFHFQPAVKKFVLKNYGENPEAYNEELKKLELLRQNAVRVPRDFEGCSVLRKYLGQLHYLQSRVPMGSGQEAAVPVTWTEIFSGKSVAHEDIKYEQACILYNLGALHSMLGAMDKRVSEEGMKVSCTHFQCAAGAFAYLREHFPQAYSVDMSRQILTLNVNLMLGQAQECLLEKSMLDNRKSFLVARISAQVVDYYKEACRALENPDTASLLGRIQKDWKKLVQMKIYYFAAVAHLHMGKQAEEQQKFGERVAYFQSALDKLNEAIKLAKGQPDTVQDALRFTMDVIGGKYNSAKKDNDFIYHEAVPALDTLQPVKGAPLVKPLPVNPTDPAVTGPDIFAKLV,QRAEEEDDDIKQLAAWAT,MET-GLU-ALA-VAL-PRO-ARG-MET-PRO-MET-ILE-TRP-LEU-ASP-LEU-LYS-GLU-ALA-GLY-ASP-PHE-HIS-PHE-GLN-PRO-ALA-VAL-LYS-LYS-PHE-VAL-LEU-LYS-ASN-TYR-GLY-GLU-ASN-PRO-GLU-ALA-TYR-ASN-GLU-GLU-LEU-LYS-LYS-LEU-GLU-LEU-LEU-ARG-GLN-ASN-ALA-VAL-ARG-VAL-PRO-ARG-ASP-PHE-GLU-GLY-CYS-SER-VAL-LEU-ARG-LYS-TYR-LEU-GLY-GLN-LEU-HIS-TYR-LEU-GLN-SER-ARG-VAL-PRO-MET-GLY-SER-GLY-GLN-GLU-ALA-ALA-VAL-PRO-VAL-THR-TRP-THR-GLU-ILE-PHE-SER-GLY-LYS-SER-VAL-ALA-HIS-GLU-ASP-ILE-LYS-TYR-GLU-GLN-ALA-CYS-ILE-LEU-TYR-ASN-LEU-GLY-ALA-LEU-HIS-SER-MET-LEU-GLY-ALA-MET-ASP-LYS-ARG-VAL-SER-GLU-GLU-GLY-MET-LYS-VAL-SER-CYS-THR-HIS-PHE-GLN-CYS-ALA-ALA-GLY-ALA-PHE-ALA-TYR-LEU-ARG-GLU-HIS-PHE-PRO-GLN-ALA-TYR-SER-VAL-ASP-MET-SER-ARG-GLN-ILE-LEU-THR-LEU-ASN-VAL-ASN-LEU-MET-LEU-GLY-GLN-ALA-GLN-GLU-CYS-LEU-LEU-GLU-LYS-SER-MET-LEU-ASP-ASN-ARG-LYS-SER-PHE-LEU-VAL-ALA-ARG-ILE-SER-ALA-GLN-VAL-VAL-ASP-TYR-TYR-LYS-GLU-ALA-CYS-ARG-ALA-LEU-GLU-ASN-PRO-ASP-THR-ALA-SER-LEU-LEU-GLY-ARG-ILE-GLN-LYS-ASP-TRP-LYS-LYS-LEU-VAL-GLN-MET-LYS-ILE-TYR-TYR-PHE-ALA-ALA-VAL-ALA-HIS-LEU-HIS-MET-GLY-LYS-GLN-ALA-GLU-GLU-GLN-GLN-LYS-PHE-GLY-GLU-ARG-VAL-ALA-TYR-PHE-GLN-SER-ALA-LEU-ASP-LYS-LEU-ASN-GLU-ALA-ILE-LYS-LEU-ALA-LYS-GLY-GLN-PRO-ASP-THR-VAL-GLN-ASP-ALA-LEU-ARG-PHE-THR-MET-ASP-VAL-ILE-GLY-GLY-LYS-TYR-ASN-SER-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-GLU-ALA-VAL-PRO-ALA-LEU-ASP-THR-LEU-GLN-PRO-VAL-LYS-GLY-ALA-PRO-LEU-VAL-LYS-PRO-LEU-PRO-VAL-ASN-PRO-THR-ASP-PRO-ALA-VAL-THR-GLY-PRO-ASP-ILE-PHE-ALA-LYS-LEU-VAL,GLN-ARG-ALA-GLU-GLU-GLU-ASP-ASP-ASP-ILE-LYS-GLN-LEU-ALA-ALA-TRP-ALA-THR,361,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C)Cc1c[nH]c2c1cccc2)C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O,Kd=89uM,4.05061,4.05,1,A,A,1,A,A,0,,E,A,dimer,1,1,361,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8885371685028076,0.6790541410446167,91.97816467285156,87.61320495605469,0.3896025121212005,0.9297682642936708,0.919560968875885,0.8457399010658264,0.8510977625846863,0.6373826861381531,QRAEEEDDDIKQLAAWAT,Low,"(3.924, 4.155]",train
5MLO,protein-peptide,Q5FWF4 P12004,MFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,EKEKQHDIRSFFVPQ,MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,GLU-LYS-GLU-LYS-GLN-HIS-ASP-ILE-ARG-SER-PHE-PHE-VAL-PRO-GLN,261,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccccc1)Cc1ccccc1)CO)CCC[NH+]=C(N)N)[C@H](CC)C)CC(=O)O)Cc1nc[nH]c1)CCC(=O)N)[NH3+],Kd=4.8uM,5.318759,5.32,1,A,A,1,A,A,0,,B,A,,1,1,261,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8769835829734802,0.7615278959274292,88.6921615600586,83.7099380493164,0.4459530413150787,0.8536653518676758,0.8954324722290039,0.8525657653808594,0.8384039402008057,0.7387683987617493,EKEKQHDIRSFFVPQ,Low,"(5.31, 5.463]",val
5MLW,protein-peptide,Q5FWF4 P12004,MFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,GSDITRFLVKK,MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,GLY-SER-ASP-ILE-THR-ARG-PHE-LEU-VAL-LYS-LYS,261,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CO)CC(=O)O)CCC[NH+]=C(N)N)Cc1ccccc1)CC(C)C,Kd=9.24uM,5.034328,5.03,1,A,A,1,A,A,0,,B,A,,1,1,261,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,0.909831404685974,0.7835546731948853,87.55157470703125,85.52706146240234,0.4448637664318084,0.735859751701355,0.8945330381393433,0.8703498244285583,0.888380229473114,0.7618558406829834,GSDITRFLVKK,Low,"(5.014, 5.105]",train
5MOC,protein-peptide,P31947 P04637,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,KLMFKTEGPDSD,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,LYS-LEU-MET-PHE-LYS-TPO-GLU-GLY-PRO-ASP-SER-ASP,236,12,[NH3+]CCCC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CO)CC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(C)C)CCSC)Cc1ccccc1,Kd=23.6uM,4.627088,4.63,1,A,A,1,A,A,0,,P,A,,0,1,236,12,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,0.9308278560638428,0.8792540431022644,94.88721466064452,91.13523864746094,0.3324680030345917,0.5611459612846375,0.9402281045913696,0.9228836297988892,0.8982358574867249,0.868346631526947,KLMFKTEGPDSD,Low,"(4.606, 4.745]",train
5N70,protein-peptide,A4GTA5 V5HCK7,IHEGPYPEPLVNLLDVVYYGPISIGTPPQDFQVIFDTGSANLWLPSSKCTTKYCLHHHRYDSSKSSTYEADGRNFTIVYGSGNVEGFISKDVCRIGSAKVSGQPLGEALVVGGESLLEAPFDGILGLAYPSIAVDGVVPVFDNMMKQGLLGEQNVFSVYLNRDPSSKEGGEVLFGGIDHDHYKGSITYVPVTAKGYWQFHVDGVKSVSASKSAPELLCKDGCEAIANTGTSLITGPPEEVDSLNQYLGGTKTEGGQYLLDCDKLESLPNVTFTISGKEFSLRSKDYVLKVNQQGQTLCVSGFMGLEMPQPLWILGDVFLGPYYTIFDRDQDRVGFAEVAHHHHHH,AFRIPLTR,ILE-HIS-GLU-GLY-PRO-TYR-PRO-GLU-PRO-LEU-VAL-ASN-LEU-LEU-ASP-VAL-VAL-TYR-TYR-GLY-PRO-ILE-SER-ILE-GLY-THR-PRO-PRO-GLN-ASP-PHE-GLN-VAL-ILE-PHE-ASP-THR-GLY-SER-ALA-ASN-LEU-TRP-LEU-PRO-SER-SER-LYS-CYS-THR-THR-LYS-TYR-CYS-LEU-HIS-HIS-HIS-ARG-TYR-ASP-SER-SER-LYS-SER-SER-THR-TYR-GLU-ALA-ASP-GLY-ARG-ASN-PHE-THR-ILE-VAL-TYR-GLY-SER-GLY-ASN-VAL-GLU-GLY-PHE-ILE-SER-LYS-ASP-VAL-CYS-ARG-ILE-GLY-SER-ALA-LYS-VAL-SER-GLY-GLN-PRO-LEU-GLY-GLU-ALA-LEU-VAL-VAL-GLY-GLY-GLU-SER-LEU-LEU-GLU-ALA-PRO-PHE-ASP-GLY-ILE-LEU-GLY-LEU-ALA-TYR-PRO-SER-ILE-ALA-VAL-ASP-GLY-VAL-VAL-PRO-VAL-PHE-ASP-ASN-MET-MET-LYS-GLN-GLY-LEU-LEU-GLY-GLU-GLN-ASN-VAL-PHE-SER-VAL-TYR-LEU-ASN-ARG-ASP-PRO-SER-SER-LYS-GLU-GLY-GLY-GLU-VAL-LEU-PHE-GLY-GLY-ILE-ASP-HIS-ASP-HIS-TYR-LYS-GLY-SER-ILE-THR-TYR-VAL-PRO-VAL-THR-ALA-LYS-GLY-TYR-TRP-GLN-PHE-HIS-VAL-ASP-GLY-VAL-LYS-SER-VAL-SER-ALA-SER-LYS-SER-ALA-PRO-GLU-LEU-LEU-CYS-LYS-ASP-GLY-CYS-GLU-ALA-ILE-ALA-ASN-THR-GLY-THR-SER-LEU-ILE-THR-GLY-PRO-PRO-GLU-GLU-VAL-ASP-SER-LEU-ASN-GLN-TYR-LEU-GLY-GLY-THR-LYS-THR-GLU-GLY-GLY-GLN-TYR-LEU-LEU-ASP-CYS-ASP-LYS-LEU-GLU-SER-LEU-PRO-ASN-VAL-THR-PHE-THR-ILE-SER-GLY-LYS-GLU-PHE-SER-LEU-ARG-SER-LYS-ASP-TYR-VAL-LEU-LYS-VAL-ASN-GLN-GLN-GLY-GLN-THR-LEU-CYS-VAL-SER-GLY-PHE-MET-GLY-LEU-GLU-MET-PRO-GLN-PRO-LEU-TRP-ILE-LEU-GLY-ASP-VAL-PHE-LEU-GLY-PRO-TYR-TYR-THR-ILE-PHE-ASP-ARG-ASP-GLN-ASP-ARG-VAL-GLY-PHE-ALA-GLU-VAL-ALA-HIS-HIS-HIS-HIS-HIS-HIS,ALA-PHE-ARG-ILE-PRO-LEU-THR-ARG,345,8,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccccc1)CCC[NH+]=C(N)N)C,Kd=3nM,8.522879,8.52,1,A,A,1,A,A,0,,B,A,,1,1,345,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.9298890829086304,0.8985853791236877,91.333740234375,88.28155517578125,0.3841257095336914,0.5194596648216248,0.9341360926628112,0.9372075200080872,0.9146629571914672,0.8889297842979431,AFRIPLTR,Moderate,"(8.383, 8.824]",train
5N7G,protein-peptide,Q96QZ7 Q15418 P07355,GSMGKPFFTRNPSELKGKFIHTKLRKSSRGFGFTVVGGDEPDEFLQIKSLVLDGPAALDGKMETGDVIVSVNDTCVLGHTHAQVVKIFQSIPIGASVDLELCRGYPLGSSAYGSVKAYTNFDAERDALNIETAIKTKGVDEVTIVNILTNRSNEQRQDIAFAYQRRTKKELASALKSALSGHLETVILGLLKTPAQYDASELKASMKGLGTDEDSLIEIICSRTNQELQEINRVYKEMYKTDLEKDIISDTSGDFRKLMVALAKGRRAEDGSVIDYELIDQDARDLYDAGVKRKGTDVPKWISIMTERSVPHLQKVFDRYKSYSPYDMLESIRKEVKGDLENAFLNLVQCIQNKPLYFADRLYDSMKGKGTRDKVLIRIMVSRSEVDMLKIRSEFKRKYGKSLYYYIQQDTKGDYQKALLYLCGGDD,KLPSTTL,GLY-SER-MET-GLY-LYS-PRO-PHE-PHE-THR-ARG-ASN-PRO-SER-GLU-LEU-LYS-GLY-LYS-PHE-ILE-HIS-THR-LYS-LEU-ARG-LYS-SER-SER-ARG-GLY-PHE-GLY-PHE-THR-VAL-VAL-GLY-GLY-ASP-GLU-PRO-ASP-GLU-PHE-LEU-GLN-ILE-LYS-SER-LEU-VAL-LEU-ASP-GLY-PRO-ALA-ALA-LEU-ASP-GLY-LYS-MET-GLU-THR-GLY-ASP-VAL-ILE-VAL-SER-VAL-ASN-ASP-THR-CYS-VAL-LEU-GLY-HIS-THR-HIS-ALA-GLN-VAL-VAL-LYS-ILE-PHE-GLN-SER-ILE-PRO-ILE-GLY-ALA-SER-VAL-ASP-LEU-GLU-LEU-CYS-ARG-GLY-TYR-PRO-LEU-GLY-SER-SER-ALA-TYR-GLY-SER-VAL-LYS-ALA-TYR-THR-ASN-PHE-ASP-ALA-GLU-ARG-ASP-ALA-LEU-ASN-ILE-GLU-THR-ALA-ILE-LYS-THR-LYS-GLY-VAL-ASP-GLU-VAL-THR-ILE-VAL-ASN-ILE-LEU-THR-ASN-ARG-SER-ASN-GLU-GLN-ARG-GLN-ASP-ILE-ALA-PHE-ALA-TYR-GLN-ARG-ARG-THR-LYS-LYS-GLU-LEU-ALA-SER-ALA-LEU-LYS-SER-ALA-LEU-SER-GLY-HIS-LEU-GLU-THR-VAL-ILE-LEU-GLY-LEU-LEU-LYS-THR-PRO-ALA-GLN-TYR-ASP-ALA-SER-GLU-LEU-LYS-ALA-SER-MET-LYS-GLY-LEU-GLY-THR-ASP-GLU-ASP-SER-LEU-ILE-GLU-ILE-ILE-CYS-SER-ARG-THR-ASN-GLN-GLU-LEU-GLN-GLU-ILE-ASN-ARG-VAL-TYR-LYS-GLU-MET-TYR-LYS-THR-ASP-LEU-GLU-LYS-ASP-ILE-ILE-SER-ASP-THR-SER-GLY-ASP-PHE-ARG-LYS-LEU-MET-VAL-ALA-LEU-ALA-LYS-GLY-ARG-ARG-ALA-GLU-ASP-GLY-SER-VAL-ILE-ASP-TYR-GLU-LEU-ILE-ASP-GLN-ASP-ALA-ARG-ASP-LEU-TYR-ASP-ALA-GLY-VAL-LYS-ARG-LYS-GLY-THR-ASP-VAL-PRO-LYS-TRP-ILE-SER-ILE-MET-THR-GLU-ARG-SER-VAL-PRO-HIS-LEU-GLN-LYS-VAL-PHE-ASP-ARG-TYR-LYS-SER-TYR-SER-PRO-TYR-ASP-MET-LEU-GLU-SER-ILE-ARG-LYS-GLU-VAL-LYS-GLY-ASP-LEU-GLU-ASN-ALA-PHE-LEU-ASN-LEU-VAL-GLN-CYS-ILE-GLN-ASN-LYS-PRO-LEU-TYR-PHE-ALA-ASP-ARG-LEU-TYR-ASP-SER-MET-LYS-GLY-LYS-GLY-THR-ARG-ASP-LYS-VAL-LEU-ILE-ARG-ILE-MET-VAL-SER-ARG-SER-GLU-VAL-ASP-MET-LEU-LYS-ILE-ARG-SER-GLU-PHE-LYS-ARG-LYS-TYR-GLY-LYS-SER-LEU-TYR-TYR-TYR-ILE-GLN-GLN-ASP-THR-LYS-GLY-ASP-TYR-GLN-LYS-ALA-LEU-LEU-TYR-LEU-CYS-GLY-GLY-ASP-ASP,LYS-LEU-PRO-SEP-THR-THR-LEU,427,7,CC(C[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)COP(O)(O)O)C,Kd=26.3uM,4.580044,4.58,1,A,A,1,A,A,0,,C,A,,1,1,427,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8668886423110962,0.8614315986633301,67.47283935546875,68.23409271240234,0.4906920492649078,0.605469822883606,0.8073305487632751,0.7934190034866333,0.8716974854469299,0.8784346580505371,KLPSTTL,Low,"(4.456, 4.606]",train
5N7X,protein-peptide,P22629,MRKIVVAAIAVSLTTVSITASASADPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAASIDAAKKAGVNNGNPLDAVQQ,EWVHPQFEQKAK,MET-ARG-LYS-ILE-VAL-VAL-ALA-ALA-ILE-ALA-VAL-SER-LEU-THR-THR-VAL-SER-ILE-THR-ALA-SER-ALA-SER-ALA-ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER-ILE-ASP-ALA-ALA-LYS-LYS-ALA-GLY-VAL-ASN-ASN-GLY-ASN-PRO-LEU-ASP-ALA-VAL-GLN-GLN,GLU-TRP-VAL-HIS-PRO-GLN-PHE-GLU-GLN-LYS-ALA-LYS,183,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1c[nH]c2c1cccc2)Cc1nc[nH]c1)CCC(=O)N)Cc1ccccc1)CCC(=O)O)CCC(=O)N,Kd=5.7uM,5.244125,5.24,1,A,A,1,A,A,0,,C,A,dimer,0,1,183,12,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,0.7989434599876404,0.8064265251159668,73.44805145263672,75.22135162353516,0.8664169311523438,0.9153308868408204,0.6805264949798584,0.7329217195510864,0.6522656083106995,0.7155131697654724,EWVHPQFEQKAK,Low,"(5.222, 5.31]",train
5NIN,protein-peptide,P24588 P0DP24,MADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,GAWASLKRLVTRRKRS,MET-ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,GLY-ALA-TRP-ALA-SER-LEU-LYS-ARG-LEU-VAL-THR-ARG-ARG-LYS-ARG-SER,149,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)C(C)C)CC(C)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1c[nH]c2c1cccc2)C)CO)CC(C)C,Ki=75nM,7.124939,7.12,1,A,A,1,A,A,0,,C,A,,1,1,149,16,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(=O)O,0.8726435303688049,0.6750905513763428,68.75707244873047,60.36954498291016,0.4790683686733246,1.0739725828170776,0.7566874027252197,0.728827714920044,0.8182991743087769,0.6616562604904175,GAWASLKRLVTRRKRS,Moderate,"(7.049, 7.268]",train
5NJX,protein-peptide,Q96HX7 Q13451,GPLGSMTTDEGAKNNEESPTATVAEQGEDITSKKDRGVLKIVKRVGNGEETPMIGDKVYVHYKGKLSNGKKFDSSHDRNEPFVFSLGKGQVIKAWDIGVATMKKGEICHLLCKPEYAYGSAGSLPKIPSNATLFFEIELLDFKGEDLFEDGGIIRRTKRKGEGYSNPNEGATVEIHLEGRCGGRMFDCRDVAFTVGEGEDHDIPIGIDKALEKMQREEQCILYLGPRYGFGEAGKPKFGIEPNAELIYEVTLKSFEKAKESWEMDTKEKLEQAAIVKEKGTVYFKGGKYMQAVIQYGKIVSWLEMEYGLSEKESKASESFLLAAFLNLAMCYLKLREYTKAVECCDKALGLDSANEKGLYRRGEAQLLMNEFESAKGDFEKVLEVNPQNKAARLQISMCQKKAKEHNERDRRIYANMFKKFAEQDAKEEANKAMGKKTSEGVTNEKGTDSQAMEEEKPEGHV,HHHHHHDDTSRMEEVD,GLY-PRO-LEU-GLY-SER-MET-THR-THR-ASP-GLU-GLY-ALA-LYS-ASN-ASN-GLU-GLU-SER-PRO-THR-ALA-THR-VAL-ALA-GLU-GLN-GLY-GLU-ASP-ILE-THR-SER-LYS-LYS-ASP-ARG-GLY-VAL-LEU-LYS-ILE-VAL-LYS-ARG-VAL-GLY-ASN-GLY-GLU-GLU-THR-PRO-MET-ILE-GLY-ASP-LYS-VAL-TYR-VAL-HIS-TYR-LYS-GLY-LYS-LEU-SER-ASN-GLY-LYS-LYS-PHE-ASP-SER-SER-HIS-ASP-ARG-ASN-GLU-PRO-PHE-VAL-PHE-SER-LEU-GLY-LYS-GLY-GLN-VAL-ILE-LYS-ALA-TRP-ASP-ILE-GLY-VAL-ALA-THR-MET-LYS-LYS-GLY-GLU-ILE-CYS-HIS-LEU-LEU-CYS-LYS-PRO-GLU-TYR-ALA-TYR-GLY-SER-ALA-GLY-SER-LEU-PRO-LYS-ILE-PRO-SER-ASN-ALA-THR-LEU-PHE-PHE-GLU-ILE-GLU-LEU-LEU-ASP-PHE-LYS-GLY-GLU-ASP-LEU-PHE-GLU-ASP-GLY-GLY-ILE-ILE-ARG-ARG-THR-LYS-ARG-LYS-GLY-GLU-GLY-TYR-SER-ASN-PRO-ASN-GLU-GLY-ALA-THR-VAL-GLU-ILE-HIS-LEU-GLU-GLY-ARG-CYS-GLY-GLY-ARG-MET-PHE-ASP-CYS-ARG-ASP-VAL-ALA-PHE-THR-VAL-GLY-GLU-GLY-GLU-ASP-HIS-ASP-ILE-PRO-ILE-GLY-ILE-ASP-LYS-ALA-LEU-GLU-LYS-MET-GLN-ARG-GLU-GLU-GLN-CYS-ILE-LEU-TYR-LEU-GLY-PRO-ARG-TYR-GLY-PHE-GLY-GLU-ALA-GLY-LYS-PRO-LYS-PHE-GLY-ILE-GLU-PRO-ASN-ALA-GLU-LEU-ILE-TYR-GLU-VAL-THR-LEU-LYS-SER-PHE-GLU-LYS-ALA-LYS-GLU-SER-TRP-GLU-MET-ASP-THR-LYS-GLU-LYS-LEU-GLU-GLN-ALA-ALA-ILE-VAL-LYS-GLU-LYS-GLY-THR-VAL-TYR-PHE-LYS-GLY-GLY-LYS-TYR-MET-GLN-ALA-VAL-ILE-GLN-TYR-GLY-LYS-ILE-VAL-SER-TRP-LEU-GLU-MET-GLU-TYR-GLY-LEU-SER-GLU-LYS-GLU-SER-LYS-ALA-SER-GLU-SER-PHE-LEU-LEU-ALA-ALA-PHE-LEU-ASN-LEU-ALA-MET-CYS-TYR-LEU-LYS-LEU-ARG-GLU-TYR-THR-LYS-ALA-VAL-GLU-CYS-CYS-ASP-LYS-ALA-LEU-GLY-LEU-ASP-SER-ALA-ASN-GLU-LYS-GLY-LEU-TYR-ARG-ARG-GLY-GLU-ALA-GLN-LEU-LEU-MET-ASN-GLU-PHE-GLU-SER-ALA-LYS-GLY-ASP-PHE-GLU-LYS-VAL-LEU-GLU-VAL-ASN-PRO-GLN-ASN-LYS-ALA-ALA-ARG-LEU-GLN-ILE-SER-MET-CYS-GLN-LYS-LYS-ALA-LYS-GLU-HIS-ASN-GLU-ARG-ASP-ARG-ARG-ILE-TYR-ALA-ASN-MET-PHE-LYS-LYS-PHE-ALA-GLU-GLN-ASP-ALA-LYS-GLU-GLU-ALA-ASN-LYS-ALA-MET-GLY-LYS-LYS-THR-SER-GLU-GLY-VAL-THR-ASN-GLU-LYS-GLY-THR-ASP-SER-GLN-ALA-MET-GLU-GLU-GLU-LYS-PRO-GLU-GLY-HIS-VAL,HIS-HIS-HIS-HIS-HIS-HIS-ASP-ASP-THR-SER-ARG-MET-GLU-GLU-VAL-ASP,462,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])CO)CCC[NH+]=C(N)N,Kd=70uM,4.154902,4.15,1,A,A,1,A,A,0,,B,A,,1,1,462,16,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,0.8148341178894043,0.600504994392395,58.38281631469727,54.53879165649414,0.5140697956085205,1.595286250114441,0.672493577003479,0.6260822415351868,0.7523543834686279,0.5129417777061462,HHHHHHDDTSRMEEVD,Low,"(3.924, 4.155]",val
5NNE,protein-peptide,P11388 O60885,SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,GKAKGKKTQMY,SER-MET-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,GLY-LYS-ALA-ALY-GLY-LYS-ALY-THR-GLN-MET-TYR,127,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)N)[C@H](O)C)CCCCNC(=O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CCCC[NH3+])C)CCCCNC(=O)C,Kd=19.5uM,4.709965,4.71,1,A,A,1,A,A,0,,C,A,,1,1,127,11,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O,0.894325315952301,0.7641904354095459,92.8344268798828,92.48126220703124,0.3254280686378479,0.6997525691986084,0.9332153797149658,0.8539205193519592,0.8347839713096619,0.741757869720459,GKAKGKKTQMY,Low,"(4.606, 4.745]",train
5ODS,protein-peptide,Q68FD5 Q9Y6A5,MAQILPIRFQEHLQLQNLGINPANIGFSTLTMESDKFICIREKVGEQAQVVIIDMNDPSNPIRRPISADSAIMNPASKVIALKAGKTLQIFNIEMKSKMKAHTMTDDVTFWKWISLNTVALVTDNAVYHWSMEGESQPVKMFDRHSSLAGCQIINYRTDAKQKWLLLTGISAQQNRVVGAMQLYSVDRKVSQPIEGHAASFAQFKMEGNAEESTLFCFAVRGQAGGKLHIIEVGTPPTGNQPFPKKAVDVFFPPEAQNDFPVAMQISEKHDVVFLITKYGYIHLYDLETGTCIYMNRISGETIFVTAPHEATAGIIGVNRKGQVLSVCVEEENIIPYITNVLQNPDLALRMAVRNNLAGAEELFARKFNALFAQGNYSEAAKVAANAPKGILRTPDTIRRFQSVPAQPGQTSPLLQYFGILLDQGQLNKYESLELCRPVLQQGRKQLLEKWLKEDKLECSEELGDLVKSVDPTLALSVYLRANVPNKVIQCFAETGQVQKIVLYAKKVGYTPDWIFLLRNVMRISPDQGQQFAQMLVQDEEPLADITQIVDVFMEYNLIQQCTAFLLDALKNNR,KESALRKQSLYLKFDPLL,MET-ALA-GLN-ILE-LEU-PRO-ILE-ARG-PHE-GLN-GLU-HIS-LEU-GLN-LEU-GLN-ASN-LEU-GLY-ILE-ASN-PRO-ALA-ASN-ILE-GLY-PHE-SER-THR-LEU-THR-MET-GLU-SER-ASP-LYS-PHE-ILE-CYS-ILE-ARG-GLU-LYS-VAL-GLY-GLU-GLN-ALA-GLN-VAL-VAL-ILE-ILE-ASP-MET-ASN-ASP-PRO-SER-ASN-PRO-ILE-ARG-ARG-PRO-ILE-SER-ALA-ASP-SER-ALA-ILE-MET-ASN-PRO-ALA-SER-LYS-VAL-ILE-ALA-LEU-LYS-ALA-GLY-LYS-THR-LEU-GLN-ILE-PHE-ASN-ILE-GLU-MET-LYS-SER-LYS-MET-LYS-ALA-HIS-THR-MET-THR-ASP-ASP-VAL-THR-PHE-TRP-LYS-TRP-ILE-SER-LEU-ASN-THR-VAL-ALA-LEU-VAL-THR-ASP-ASN-ALA-VAL-TYR-HIS-TRP-SER-MET-GLU-GLY-GLU-SER-GLN-PRO-VAL-LYS-MET-PHE-ASP-ARG-HIS-SER-SER-LEU-ALA-GLY-CYS-GLN-ILE-ILE-ASN-TYR-ARG-THR-ASP-ALA-LYS-GLN-LYS-TRP-LEU-LEU-LEU-THR-GLY-ILE-SER-ALA-GLN-GLN-ASN-ARG-VAL-VAL-GLY-ALA-MET-GLN-LEU-TYR-SER-VAL-ASP-ARG-LYS-VAL-SER-GLN-PRO-ILE-GLU-GLY-HIS-ALA-ALA-SER-PHE-ALA-GLN-PHE-LYS-MET-GLU-GLY-ASN-ALA-GLU-GLU-SER-THR-LEU-PHE-CYS-PHE-ALA-VAL-ARG-GLY-GLN-ALA-GLY-GLY-LYS-LEU-HIS-ILE-ILE-GLU-VAL-GLY-THR-PRO-PRO-THR-GLY-ASN-GLN-PRO-PHE-PRO-LYS-LYS-ALA-VAL-ASP-VAL-PHE-PHE-PRO-PRO-GLU-ALA-GLN-ASN-ASP-PHE-PRO-VAL-ALA-MET-GLN-ILE-SER-GLU-LYS-HIS-ASP-VAL-VAL-PHE-LEU-ILE-THR-LYS-TYR-GLY-TYR-ILE-HIS-LEU-TYR-ASP-LEU-GLU-THR-GLY-THR-CYS-ILE-TYR-MET-ASN-ARG-ILE-SER-GLY-GLU-THR-ILE-PHE-VAL-THR-ALA-PRO-HIS-GLU-ALA-THR-ALA-GLY-ILE-ILE-GLY-VAL-ASN-ARG-LYS-GLY-GLN-VAL-LEU-SER-VAL-CYS-VAL-GLU-GLU-GLU-ASN-ILE-ILE-PRO-TYR-ILE-THR-ASN-VAL-LEU-GLN-ASN-PRO-ASP-LEU-ALA-LEU-ARG-MET-ALA-VAL-ARG-ASN-ASN-LEU-ALA-GLY-ALA-GLU-GLU-LEU-PHE-ALA-ARG-LYS-PHE-ASN-ALA-LEU-PHE-ALA-GLN-GLY-ASN-TYR-SER-GLU-ALA-ALA-LYS-VAL-ALA-ALA-ASN-ALA-PRO-LYS-GLY-ILE-LEU-ARG-THR-PRO-ASP-THR-ILE-ARG-ARG-PHE-GLN-SER-VAL-PRO-ALA-GLN-PRO-GLY-GLN-THR-SER-PRO-LEU-LEU-GLN-TYR-PHE-GLY-ILE-LEU-LEU-ASP-GLN-GLY-GLN-LEU-ASN-LYS-TYR-GLU-SER-LEU-GLU-LEU-CYS-ARG-PRO-VAL-LEU-GLN-GLN-GLY-ARG-LYS-GLN-LEU-LEU-GLU-LYS-TRP-LEU-LYS-GLU-ASP-LYS-LEU-GLU-CYS-SER-GLU-GLU-LEU-GLY-ASP-LEU-VAL-LYS-SER-VAL-ASP-PRO-THR-LEU-ALA-LEU-SER-VAL-TYR-LEU-ARG-ALA-ASN-VAL-PRO-ASN-LYS-VAL-ILE-GLN-CYS-PHE-ALA-GLU-THR-GLY-GLN-VAL-GLN-LYS-ILE-VAL-LEU-TYR-ALA-LYS-LYS-VAL-GLY-TYR-THR-PRO-ASP-TRP-ILE-PHE-LEU-LEU-ARG-ASN-VAL-MET-ARG-ILE-SER-PRO-ASP-GLN-GLY-GLN-GLN-PHE-ALA-GLN-MET-LEU-VAL-GLN-ASP-GLU-GLU-PRO-LEU-ALA-ASP-ILE-THR-GLN-ILE-VAL-ASP-VAL-PHE-MET-GLU-TYR-ASN-LEU-ILE-GLN-GLN-CYS-THR-ALA-PHE-LEU-LEU-ASP-ALA-LEU-LYS-ASN-ASN-ARG,LYS-GLU-SER-ALA-LEU-ARG-LYS-GLN-SEP-LEU-TYR-LEU-LYS-PHE-ASP-PRO-LEU-LEU,574,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)CC(=O)O)Cc1ccccc1)CCCC[NH3+])CC(C)C)Cc1ccc(cc1)O)CC(C)C)COP(O)(O)O)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CO)C)CC(C)C)CCC[NH+]=C(N)N,Kd=47uM,4.327902,4.33,1,A,A,1,A,A,0,,E,A,,1,1,574,18,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.5498135685920715,0.554291844367981,66.18903350830078,63.72649383544922,0.6380916237831116,1.5506610870361328,0.7195847034454346,0.6995591521263123,0.4883674085140228,0.5179750323295593,KESALRKQSLYLKFDPLL,Low,"(4.319, 4.456]",train
5OVC,protein-peptide,P97836 Q9JLU4,SVAILQKRDHEGFGFVLRGAKAETPIEEFTPTPAFPALQYLESVDVEGVAWKAGLRTGDFLIEVNGVNVVKVGHKQVVGLIRQGGNRLVMKVVSVT,EAQTRL,SER-VAL-ALA-ILE-LEU-GLN-LYS-ARG-ASP-HIS-GLU-GLY-PHE-GLY-PHE-VAL-LEU-ARG-GLY-ALA-LYS-ALA-GLU-THR-PRO-ILE-GLU-GLU-PHE-THR-PRO-THR-PRO-ALA-PHE-PRO-ALA-LEU-GLN-TYR-LEU-GLU-SER-VAL-ASP-VAL-GLU-GLY-VAL-ALA-TRP-LYS-ALA-GLY-LEU-ARG-THR-GLY-ASP-PHE-LEU-ILE-GLU-VAL-ASN-GLY-VAL-ASN-VAL-VAL-LYS-VAL-GLY-HIS-LYS-GLN-VAL-VAL-GLY-LEU-ILE-ARG-GLN-GLY-GLY-ASN-ARG-LEU-VAL-MET-LYS-VAL-VAL-SER-VAL-THR,ACE-GLU-ALA-GLN-THR-ARG-LEU,96,7,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)O)C)CCC(=O)N)CCC[NH+]=C(N)N)C,Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,B,A,,1,1,96,7,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)O,0.9566067457199096,0.9230400919914246,96.96002197265624,95.21651458740234,0.3064395785331726,0.3894588053226471,0.924211084842682,0.9337124824523926,0.9279409050941468,0.9203720092773438,EAQTRL,Low,"(5.821, 5.959]",train
5OVP,protein-peptide,O88917 Q9JLU4,SVAILQKRDHEGFGFVLRGAKAETPIEEFTPTPAFPALQYLESVDVEGVAWKAGLRTGDFLIEVNGVNVVKVGHKQVVGLIRQGGNRLVMKVVSVT,QLVTSL,SER-VAL-ALA-ILE-LEU-GLN-LYS-ARG-ASP-HIS-GLU-GLY-PHE-GLY-PHE-VAL-LEU-ARG-GLY-ALA-LYS-ALA-GLU-THR-PRO-ILE-GLU-GLU-PHE-THR-PRO-THR-PRO-ALA-PHE-PRO-ALA-LEU-GLN-TYR-LEU-GLU-SER-VAL-ASP-VAL-GLU-GLY-VAL-ALA-TRP-LYS-ALA-GLY-LEU-ARG-THR-GLY-ASP-PHE-LEU-ILE-GLU-VAL-ASN-GLY-VAL-ASN-VAL-VAL-LYS-VAL-GLY-HIS-LYS-GLN-VAL-VAL-GLY-LEU-ILE-ARG-GLN-GLY-GLY-ASN-ARG-LEU-VAL-MET-LYS-VAL-VAL-SER-VAL-THR,ACE-GLN-LEU-VAL-THR-SER-LEU,96,7,OC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC(C)C,Kd=9.1uM,5.040959,5.04,1,A,A,1,A,A,0,,B,A,,1,1,96,7,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)[C@@H](C)O)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)[C@@H](C)O)C(=O)O,0.9707416892051696,0.8251522779464722,95.7843017578125,94.26100158691406,0.3010096549987793,0.5326579213142395,0.9277390241622924,0.8888028264045715,0.9447275996208192,0.8092395663261414,QLVTSL,Low,"(5.014, 5.105]",train
5OVV,protein-peptide,Q8K1Q4 Q9JLU4,MGPHHHHHHLESTSLYKKAGSENLYFQSVAILQKRDHEGFGFVLRGAKAETPIEEFTPTPAFPALQYLESVDVEGVAWKAGLRTGDFLIEVNGVNVVKVGHKQVVGLIRQGGNRLVMKVVSVT,IESTEI,MET-GLY-PRO-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-SER-THR-SER-LEU-TYR-LYS-LYS-ALA-GLY-SER-GLU-ASN-LEU-TYR-PHE-GLN-SER-VAL-ALA-ILE-LEU-GLN-LYS-ARG-ASP-HIS-GLU-GLY-PHE-GLY-PHE-VAL-LEU-ARG-GLY-ALA-LYS-ALA-GLU-THR-PRO-ILE-GLU-GLU-PHE-THR-PRO-THR-PRO-ALA-PHE-PRO-ALA-LEU-GLN-TYR-LEU-GLU-SER-VAL-ASP-VAL-GLU-GLY-VAL-ALA-TRP-LYS-ALA-GLY-LEU-ARG-THR-GLY-ASP-PHE-LEU-ILE-GLU-VAL-ASN-GLY-VAL-ASN-VAL-VAL-LYS-VAL-GLY-HIS-LYS-GLN-VAL-VAL-GLY-LEU-ILE-ARG-GLN-GLY-GLY-ASN-ARG-LEU-VAL-MET-LYS-VAL-VAL-SER-VAL-THR,ACE-ILE-GLU-SER-THR-GLU-ILE,123,7,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)CCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)C)CCC(=O)O,Kd=33uM,4.481486,4.48,1,A,A,1,A,A,0,,B,A,,1,1,123,7,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O,,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)[C@@H](C)O,1.0487186908721924,1.0149219036102295,80.6678466796875,82.15837860107422,0.4459368586540222,0.4855003654956817,0.8254135251045227,0.8444420695304871,0.9446612000465392,0.9203466773033142,IESTEI,Low,"(4.456, 4.606]",train
5SWF,protein-peptide,O60566 Q13362,GHMGSRDVPPADQEKLFIQKLRQCCVLFDFVSDPLSDLKWKEVKRAALSEMVEYITHNRNVITEPIYPEVVHMFAVNMFRTLPPSSNPTGAEFDPEEDEPTLEAAWPHLQLVYEFFLRFLESPDFQPNIAKKYIDQKFVLQLLELFDSEDPRERDFLKTTLHRIYGKFLGLRAYIRKQINNIFYRFIYETEHHNGIAELLEILGSIINGFALPLKEEHKIFLLKVLLPLHKVKSLSVYHPQLAYCVVQFLEKDSTLTEPVVMALLKYWPKTHSPKEVMFLNELEEILDVIEPSEFVKIMEPLFRQLAKCVSSPHFQVAERALYYWNNEYIMSLISDNAAKILPIMFPSLYRNSKT,KLSPIIEDS,GLY-HIS-MET-GLY-SER-ARG-ASP-VAL-PRO-PRO-ALA-ASP-GLN-GLU-LYS-LEU-PHE-ILE-GLN-LYS-LEU-ARG-GLN-CYS-CYS-VAL-LEU-PHE-ASP-PHE-VAL-SER-ASP-PRO-LEU-SER-ASP-LEU-LYS-TRP-LYS-GLU-VAL-LYS-ARG-ALA-ALA-LEU-SER-GLU-MET-VAL-GLU-TYR-ILE-THR-HIS-ASN-ARG-ASN-VAL-ILE-THR-GLU-PRO-ILE-TYR-PRO-GLU-VAL-VAL-HIS-MET-PHE-ALA-VAL-ASN-MET-PHE-ARG-THR-LEU-PRO-PRO-SER-SER-ASN-PRO-THR-GLY-ALA-GLU-PHE-ASP-PRO-GLU-GLU-ASP-GLU-PRO-THR-LEU-GLU-ALA-ALA-TRP-PRO-HIS-LEU-GLN-LEU-VAL-TYR-GLU-PHE-PHE-LEU-ARG-PHE-LEU-GLU-SER-PRO-ASP-PHE-GLN-PRO-ASN-ILE-ALA-LYS-LYS-TYR-ILE-ASP-GLN-LYS-PHE-VAL-LEU-GLN-LEU-LEU-GLU-LEU-PHE-ASP-SER-GLU-ASP-PRO-ARG-GLU-ARG-ASP-PHE-LEU-LYS-THR-THR-LEU-HIS-ARG-ILE-TYR-GLY-LYS-PHE-LEU-GLY-LEU-ARG-ALA-TYR-ILE-ARG-LYS-GLN-ILE-ASN-ASN-ILE-PHE-TYR-ARG-PHE-ILE-TYR-GLU-THR-GLU-HIS-HIS-ASN-GLY-ILE-ALA-GLU-LEU-LEU-GLU-ILE-LEU-GLY-SER-ILE-ILE-ASN-GLY-PHE-ALA-LEU-PRO-LEU-LYS-GLU-GLU-HIS-LYS-ILE-PHE-LEU-LEU-LYS-VAL-LEU-LEU-PRO-LEU-HIS-LYS-VAL-LYS-SER-LEU-SER-VAL-TYR-HIS-PRO-GLN-LEU-ALA-TYR-CYS-VAL-VAL-GLN-PHE-LEU-GLU-LYS-ASP-SER-THR-LEU-THR-GLU-PRO-VAL-VAL-MET-ALA-LEU-LEU-LYS-TYR-TRP-PRO-LYS-THR-HIS-SER-PRO-LYS-GLU-VAL-MET-PHE-LEU-ASN-GLU-LEU-GLU-GLU-ILE-LEU-ASP-VAL-ILE-GLU-PRO-SER-GLU-PHE-VAL-LYS-ILE-MET-GLU-PRO-LEU-PHE-ARG-GLN-LEU-ALA-LYS-CYS-VAL-SER-SER-PRO-HIS-PHE-GLN-VAL-ALA-GLU-ARG-ALA-LEU-TYR-TYR-TRP-ASN-ASN-GLU-TYR-ILE-MET-SER-LEU-ILE-SER-ASP-ASN-ALA-ALA-LYS-ILE-LEU-PRO-ILE-MET-PHE-PRO-SER-LEU-TYR-ARG-ASN-SER-LYS-THR,LYS-LEU-SEP-PRO-ILE-ILE-GLU-ASP-SEP,355,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)O)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC)[NH3+])CC(C)C)COP(O)(O)O)C,Kd=0.55uM,6.259637,6.26,1,A,A,1,A,A,0,,B,A,,1,1,355,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NC(COP(=O)(O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)NC(COP(=O)(O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,0.9146580100059508,0.8861275315284729,83.40016174316406,81.59846496582031,0.3854206800460815,0.5272746086120605,0.9170510172843932,0.9086210131645204,0.8986064195632935,0.8805041313171387,KLSPIIEDS,Low,"(6.097, 6.26]",train
5T1I,protein-peptide,Q13185 P68431,GAADKPRGFARGLDPERIIGATDSSGELMFLMKWKDSDEADLVLAKEANMKCPQIVIAFYEERLTWHS,PHRYRPGTVALREIR,GLY-ALA-ALA-ASP-LYS-PRO-ARG-GLY-PHE-ALA-ARG-GLY-LEU-ASP-PRO-GLU-ARG-ILE-ILE-GLY-ALA-THR-ASP-SER-SER-GLY-GLU-LEU-MET-PHE-LEU-MET-LYS-TRP-LYS-ASP-SER-ASP-GLU-ALA-ASP-LEU-VAL-LEU-ALA-LYS-GLU-ALA-ASN-MET-LYS-CYS-PRO-GLN-ILE-VAL-ILE-ALA-PHE-TYR-GLU-GLU-ARG-LEU-THR-TRP-HIS-SER,N7P-HIS-ARG-TYR-ARG-PRO-GLY-THR-VAL-ALA-LEU-ARG-GLU-ILE-AAR,68,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H]1C=CCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)C)CC(C)C)C)CCC(=O)O)C,Kd=121.5uM,3.915424,3.92,1,A,A,1,A,A,0,,C,A,dimer,1,1,68,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)NC(CCC[NH+]=C(N)N)C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C1CCCN1C(C)=O)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)NC(CCC[NH+]=C(N)N)C(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C1CCCN1C(C)=O)[C@@H](C)O)C(C)C)C(=O)O,0.8320097923278809,0.689838171005249,85.28411865234375,85.54154968261719,0.4041244387626648,0.848503053188324,0.8262466192245483,0.7371557950973511,0.712968647480011,0.6412439346313477,PHRYRPGTVALREIR,Low,"(3.548, 3.924]",train
5T90,protein-peptide,P58154,LDRADILYNIRQTSRPDVIPTQRDRPVAVSVSLKFINILEVNEITNEVDVVFWQQTTWSDRTLAWNSSHSPDQVSVPISSLWVPDLAAYNAISKPEVLTPQLARVVSDGEVLYMPSIRQRFSCDVSGVDTESGATCRIKIGSWTHHSREISVDPTTENSDDSEYFSQYSRFEILDVTQKKNSVTYSCCPEAYEDVEVSLNFRKKGRSEIL,SGCCSNPACRVNNPNIC,LEU-ASP-ARG-ALA-ASP-ILE-LEU-TYR-ASN-ILE-ARG-GLN-THR-SER-ARG-PRO-ASP-VAL-ILE-PRO-THR-GLN-ARG-ASP-ARG-PRO-VAL-ALA-VAL-SER-VAL-SER-LEU-LYS-PHE-ILE-ASN-ILE-LEU-GLU-VAL-ASN-GLU-ILE-THR-ASN-GLU-VAL-ASP-VAL-VAL-PHE-TRP-GLN-GLN-THR-THR-TRP-SER-ASP-ARG-THR-LEU-ALA-TRP-ASN-SER-SER-HIS-SER-PRO-ASP-GLN-VAL-SER-VAL-PRO-ILE-SER-SER-LEU-TRP-VAL-PRO-ASP-LEU-ALA-ALA-TYR-ASN-ALA-ILE-SER-LYS-PRO-GLU-VAL-LEU-THR-PRO-GLN-LEU-ALA-ARG-VAL-VAL-SER-ASP-GLY-GLU-VAL-LEU-TYR-MET-PRO-SER-ILE-ARG-GLN-ARG-PHE-SER-CYS-ASP-VAL-SER-GLY-VAL-ASP-THR-GLU-SER-GLY-ALA-THR-CYS-ARG-ILE-LYS-ILE-GLY-SER-TRP-THR-HIS-HIS-SER-ARG-GLU-ILE-SER-VAL-ASP-PRO-THR-THR-GLU-ASN-SER-ASP-ASP-SER-GLU-TYR-PHE-SER-GLN-TYR-SER-ARG-PHE-GLU-ILE-LEU-ASP-VAL-THR-GLN-LYS-LYS-ASN-SER-VAL-THR-TYR-SER-CYS-CYS-PRO-GLU-ALA-TYR-GLU-ASP-VAL-GLU-VAL-SER-LEU-ASN-PHE-ARG-LYS-LYS-GLY-ARG-SER-GLU-ILE-LEU,SER-GLY-CYS-CYS-SER-ASN-PRO-ALA-CYS-ARG-VAL-ASN-ASN-PRO-ASN-ILE-CYS-NH2,210,18,CC[C@@H]([C@@H]1NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@@H](CSSC[C@H](NC1=O)C(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N2)C)NC(=O)CNC(=O)[C@H](CO)[NH3+])CCC[NH+]=C(N)N)C(C)C)C,IC50=0.21uM,6.677781,6.68,1,A,A,1,A,A,0,,F,A,dimer,1,1,210,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CS)C(=O)O,0.8282533884048462,0.7285858392715454,84.05220794677734,85.6565170288086,0.4695012867450714,0.8223488926887512,0.8677537441253662,0.8308508992195129,0.7715720534324646,0.7030195593833923,SGCCSNPACRVNNPNIC,Low,"(6.523, 6.696]",train
5TBN,protein-peptide,Q9BVI0 P68431,GHMDRYDFEVVRCICEVQEENDFMIQCEECQCWQHGVCMGLLEENVPEKYTCYVCQD,ARTKQTARKST,GLY-HIS-MET-ASP-ARG-TYR-ASP-PHE-GLU-VAL-VAL-ARG-CYS-ILE-CYS-GLU-VAL-GLN-GLU-GLU-ASN-ASP-PHE-MET-ILE-GLN-CYS-GLU-GLU-CYS-GLN-CYS-TRP-GLN-HIS-GLY-VAL-CYS-MET-GLY-LEU-LEU-GLU-GLU-ASN-VAL-PRO-GLU-LYS-TYR-THR-CYS-TYR-VAL-CYS-GLN-ASP,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-LYS-SER-THR-NH2,57,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=3.6uM,5.443697,5.44,1,A,A,1,A,A,0,,C,A,,1,1,57,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9618784189224244,0.895020604133606,82.73157501220703,84.91985321044922,0.3845568299293518,0.6775317192077637,0.8154944181442261,0.8059649467468262,0.7870773673057556,0.7747406363487244,ARTKQTARKST,Low,"(5.31, 5.463]",train
5TDR,protein-peptide,P36124 P68431,MGIITCICDLNDDDGFTIQCDHCNRWQHAICYGIKDIGMAPDDYLCNSCDPREVDINLARKIQQERINVK,ARTKQTARKST,MET-GLY-ILE-ILE-THR-CYS-ILE-CYS-ASP-LEU-ASN-ASP-ASP-ASP-GLY-PHE-THR-ILE-GLN-CYS-ASP-HIS-CYS-ASN-ARG-TRP-GLN-HIS-ALA-ILE-CYS-TYR-GLY-ILE-LYS-ASP-ILE-GLY-MET-ALA-PRO-ASP-ASP-TYR-LEU-CYS-ASN-SER-CYS-ASP-PRO-ARG-GLU-VAL-ASP-ILE-ASN-LEU-ALA-ARG-LYS-ILE-GLN-GLN-GLU-ARG-ILE-ASN-VAL-LYS,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-LYS-SER-THR,70,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=29uM,4.537602,4.54,1,A,A,1,A,A,0,,B,A,,1,1,70,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7806616425514221,0.7091488242149353,90.36500549316406,90.00003814697266,0.458312451839447,0.731741726398468,0.7949113249778748,0.7977414727210999,0.6922225952148438,0.6870006918907166,ARTKQTARKST,Low,"(4.456, 4.606]",train
5TDW,protein-peptide,P36124 P68431,GIITCICDLNDDDGFTIQCDHCNRWQHAICYGIKDIGMAPDDYLCNSCDPREVDINLARKIQQERINVK,ARTKQTARKST,GLY-ILE-ILE-THR-CYS-ILE-CYS-ASP-LEU-ASN-ASP-ASP-ASP-GLY-PHE-THR-ILE-GLN-CYS-ASP-HIS-CYS-ASN-ARG-TRP-GLN-HIS-ALA-ILE-CYS-TYR-GLY-ILE-LYS-ASP-ILE-GLY-MET-ALA-PRO-ASP-ASP-TYR-LEU-CYS-ASN-SER-CYS-ASP-PRO-ARG-GLU-VAL-ASP-ILE-ASN-LEU-ALA-ARG-LYS-ILE-GLN-GLN-GLU-ARG-ILE-ASN-VAL-LYS,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR,69,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=20uM,4.69897,4.7,1,A,A,1,A,A,0,,B,A,,1,1,69,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.883639931678772,0.7363525032997131,94.94717407226562,91.20475769042967,0.3672628700733185,0.7263205647468567,0.8619286417961121,0.8093245625495911,0.8031301498413086,0.7181094288825989,ARTKQTARKST,Low,"(4.606, 4.745]",val
5TEG,protein-peptide,Q9NQR1 P62805,KSKAELQSEERKRIDELIESGKEEGMKIDLIDGKGRGVIATKQFSRGDFVVEYHGDLIEITDAKKREALYAQDPSTGCYMYYFQYLSKTYCVDATRETNRLGRLINHSKSGNCQTKLHDIDGVPHLILIASRDIAAGEELLYDYGDRSKASIEAHPWLKH,KRHRLVLR,LYS-SER-LYS-ALA-GLU-LEU-GLN-SER-GLU-GLU-ARG-LYS-ARG-ILE-ASP-GLU-LEU-ILE-GLU-SER-GLY-LYS-GLU-GLU-GLY-MET-LYS-ILE-ASP-LEU-ILE-ASP-GLY-LYS-GLY-ARG-GLY-VAL-ILE-ALA-THR-LYS-GLN-PHE-SER-ARG-GLY-ASP-PHE-VAL-VAL-GLU-TYR-HIS-GLY-ASP-LEU-ILE-GLU-ILE-THR-ASP-ALA-LYS-LYS-ARG-GLU-ALA-LEU-TYR-ALA-GLN-ASP-PRO-SER-THR-GLY-CYS-TYR-MET-TYR-TYR-PHE-GLN-TYR-LEU-SER-LYS-THR-TYR-CYS-VAL-ASP-ALA-THR-ARG-GLU-THR-ASN-ARG-LEU-GLY-ARG-LEU-ILE-ASN-HIS-SER-LYS-SER-GLY-ASN-CYS-GLN-THR-LYS-LEU-HIS-ASP-ILE-ASP-GLY-VAL-PRO-HIS-LEU-ILE-LEU-ILE-ALA-SER-ARG-ASP-ILE-ALA-ALA-GLY-GLU-GLU-LEU-LEU-TYR-ASP-TYR-GLY-ASP-ARG-SER-LYS-ALA-SER-ILE-GLU-ALA-HIS-PRO-TRP-LEU-LYS-HIS,LYS-ARG-HIS-ARG-NLE-VAL-LEU-ARG,160,8,CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=0.14uM,6.853872,6.85,1,A,A,1,A,A,0,,D,A,,1,1,160,8,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.897541880607605,0.8224483132362366,90.93862915039062,89.8515625,0.3577194213867187,0.6795156002044678,0.91352117061615,0.8781196475028992,0.8637850284576416,0.8085304498672485,KRHRLVLR,Low,"(6.824, 7.049]",train
5TQ1,protein-peptide,P08487 P15127,GSHMHESKEWYHASLTRAQAEHMLMRVPRDGAFLVRKRNEPNSYAISFRAEGKIKHCRVQQEGQTVMLGNSEFDSLVDLISYYEKHPLYRKMKLRYPINEE,PSSVYVPDEWE,GLY-SER-HIS-MET-HIS-GLU-SER-LYS-GLU-TRP-TYR-HIS-ALA-SER-LEU-THR-ARG-ALA-GLN-ALA-GLU-HIS-MET-LEU-MET-ARG-VAL-PRO-ARG-ASP-GLY-ALA-PHE-LEU-VAL-ARG-LYS-ARG-ASN-GLU-PRO-ASN-SER-TYR-ALA-ILE-SER-PHE-ARG-ALA-GLU-GLY-LYS-ILE-LYS-HIS-CYS-ARG-VAL-GLN-GLN-GLU-GLY-GLN-THR-VAL-MET-LEU-GLY-ASN-SER-GLU-PHE-ASP-SER-LEU-VAL-ASP-LEU-ILE-SER-TYR-TYR-GLU-LYS-HIS-PRO-LEU-TYR-ARG-LYS-MET-LYS-LEU-ARG-TYR-PRO-ILE-ASN-GLU-GLU,PRO-SER-SER-VAL-PTR-VAL-PRO-ASP-GLU-TRP-GLU,101,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)C(C)C)Cc1ccc(cc1)OP(O)(O)O)C(C)C)NC(=O)[C@H](CO)[NH3+],Kd=3.21uM,5.493495,5.49,1,A,A,1,A,A,0,,B,A,,1,1,101,11,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9129027128219604,0.8772697448730469,95.8080825805664,94.3219757080078,0.3259985148906708,0.512096107006073,0.9287417531013488,0.9069163799285888,0.8475590348243713,0.8698580265045166,PSSVYVPDEWE,Low,"(5.463, 5.6]",train
5TTW,protein-peptide,O75530,GKKCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,PSKFL,GLY-LYS-LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,PRO-SER-M3L-PHE-NLW,367,5,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)Cc1ccccc1)CCCC[N+](C)(C)C)NC(=O)[C@@H]1CCC[NH2+]1,Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,B,A,,1,1,367,5,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(N)=O,CC(C)CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(N)=O,0.9136150479316713,0.9235154390335084,95.86653900146484,96.47368621826172,0.3123364150524139,0.4131477773189544,0.9605684280395508,0.9518138766288756,0.893476128578186,0.9164407849311828,PSKFL,Low,"(5.821, 5.959]",train
5TWG,protein-peptide,Q13043 Q9H8S9,MSFLFSSRSSKTFKPKKNIPEGSHQYELLKHAEATLGSGNLRQAVMLPEGEDLNEWIAVNTVDFFNQINMLYGTITEFCTEASCPVMSAGPRYEYHWADGTNIKKPIKCSAPKYIDYLMTWVQDQLDDETLFPSKIGVPFPKNFMSVAKTILKRLFRVYAHIYHQHFDSVMQLQEEAHLNTSFKHFIFFVQEFNLIDRRELAPLQELIEKLGSKDR,VASTMTDGANTMIEP,MET-SER-PHE-LEU-PHE-SER-SER-ARG-SER-SER-LYS-THR-PHE-LYS-PRO-LYS-LYS-ASN-ILE-PRO-GLU-GLY-SER-HIS-GLN-TYR-GLU-LEU-LEU-LYS-HIS-ALA-GLU-ALA-THR-LEU-GLY-SER-GLY-ASN-LEU-ARG-GLN-ALA-VAL-MET-LEU-PRO-GLU-GLY-GLU-ASP-LEU-ASN-GLU-TRP-ILE-ALA-VAL-ASN-THR-VAL-ASP-PHE-PHE-ASN-GLN-ILE-ASN-MET-LEU-TYR-GLY-THR-ILE-THR-GLU-PHE-CYS-THR-GLU-ALA-SER-CYS-PRO-VAL-MET-SER-ALA-GLY-PRO-ARG-TYR-GLU-TYR-HIS-TRP-ALA-ASP-GLY-THR-ASN-ILE-LYS-LYS-PRO-ILE-LYS-CYS-SER-ALA-PRO-LYS-TYR-ILE-ASP-TYR-LEU-MET-THR-TRP-VAL-GLN-ASP-GLN-LEU-ASP-ASP-GLU-THR-LEU-PHE-PRO-SER-LYS-ILE-GLY-VAL-PRO-PHE-PRO-LYS-ASN-PHE-MET-SER-VAL-ALA-LYS-THR-ILE-LEU-LYS-ARG-LEU-PHE-ARG-VAL-TYR-ALA-HIS-ILE-TYR-HIS-GLN-HIS-PHE-ASP-SER-VAL-MET-GLN-LEU-GLN-GLU-GLU-ALA-HIS-LEU-ASN-THR-SER-PHE-LYS-HIS-PHE-ILE-PHE-PHE-VAL-GLN-GLU-PHE-ASN-LEU-ILE-ASP-ARG-ARG-GLU-LEU-ALA-PRO-LEU-GLN-GLU-LEU-ILE-GLU-LYS-LEU-GLY-SER-LYS-ASP-ARG,VAL-ALA-SER-THR-MET-THR-ASP-GLY-ALA-ASN-TPO-MET-ILE-GLU-PRO,216,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC(=O)O)C)NC(=O)[C@H]([C@H](OP(O)(O)O)C)[NH3+],Kd=0.68uM,6.167491,6.17,1,A,A,1,A,A,0,,E,A,,1,1,216,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)NC(C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)OP(=O)(O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)NC(C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(C)OP(=O)(O)O,0.8185922503471375,0.7815190553665161,80.23108673095703,84.73892211914062,0.6021502017974854,0.7499828338623047,0.8552939891815186,0.8497317433357239,0.7309536337852478,0.7268500924110413,VASTMTDGANTMIEP,Low,"(6.097, 6.26]",val
5TWH,protein-peptide,Q13043 Q9H8S9,MSFLFSSRSSKTFKPKKNIPEGSHQYELLKHAEATLGSGNLRQAVMLPEGEDLNEWIAVNTVDFFNQINMLYGTITEFCTEASCPVMSAGPRYEYHWADGTNIKKPIKCSAPKYIDYLMTWVQDQLDDETLFPSKIGVPFPKNFMSVAKTILKRLFRVYAHIYHQHFDSVMQLQEEAHLNTSFKHFIFFVQEFNLIDRRELAPLQELIEKLGSKDR,DDTLPSQLGTMVINAED,MET-SER-PHE-LEU-PHE-SER-SER-ARG-SER-SER-LYS-THR-PHE-LYS-PRO-LYS-LYS-ASN-ILE-PRO-GLU-GLY-SER-HIS-GLN-TYR-GLU-LEU-LEU-LYS-HIS-ALA-GLU-ALA-THR-LEU-GLY-SER-GLY-ASN-LEU-ARG-GLN-ALA-VAL-MET-LEU-PRO-GLU-GLY-GLU-ASP-LEU-ASN-GLU-TRP-ILE-ALA-VAL-ASN-THR-VAL-ASP-PHE-PHE-ASN-GLN-ILE-ASN-MET-LEU-TYR-GLY-THR-ILE-THR-GLU-PHE-CYS-THR-GLU-ALA-SER-CYS-PRO-VAL-MET-SER-ALA-GLY-PRO-ARG-TYR-GLU-TYR-HIS-TRP-ALA-ASP-GLY-THR-ASN-ILE-LYS-LYS-PRO-ILE-LYS-CYS-SER-ALA-PRO-LYS-TYR-ILE-ASP-TYR-LEU-MET-THR-TRP-VAL-GLN-ASP-GLN-LEU-ASP-ASP-GLU-THR-LEU-PHE-PRO-SER-LYS-ILE-GLY-VAL-PRO-PHE-PRO-LYS-ASN-PHE-MET-SER-VAL-ALA-LYS-THR-ILE-LEU-LYS-ARG-LEU-PHE-ARG-VAL-TYR-ALA-HIS-ILE-TYR-HIS-GLN-HIS-PHE-ASP-SER-VAL-MET-GLN-LEU-GLN-GLU-GLU-ALA-HIS-LEU-ASN-THR-SER-PHE-LYS-HIS-PHE-ILE-PHE-PHE-VAL-GLN-GLU-PHE-ASN-LEU-ILE-ASP-ARG-ARG-GLU-LEU-ALA-PRO-LEU-GLN-GLU-LEU-ILE-GLU-LYS-LEU-GLY-SER-LYS-ASP-ARG,ASP-ASP-THR-LEU-PRO-SER-GLN-LEU-GLY-TPO-MET-VAL-ILE-ASN-ALA-GLU-ASP,216,17,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N)C)[C@H](CC)C)C(C)C)NC(=O)[C@H]([C@H](OP(O)(O)O)C)[NH3+],Kd=0.28uM,6.552842,6.55,1,A,A,1,A,A,0,,E,A,,1,1,216,17,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)NC(C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)NC(C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,0.7734699249267578,0.6579792499542236,79.32010650634766,82.63807678222656,0.6529372930526733,0.913342535495758,0.8419241905212402,0.7834377288818359,0.6705194711685181,0.5889989137649536,DDTLPSQLGTMVINAED,Low,"(6.523, 6.696]",val
5SVZ,protein-peptide,P04326 P52293,MHHHHHHSSGLVPRGSGMLETAAALFERNHMDSPDLGTDDDDLAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,SGRKKRRQRRRAPQN,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LEU-GLU-THR-ALA-ALA-ALA-LEU-PHE-GLU-ARG-ASN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LEU-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,SER-GLY-ARG-LYS-LYS-ARG-ARG-GLN-ARG-ARG-ARG-ALA-PRO-GLN-ASN,510,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CCC[NH+]=C(N)N)CCCC[NH3+],Kd=1.2uM,5.920819,5.92,1,A,A,1,A,A,0,,B,A,,1,1,510,15,0,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8881796002388,0.7585658431053162,79.53470611572266,81.43108367919922,0.4971675276756286,1.1505950689315796,0.8219848871231079,0.7855768799781799,0.7940139174461365,0.65622478723526,SGRKKRRQRRRAPQN,Low,"(5.821, 5.959]",train
5UNJ,protein-peptide,Q9UBK2 O00482,SNASIPHLILELLKCEPDEPQVQAKIMAYLQQEQANRSKHEKLSTFGLMCKMADQTLFSIVEWARSSIFFRELKVDDQMKLLQNCWSELLILDHIYRQVVHGKEGSIFLVTGQQVDYSIIASQAGATLNNLMSHAQELVAKLRSLQFDQREFVCLKFLVLFSLDVKNLENFQLVEGVQEQVNAALLDYTMCNYPQQTEKFGQLLLRLPEIRAISMQAEEYLYYKHLNGDVPYNNLLIEMLHAKRA,EEPSLLKKLLLAPA,SER-ASN-ALA-SER-ILE-PRO-HIS-LEU-ILE-LEU-GLU-LEU-LEU-LYS-CYS-GLU-PRO-ASP-GLU-PRO-GLN-VAL-GLN-ALA-LYS-ILE-MET-ALA-TYR-LEU-GLN-GLN-GLU-GLN-ALA-ASN-ARG-SER-LYS-HIS-GLU-LYS-LEU-SER-THR-PHE-GLY-LEU-MET-CYS-LYS-MET-ALA-ASP-GLN-THR-LEU-PHE-SER-ILE-VAL-GLU-TRP-ALA-ARG-SER-SER-ILE-PHE-PHE-ARG-GLU-LEU-LYS-VAL-ASP-ASP-GLN-MET-LYS-LEU-LEU-GLN-ASN-CYS-TRP-SER-GLU-LEU-LEU-ILE-LEU-ASP-HIS-ILE-TYR-ARG-GLN-VAL-VAL-HIS-GLY-LYS-GLU-GLY-SER-ILE-PHE-LEU-VAL-THR-GLY-GLN-GLN-VAL-ASP-TYR-SER-ILE-ILE-ALA-SER-GLN-ALA-GLY-ALA-THR-LEU-ASN-ASN-LEU-MET-SER-HIS-ALA-GLN-GLU-LEU-VAL-ALA-LYS-LEU-ARG-SER-LEU-GLN-PHE-ASP-GLN-ARG-GLU-PHE-VAL-CYS-LEU-LYS-PHE-LEU-VAL-LEU-PHE-SER-LEU-ASP-VAL-LYS-ASN-LEU-GLU-ASN-PHE-GLN-LEU-VAL-GLU-GLY-VAL-GLN-GLU-GLN-VAL-ASN-ALA-ALA-LEU-LEU-ASP-TYR-THR-MET-CYS-ASN-TYR-PRO-GLN-GLN-THR-GLU-LYS-PHE-GLY-GLN-LEU-LEU-LEU-ARG-LEU-PRO-GLU-ILE-ARG-ALA-ILE-SER-MET-GLN-ALA-GLU-GLU-TYR-LEU-TYR-TYR-LYS-HIS-LEU-ASN-GLY-ASP-VAL-PRO-TYR-ASN-ASN-LEU-LEU-ILE-GLU-MET-LEU-HIS-ALA-LYS-ARG-ALA,GLU-GLU-PRO-SER-LEU-LEU-LYS-LYS-LEU-LEU-LEU-ALA-PRO-ALA,245,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CC(C)C)CCCC[NH3+],Kd=0.24uM,6.619789,6.62,1,A,A,1,A,A,0,,C,A,,1,1,245,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.9531632661819458,0.7865797877311707,94.63874053955078,91.3580551147461,0.3161496222019195,0.7615553736686707,0.9508375525474548,0.8826324343681335,0.9199608564376832,0.7625666260719299,EEPSLLKKLLLAPA,Low,"(6.523, 6.696]",train
5UW5,protein-peptide,F6LNL5 R4P353,MSYYHHHHHHLESTSLYKKAGSEFALMATSGFSKPLHYPPVRRDETVVDDYFGVKVADPYRWLEDPNSEETKEFVDNQEKLANSVLEECELIDKFKQKIIDFVNFPRCGVPFRRANKYFHFYNSGLQAQNVFQMQDDLDGKPEVLYDPNLREGGRSGLSLYSVSEDAKYFAFGIHSGLTEWVTIKILKTEDRSYLPDTLEWVKFSPAIWTHDNKGFFYCPYPPLKEGEDHMTRSAVNQEARYHFLGTDQSEDILLWRDLENPAHHLKCQITDDGKYFLLYILDGCDDANKVYCLDLTKLPNGLESFRGREDSAPFMKLIDSFDASYTAIANDGSVFTFQTNKDAPRKKLVRVDLNNPSVWTDLVPESKKDLLESAHAVNENQLILRYLSDVKHVLEIRDLESGALQHRLPIDIGSVDGITARRRDSVVFFKFTSILTPGIVYQCDLKNDPTQLKIFRESVVPDFDRSEFEVKQVFVPSKDGTKIPIFIAARKGISLDGSHPCEMHGYGGFGINMMPTFSASRIVFLKHLGGVFCLANIRGGGEYGEEWHKAGFRDKKQNVFDDFISAAEYLISSGYTKARRVAIEGGSNGGLLVAACINQRPDLFGCAEANCGVMDMLRFHKFTLGYLWTGDYGCSDKEEEFKWLIKYSPIHNVRRPWEQPGNEETQYPATMILTADHDDRVVPLHSFKLLATMQHVLCTSLEDSPQKNPIIARIQRKAAAYGRATMTQIAEVADRYGFMAKALEAPWID,GVPVWAFQAKDVENASAPV,MET-SER-TYR-TYR-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-SER-THR-SER-LEU-TYR-LYS-LYS-ALA-GLY-SER-GLU-PHE-ALA-LEU-MET-ALA-THR-SER-GLY-PHE-SER-LYS-PRO-LEU-HIS-TYR-PRO-PRO-VAL-ARG-ARG-ASP-GLU-THR-VAL-VAL-ASP-ASP-TYR-PHE-GLY-VAL-LYS-VAL-ALA-ASP-PRO-TYR-ARG-TRP-LEU-GLU-ASP-PRO-ASN-SER-GLU-GLU-THR-LYS-GLU-PHE-VAL-ASP-ASN-GLN-GLU-LYS-LEU-ALA-ASN-SER-VAL-LEU-GLU-GLU-CYS-GLU-LEU-ILE-ASP-LYS-PHE-LYS-GLN-LYS-ILE-ILE-ASP-PHE-VAL-ASN-PHE-PRO-ARG-CYS-GLY-VAL-PRO-PHE-ARG-ARG-ALA-ASN-LYS-TYR-PHE-HIS-PHE-TYR-ASN-SER-GLY-LEU-GLN-ALA-GLN-ASN-VAL-PHE-GLN-MET-GLN-ASP-ASP-LEU-ASP-GLY-LYS-PRO-GLU-VAL-LEU-TYR-ASP-PRO-ASN-LEU-ARG-GLU-GLY-GLY-ARG-SER-GLY-LEU-SER-LEU-TYR-SER-VAL-SER-GLU-ASP-ALA-LYS-TYR-PHE-ALA-PHE-GLY-ILE-HIS-SER-GLY-LEU-THR-GLU-TRP-VAL-THR-ILE-LYS-ILE-LEU-LYS-THR-GLU-ASP-ARG-SER-TYR-LEU-PRO-ASP-THR-LEU-GLU-TRP-VAL-LYS-PHE-SER-PRO-ALA-ILE-TRP-THR-HIS-ASP-ASN-LYS-GLY-PHE-PHE-TYR-CYS-PRO-TYR-PRO-PRO-LEU-LYS-GLU-GLY-GLU-ASP-HIS-MET-THR-ARG-SER-ALA-VAL-ASN-GLN-GLU-ALA-ARG-TYR-HIS-PHE-LEU-GLY-THR-ASP-GLN-SER-GLU-ASP-ILE-LEU-LEU-TRP-ARG-ASP-LEU-GLU-ASN-PRO-ALA-HIS-HIS-LEU-LYS-CYS-GLN-ILE-THR-ASP-ASP-GLY-LYS-TYR-PHE-LEU-LEU-TYR-ILE-LEU-ASP-GLY-CYS-ASP-ASP-ALA-ASN-LYS-VAL-TYR-CYS-LEU-ASP-LEU-THR-LYS-LEU-PRO-ASN-GLY-LEU-GLU-SER-PHE-ARG-GLY-ARG-GLU-ASP-SER-ALA-PRO-PHE-MET-LYS-LEU-ILE-ASP-SER-PHE-ASP-ALA-SER-TYR-THR-ALA-ILE-ALA-ASN-ASP-GLY-SER-VAL-PHE-THR-PHE-GLN-THR-ASN-LYS-ASP-ALA-PRO-ARG-LYS-LYS-LEU-VAL-ARG-VAL-ASP-LEU-ASN-ASN-PRO-SER-VAL-TRP-THR-ASP-LEU-VAL-PRO-GLU-SER-LYS-LYS-ASP-LEU-LEU-GLU-SER-ALA-HIS-ALA-VAL-ASN-GLU-ASN-GLN-LEU-ILE-LEU-ARG-TYR-LEU-SER-ASP-VAL-LYS-HIS-VAL-LEU-GLU-ILE-ARG-ASP-LEU-GLU-SER-GLY-ALA-LEU-GLN-HIS-ARG-LEU-PRO-ILE-ASP-ILE-GLY-SER-VAL-ASP-GLY-ILE-THR-ALA-ARG-ARG-ARG-ASP-SER-VAL-VAL-PHE-PHE-LYS-PHE-THR-SER-ILE-LEU-THR-PRO-GLY-ILE-VAL-TYR-GLN-CYS-ASP-LEU-LYS-ASN-ASP-PRO-THR-GLN-LEU-LYS-ILE-PHE-ARG-GLU-SER-VAL-VAL-PRO-ASP-PHE-ASP-ARG-SER-GLU-PHE-GLU-VAL-LYS-GLN-VAL-PHE-VAL-PRO-SER-LYS-ASP-GLY-THR-LYS-ILE-PRO-ILE-PHE-ILE-ALA-ALA-ARG-LYS-GLY-ILE-SER-LEU-ASP-GLY-SER-HIS-PRO-CYS-GLU-MET-HIS-GLY-TYR-GLY-GLY-PHE-GLY-ILE-ASN-MET-MET-PRO-THR-PHE-SER-ALA-SER-ARG-ILE-VAL-PHE-LEU-LYS-HIS-LEU-GLY-GLY-VAL-PHE-CYS-LEU-ALA-ASN-ILE-ARG-GLY-GLY-GLY-GLU-TYR-GLY-GLU-GLU-TRP-HIS-LYS-ALA-GLY-PHE-ARG-ASP-LYS-LYS-GLN-ASN-VAL-PHE-ASP-ASP-PHE-ILE-SER-ALA-ALA-GLU-TYR-LEU-ILE-SER-SER-GLY-TYR-THR-LYS-ALA-ARG-ARG-VAL-ALA-ILE-GLU-GLY-GLY-SER-ASN-GLY-GLY-LEU-LEU-VAL-ALA-ALA-CYS-ILE-ASN-GLN-ARG-PRO-ASP-LEU-PHE-GLY-CYS-ALA-GLU-ALA-ASN-CYS-GLY-VAL-MET-ASP-MET-LEU-ARG-PHE-HIS-LYS-PHE-THR-LEU-GLY-TYR-LEU-TRP-THR-GLY-ASP-TYR-GLY-CYS-SER-ASP-LYS-GLU-GLU-GLU-PHE-LYS-TRP-LEU-ILE-LYS-TYR-SER-PRO-ILE-HIS-ASN-VAL-ARG-ARG-PRO-TRP-GLU-GLN-PRO-GLY-ASN-GLU-GLU-THR-GLN-TYR-PRO-ALA-THR-MET-ILE-LEU-THR-ALA-ASP-HIS-ASP-ASP-ARG-VAL-VAL-PRO-LEU-HIS-SER-PHE-LYS-LEU-LEU-ALA-THR-MET-GLN-HIS-VAL-LEU-CYS-THR-SER-LEU-GLU-ASP-SER-PRO-GLN-LYS-ASN-PRO-ILE-ILE-ALA-ARG-ILE-GLN-ARG-LYS-ALA-ALA-ALA-TYR-GLY-ARG-ALA-THR-MET-THR-GLN-ILE-ALA-GLU-VAL-ALA-ASP-ARG-TYR-GLY-PHE-MET-ALA-LYS-ALA-LEU-GLU-ALA-PRO-TRP-ILE-ASP,GLY-VAL-PRO-VAL-TRP-ALA-PHE-GLN-ALA-LYS-ASP-VAL-GLU-ASN-ALA-SER-ALA-PRO-VAL,750,19,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])C,Ki=1.10uM,5.958607,5.96,1,A,A,1,A,A,0,,E,A,,1,1,750,19,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CN)C(C)C)C(C)C)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.7938187718391418,0.7572051286697388,80.75548553466797,79.49903869628906,0.5390480160713196,0.9982211589813232,0.8720009326934814,0.8490345478057861,0.7344487309455872,0.7092477679252625,GVPVWAFQAKDVENASAPV,Low,"(5.821, 5.959]",val
5V1D,protein-peptide,A5D791,EPDIRPCGRSLVIISTLDGRIAALDPENHGKKQWDLDVGSGSLVSSSLSKPEVFGNKMIIPSLDGDLFQWDRDRESMETVPFTVESLLESSYKFGDDVVLVGGKSLTTYGLSAYSGKVRYICSALGCRQWDNDEMEQEEDILLLQRTQKTVRAVGPRSGNEKWNFSVGHFELRYIPDMETRAGFIESTLKPSGNKEQSKIISDVEEQEAVMMDTVIKVSVADWKVMAFNKKGGHLEWEYQFSTPIASAWLVKDGKVIPISLFDDTSYAPNDGVLEDEEDIVEAARGATENSVYLGMYRGQLYLQSSVRISEKFPTSPKALESVSSE,ADPQPWRFYAPR,GLU-PRO-ASP-ILE-ARG-PRO-CYS-GLY-ARG-SER-LEU-VAL-ILE-ILE-SER-THR-LEU-ASP-GLY-ARG-ILE-ALA-ALA-LEU-ASP-PRO-GLU-ASN-HIS-GLY-LYS-LYS-GLN-TRP-ASP-LEU-ASP-VAL-GLY-SER-GLY-SER-LEU-VAL-SER-SER-SER-LEU-SER-LYS-PRO-GLU-VAL-PHE-GLY-ASN-LYS-MET-ILE-ILE-PRO-SER-LEU-ASP-GLY-ASP-LEU-PHE-GLN-TRP-ASP-ARG-ASP-ARG-GLU-SER-MET-GLU-THR-VAL-PRO-PHE-THR-VAL-GLU-SER-LEU-LEU-GLU-SER-SER-TYR-LYS-PHE-GLY-ASP-ASP-VAL-VAL-LEU-VAL-GLY-GLY-LYS-SER-LEU-THR-THR-TYR-GLY-LEU-SER-ALA-TYR-SER-GLY-LYS-VAL-ARG-TYR-ILE-CYS-SER-ALA-LEU-GLY-CYS-ARG-GLN-TRP-ASP-ASN-ASP-GLU-MET-GLU-GLN-GLU-GLU-ASP-ILE-LEU-LEU-LEU-GLN-ARG-THR-GLN-LYS-THR-VAL-ARG-ALA-VAL-GLY-PRO-ARG-SER-GLY-ASN-GLU-LYS-TRP-ASN-PHE-SER-VAL-GLY-HIS-PHE-GLU-LEU-ARG-TYR-ILE-PRO-ASP-MET-GLU-THR-ARG-ALA-GLY-PHE-ILE-GLU-SER-THR-LEU-LYS-PRO-SER-GLY-ASN-LYS-GLU-GLN-SER-LYS-ILE-ILE-SER-ASP-VAL-GLU-GLU-GLN-GLU-ALA-VAL-MET-MET-ASP-THR-VAL-ILE-LYS-VAL-SER-VAL-ALA-ASP-TRP-LYS-VAL-MET-ALA-PHE-ASN-LYS-LYS-GLY-GLY-HIS-LEU-GLU-TRP-GLU-TYR-GLN-PHE-SER-THR-PRO-ILE-ALA-SER-ALA-TRP-LEU-VAL-LYS-ASP-GLY-LYS-VAL-ILE-PRO-ILE-SER-LEU-PHE-ASP-ASP-THR-SER-TYR-ALA-PRO-ASN-ASP-GLY-VAL-LEU-GLU-ASP-GLU-GLU-ASP-ILE-VAL-GLU-ALA-ALA-ARG-GLY-ALA-THR-GLU-ASN-SER-VAL-TYR-LEU-GLY-MET-TYR-ARG-GLY-GLN-LEU-TYR-LEU-GLN-SER-SER-VAL-ARG-ILE-SER-GLU-LYS-PHE-PRO-THR-SER-PRO-LYS-ALA-LEU-GLU-SER-VAL-SER-SER-GLU,ALA-ASP-PRO-GLN-PRO-TRP-ARG-PHE-TYR-ALA-PRO-ARG,326,12,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)Cc1ccc(cc1)O)Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC(=O)N)N,Kd=0.2uM,6.69897,6.7,1,A,A,1,A,A,0,,E,A,,1,1,326,12,0,C[C@H](N)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.6809518337249756,0.7819269299507141,65.17828369140625,62.404571533203125,0.9059340953826904,1.079949140548706,0.7297393679618835,0.7236664891242981,0.5799975395202637,0.7198048830032349,ADPQPWRFYAPR,Low,"(6.696, 6.824]",train
5V2P,protein-peptide,Q8VGC3 Q13936,GSADSYTSRPSDSDVSSLEEDREAVRREAERQAQAQLEKAKTKPVAFAVRTNVRYSAAQEDDVPVPGMAISFEAKDFLHVKEKFNNDWWIGRLVKEGCEIGFIPSPVKLENMRLQHEQRAKQGSSKEKRMPFFKKTEHTPPYDVVPSMRPVVLVGPSLKGYEVTDMMQKALFDFLKHRFEGRISITRVTADISLAKRSVLNNPSKHAIIERSNTRSSLAEVQSEIERIFELARTLQLVVLDADTINHPAQLSKTSLAPIIVYVKISSPKVLQRLIKSRGKSQAKHLNVQMVAADKLAQCPPQESFDVILDENQLEDACEHLADYLEAYWKATHPPSSNLPNPLLSRT,CSPLECDLKGYLDWITQAE,GLY-SER-ALA-ASP-SER-TYR-THR-SER-ARG-PRO-SER-ASP-SER-ASP-VAL-SER-SER-LEU-GLU-GLU-ASP-ARG-GLU-ALA-VAL-ARG-ARG-GLU-ALA-GLU-ARG-GLN-ALA-GLN-ALA-GLN-LEU-GLU-LYS-ALA-LYS-THR-LYS-PRO-VAL-ALA-PHE-ALA-VAL-ARG-THR-ASN-VAL-ARG-TYR-SER-ALA-ALA-GLN-GLU-ASP-ASP-VAL-PRO-VAL-PRO-GLY-MET-ALA-ILE-SER-PHE-GLU-ALA-LYS-ASP-PHE-LEU-HIS-VAL-LYS-GLU-LYS-PHE-ASN-ASN-ASP-TRP-TRP-ILE-GLY-ARG-LEU-VAL-LYS-GLU-GLY-CYS-GLU-ILE-GLY-PHE-ILE-PRO-SER-PRO-VAL-LYS-LEU-GLU-ASN-MET-ARG-LEU-GLN-HIS-GLU-GLN-ARG-ALA-LYS-GLN-GLY-SER-SER-LYS-GLU-LYS-ARG-MET-PRO-PHE-PHE-LYS-LYS-THR-GLU-HIS-THR-PRO-PRO-TYR-ASP-VAL-VAL-PRO-SER-MET-ARG-PRO-VAL-VAL-LEU-VAL-GLY-PRO-SER-LEU-LYS-GLY-TYR-GLU-VAL-THR-ASP-MET-MET-GLN-LYS-ALA-LEU-PHE-ASP-PHE-LEU-LYS-HIS-ARG-PHE-GLU-GLY-ARG-ILE-SER-ILE-THR-ARG-VAL-THR-ALA-ASP-ILE-SER-LEU-ALA-LYS-ARG-SER-VAL-LEU-ASN-ASN-PRO-SER-LYS-HIS-ALA-ILE-ILE-GLU-ARG-SER-ASN-THR-ARG-SER-SER-LEU-ALA-GLU-VAL-GLN-SER-GLU-ILE-GLU-ARG-ILE-PHE-GLU-LEU-ALA-ARG-THR-LEU-GLN-LEU-VAL-VAL-LEU-ASP-ALA-ASP-THR-ILE-ASN-HIS-PRO-ALA-GLN-LEU-SER-LYS-THR-SER-LEU-ALA-PRO-ILE-ILE-VAL-TYR-VAL-LYS-ILE-SER-SER-PRO-LYS-VAL-LEU-GLN-ARG-LEU-ILE-LYS-SER-ARG-GLY-LYS-SER-GLN-ALA-LYS-HIS-LEU-ASN-VAL-GLN-MET-VAL-ALA-ALA-ASP-LYS-LEU-ALA-GLN-CYS-PRO-PRO-GLN-GLU-SER-PHE-ASP-VAL-ILE-LEU-ASP-GLU-ASN-GLN-LEU-GLU-ASP-ALA-CYS-GLU-HIS-LEU-ALA-ASP-TYR-LEU-GLU-ALA-TYR-TRP-LYS-ALA-THR-HIS-PRO-PRO-SER-SER-ASN-LEU-PRO-ASN-PRO-LEU-LEU-SER-ARG-THR,CYS-SER-PRO-LEU-GLU-CYS-ASP-LEU-LYS-GLY-TYR-LEU-ASP-TRP-ILE-THR-GLN-ALA-GLU,347,19,[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)CCC(=O)N)[C@H](O)C)[C@H](CC)C)Cc1c[nH]c2c1cccc2)CC(=O)O)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CSCc2cccc(c2)CSC[C@H]([NH3+])C(=O)N[C@H](C(=O)N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CCC(=O)O)CC(C)C)CCC2)CO)CC(=O)O)CC(C)C,Kd=5.1nM,8.29243,8.29,1,A,A,1,A,A,0,,B,A,,1,1,347,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.802259624004364,0.6418129205703735,71.43798065185547,63.30977630615234,0.6833786964416504,1.4025123119354248,0.7482894062995911,0.669585645198822,0.7047548890113831,0.5628236532211304,CSPLECDLKGYLDWITQAE,Moderate,"(7.921, 8.383]",val
5V2Q,protein-peptide,Q8VGC3 Q13936,GSADSYTSRPSDSDVSLEEDREAVRREAERQAQAQLEKAKTKPVAFAVRTNVRYSAAQEDDVPVPGMAISFEAKDFLHVKEKFNNDWWIGRLVKEGCEIGFIPSPVKLENMRLQHEQRAKQGSSKEKRMPFFKKTEHTPPYDVVPSMRPVVLVGPSLKGYEVTDMMQKALFDFLKHRFEGRISITRVTADISLAKRSVLNNPSKHAIIERSNTRSSLAEVQSEIERIFELARTLQLVVLDADTINHPAQLSKTSLAPIIVYVKISSPKVLQRLIKSRGKSQAKHLNVQMVAADKLAQCPPQESFDVILDENQLEDACEHLADYLEAYWKATHPPSSNLPNPLLSRT,ASPLEEDLCGYLCWITQAE,GLY-SER-ALA-ASP-SER-TYR-THR-SER-ARG-PRO-SER-ASP-SER-ASP-VAL-SER-LEU-GLU-GLU-ASP-ARG-GLU-ALA-VAL-ARG-ARG-GLU-ALA-GLU-ARG-GLN-ALA-GLN-ALA-GLN-LEU-GLU-LYS-ALA-LYS-THR-LYS-PRO-VAL-ALA-PHE-ALA-VAL-ARG-THR-ASN-VAL-ARG-TYR-SER-ALA-ALA-GLN-GLU-ASP-ASP-VAL-PRO-VAL-PRO-GLY-MET-ALA-ILE-SER-PHE-GLU-ALA-LYS-ASP-PHE-LEU-HIS-VAL-LYS-GLU-LYS-PHE-ASN-ASN-ASP-TRP-TRP-ILE-GLY-ARG-LEU-VAL-LYS-GLU-GLY-CYS-GLU-ILE-GLY-PHE-ILE-PRO-SER-PRO-VAL-LYS-LEU-GLU-ASN-MET-ARG-LEU-GLN-HIS-GLU-GLN-ARG-ALA-LYS-GLN-GLY-SER-SER-LYS-GLU-LYS-ARG-MET-PRO-PHE-PHE-LYS-LYS-THR-GLU-HIS-THR-PRO-PRO-TYR-ASP-VAL-VAL-PRO-SER-MET-ARG-PRO-VAL-VAL-LEU-VAL-GLY-PRO-SER-LEU-LYS-GLY-TYR-GLU-VAL-THR-ASP-MET-MET-GLN-LYS-ALA-LEU-PHE-ASP-PHE-LEU-LYS-HIS-ARG-PHE-GLU-GLY-ARG-ILE-SER-ILE-THR-ARG-VAL-THR-ALA-ASP-ILE-SER-LEU-ALA-LYS-ARG-SER-VAL-LEU-ASN-ASN-PRO-SER-LYS-HIS-ALA-ILE-ILE-GLU-ARG-SER-ASN-THR-ARG-SER-SER-LEU-ALA-GLU-VAL-GLN-SER-GLU-ILE-GLU-ARG-ILE-PHE-GLU-LEU-ALA-ARG-THR-LEU-GLN-LEU-VAL-VAL-LEU-ASP-ALA-ASP-THR-ILE-ASN-HIS-PRO-ALA-GLN-LEU-SER-LYS-THR-SER-LEU-ALA-PRO-ILE-ILE-VAL-TYR-VAL-LYS-ILE-SER-SER-PRO-LYS-VAL-LEU-GLN-ARG-LEU-ILE-LYS-SER-ARG-GLY-LYS-SER-GLN-ALA-LYS-HIS-LEU-ASN-VAL-GLN-MET-VAL-ALA-ALA-ASP-LYS-LEU-ALA-GLN-CYS-PRO-PRO-GLN-GLU-SER-PHE-ASP-VAL-ILE-LEU-ASP-GLU-ASN-GLN-LEU-GLU-ASP-ALA-CYS-GLU-HIS-LEU-ALA-ASP-TYR-LEU-GLU-ALA-TYR-TRP-LYS-ALA-THR-HIS-PRO-PRO-SER-SER-ASN-LEU-PRO-ASN-PRO-LEU-LEU-SER-ARG-THR,ALA-SER-PRO-LEU-GLU-GLU-ASP-LEU-CYS-GLY-TYR-LEU-CYS-TRP-ILE-THR-GLN-ALA-GLU,346,19,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)C)CCC(=O)N)[C@H](O)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CSCc2cccc(c2)CSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)CC(C)C)CCC(=O)O)CCC(=O)O)CC(=O)O)CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)Cc1ccc(cc1)O)C,Kd=5.2nM,8.283997,8.28,1,A,A,1,A,A,0,,B,A,,1,1,346,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7250701189041138,0.7418619990348816,69.58248901367188,64.965087890625,0.704049289226532,1.083189845085144,0.7594519257545471,0.7339180111885071,0.6120225787162781,0.6697872877120972,ASPLEEDLCGYLCWITQAE,Moderate,"(7.921, 8.383]",train
5V3R,protein-peptide,Q8WUM4 Q96CF2,GHHHHHHHHHHSGENLYFQGHMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQKKFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMV,QRAEEEDDDIKQLAAWAT,GLY-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLY-GLU-ASN-LEU-TYR-PHE-GLN-GLY-HIS-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-LYS-LYS-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL,GLN-ARG-ALA-GLU-GLU-GLU-ASP-ASP-ASP-ILE-LYS-GLN-LEU-ALA-ALA-TRP-ALA-THR,380,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C)Cc1c[nH]c2c1cccc2)C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CC(=O)O,Ki=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,380,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8694912791252136,0.7403912544250488,86.03131103515625,81.88520050048828,0.4952450692653656,0.8854420781135559,0.8738823533058167,0.8352514505386353,0.816571831703186,0.6936498880386353,QRAEEEDDDIKQLAAWAT,Low,"(5.222, 5.31]",val
5V6Y,protein-peptide,P35318 O60894 Q16602,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFTTACQEANYGALLRELCLTQFQVDMEAVGETLWCDWGRTIRSYRELADCTWHMAEKLGCFWPNAEVDRFFLAVHGRYFRSCPISGRAVGSAGSAGSAEDSIQLGVTRNKIMTAQYECYQKIMQDPIQQAEGVYCNRTWDGWLCWNDVAAGTESMQLCPDYFQDFDPSEKVTKICDQDGNWFRHPASNRTWTNYTQCNVNTHEKVKTALNLFYLHHHHHH,DKDNVAPRWLISPWGF,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-THR-THR-ALA-CYS-GLN-GLU-ALA-ASN-TYR-GLY-ALA-LEU-LEU-ARG-GLU-LEU-CYS-LEU-THR-GLN-PHE-GLN-VAL-ASP-MET-GLU-ALA-VAL-GLY-GLU-THR-LEU-TRP-CYS-ASP-TRP-GLY-ARG-THR-ILE-ARG-SER-TYR-ARG-GLU-LEU-ALA-ASP-CYS-THR-TRP-HIS-MET-ALA-GLU-LYS-LEU-GLY-CYS-PHE-TRP-PRO-ASN-ALA-GLU-VAL-ASP-ARG-PHE-PHE-LEU-ALA-VAL-HIS-GLY-ARG-TYR-PHE-ARG-SER-CYS-PRO-ILE-SER-GLY-ARG-ALA-VAL-GLY-SER-ALA-GLY-SER-ALA-GLY-SER-ALA-GLU-ASP-SER-ILE-GLN-LEU-GLY-VAL-THR-ARG-ASN-LYS-ILE-MET-THR-ALA-GLN-TYR-GLU-CYS-TYR-GLN-LYS-ILE-MET-GLN-ASP-PRO-ILE-GLN-GLN-ALA-GLU-GLY-VAL-TYR-CYS-ASN-ARG-THR-TRP-ASP-GLY-TRP-LEU-CYS-TRP-ASN-ASP-VAL-ALA-ALA-GLY-THR-GLU-SER-MET-GLN-LEU-CYS-PRO-ASP-TYR-PHE-GLN-ASP-PHE-ASP-PRO-SER-GLU-LYS-VAL-THR-LYS-ILE-CYS-ASP-GLN-ASP-GLY-ASN-TRP-PHE-ARG-HIS-PRO-ALA-SER-ASN-ARG-THR-TRP-THR-ASN-TYR-THR-GLN-CYS-ASN-VAL-ASN-THR-HIS-GLU-LYS-VAL-LYS-THR-ALA-LEU-ASN-LEU-PHE-TYR-LEU-HIS-HIS-HIS-HIS-HIS-HIS,ASP-LYS-ASP-ASN-VAL-ALA-PRO-ARG-TRP-LEU-ILE-SER-PRO-TRP-GLY-PHE-NH2,593,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1c[nH]c2c1cccc2)CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)O)CC(=O)N)C)C)CC(C)C)C,Ki=3.39nM,8.4698,8.47,1,A,A,1,A,A,0,,E,A,,1,1,593,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.7201380729675293,0.5700864791870117,52.333984375,54.9890022277832,0.8127465844154358,1.5358713865280151,0.6601473093032837,0.6875169277191162,0.7053737640380859,0.5407288670539856,DKDNVAPRWLISPWGF,Moderate,"(8.383, 8.824]",val
5VB9,protein-peptide,Q16552,GDKNFPRTVMVNLNIHNRNTNTNPKRSSDYYDRSTSPWNLHRNEDPERYPSVIWEAKCRHLGCINADGNVDYHMNSVPIQQEILVLRREPPHSPNSFRLEKILVSVGCTCVTPIVHHVA,CWVLEYDMFGALHCR,GLY-ASP-LYS-ASN-PHE-PRO-ARG-THR-VAL-MET-VAL-ASN-LEU-ASN-ILE-HIS-ASN-ARG-ASN-THR-ASN-THR-ASN-PRO-LYS-ARG-SER-SER-ASP-TYR-TYR-ASP-ARG-SER-THR-SER-PRO-TRP-ASN-LEU-HIS-ARG-ASN-GLU-ASP-PRO-GLU-ARG-TYR-PRO-SER-VAL-ILE-TRP-GLU-ALA-LYS-CYS-ARG-HIS-LEU-GLY-CYS-ILE-ASN-ALA-ASP-GLY-ASN-VAL-ASP-TYR-HIS-MET-ASN-SER-VAL-PRO-ILE-GLN-GLN-GLU-ILE-LEU-VAL-LEU-ARG-ARG-GLU-PRO-PRO-HIS-SER-PRO-ASN-SER-PHE-ARG-LEU-GLU-LYS-ILE-LEU-VAL-SER-VAL-GLY-CYS-THR-CYS-VAL-THR-PRO-ILE-VAL-HIS-HIS-VAL-ALA,CYS-TRP-VAL-LEU-GLU-TYR-ASP-MET-PHE-GLY-ALA-LEU-HIS-CYS-ARG,119,15,CSCC[C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC1=O)Cc1ccccc1)C)CC(C)C)Cc1cnc[nH]1)C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2)C(C)C,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,C,A,,1,1,119,15,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.8916769027709961,0.8080196380615234,70.66363525390625,70.25959014892578,0.7203356027603149,1.0907520055770874,0.6345719695091248,0.6792604327201843,0.7414008975028992,0.6826463937759399,CWVLEYDMFGALHCR,Low,"(5.821, 5.959]",val
5VNB,protein-peptide,O95619 P68431,MFKRMAEFGPDSGGRVKGVTIVKPIVYGNVARYFGKKREEDGHTHQWTVYVKPYRNEDMSAYVKKIQFKLHESYGNPLRVVTKPPYEITETGWGEFEIIIKIFFIDPNERPVTLYHLLKLFQSDTNAMLGKKTVVSEFYDEMIFQDPT,ATKAARKSAP,MET-PHE-LYS-ARG-MET-ALA-GLU-PHE-GLY-PRO-ASP-SER-GLY-GLY-ARG-VAL-LYS-GLY-VAL-THR-ILE-VAL-LYS-PRO-ILE-VAL-TYR-GLY-ASN-VAL-ALA-ARG-TYR-PHE-GLY-LYS-LYS-ARG-GLU-GLU-ASP-GLY-HIS-THR-HIS-GLN-TRP-THR-VAL-TYR-VAL-LYS-PRO-TYR-ARG-ASN-GLU-ASP-MET-SER-ALA-TYR-VAL-LYS-LYS-ILE-GLN-PHE-LYS-LEU-HIS-GLU-SER-TYR-GLY-ASN-PRO-LEU-ARG-VAL-VAL-THR-LYS-PRO-PRO-TYR-GLU-ILE-THR-GLU-THR-GLY-TRP-GLY-GLU-PHE-GLU-ILE-ILE-ILE-LYS-ILE-PHE-PHE-ILE-ASP-PRO-ASN-GLU-ARG-PRO-VAL-THR-LEU-TYR-HIS-LEU-LEU-LYS-LEU-PHE-GLN-SER-ASP-THR-ASN-ALA-MET-LEU-GLY-LYS-LYS-THR-VAL-VAL-SER-GLU-PHE-TYR-ASP-GLU-MET-ILE-PHE-GLN-ASP-PRO-THR,ALA-THR-ALY-ALA-ALA-ARG-ALY-SER-ALA-PRO,148,10,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCCCNC(=O)C)C)C)CCC[NH+]=C(N)N)CCCCNC(=O)C,Kd=5.0uM,5.30103,5.3,1,A,A,1,A,A,0,,K,A,3mer,1,1,148,10,0,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.896919310092926,0.8035429120063782,82.82015228271484,80.57339477539062,0.427706629037857,0.7805179357528687,0.8716254830360413,0.8177493214607239,0.8162174224853516,0.7408697009086609,ATKAARKSAP,Low,"(5.222, 5.31]",train
5VWI,protein-peptide,Q14160,GPLGSVEEIRLPRAGGPLGLSIVGGSDHSSHPFGVQEPGVFISKVLPRGLAARSGLRVGDRILAVNGQDVRDATHQEAVSALLRPCLELSLLVRRD,PAWDETNL,GLY-PRO-LEU-GLY-SER-VAL-GLU-GLU-ILE-ARG-LEU-PRO-ARG-ALA-GLY-GLY-PRO-LEU-GLY-LEU-SER-ILE-VAL-GLY-GLY-SER-ASP-HIS-SER-SER-HIS-PRO-PHE-GLY-VAL-GLN-GLU-PRO-GLY-VAL-PHE-ILE-SER-LYS-VAL-LEU-PRO-ARG-GLY-LEU-ALA-ALA-ARG-SER-GLY-LEU-ARG-VAL-GLY-ASP-ARG-ILE-LEU-ALA-VAL-ASN-GLY-GLN-ASP-VAL-ARG-ASP-ALA-THR-HIS-GLN-GLU-ALA-VAL-SER-ALA-LEU-LEU-ARG-PRO-CYS-LEU-GLU-LEU-SER-LEU-LEU-VAL-ARG-ARG-ASP,PRO-ALA-TRP-ASP-GLU-THR-ASN-LEU,96,8,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CC(=O)O,Kd=14.5uM,4.838632,4.84,1,A,A,1,A,A,0,,C,A,,1,1,96,8,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.9635542035102844,0.9109291434288024,96.59156036376952,95.7332992553711,0.2990640699863434,0.4499157071113586,0.9386112689971924,0.9266805052757264,0.9217129349708556,0.9069913029670716,PAWDETNL,Low,"(4.745, 4.866]",val
5W4S,protein-peptide,P05696,HTEKRGRIYLKAEVTDEKLHVTVRDAKNLIPMDPNGLSDPYVKLKLIPDPKNESKQKTKTIRSTLNPQWNESFTFKLKPSDKDRRLSVEIWDWDRTTRNDFMGSLSFGVSELMKMPASGWYKLLNQEEGEYYNVPIPEG,DQSDFEGFSY,HIS-THR-GLU-LYS-ARG-GLY-ARG-ILE-TYR-LEU-LYS-ALA-GLU-VAL-THR-ASP-GLU-LYS-LEU-HIS-VAL-THR-VAL-ARG-ASP-ALA-LYS-ASN-LEU-ILE-PRO-MET-ASP-PRO-ASN-GLY-LEU-SER-ASP-PRO-TYR-VAL-LYS-LEU-LYS-LEU-ILE-PRO-ASP-PRO-LYS-ASN-GLU-SER-LYS-GLN-LYS-THR-LYS-THR-ILE-ARG-SER-THR-LEU-ASN-PRO-GLN-TRP-ASN-GLU-SER-PHE-THR-PHE-LYS-LEU-LYS-PRO-SER-ASP-LYS-ASP-ARG-ARG-LEU-SER-VAL-GLU-ILE-TRP-ASP-TRP-ASP-ARG-THR-THR-ARG-ASN-ASP-PHE-MET-GLY-SER-LEU-SER-PHE-GLY-VAL-SER-GLU-LEU-MET-LYS-MET-PRO-ALA-SER-GLY-TRP-TYR-LYS-LEU-LEU-ASN-GLN-GLU-GLU-GLY-GLU-TYR-TYR-ASN-VAL-PRO-ILE-PRO-GLU-GLY,ACE-ASP-GLN-SER-ASP-PHE-GLU-GLY-PHE-SEP-TYR-NH2,139,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)COP(O)(O)O)Cc1ccccc1)CCC(=O)O)Cc1ccccc1)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CC(=O)O)CCC(=O)N,Kd=94uM,4.026872,4.03,1,A,A,1,A,A,0,,B,A,,1,1,139,12,0,NC(=O)CC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,,NC(=O)CC[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.8959962129592896,0.6362626552581787,95.35401153564452,90.68589782714844,0.3343533873558044,0.8508836627006531,0.932783305644989,0.8124062418937683,0.8448531031608582,0.5922267436981201,DQSDFEGFSY,Low,"(3.924, 4.155]",val
5W7I,protein-peptide,Q8IUH5 P60880,GPHMKTHIDDYSTWDIVKATQYGIYERCRELVEAGYDVRQPDKENVTLLHWAAINNRIDLVKYYISKGAIVDQLGGDLNSTPLHWATRQGHLSMVVQLMKYGADPSLIDGEGCSCIHLAAQFGHTSIVAYLIAKGQDVDMMDQNGMTPLMWAAYRTHSVDPTRLLLTFNVSVNLGDKYHKNTALHWAVLAGNTTVISLLLEAGANVDAQNIKGESALDLAKQRKNVWMINHLQEARQAK,GVVASQPARV,GLY-PRO-HIS-MET-LYS-THR-HIS-ILE-ASP-ASP-TYR-SER-THR-TRP-ASP-ILE-VAL-LYS-ALA-THR-GLN-TYR-GLY-ILE-TYR-GLU-ARG-CYS-ARG-GLU-LEU-VAL-GLU-ALA-GLY-TYR-ASP-VAL-ARG-GLN-PRO-ASP-LYS-GLU-ASN-VAL-THR-LEU-LEU-HIS-TRP-ALA-ALA-ILE-ASN-ASN-ARG-ILE-ASP-LEU-VAL-LYS-TYR-TYR-ILE-SER-LYS-GLY-ALA-ILE-VAL-ASP-GLN-LEU-GLY-GLY-ASP-LEU-ASN-SER-THR-PRO-LEU-HIS-TRP-ALA-THR-ARG-GLN-GLY-HIS-LEU-SER-MET-VAL-VAL-GLN-LEU-MET-LYS-TYR-GLY-ALA-ASP-PRO-SER-LEU-ILE-ASP-GLY-GLU-GLY-CYS-SER-CYS-ILE-HIS-LEU-ALA-ALA-GLN-PHE-GLY-HIS-THR-SER-ILE-VAL-ALA-TYR-LEU-ILE-ALA-LYS-GLY-GLN-ASP-VAL-ASP-MET-MET-ASP-GLN-ASN-GLY-MET-THR-PRO-LEU-MET-TRP-ALA-ALA-TYR-ARG-THR-HIS-SER-VAL-ASP-PRO-THR-ARG-LEU-LEU-LEU-THR-PHE-ASN-VAL-SER-VAL-ASN-LEU-GLY-ASP-LYS-TYR-HIS-LYS-ASN-THR-ALA-LEU-HIS-TRP-ALA-VAL-LEU-ALA-GLY-ASN-THR-THR-VAL-ILE-SER-LEU-LEU-LEU-GLU-ALA-GLY-ALA-ASN-VAL-ASP-ALA-GLN-ASN-ILE-LYS-GLY-GLU-SER-ALA-LEU-ASP-LEU-ALA-LYS-GLN-ARG-LYS-ASN-VAL-TRP-MET-ILE-ASN-HIS-LEU-GLN-GLU-ALA-ARG-GLN-ALA-LYS,GLY-VAL-VAL-ALA-SER-GLN-PRO-ALA-ARG-VAL,239,10,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)C)CCC(=O)N)CO)C)C(C)C)C(C)C,Kd=11.2uM,4.950782,4.95,1,A,A,1,A,A,0,,B,A,dimer,1,1,239,10,0,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)C(C)C)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,0.9125378131866456,0.8074831366539001,89.54765319824219,88.59746551513672,0.3274083733558655,0.6265360713005066,0.9281843304634094,0.8811763525009155,0.8609353303909302,0.7629091739654541,GVVASQPARV,Low,"(4.866, 5.014]",train
5W7J,protein-peptide,Q8IUH5 P60880,GPHMKTHIDDYSTWDIVKATQYGIYERCRELVEAGYDVRQPDKANVTLLHWAAINNRIDLVKYYISKGAIVDQLGGDLNSTPLHWATRQGHLSMVVQLMKYGADPSLIDGEGCSCIHLAAQFGHTSIVAYLIAKGQDVDMMDQNGMTPLMWAAYRTHSVDPTRLLLTFNVSVNLGDKYHKNTALHWAVLAGNTTVISLLLEAGANVDAQNIKGESALDLAKQRKNVWMINHLQEARQAK,GVVASQPARV,GLY-PRO-HIS-MET-LYS-THR-HIS-ILE-ASP-ASP-TYR-SER-THR-TRP-ASP-ILE-VAL-LYS-ALA-THR-GLN-TYR-GLY-ILE-TYR-GLU-ARG-CYS-ARG-GLU-LEU-VAL-GLU-ALA-GLY-TYR-ASP-VAL-ARG-GLN-PRO-ASP-LYS-ALA-ASN-VAL-THR-LEU-LEU-HIS-TRP-ALA-ALA-ILE-ASN-ASN-ARG-ILE-ASP-LEU-VAL-LYS-TYR-TYR-ILE-SER-LYS-GLY-ALA-ILE-VAL-ASP-GLN-LEU-GLY-GLY-ASP-LEU-ASN-SER-THR-PRO-LEU-HIS-TRP-ALA-THR-ARG-GLN-GLY-HIS-LEU-SER-MET-VAL-VAL-GLN-LEU-MET-LYS-TYR-GLY-ALA-ASP-PRO-SER-LEU-ILE-ASP-GLY-GLU-GLY-CYS-SER-CYS-ILE-HIS-LEU-ALA-ALA-GLN-PHE-GLY-HIS-THR-SER-ILE-VAL-ALA-TYR-LEU-ILE-ALA-LYS-GLY-GLN-ASP-VAL-ASP-MET-MET-ASP-GLN-ASN-GLY-MET-THR-PRO-LEU-MET-TRP-ALA-ALA-TYR-ARG-THR-HIS-SER-VAL-ASP-PRO-THR-ARG-LEU-LEU-LEU-THR-PHE-ASN-VAL-SER-VAL-ASN-LEU-GLY-ASP-LYS-TYR-HIS-LYS-ASN-THR-ALA-LEU-HIS-TRP-ALA-VAL-LEU-ALA-GLY-ASN-THR-THR-VAL-ILE-SER-LEU-LEU-LEU-GLU-ALA-GLY-ALA-ASN-VAL-ASP-ALA-GLN-ASN-ILE-LYS-GLY-GLU-SER-ALA-LEU-ASP-LEU-ALA-LYS-GLN-ARG-LYS-ASN-VAL-TRP-MET-ILE-ASN-HIS-LEU-GLN-GLU-ALA-ARG-GLN-ALA-LYS,GLY-VAL-VAL-ALA-SER-GLN-PRO-ALA-ARG-VAL,239,10,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)C)CCC(=O)N)CO)C)C(C)C)C(C)C,Kd=0.8uM,6.09691,6.1,1,A,A,1,A,A,0,,B,A,dimer,1,1,239,10,0,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN)C(C)C)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)O,0.9137484431266784,0.8486124277114868,90.12317657470705,88.4157943725586,0.3211249411106109,0.564177930355072,0.9315280318260192,0.8928909301757812,0.8616126775741577,0.8113921284675598,GVVASQPARV,Low,"(5.959, 6.097]",train
5WA1,protein-peptide,Q8WUM4 Q96CF2,MHHHHHHHHHHSGQNLYFQGHMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQKKFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKM,QRAEEEDDDIKQLAAWTT,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLY-GLN-ASN-LEU-TYR-PHE-GLN-GLY-HIS-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-LYS-LYS-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET,GLN-ARG-ALA-GLU-GLU-GLU-ASP-ASP-ASP-ILE-LYS-GLN-LEU-ALA-ALA-TRP-THR-THR,379,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](O)C)Cc1c[nH]c2c1cccc2)C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CC(=O)O,Ki=67uM,4.173925,4.17,1,A,A,1,A,A,0,,B,A,,1,1,379,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.882970929145813,0.7127736806869507,86.52235412597656,82.56383514404297,0.4630206525325775,0.8666738867759705,0.8834088444709778,0.8314213752746582,0.8309093117713928,0.6649718880653381,QRAEEEDDDIKQLAAWTT,Low,"(4.155, 4.319]",train
5WBK,protein-peptide,P23443 Q93YQ1,SVDMALGDLMVSRFSQSSVSLVSNHRYDEDCVSSHDDGDSRRKDSEAKSSSSYGNGTTEGAATATSMAYLPQTIVLCELRHDASEASAPLGTSEIVLVPKWRLKERMKTGCVALVLCLNITVDPPDVIKISPCARIEAWIDPFSMAPPKALETIGKNLSTQYERWQPRARYKVQLDPTVDEVRKLCLTCRKYAKTERVLFHYNGHGVPKPTANGEIWVFNKSYTQYIPLPISELDSWLKTPSIYVFDCSAARMILNAFAELHDWGSSGSSGSSRDCILLAACDVHETLPQSVEFPADVFTSCLTTPIKMALKWFCRRSLLKEIIDESLIDRIPGRQNDRKTLLGELNWIFTAVTDTIAWNVLPHELFQRLFRQDLLVASLFRNFLLAERIMRSANCNPISHPMLPPTHQHHMWDAWDMAAEICLSQLPQLVLDPSTEFQPSPFFTEQLTAFEVWLDHGSEHKKPPEQLPIVLQVLLSQCHRFRALVLLGRFLDMGSWAVDLALSVGIFPYVLKLLQTTTNELRQILVFIWTKILALDKSCQIDLVKDGGHTYFIRFLDSSGAFPEQRAMAAFVLAVIVDGHRRGQEACLEANLIGVCLGHLEASRPSDPQPEPLFLQWLCLCLGKLWEDFMEAQIMGREANAFEKLAPLLSEPQPEVRAAAVFALGTLLDIGFDSNKSVVEDEFDDDEKIRAEDAIIKSLLDVVSDGSPLVRAEVAVALARFAFGHKQHLKLAAASYWKPQSSSLLTSLPSIAKFHDPGSATIVSLHMSPLTRASTDSQPVARESRISSSPLGSSGLMQGSPLSDDSSLHSDSGMMHDSVSNGAVHQPRLLDNAVYSQCVRAMFALAKDPSPRIASLGRRVLSIIGIEQVVAKPSKPTGRPGEAADSGLADPLLGASGSERSLLPLSTIYGWSCGHFSKPLLGGADASQEIAAKREEKEKFALEHIAKCQHSSISKLNNNPIANWDTRFETGTKTALLHPFSPIVVAADENERIRVWNYEEATLLNGFDNHDFPDKGISKLCLINELDDSLLLVASCDGSVRIWKNYATKGKQKLVTGFSSIQGHKPGARDLNAVVDWQQQSGYLYASGETSTVTLWDLEKEQLVRSVPSESECGVTALSASQVHGGQLAAGFADGSLRLYDVRSPEPLVCATRPHQKVERVVGLSFQPGLDPAKVVSASQAGDIQFLDLRTTRDTYLTIDAHRGSLTALAVHRHAPIIASGSAKQLIKVFSLQGEQLGIIRYYPSFMAQKIGSVSCLTFHPYQVLLAAGAADSFVSIYTHDNSQAR,MAGVFDIDLDQPED,SER-VAL-ASP-MET-ALA-LEU-GLY-ASP-LEU-MET-VAL-SER-ARG-PHE-SER-GLN-SER-SER-VAL-SER-LEU-VAL-SER-ASN-HIS-ARG-TYR-ASP-GLU-ASP-CYS-VAL-SER-SER-HIS-ASP-ASP-GLY-ASP-SER-ARG-ARG-LYS-ASP-SER-GLU-ALA-LYS-SER-SER-SER-SER-TYR-GLY-ASN-GLY-THR-THR-GLU-GLY-ALA-ALA-THR-ALA-THR-SER-MET-ALA-TYR-LEU-PRO-GLN-THR-ILE-VAL-LEU-CYS-GLU-LEU-ARG-HIS-ASP-ALA-SER-GLU-ALA-SER-ALA-PRO-LEU-GLY-THR-SER-GLU-ILE-VAL-LEU-VAL-PRO-LYS-TRP-ARG-LEU-LYS-GLU-ARG-MET-LYS-THR-GLY-CYS-VAL-ALA-LEU-VAL-LEU-CYS-LEU-ASN-ILE-THR-VAL-ASP-PRO-PRO-ASP-VAL-ILE-LYS-ILE-SER-PRO-CYS-ALA-ARG-ILE-GLU-ALA-TRP-ILE-ASP-PRO-PHE-SER-MET-ALA-PRO-PRO-LYS-ALA-LEU-GLU-THR-ILE-GLY-LYS-ASN-LEU-SER-THR-GLN-TYR-GLU-ARG-TRP-GLN-PRO-ARG-ALA-ARG-TYR-LYS-VAL-GLN-LEU-ASP-PRO-THR-VAL-ASP-GLU-VAL-ARG-LYS-LEU-CYS-LEU-THR-CYS-ARG-LYS-TYR-ALA-LYS-THR-GLU-ARG-VAL-LEU-PHE-HIS-TYR-ASN-GLY-HIS-GLY-VAL-PRO-LYS-PRO-THR-ALA-ASN-GLY-GLU-ILE-TRP-VAL-PHE-ASN-LYS-SER-TYR-THR-GLN-TYR-ILE-PRO-LEU-PRO-ILE-SER-GLU-LEU-ASP-SER-TRP-LEU-LYS-THR-PRO-SER-ILE-TYR-VAL-PHE-ASP-CYS-SER-ALA-ALA-ARG-MET-ILE-LEU-ASN-ALA-PHE-ALA-GLU-LEU-HIS-ASP-TRP-GLY-SER-SER-GLY-SER-SER-GLY-SER-SER-ARG-ASP-CYS-ILE-LEU-LEU-ALA-ALA-CYS-ASP-VAL-HIS-GLU-THR-LEU-PRO-GLN-SER-VAL-GLU-PHE-PRO-ALA-ASP-VAL-PHE-THR-SER-CYS-LEU-THR-THR-PRO-ILE-LYS-MET-ALA-LEU-LYS-TRP-PHE-CYS-ARG-ARG-SER-LEU-LEU-LYS-GLU-ILE-ILE-ASP-GLU-SER-LEU-ILE-ASP-ARG-ILE-PRO-GLY-ARG-GLN-ASN-ASP-ARG-LYS-THR-LEU-LEU-GLY-GLU-LEU-ASN-TRP-ILE-PHE-THR-ALA-VAL-THR-ASP-THR-ILE-ALA-TRP-ASN-VAL-LEU-PRO-HIS-GLU-LEU-PHE-GLN-ARG-LEU-PHE-ARG-GLN-ASP-LEU-LEU-VAL-ALA-SER-LEU-PHE-ARG-ASN-PHE-LEU-LEU-ALA-GLU-ARG-ILE-MET-ARG-SER-ALA-ASN-CYS-ASN-PRO-ILE-SER-HIS-PRO-MET-LEU-PRO-PRO-THR-HIS-GLN-HIS-HIS-MET-TRP-ASP-ALA-TRP-ASP-MET-ALA-ALA-GLU-ILE-CYS-LEU-SER-GLN-LEU-PRO-GLN-LEU-VAL-LEU-ASP-PRO-SER-THR-GLU-PHE-GLN-PRO-SER-PRO-PHE-PHE-THR-GLU-GLN-LEU-THR-ALA-PHE-GLU-VAL-TRP-LEU-ASP-HIS-GLY-SER-GLU-HIS-LYS-LYS-PRO-PRO-GLU-GLN-LEU-PRO-ILE-VAL-LEU-GLN-VAL-LEU-LEU-SER-GLN-CYS-HIS-ARG-PHE-ARG-ALA-LEU-VAL-LEU-LEU-GLY-ARG-PHE-LEU-ASP-MET-GLY-SER-TRP-ALA-VAL-ASP-LEU-ALA-LEU-SER-VAL-GLY-ILE-PHE-PRO-TYR-VAL-LEU-LYS-LEU-LEU-GLN-THR-THR-THR-ASN-GLU-LEU-ARG-GLN-ILE-LEU-VAL-PHE-ILE-TRP-THR-LYS-ILE-LEU-ALA-LEU-ASP-LYS-SER-CYS-GLN-ILE-ASP-LEU-VAL-LYS-ASP-GLY-GLY-HIS-THR-TYR-PHE-ILE-ARG-PHE-LEU-ASP-SER-SER-GLY-ALA-PHE-PRO-GLU-GLN-ARG-ALA-MET-ALA-ALA-PHE-VAL-LEU-ALA-VAL-ILE-VAL-ASP-GLY-HIS-ARG-ARG-GLY-GLN-GLU-ALA-CYS-LEU-GLU-ALA-ASN-LEU-ILE-GLY-VAL-CYS-LEU-GLY-HIS-LEU-GLU-ALA-SER-ARG-PRO-SER-ASP-PRO-GLN-PRO-GLU-PRO-LEU-PHE-LEU-GLN-TRP-LEU-CYS-LEU-CYS-LEU-GLY-LYS-LEU-TRP-GLU-ASP-PHE-MET-GLU-ALA-GLN-ILE-MET-GLY-ARG-GLU-ALA-ASN-ALA-PHE-GLU-LYS-LEU-ALA-PRO-LEU-LEU-SER-GLU-PRO-GLN-PRO-GLU-VAL-ARG-ALA-ALA-ALA-VAL-PHE-ALA-LEU-GLY-THR-LEU-LEU-ASP-ILE-GLY-PHE-ASP-SER-ASN-LYS-SER-VAL-VAL-GLU-ASP-GLU-PHE-ASP-ASP-ASP-GLU-LYS-ILE-ARG-ALA-GLU-ASP-ALA-ILE-ILE-LYS-SER-LEU-LEU-ASP-VAL-VAL-SER-ASP-GLY-SER-PRO-LEU-VAL-ARG-ALA-GLU-VAL-ALA-VAL-ALA-LEU-ALA-ARG-PHE-ALA-PHE-GLY-HIS-LYS-GLN-HIS-LEU-LYS-LEU-ALA-ALA-ALA-SER-TYR-TRP-LYS-PRO-GLN-SER-SER-SER-LEU-LEU-THR-SER-LEU-PRO-SER-ILE-ALA-LYS-PHE-HIS-ASP-PRO-GLY-SER-ALA-THR-ILE-VAL-SER-LEU-HIS-MET-SER-PRO-LEU-THR-ARG-ALA-SER-THR-ASP-SER-GLN-PRO-VAL-ALA-ARG-GLU-SER-ARG-ILE-SER-SER-SER-PRO-LEU-GLY-SER-SER-GLY-LEU-MET-GLN-GLY-SER-PRO-LEU-SER-ASP-ASP-SER-SER-LEU-HIS-SER-ASP-SER-GLY-MET-MET-HIS-ASP-SER-VAL-SER-ASN-GLY-ALA-VAL-HIS-GLN-PRO-ARG-LEU-LEU-ASP-ASN-ALA-VAL-TYR-SER-GLN-CYS-VAL-ARG-ALA-MET-PHE-ALA-LEU-ALA-LYS-ASP-PRO-SER-PRO-ARG-ILE-ALA-SER-LEU-GLY-ARG-ARG-VAL-LEU-SER-ILE-ILE-GLY-ILE-GLU-GLN-VAL-VAL-ALA-LYS-PRO-SER-LYS-PRO-THR-GLY-ARG-PRO-GLY-GLU-ALA-ALA-ASP-SER-GLY-LEU-ALA-ASP-PRO-LEU-LEU-GLY-ALA-SER-GLY-SER-GLU-ARG-SER-LEU-LEU-PRO-LEU-SER-THR-ILE-TYR-GLY-TRP-SER-CYS-GLY-HIS-PHE-SER-LYS-PRO-LEU-LEU-GLY-GLY-ALA-ASP-ALA-SER-GLN-GLU-ILE-ALA-ALA-LYS-ARG-GLU-GLU-LYS-GLU-LYS-PHE-ALA-LEU-GLU-HIS-ILE-ALA-LYS-CYS-GLN-HIS-SER-SER-ILE-SER-LYS-LEU-ASN-ASN-ASN-PRO-ILE-ALA-ASN-TRP-ASP-THR-ARG-PHE-GLU-THR-GLY-THR-LYS-THR-ALA-LEU-LEU-HIS-PRO-PHE-SER-PRO-ILE-VAL-VAL-ALA-ALA-ASP-GLU-ASN-GLU-ARG-ILE-ARG-VAL-TRP-ASN-TYR-GLU-GLU-ALA-THR-LEU-LEU-ASN-GLY-PHE-ASP-ASN-HIS-ASP-PHE-PRO-ASP-LYS-GLY-ILE-SER-LYS-LEU-CYS-LEU-ILE-ASN-GLU-LEU-ASP-ASP-SER-LEU-LEU-LEU-VAL-ALA-SER-CYS-ASP-GLY-SER-VAL-ARG-ILE-TRP-LYS-ASN-TYR-ALA-THR-LYS-GLY-LYS-GLN-LYS-LEU-VAL-THR-GLY-PHE-SER-SER-ILE-GLN-GLY-HIS-LYS-PRO-GLY-ALA-ARG-ASP-LEU-ASN-ALA-VAL-VAL-ASP-TRP-GLN-GLN-GLN-SER-GLY-TYR-LEU-TYR-ALA-SER-GLY-GLU-THR-SER-THR-VAL-THR-LEU-TRP-ASP-LEU-GLU-LYS-GLU-GLN-LEU-VAL-ARG-SER-VAL-PRO-SER-GLU-SER-GLU-CYS-GLY-VAL-THR-ALA-LEU-SER-ALA-SER-GLN-VAL-HIS-GLY-GLY-GLN-LEU-ALA-ALA-GLY-PHE-ALA-ASP-GLY-SER-LEU-ARG-LEU-TYR-ASP-VAL-ARG-SER-PRO-GLU-PRO-LEU-VAL-CYS-ALA-THR-ARG-PRO-HIS-GLN-LYS-VAL-GLU-ARG-VAL-VAL-GLY-LEU-SER-PHE-GLN-PRO-GLY-LEU-ASP-PRO-ALA-LYS-VAL-VAL-SER-ALA-SER-GLN-ALA-GLY-ASP-ILE-GLN-PHE-LEU-ASP-LEU-ARG-THR-THR-ARG-ASP-THR-TYR-LEU-THR-ILE-ASP-ALA-HIS-ARG-GLY-SER-LEU-THR-ALA-LEU-ALA-VAL-HIS-ARG-HIS-ALA-PRO-ILE-ILE-ALA-SER-GLY-SER-ALA-LYS-GLN-LEU-ILE-LYS-VAL-PHE-SER-LEU-GLN-GLY-GLU-GLN-LEU-GLY-ILE-ILE-ARG-TYR-TYR-PRO-SER-PHE-MET-ALA-GLN-LYS-ILE-GLY-SER-VAL-SER-CYS-LEU-THR-PHE-HIS-PRO-TYR-GLN-VAL-LEU-LEU-ALA-ALA-GLY-ALA-ALA-ASP-SER-PHE-VAL-SER-ILE-TYR-THR-HIS-ASP-ASN-SER-GLN-ALA-ARG,MET-ALA-GLY-VAL-PHE-ASP-ILE-ASP-LEU-ASP-GLN-PRO-GLU-ASP,1287,14,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]([NH3+])C)Cc1ccccc1)CC(=O)O)C,Kd=0.94uM,6.026872,6.03,1,A,A,1,A,A,0,,T,A,,1,1,1287,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)CCSC)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C)C(=O)O,0.7736600041389465,0.7193783521652222,58.919883728027344,58.19918441772461,0.7827386856079102,1.1011981964111328,0.7508670687675476,0.7446539402008057,0.6962490677833557,0.6324455738067627,MAGVFDIDLDQPED,Low,"(5.959, 6.097]",train
5WBL,protein-peptide,Q96B36 Q93YQ1,SVDMALGDLMVSRFSQSSVSLVSNHRYDEDCVSSHDDGDSRRKDSEAKSSSSYGNGTTEGAATATSMAYLPQTIVLCELRHDASEASAPLGTSEIVLVPKWRLKERMKTGCVALVLCLNITVDPPDVIKISPCARIEAWIDPFSMAPPKALETIGKNLSTQYERWQPRARYKVQLDPTVDEVRKLCLTCRKYAKTERVLFHYNGHGVPKPTANGEIWVFNKSYTQYIPLPISELDSWLKTPSIYVFDCSAARMILNAFAELHDWGSSGSSGSSRDCILLAACDVHETLPQSVEFPADVFTSCLTTPIKMALKWFCRRSLLKEIIDESLIDRIPGRQNDRKTLLGELNWIFTAVTDTIAWNVLPHELFQRLFRQDLLVASLFRNFLLAERIMRSANCNPISHPMLPPTHQHHMWDAWDMAAEICLSQLPQLVLDPSTEFQPSPFFTEQLTAFEVWLDHGSEHKKPPEQLPIVLQVLLSQCHRFRALVLLGRFLDMGSWAVDLALSVGIFPYVLKLLQTTTNELRQILVFIWTKILALDKSCQIDLVKDGGHTYFIRFLDSSGAFPEQRAMAAFVLAVIVDGHRRGQEACLEANLIGVCLGHLEASRPSDPQPEPLFLQWLCLCLGKLWEDFMEAQIMGREANAFEKLAPLLSEPQPEVRAAAVFALGTLLDIGFDSNKSVVEDEFDDDEKIRAEDAIIKSLLDVVSDGSPLVRAEVAVALARFAFGHKQHLKLAAASYWKPQSSSLLTSLPSIAKFHDPGSATIVSLHMSPLTRASTDSQPVARESRISSSPLGSSGLMQGSPLSDDSSLHSDSGMMHDSVSNGAVHQPRLLDNAVYSQCVRAMFALAKDPSPRIASLGRRVLSIIGIEQVVAKPSKPTGRPGEAADSGLADPLLGASGSERSLLPLSTIYGWSCGHFSKPLLGGADASQEIAAKREEKEKFALEHIAKCQHSSISKLNNNPIANWDTRFETGTKTALLHPFSPIVVAADENERIRVWNYEEATLLNGFDNHDFPDKGISKLCLINELDDSLLLVASCDGSVRIWKNYATKGKQKLVTGFSSIQGHKPGARDLNAVVDWQQQSGYLYASGETSTVTLWDLEKEQLVRSVPSESECGVTALSASQVHGGQLAAGFADGSLRLYDVRSPEPLVCATRPHQKVERVVGLSFQPGLDPAKVVSASQAGDIQFLDLRTTRDTYLTIDAHRGSLTALAVHRHAPIIASGSAKQLIKVFSLQGEQLGIIRYYPSFMAQKIGSVSCLTFHPYQVLLAAGAADSFVSIYTHDNSQAR,DNGGLFVMDEDATLQD,SER-VAL-ASP-MET-ALA-LEU-GLY-ASP-LEU-MET-VAL-SER-ARG-PHE-SER-GLN-SER-SER-VAL-SER-LEU-VAL-SER-ASN-HIS-ARG-TYR-ASP-GLU-ASP-CYS-VAL-SER-SER-HIS-ASP-ASP-GLY-ASP-SER-ARG-ARG-LYS-ASP-SER-GLU-ALA-LYS-SER-SER-SER-SER-TYR-GLY-ASN-GLY-THR-THR-GLU-GLY-ALA-ALA-THR-ALA-THR-SER-MET-ALA-TYR-LEU-PRO-GLN-THR-ILE-VAL-LEU-CYS-GLU-LEU-ARG-HIS-ASP-ALA-SER-GLU-ALA-SER-ALA-PRO-LEU-GLY-THR-SER-GLU-ILE-VAL-LEU-VAL-PRO-LYS-TRP-ARG-LEU-LYS-GLU-ARG-MET-LYS-THR-GLY-CYS-VAL-ALA-LEU-VAL-LEU-CYS-LEU-ASN-ILE-THR-VAL-ASP-PRO-PRO-ASP-VAL-ILE-LYS-ILE-SER-PRO-CYS-ALA-ARG-ILE-GLU-ALA-TRP-ILE-ASP-PRO-PHE-SER-MET-ALA-PRO-PRO-LYS-ALA-LEU-GLU-THR-ILE-GLY-LYS-ASN-LEU-SER-THR-GLN-TYR-GLU-ARG-TRP-GLN-PRO-ARG-ALA-ARG-TYR-LYS-VAL-GLN-LEU-ASP-PRO-THR-VAL-ASP-GLU-VAL-ARG-LYS-LEU-CYS-LEU-THR-CYS-ARG-LYS-TYR-ALA-LYS-THR-GLU-ARG-VAL-LEU-PHE-HIS-TYR-ASN-GLY-HIS-GLY-VAL-PRO-LYS-PRO-THR-ALA-ASN-GLY-GLU-ILE-TRP-VAL-PHE-ASN-LYS-SER-TYR-THR-GLN-TYR-ILE-PRO-LEU-PRO-ILE-SER-GLU-LEU-ASP-SER-TRP-LEU-LYS-THR-PRO-SER-ILE-TYR-VAL-PHE-ASP-CYS-SER-ALA-ALA-ARG-MET-ILE-LEU-ASN-ALA-PHE-ALA-GLU-LEU-HIS-ASP-TRP-GLY-SER-SER-GLY-SER-SER-GLY-SER-SER-ARG-ASP-CYS-ILE-LEU-LEU-ALA-ALA-CYS-ASP-VAL-HIS-GLU-THR-LEU-PRO-GLN-SER-VAL-GLU-PHE-PRO-ALA-ASP-VAL-PHE-THR-SER-CYS-LEU-THR-THR-PRO-ILE-LYS-MET-ALA-LEU-LYS-TRP-PHE-CYS-ARG-ARG-SER-LEU-LEU-LYS-GLU-ILE-ILE-ASP-GLU-SER-LEU-ILE-ASP-ARG-ILE-PRO-GLY-ARG-GLN-ASN-ASP-ARG-LYS-THR-LEU-LEU-GLY-GLU-LEU-ASN-TRP-ILE-PHE-THR-ALA-VAL-THR-ASP-THR-ILE-ALA-TRP-ASN-VAL-LEU-PRO-HIS-GLU-LEU-PHE-GLN-ARG-LEU-PHE-ARG-GLN-ASP-LEU-LEU-VAL-ALA-SER-LEU-PHE-ARG-ASN-PHE-LEU-LEU-ALA-GLU-ARG-ILE-MET-ARG-SER-ALA-ASN-CYS-ASN-PRO-ILE-SER-HIS-PRO-MET-LEU-PRO-PRO-THR-HIS-GLN-HIS-HIS-MET-TRP-ASP-ALA-TRP-ASP-MET-ALA-ALA-GLU-ILE-CYS-LEU-SER-GLN-LEU-PRO-GLN-LEU-VAL-LEU-ASP-PRO-SER-THR-GLU-PHE-GLN-PRO-SER-PRO-PHE-PHE-THR-GLU-GLN-LEU-THR-ALA-PHE-GLU-VAL-TRP-LEU-ASP-HIS-GLY-SER-GLU-HIS-LYS-LYS-PRO-PRO-GLU-GLN-LEU-PRO-ILE-VAL-LEU-GLN-VAL-LEU-LEU-SER-GLN-CYS-HIS-ARG-PHE-ARG-ALA-LEU-VAL-LEU-LEU-GLY-ARG-PHE-LEU-ASP-MET-GLY-SER-TRP-ALA-VAL-ASP-LEU-ALA-LEU-SER-VAL-GLY-ILE-PHE-PRO-TYR-VAL-LEU-LYS-LEU-LEU-GLN-THR-THR-THR-ASN-GLU-LEU-ARG-GLN-ILE-LEU-VAL-PHE-ILE-TRP-THR-LYS-ILE-LEU-ALA-LEU-ASP-LYS-SER-CYS-GLN-ILE-ASP-LEU-VAL-LYS-ASP-GLY-GLY-HIS-THR-TYR-PHE-ILE-ARG-PHE-LEU-ASP-SER-SER-GLY-ALA-PHE-PRO-GLU-GLN-ARG-ALA-MET-ALA-ALA-PHE-VAL-LEU-ALA-VAL-ILE-VAL-ASP-GLY-HIS-ARG-ARG-GLY-GLN-GLU-ALA-CYS-LEU-GLU-ALA-ASN-LEU-ILE-GLY-VAL-CYS-LEU-GLY-HIS-LEU-GLU-ALA-SER-ARG-PRO-SER-ASP-PRO-GLN-PRO-GLU-PRO-LEU-PHE-LEU-GLN-TRP-LEU-CYS-LEU-CYS-LEU-GLY-LYS-LEU-TRP-GLU-ASP-PHE-MET-GLU-ALA-GLN-ILE-MET-GLY-ARG-GLU-ALA-ASN-ALA-PHE-GLU-LYS-LEU-ALA-PRO-LEU-LEU-SER-GLU-PRO-GLN-PRO-GLU-VAL-ARG-ALA-ALA-ALA-VAL-PHE-ALA-LEU-GLY-THR-LEU-LEU-ASP-ILE-GLY-PHE-ASP-SER-ASN-LYS-SER-VAL-VAL-GLU-ASP-GLU-PHE-ASP-ASP-ASP-GLU-LYS-ILE-ARG-ALA-GLU-ASP-ALA-ILE-ILE-LYS-SER-LEU-LEU-ASP-VAL-VAL-SER-ASP-GLY-SER-PRO-LEU-VAL-ARG-ALA-GLU-VAL-ALA-VAL-ALA-LEU-ALA-ARG-PHE-ALA-PHE-GLY-HIS-LYS-GLN-HIS-LEU-LYS-LEU-ALA-ALA-ALA-SER-TYR-TRP-LYS-PRO-GLN-SER-SER-SER-LEU-LEU-THR-SER-LEU-PRO-SER-ILE-ALA-LYS-PHE-HIS-ASP-PRO-GLY-SER-ALA-THR-ILE-VAL-SER-LEU-HIS-MET-SER-PRO-LEU-THR-ARG-ALA-SER-THR-ASP-SER-GLN-PRO-VAL-ALA-ARG-GLU-SER-ARG-ILE-SER-SER-SER-PRO-LEU-GLY-SER-SER-GLY-LEU-MET-GLN-GLY-SER-PRO-LEU-SER-ASP-ASP-SER-SER-LEU-HIS-SER-ASP-SER-GLY-MET-MET-HIS-ASP-SER-VAL-SER-ASN-GLY-ALA-VAL-HIS-GLN-PRO-ARG-LEU-LEU-ASP-ASN-ALA-VAL-TYR-SER-GLN-CYS-VAL-ARG-ALA-MET-PHE-ALA-LEU-ALA-LYS-ASP-PRO-SER-PRO-ARG-ILE-ALA-SER-LEU-GLY-ARG-ARG-VAL-LEU-SER-ILE-ILE-GLY-ILE-GLU-GLN-VAL-VAL-ALA-LYS-PRO-SER-LYS-PRO-THR-GLY-ARG-PRO-GLY-GLU-ALA-ALA-ASP-SER-GLY-LEU-ALA-ASP-PRO-LEU-LEU-GLY-ALA-SER-GLY-SER-GLU-ARG-SER-LEU-LEU-PRO-LEU-SER-THR-ILE-TYR-GLY-TRP-SER-CYS-GLY-HIS-PHE-SER-LYS-PRO-LEU-LEU-GLY-GLY-ALA-ASP-ALA-SER-GLN-GLU-ILE-ALA-ALA-LYS-ARG-GLU-GLU-LYS-GLU-LYS-PHE-ALA-LEU-GLU-HIS-ILE-ALA-LYS-CYS-GLN-HIS-SER-SER-ILE-SER-LYS-LEU-ASN-ASN-ASN-PRO-ILE-ALA-ASN-TRP-ASP-THR-ARG-PHE-GLU-THR-GLY-THR-LYS-THR-ALA-LEU-LEU-HIS-PRO-PHE-SER-PRO-ILE-VAL-VAL-ALA-ALA-ASP-GLU-ASN-GLU-ARG-ILE-ARG-VAL-TRP-ASN-TYR-GLU-GLU-ALA-THR-LEU-LEU-ASN-GLY-PHE-ASP-ASN-HIS-ASP-PHE-PRO-ASP-LYS-GLY-ILE-SER-LYS-LEU-CYS-LEU-ILE-ASN-GLU-LEU-ASP-ASP-SER-LEU-LEU-LEU-VAL-ALA-SER-CYS-ASP-GLY-SER-VAL-ARG-ILE-TRP-LYS-ASN-TYR-ALA-THR-LYS-GLY-LYS-GLN-LYS-LEU-VAL-THR-GLY-PHE-SER-SER-ILE-GLN-GLY-HIS-LYS-PRO-GLY-ALA-ARG-ASP-LEU-ASN-ALA-VAL-VAL-ASP-TRP-GLN-GLN-GLN-SER-GLY-TYR-LEU-TYR-ALA-SER-GLY-GLU-THR-SER-THR-VAL-THR-LEU-TRP-ASP-LEU-GLU-LYS-GLU-GLN-LEU-VAL-ARG-SER-VAL-PRO-SER-GLU-SER-GLU-CYS-GLY-VAL-THR-ALA-LEU-SER-ALA-SER-GLN-VAL-HIS-GLY-GLY-GLN-LEU-ALA-ALA-GLY-PHE-ALA-ASP-GLY-SER-LEU-ARG-LEU-TYR-ASP-VAL-ARG-SER-PRO-GLU-PRO-LEU-VAL-CYS-ALA-THR-ARG-PRO-HIS-GLN-LYS-VAL-GLU-ARG-VAL-VAL-GLY-LEU-SER-PHE-GLN-PRO-GLY-LEU-ASP-PRO-ALA-LYS-VAL-VAL-SER-ALA-SER-GLN-ALA-GLY-ASP-ILE-GLN-PHE-LEU-ASP-LEU-ARG-THR-THR-ARG-ASP-THR-TYR-LEU-THR-ILE-ASP-ALA-HIS-ARG-GLY-SER-LEU-THR-ALA-LEU-ALA-VAL-HIS-ARG-HIS-ALA-PRO-ILE-ILE-ALA-SER-GLY-SER-ALA-LYS-GLN-LEU-ILE-LYS-VAL-PHE-SER-LEU-GLN-GLY-GLU-GLN-LEU-GLY-ILE-ILE-ARG-TYR-TYR-PRO-SER-PHE-MET-ALA-GLN-LYS-ILE-GLY-SER-VAL-SER-CYS-LEU-THR-PHE-HIS-PRO-TYR-GLN-VAL-LEU-LEU-ALA-ALA-GLY-ALA-ALA-ASP-SER-PHE-VAL-SER-ILE-TYR-THR-HIS-ASP-ASN-SER-GLN-ALA-ARG,ASP-ASN-GLY-GLY-LEU-PHE-VAL-MET-ASP-GLU-ASP-ALA-THR-LEU-GLN-ASP,1287,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CC(C)C)Cc1ccccc1,Kd=0.36uM,6.443697,6.44,1,A,A,1,A,A,0,,T,A,,1,1,1287,16,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,0.7389240860939026,0.7074835300445557,59.66725540161133,58.16355895996094,0.7759595513343811,1.156977891921997,0.7588230967521667,0.7451906204223633,0.6552846431732178,0.6169573068618774,DNGGLFVMDEDATLQD,Low,"(6.398, 6.523]",val
5WIR,protein-peptide,P54274 Q8NA31,SEDAGLVAEAEAVAAGWMLDFLCLSLCRAFRDGRSEDFRRTRNSAEAIIHGLSSLTACQLRTIYICQFLTRIAAGKTLDAQFENDERITPLESALMIWGSIEKEHDKLHEEIQNLIKIQAIAVCMENGNFKEAEEVFERIFGDPNSHMPFKSKLLMIISQKDTFHSFFQHFSYNHMMEKIKSYVNYVLSEKSSTFLMKAAAKVVE,SKKILLTPRRRQRLS,SER-GLU-ASP-ALA-GLY-LEU-VAL-ALA-GLU-ALA-GLU-ALA-VAL-ALA-ALA-GLY-TRP-MET-LEU-ASP-PHE-LEU-CYS-LEU-SER-LEU-CYS-ARG-ALA-PHE-ARG-ASP-GLY-ARG-SER-GLU-ASP-PHE-ARG-ARG-THR-ARG-ASN-SER-ALA-GLU-ALA-ILE-ILE-HIS-GLY-LEU-SER-SER-LEU-THR-ALA-CYS-GLN-LEU-ARG-THR-ILE-TYR-ILE-CYS-GLN-PHE-LEU-THR-ARG-ILE-ALA-ALA-GLY-LYS-THR-LEU-ASP-ALA-GLN-PHE-GLU-ASN-ASP-GLU-ARG-ILE-THR-PRO-LEU-GLU-SER-ALA-LEU-MET-ILE-TRP-GLY-SER-ILE-GLU-LYS-GLU-HIS-ASP-LYS-LEU-HIS-GLU-GLU-ILE-GLN-ASN-LEU-ILE-LYS-ILE-GLN-ALA-ILE-ALA-VAL-CYS-MET-GLU-ASN-GLY-ASN-PHE-LYS-GLU-ALA-GLU-GLU-VAL-PHE-GLU-ARG-ILE-PHE-GLY-ASP-PRO-ASN-SER-HIS-MET-PRO-PHE-LYS-SER-LYS-LEU-LEU-MET-ILE-ILE-SER-GLN-LYS-ASP-THR-PHE-HIS-SER-PHE-PHE-GLN-HIS-PHE-SER-TYR-ASN-HIS-MET-MET-GLU-LYS-ILE-LYS-SER-TYR-VAL-ASN-TYR-VAL-LEU-SER-GLU-LYS-SER-SER-THR-PHE-LEU-MET-LYS-ALA-ALA-ALA-LYS-VAL-VAL-GLU,SER-LYS-LYS-ILE-LEU-LEU-THR-PRO-ARG-ARG-ARG-GLN-ARG-LEU-SER,205,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](O)C)CC(C)C)CC(C)C)[C@H](CC)C)[NH3+],Kd=75.1nM,7.12436,7.12,1,A,A,1,A,A,0,,C,A,,0,1,205,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8702893257141113,0.7526161670684814,88.49453735351562,80.50553131103516,0.3940151333808899,0.8657402992248535,0.9012386202812196,0.8426914215087891,0.8199383020401001,0.7209510207176208,SKKILLTPRRRQRLS,Moderate,"(7.049, 7.268]",val
5WLE,protein-peptide,Q9VG78 P68431,GDDDDPNKLWCICRQPHNNRFMICCDLCEDWFHGTCVGVTKAMGTDMENKGIDWKCPKCVKRQ,ARTKQTARKSTG,GLY-ASP-ASP-ASP-ASP-PRO-ASN-LYS-LEU-TRP-CYS-ILE-CYS-ARG-GLN-PRO-HIS-ASN-ASN-ARG-PHE-MET-ILE-CYS-CYS-ASP-LEU-CYS-GLU-ASP-TRP-PHE-HIS-GLY-THR-CYS-VAL-GLY-VAL-THR-LYS-ALA-MET-GLY-THR-ASP-MET-GLU-ASN-LYS-GLY-ILE-ASP-TRP-LYS-CYS-PRO-LYS-CYS-VAL-LYS-ARG-GLN,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,63,12,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,C,A,,1,1,63,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8463767170906067,0.8632484674453735,88.08012390136719,89.18052673339844,0.4139913320541382,0.6875671148300171,0.8122292160987854,0.8291589021682739,0.7549135684967041,0.7725644707679749,ARTKQTARKSTG,Low,"(5.699, 5.821]",train
5WOU,protein-peptide,Q7KRY7 Q9VE13,GPLGSRLEQYEIHIERTAAGLGLSIAGGKGSTPFKGDDDGIFISRVTEAGPADLAGLKVGDKVIKVNGIVVVDADHYQAVQVLKACGAVLVLVVQREVTR,LPSFETAL,GLY-PRO-LEU-GLY-SER-ARG-LEU-GLU-GLN-TYR-GLU-ILE-HIS-ILE-GLU-ARG-THR-ALA-ALA-GLY-LEU-GLY-LEU-SER-ILE-ALA-GLY-GLY-LYS-GLY-SER-THR-PRO-PHE-LYS-GLY-ASP-ASP-ASP-GLY-ILE-PHE-ILE-SER-ARG-VAL-THR-GLU-ALA-GLY-PRO-ALA-ASP-LEU-ALA-GLY-LEU-LYS-VAL-GLY-ASP-LYS-VAL-ILE-LYS-VAL-ASN-GLY-ILE-VAL-VAL-VAL-ASP-ALA-ASP-HIS-TYR-GLN-ALA-VAL-GLN-VAL-LEU-LYS-ALA-CYS-GLY-ALA-VAL-LEU-VAL-LEU-VAL-VAL-GLN-ARG-GLU-VAL-THR-ARG,LEU-PRO-SER-PHE-GLU-THR-ALA-LEU,100,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)C)[C@H](O)C)CCC(=O)O)Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)[NH3+],Kd=664nM,6.177832,6.18,1,A,A,1,A,A,0,,V,A,,1,1,100,8,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.97660231590271,0.8990797996520996,98.14907836914062,95.01414489746094,0.295679360628128,0.4566733241081238,0.9410420060157776,0.9138524532318116,0.9391961097717284,0.8828866481781006,LPSFETAL,Low,"(6.097, 6.26]",train
5WQD,protein-peptide,O60934 Q15554,GAGEARLEEAVNRWVLKFYFHEALRAFRGSRYGDFRQIRDIMQALLVRPLGKEHTVSRLLRVMQCLSRIEEGENLDCSFDMEAELTPLESAINVLEMIKTEFTLTEAVVESSRKLVKEAAVIICIKNKEFEKASKILKKHMSKDPTTQKLRNDLLNIIREKNLAHPVIQNFSYETFQQKMLRFLESHLDDAEPYLLTMAKKALK,KMRIPNYQLSPTKLPS,GLY-ALA-GLY-GLU-ALA-ARG-LEU-GLU-GLU-ALA-VAL-ASN-ARG-TRP-VAL-LEU-LYS-PHE-TYR-PHE-HIS-GLU-ALA-LEU-ARG-ALA-PHE-ARG-GLY-SER-ARG-TYR-GLY-ASP-PHE-ARG-GLN-ILE-ARG-ASP-ILE-MET-GLN-ALA-LEU-LEU-VAL-ARG-PRO-LEU-GLY-LYS-GLU-HIS-THR-VAL-SER-ARG-LEU-LEU-ARG-VAL-MET-GLN-CYS-LEU-SER-ARG-ILE-GLU-GLU-GLY-GLU-ASN-LEU-ASP-CYS-SER-PHE-ASP-MET-GLU-ALA-GLU-LEU-THR-PRO-LEU-GLU-SER-ALA-ILE-ASN-VAL-LEU-GLU-MET-ILE-LYS-THR-GLU-PHE-THR-LEU-THR-GLU-ALA-VAL-VAL-GLU-SER-SER-ARG-LYS-LEU-VAL-LYS-GLU-ALA-ALA-VAL-ILE-ILE-CYS-ILE-LYS-ASN-LYS-GLU-PHE-GLU-LYS-ALA-SER-LYS-ILE-LEU-LYS-LYS-HIS-MET-SER-LYS-ASP-PRO-THR-THR-GLN-LYS-LEU-ARG-ASN-ASP-LEU-LEU-ASN-ILE-ILE-ARG-GLU-LYS-ASN-LEU-ALA-HIS-PRO-VAL-ILE-GLN-ASN-PHE-SER-TYR-GLU-THR-PHE-GLN-GLN-LYS-MET-LEU-ARG-PHE-LEU-GLU-SER-HIS-LEU-ASP-ASP-ALA-GLU-PRO-TYR-LEU-LEU-THR-MET-ALA-LYS-LYS-ALA-LEU-LYS,LYS-MET-ARG-ILE-PRO-ASN-TYR-GLN-LEU-SER-PRO-THR-LYS-LEU-PRO-SER,204,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(=O)N)Cc1ccc(cc1)O)CCC(=O)N)CC(C)C)CO,Kd=17uM,4.769551,4.77,1,A,A,1,A,A,0,,H,A,,1,1,204,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9522884488105774,0.906269073486328,91.72733306884766,90.59186553955078,0.3278983235359192,0.5102705955505371,0.9374250769615172,0.9287340641021729,0.9105496406555176,0.9006528258323669,KMRIPNYQLSPTKLPS,Low,"(4.745, 4.866]",train
5WXF,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKEENGLAL,CSWRGLENHAAC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU-GLU-ASN-GLY-LEU-ALA-LEU,CYS-SER-TRP-HRG-GLY-LEU-GLU-ASN-HIS-ALA-ALA-CYS,253,12,OC[C@@H]1NC(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c2c1cccc2)CCCC[NH+]=C(N)N)CC(C)C)CCC(=O)O)CC(=O)N)C(=O)O,Ki=33uM,4.481486,4.48,1,A,A,1,A,A,0,,P,U,,1,1,253,12,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)NCC(=O)NC(CCCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)NCC(=O)NC(CCCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,0.925024390220642,0.8690153956413269,95.49305725097656,93.63825988769533,0.3261574506759643,0.5675048232078552,0.9568981528282166,0.9320866465568542,0.8887539505958557,0.8532475829124451,CSWRGLENHAAC,Low,"(4.456, 4.606]",train
5WXO,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKEENGLAL,CSARGLENHAAC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU-GLU-ASN-GLY-LEU-ALA-LEU,CYS-SER-ALA-HRG-GLY-LEU-GLU-ASN-HIS-ALA-ALA-CYS,253,12,OC[C@@H]1NC(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc2nc[nH]c2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C)CCCC[NH+]=C(N)N)CC(C)C)CCC(=O)O)CC(=O)N)C(=O)O,Ki=207uM,3.68403,3.68,1,A,A,1,A,A,0,,P,U,,1,1,253,12,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)NCC(=O)NC(CCCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)NCC(=O)NC(CCCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,0.9103314876556396,0.8390730023384094,95.72259521484376,93.4771499633789,0.3358226418495178,0.6035220623016357,0.9555970430374146,0.9213546514511108,0.8707132339477539,0.8110914826393127,CSARGLENHAAC,Low,"(3.548, 3.924]",train
5XN3,protein-peptide,Q99619 P35228,MGDLSCPEGLEELLSAPPPDLGAQRRHGWNPKDCSENIEVKEGGLYFERRPVAQSTDGARGKRGYSRGLHAWEISWPLEQRGTHAVVGVATALAPLQTDHYAALLGSNSESWGWDIGRGKLYHQSKGPGAPQYPAGTQGEQLEVPERLLVVLDMEEGTLGYAIGGTYLGPAFRGLKGRTLYPAVSAVWGQCQVRIRYLGERGSHHHHHH,RGDINNNV,MET-GLY-ASP-LEU-SER-CYS-PRO-GLU-GLY-LEU-GLU-GLU-LEU-LEU-SER-ALA-PRO-PRO-PRO-ASP-LEU-GLY-ALA-GLN-ARG-ARG-HIS-GLY-TRP-ASN-PRO-LYS-ASP-CYS-SER-GLU-ASN-ILE-GLU-VAL-LYS-GLU-GLY-GLY-LEU-TYR-PHE-GLU-ARG-ARG-PRO-VAL-ALA-GLN-SER-THR-ASP-GLY-ALA-ARG-GLY-LYS-ARG-GLY-TYR-SER-ARG-GLY-LEU-HIS-ALA-TRP-GLU-ILE-SER-TRP-PRO-LEU-GLU-GLN-ARG-GLY-THR-HIS-ALA-VAL-VAL-GLY-VAL-ALA-THR-ALA-LEU-ALA-PRO-LEU-GLN-THR-ASP-HIS-TYR-ALA-ALA-LEU-LEU-GLY-SER-ASN-SER-GLU-SER-TRP-GLY-TRP-ASP-ILE-GLY-ARG-GLY-LYS-LEU-TYR-HIS-GLN-SER-LYS-GLY-PRO-GLY-ALA-PRO-GLN-TYR-PRO-ALA-GLY-THR-GLN-GLY-GLU-GLN-LEU-GLU-VAL-PRO-GLU-ARG-LEU-LEU-VAL-VAL-LEU-ASP-MET-GLU-GLU-GLY-THR-LEU-GLY-TYR-ALA-ILE-GLY-GLY-THR-TYR-LEU-GLY-PRO-ALA-PHE-ARG-GLY-LEU-LYS-GLY-ARG-THR-LEU-TYR-PRO-ALA-VAL-SER-ALA-VAL-TRP-GLY-GLN-CYS-GLN-VAL-ARG-ILE-ARG-TYR-LEU-GLY-GLU-ARG-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS,ARG-GLY-ASP-ILE-ASN-ASN-ASN-VAL,209,8,CC[C@@H]([C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@]2(CCC[NH+]=C(N)N)ON2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)N)CC(=O)N)CC(=O)N)C(C)C)C,Kd=671nM,6.173277,6.17,1,A,A,1,A,A,0,,B,A,,1,1,209,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.848890483379364,0.8032551407814026,92.03996276855467,90.29878997802734,0.3740185797214508,0.6434457898139954,0.9319116473197936,0.8936458230018616,0.8050937056541443,0.7806574702262878,RGDINNNV,Low,"(6.097, 6.26]",train
5XUP,protein-peptide,P54274 Q8NA31,GLVAEAEAVAAGWMLDFLCLSLCRAFRDGRSEDFRRTRNSAEAIIHGLSSLTACQLRTIYICQFLTRIAAGKTLDAQFENDERITPLESALMIWGSIEKEHDKLHEEIQNLIKIQAIAVCMENGNFKEAEEVFERIFGDPNSHMPFKSKLLMIISQKDTFHSFFQHFSYNHMMEKIKSYVNYVLSEKSSTFLMKAAAKVVES,KILLTPRRRQRL,GLY-LEU-VAL-ALA-GLU-ALA-GLU-ALA-VAL-ALA-ALA-GLY-TRP-MET-LEU-ASP-PHE-LEU-CYS-LEU-SER-LEU-CYS-ARG-ALA-PHE-ARG-ASP-GLY-ARG-SER-GLU-ASP-PHE-ARG-ARG-THR-ARG-ASN-SER-ALA-GLU-ALA-ILE-ILE-HIS-GLY-LEU-SER-SER-LEU-THR-ALA-CYS-GLN-LEU-ARG-THR-ILE-TYR-ILE-CYS-GLN-PHE-LEU-THR-ARG-ILE-ALA-ALA-GLY-LYS-THR-LEU-ASP-ALA-GLN-PHE-GLU-ASN-ASP-GLU-ARG-ILE-THR-PRO-LEU-GLU-SER-ALA-LEU-MET-ILE-TRP-GLY-SER-ILE-GLU-LYS-GLU-HIS-ASP-LYS-LEU-HIS-GLU-GLU-ILE-GLN-ASN-LEU-ILE-LYS-ILE-GLN-ALA-ILE-ALA-VAL-CYS-MET-GLU-ASN-GLY-ASN-PHE-LYS-GLU-ALA-GLU-GLU-VAL-PHE-GLU-ARG-ILE-PHE-GLY-ASP-PRO-ASN-SER-HIS-MET-PRO-PHE-LYS-SER-LYS-LEU-LEU-MET-ILE-ILE-SER-GLN-LYS-ASP-THR-PHE-HIS-SER-PHE-PHE-GLN-HIS-PHE-SER-TYR-ASN-HIS-MET-MET-GLU-LYS-ILE-LYS-SER-TYR-VAL-ASN-TYR-VAL-LEU-SER-GLU-LYS-SER-SER-THR-PHE-LEU-MET-LYS-ALA-ALA-ALA-LYS-VAL-VAL-GLU-SER,LYS-ILE-LEU-LEU-THR-PRO-ARG-ARG-ARG-GLN-ARG-LEU,202,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](O)C)CC(C)C)CC(C)C)[C@H](CC)C)[NH3+],Kd=5.6uM,5.251812,5.25,1,A,A,1,A,A,0,,C,A,,1,1,202,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9292626976966858,0.7401187419891357,89.81063079833984,84.17637634277344,0.349615216255188,0.8287156224250793,0.9234858751296996,0.8542097806930542,0.8956601023674011,0.7115960121154785,KILLTPRRRQRL,Low,"(5.222, 5.31]",val
5Y1U,protein-peptide,Q6ZN18 Q09028,MSYYHHHHHHDYDIPTTENLYFQGAMGSGIQMADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,KRRKLKNKRRRS,MET-SER-TYR-TYR-HIS-HIS-HIS-HIS-HIS-HIS-ASP-TYR-ASP-ILE-PRO-THR-THR-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ALA-MET-GLY-SER-GLY-ILE-GLN-MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,LYS-ARG-ARG-LYS-LEU-LYS-ASN-LYS-ARG-ARG-ARG-SER,456,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=7.6uM,5.119186,5.12,1,A,A,1,A,A,0,,C,A,,0,1,456,12,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.8557014465332031,0.6961020827293396,80.0605239868164,79.40164184570312,0.5158076286315918,1.1341933012008667,0.8446343541145325,0.803282618522644,0.786352813243866,0.6117411255836487,KRRKLKNKRRRS,Low,"(5.105, 5.222]",train
5Y20,protein-peptide,Q9FFF5 P68431,DTLCGSCGGNYTNDEFWICCDVCERWYHGKCVKITPAKAESIKQYKCPSCCT,ARTKQTA,ASP-THR-LEU-CYS-GLY-SER-CYS-GLY-GLY-ASN-TYR-THR-ASN-ASP-GLU-PHE-TRP-ILE-CYS-CYS-ASP-VAL-CYS-GLU-ARG-TRP-TYR-HIS-GLY-LYS-CYS-VAL-LYS-ILE-THR-PRO-ALA-LYS-ALA-GLU-SER-ILE-LYS-GLN-TYR-LYS-CYS-PRO-SER-CYS-CYS-THR,ALA-ARG-THR-M3L-GLN-THR-ALA,52,7,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=30.4uM,4.517126,4.52,1,A,A,1,A,A,0,,P,A,,1,1,52,7,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.913802444934845,0.851088285446167,95.67173767089844,88.97386169433594,0.350132554769516,0.4770634174346924,0.8551727533340454,0.8787729740142822,0.854307234287262,0.8441670536994934,ARTKQTA,Low,"(4.456, 4.606]",val
5Y24,protein-peptide,O64094,MELIRIAMKKDLENDNSLMNKWATVAGLKNPNPLYDFLNHDGKTFNEFSSIVNIVKSQYPDREYELMKDYCLNLDVKTKAARSALEYADANMFFEIEDVLIDSMISCSNMKSKEYGKVYKIHRELSNSVITEFEAVKRLGKLNIKTPEMNSFSRLLLLYHYLSTGNFSPMAQLIKQIDLSEISENMYIRNTYQTRVHVLMSNIKLNENSLEECREYSKKALESTNILRFQVFSYLTIGNSLLFSNYELAQENFLKGLSISVQNENYNMIFQQALCFLNNVWRKENKWINFESDSIMDLQEQAHCFINFNENSKAKEVLDKLDLLVHNDNELAMHYYLKGRLEQNKACFYSSIEYFKKSNDKFLIRLPLLELQKMGENQKLLELLLLLEHHHHHHHH,GMPRGA,MSE-GLU-LEU-ILE-ARG-ILE-ALA-MSE-LYS-LYS-ASP-LEU-GLU-ASN-ASP-ASN-SER-LEU-MSE-ASN-LYS-TRP-ALA-THR-VAL-ALA-GLY-LEU-LYS-ASN-PRO-ASN-PRO-LEU-TYR-ASP-PHE-LEU-ASN-HIS-ASP-GLY-LYS-THR-PHE-ASN-GLU-PHE-SER-SER-ILE-VAL-ASN-ILE-VAL-LYS-SER-GLN-TYR-PRO-ASP-ARG-GLU-TYR-GLU-LEU-MSE-LYS-ASP-TYR-CYS-LEU-ASN-LEU-ASP-VAL-LYS-THR-LYS-ALA-ALA-ARG-SER-ALA-LEU-GLU-TYR-ALA-ASP-ALA-ASN-MSE-PHE-PHE-GLU-ILE-GLU-ASP-VAL-LEU-ILE-ASP-SER-MSE-ILE-SER-CYS-SER-ASN-MSE-LYS-SER-LYS-GLU-TYR-GLY-LYS-VAL-TYR-LYS-ILE-HIS-ARG-GLU-LEU-SER-ASN-SER-VAL-ILE-THR-GLU-PHE-GLU-ALA-VAL-LYS-ARG-LEU-GLY-LYS-LEU-ASN-ILE-LYS-THR-PRO-GLU-MSE-ASN-SER-PHE-SER-ARG-LEU-LEU-LEU-LEU-TYR-HIS-TYR-LEU-SER-THR-GLY-ASN-PHE-SER-PRO-MSE-ALA-GLN-LEU-ILE-LYS-GLN-ILE-ASP-LEU-SER-GLU-ILE-SER-GLU-ASN-MSE-TYR-ILE-ARG-ASN-THR-TYR-GLN-THR-ARG-VAL-HIS-VAL-LEU-MSE-SER-ASN-ILE-LYS-LEU-ASN-GLU-ASN-SER-LEU-GLU-GLU-CYS-ARG-GLU-TYR-SER-LYS-LYS-ALA-LEU-GLU-SER-THR-ASN-ILE-LEU-ARG-PHE-GLN-VAL-PHE-SER-TYR-LEU-THR-ILE-GLY-ASN-SER-LEU-LEU-PHE-SER-ASN-TYR-GLU-LEU-ALA-GLN-GLU-ASN-PHE-LEU-LYS-GLY-LEU-SER-ILE-SER-VAL-GLN-ASN-GLU-ASN-TYR-ASN-MSE-ILE-PHE-GLN-GLN-ALA-LEU-CYS-PHE-LEU-ASN-ASN-VAL-TRP-ARG-LYS-GLU-ASN-LYS-TRP-ILE-ASN-PHE-GLU-SER-ASP-SER-ILE-MSE-ASP-LEU-GLN-GLU-GLN-ALA-HIS-CYS-PHE-ILE-ASN-PHE-ASN-GLU-ASN-SER-LYS-ALA-LYS-GLU-VAL-LEU-ASP-LYS-LEU-ASP-LEU-LEU-VAL-HIS-ASN-ASP-ASN-GLU-LEU-ALA-MSE-HIS-TYR-TYR-LEU-LYS-GLY-ARG-LEU-GLU-GLN-ASN-LYS-ALA-CYS-PHE-TYR-SER-SER-ILE-GLU-TYR-PHE-LYS-LYS-SER-ASN-ASP-LYS-PHE-LEU-ILE-ARG-LEU-PRO-LEU-LEU-GLU-LEU-GLN-LYS-MSE-GLY-GLU-ASN-GLN-LYS-LEU-LEU-GLU-LEU-LEU-LEU-LEU-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS,GLY-MET-PRO-ARG-GLY-ALA,396,6,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)NC(=O)C[NH3+],Kd=4.6nM,8.337242,8.34,1,A,A,1,A,A,0,,C,A,,1,1,396,6,0,CSCC[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.9795379638671876,0.946613609790802,87.1900405883789,84.88691711425781,0.3475761711597442,0.4256344437599182,0.9235256910324096,0.9125226140022278,0.9686654210090636,0.9361969232559204,GMPRGA,Moderate,"(7.921, 8.383]",train
5Y59,protein-peptide,Q04437,SSESTTFIVDVSPSMMKNNNVSKSMAYLEYTLLNKSKKSRKTDWISCYLANCPVSENSQEIPNVFQIQSFLAPVTTTATIGFIKRLKQYCDQHSHDSSNEGLQSMIQCLLVVSLDIKQQFQARKILKQIVVFTDNLDDLDITDEEIDLLTEELSTRIILIDCGKDTQEERKKSNWLKLVEAIPNSRIYNMNELLVEITS,NSKLLSLLRSKT,SER-SER-GLU-SER-THR-THR-PHE-ILE-VAL-ASP-VAL-SER-PRO-SER-MET-MET-LYS-ASN-ASN-ASN-VAL-SER-LYS-SER-MET-ALA-TYR-LEU-GLU-TYR-THR-LEU-LEU-ASN-LYS-SER-LYS-LYS-SER-ARG-LYS-THR-ASP-TRP-ILE-SER-CYS-TYR-LEU-ALA-ASN-CYS-PRO-VAL-SER-GLU-ASN-SER-GLN-GLU-ILE-PRO-ASN-VAL-PHE-GLN-ILE-GLN-SER-PHE-LEU-ALA-PRO-VAL-THR-THR-THR-ALA-THR-ILE-GLY-PHE-ILE-LYS-ARG-LEU-LYS-GLN-TYR-CYS-ASP-GLN-HIS-SER-HIS-ASP-SER-SER-ASN-GLU-GLY-LEU-GLN-SER-MET-ILE-GLN-CYS-LEU-LEU-VAL-VAL-SER-LEU-ASP-ILE-LYS-GLN-GLN-PHE-GLN-ALA-ARG-LYS-ILE-LEU-LYS-GLN-ILE-VAL-VAL-PHE-THR-ASP-ASN-LEU-ASP-ASP-LEU-ASP-ILE-THR-ASP-GLU-GLU-ILE-ASP-LEU-LEU-THR-GLU-GLU-LEU-SER-THR-ARG-ILE-ILE-LEU-ILE-ASP-CYS-GLY-LYS-ASP-THR-GLN-GLU-GLU-ARG-LYS-LYS-SER-ASN-TRP-LEU-LYS-LEU-VAL-GLU-ALA-ILE-PRO-ASN-SER-ARG-ILE-TYR-ASN-MET-ASN-GLU-LEU-LEU-VAL-GLU-ILE-THR-SER,ASN-SER-LYS-LEU-LEU-SER-LEU-LEU-ARG-SER-LYS-THR,199,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCC[NH3+])CO)CCC[NH+]=C(N)N)CC(C)C)CC(C)C)CO)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CO,Kd=5.1uM,5.29243,5.29,1,A,A,1,A,A,0,,C,B,,1,1,199,12,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8605560660362244,0.7003487348556519,81.26976013183594,58.54523468017578,0.5436287522315979,1.078327178955078,0.8590136170387268,0.7179164886474609,0.8253965973854065,0.6959567666053772,NSKLLSLLRSKT,Low,"(5.222, 5.31]",val
5YBA,protein-peptide,A2DT06 Q58HP2,GSMLKRPKTFFDISIRGDKVGKIVFELFNDIVPKTAENFRALCTGEKGIGKSGMPLSYKGTMFHRIIPQFMIQGGDFTRFNGTGGESIYGMKFDDENFKVKHDKPGLLSMANAGPNTNGSQFFITTVETPWLDGHHCVFGQVIEGMDIVKQIESCGTESGRPRAMCMVTDCGEMK,EYGPKWNK,GLY-SER-MET-LEU-LYS-ARG-PRO-LYS-THR-PHE-PHE-ASP-ILE-SER-ILE-ARG-GLY-ASP-LYS-VAL-GLY-LYS-ILE-VAL-PHE-GLU-LEU-PHE-ASN-ASP-ILE-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-ALA-LEU-CYS-THR-GLY-GLU-LYS-GLY-ILE-GLY-LYS-SER-GLY-MET-PRO-LEU-SER-TYR-LYS-GLY-THR-MET-PHE-HIS-ARG-ILE-ILE-PRO-GLN-PHE-MET-ILE-GLN-GLY-GLY-ASP-PHE-THR-ARG-PHE-ASN-GLY-THR-GLY-GLY-GLU-SER-ILE-TYR-GLY-MET-LYS-PHE-ASP-ASP-GLU-ASN-PHE-LYS-VAL-LYS-HIS-ASP-LYS-PRO-GLY-LEU-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-THR-THR-VAL-GLU-THR-PRO-TRP-LEU-ASP-GLY-HIS-HIS-CYS-VAL-PHE-GLY-GLN-VAL-ILE-GLU-GLY-MET-ASP-ILE-VAL-LYS-GLN-ILE-GLU-SER-CYS-GLY-THR-GLU-SER-GLY-ARG-PRO-ARG-ALA-MET-CYS-MET-VAL-THR-ASP-CYS-GLY-GLU-MET-LYS,GLU-TYR-GLY-PRO-LYS-TRP-ASN-LYS,175,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)[NH3+],Kd=16.81uM,4.774432,4.77,1,A,A,1,A,A,0,,B,A,,1,1,175,8,0,NCCCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.9598950743675232,0.8850691914558411,95.58287048339844,95.826904296875,0.3226650059223175,0.5437837839126587,0.9494510293006896,0.9292978048324584,0.9351837038993835,0.8740120530128479,EYGPKWNK,Low,"(4.745, 4.866]",val
5YBE,protein-peptide,Q9QXL2 Q6AXG6,GPGSEFEPEKEEIRERYELSEKMLSACNLLKYNIKDPKALASKDMRICLNTLQHDWFRVSSQKSAVPAMVGDYIAAFEAVSPDVLRYIINMADGNGNTALHYSVSHSNFQIVKLLLDADVCNVDHQNKAGYTPIMLAALAAVEAEKDMQVVEELFSCGDVNAKASQAGQTALMLAVSHGRIDMVKGLLACGADVNIQDDEGSTALMCASEHGHVEIVKLLLAQPGCNGHLEDNDGSTALSIALEAGHKDIAVLLYAHLNFSKAQSPSTPRLGRKTSPGPTHRGSFD,PKNKARRRTTTQMELLYAD,GLY-PRO-GLY-SER-GLU-PHE-GLU-PRO-GLU-LYS-GLU-GLU-ILE-ARG-GLU-ARG-TYR-GLU-LEU-SER-GLU-LYS-MET-LEU-SER-ALA-CYS-ASN-LEU-LEU-LYS-TYR-ASN-ILE-LYS-ASP-PRO-LYS-ALA-LEU-ALA-SER-LYS-ASP-MET-ARG-ILE-CYS-LEU-ASN-THR-LEU-GLN-HIS-ASP-TRP-PHE-ARG-VAL-SER-SER-GLN-LYS-SER-ALA-VAL-PRO-ALA-MET-VAL-GLY-ASP-TYR-ILE-ALA-ALA-PHE-GLU-ALA-VAL-SER-PRO-ASP-VAL-LEU-ARG-TYR-ILE-ILE-ASN-MET-ALA-ASP-GLY-ASN-GLY-ASN-THR-ALA-LEU-HIS-TYR-SER-VAL-SER-HIS-SER-ASN-PHE-GLN-ILE-VAL-LYS-LEU-LEU-LEU-ASP-ALA-ASP-VAL-CYS-ASN-VAL-ASP-HIS-GLN-ASN-LYS-ALA-GLY-TYR-THR-PRO-ILE-MET-LEU-ALA-ALA-LEU-ALA-ALA-VAL-GLU-ALA-GLU-LYS-ASP-MET-GLN-VAL-VAL-GLU-GLU-LEU-PHE-SER-CYS-GLY-ASP-VAL-ASN-ALA-LYS-ALA-SER-GLN-ALA-GLY-GLN-THR-ALA-LEU-MET-LEU-ALA-VAL-SER-HIS-GLY-ARG-ILE-ASP-MET-VAL-LYS-GLY-LEU-LEU-ALA-CYS-GLY-ALA-ASP-VAL-ASN-ILE-GLN-ASP-ASP-GLU-GLY-SER-THR-ALA-LEU-MET-CYS-ALA-SER-GLU-HIS-GLY-HIS-VAL-GLU-ILE-VAL-LYS-LEU-LEU-LEU-ALA-GLN-PRO-GLY-CYS-ASN-GLY-HIS-LEU-GLU-ASP-ASN-ASP-GLY-SER-THR-ALA-LEU-SER-ILE-ALA-LEU-GLU-ALA-GLY-HIS-LYS-ASP-ILE-ALA-VAL-LEU-LEU-TYR-ALA-HIS-LEU-ASN-PHE-SER-LYS-ALA-GLN-SER-PRO-SER-THR-PRO-ARG-LEU-GLY-ARG-LYS-THR-SER-PRO-GLY-PRO-THR-HIS-ARG-GLY-SER-PHE-ASP,PRO-LYS-ASN-LYS-ALA-ARG-ARG-ARG-THR-THR-THR-GLN-MET-GLU-LEU-LEU-TYR-ALA-ASP,286,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)Cc1ccc(cc1)O)CC(C)C)CC(C)C)CCC(=O)O)CCSC)CCC(=O)N)[C@H](O)C)[C@H](O)C)[C@H](O)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCCC[NH3+])CC(=O)N,Kd=0.58uM,6.236572,6.24,1,A,A,1,A,A,0,,B,A,,1,1,286,19,0,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9196856021881104,0.8604189157485962,81.67710876464844,80.37874603271484,0.427017331123352,0.8197128772735596,0.8237890601158142,0.8216875791549683,0.8186596632003784,0.778318464756012,PKNKARRRTTTQMELLYAD,Low,"(6.097, 6.26]",train
5YC1,protein-peptide,Q9BUZ4,QELQELRRELEELSVGSDGVLIWKIGSYGRRLQEAKAKPNLECFSPAFYTHKYGYKLQVSAFLNGNGSGEGTHLSLYIRVLPGAFDNLLEWPFARRVTFSLLDQSDPGLAKPQHVTETFHPDPNWKNFQKPGTWRGSLDESSLGFGYPKFISHQDIRKRNYVRDDAVFIRAAVELPRKILS,RLRAR,GLN-GLU-LEU-GLN-GLU-LEU-ARG-ARG-GLU-LEU-GLU-GLU-LEU-SER-VAL-GLY-SER-ASP-GLY-VAL-LEU-ILE-TRP-LYS-ILE-GLY-SER-TYR-GLY-ARG-ARG-LEU-GLN-GLU-ALA-LYS-ALA-LYS-PRO-ASN-LEU-GLU-CYS-PHE-SER-PRO-ALA-PHE-TYR-THR-HIS-LYS-TYR-GLY-TYR-LYS-LEU-GLN-VAL-SER-ALA-PHE-LEU-ASN-GLY-ASN-GLY-SER-GLY-GLU-GLY-THR-HIS-LEU-SER-LEU-TYR-ILE-ARG-VAL-LEU-PRO-GLY-ALA-PHE-ASP-ASN-LEU-LEU-GLU-TRP-PRO-PHE-ALA-ARG-ARG-VAL-THR-PHE-SER-LEU-LEU-ASP-GLN-SER-ASP-PRO-GLY-LEU-ALA-LYS-PRO-GLN-HIS-VAL-THR-GLU-THR-PHE-HIS-PRO-ASP-PRO-ASN-TRP-LYS-ASN-PHE-GLN-LYS-PRO-GLY-THR-TRP-ARG-GLY-SER-LEU-ASP-GLU-SER-SER-LEU-GLY-PHE-GLY-TYR-PRO-LYS-PHE-ILE-SER-HIS-GLN-ASP-ILE-ARG-LYS-ARG-ASN-TYR-VAL-ARG-ASP-ASP-ALA-VAL-PHE-ILE-ARG-ALA-ALA-VAL-GLU-LEU-PRO-ARG-LYS-ILE-LEU-SER,ARG-LEU-ARG-ALA-ARG,181,5,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(C)C)N,Kd=46.1uM,4.336299,4.34,1,A,A,1,A,A,0,,G,A,,0,1,181,5,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9467371702194214,0.8986179232597351,87.82099151611328,83.2542495727539,0.3641588687896728,0.5644381046295166,0.9108644127845764,0.870026171207428,0.9153827428817748,0.8781415820121765,RLRAR,Low,"(4.319, 4.456]",val
5YC2,protein-peptide,Q96TL7 O60158 Q12306,GPETHINLKVSDGSSEIFFKIKKTTPLRRLMEAFAKRQGKEMDSLRFLYDGIRIEADQTPEDLDMEDNDIIEAHRSLPAERNPLYKDDTLDHTPLIPKCRAQVIEFPDGPATFVRLKCTNPESKVPHFLMRMAKDSSISATSMFRSAFPKATQEEEDLEMRWIRDNLNPIEDKRVAGLWVPPADALALAKDYSMTPFINALLEASST,GPLDDEEAFEKQVTSSYS,GLY-PRO-GLU-THR-HIS-ILE-ASN-LEU-LYS-VAL-SER-ASP-GLY-SER-SER-GLU-ILE-PHE-PHE-LYS-ILE-LYS-LYS-THR-THR-PRO-LEU-ARG-ARG-LEU-MET-GLU-ALA-PHE-ALA-LYS-ARG-GLN-GLY-LYS-GLU-MET-ASP-SER-LEU-ARG-PHE-LEU-TYR-ASP-GLY-ILE-ARG-ILE-GLU-ALA-ASP-GLN-THR-PRO-GLU-ASP-LEU-ASP-MET-GLU-ASP-ASN-ASP-ILE-ILE-GLU-ALA-HIS-ARG-SER-LEU-PRO-ALA-GLU-ARG-ASN-PRO-LEU-TYR-LYS-ASP-ASP-THR-LEU-ASP-HIS-THR-PRO-LEU-ILE-PRO-LYS-CYS-ARG-ALA-GLN-VAL-ILE-GLU-PHE-PRO-ASP-GLY-PRO-ALA-THR-PHE-VAL-ARG-LEU-LYS-CYS-THR-ASN-PRO-GLU-SER-LYS-VAL-PRO-HIS-PHE-LEU-MET-ARG-MET-ALA-LYS-ASP-SER-SER-ILE-SER-ALA-THR-SER-MET-PHE-ARG-SER-ALA-PHE-PRO-LYS-ALA-THR-GLN-GLU-GLU-GLU-ASP-LEU-GLU-MET-ARG-TRP-ILE-ARG-ASP-ASN-LEU-ASN-PRO-ILE-GLU-ASP-LYS-ARG-VAL-ALA-GLY-LEU-TRP-VAL-PRO-PRO-ALA-ASP-ALA-LEU-ALA-LEU-ALA-LYS-ASP-TYR-SER-MET-THR-PRO-PHE-ILE-ASN-ALA-LEU-LEU-GLU-ALA-SER-SER-THR,GLY-PRO-LEU-ASP-ASP-GLU-GLU-ALA-PHE-GLU-LYS-GLN-VAL-THR-SER-SER-TYR-SER,207,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@H](O)C)C(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CC(C)C)CC(=O)O)CC(=O)O)CCC(=O)O)CCC(=O)O)C)Cc1ccccc1)CCC(=O)O,Kd=11.4uM,4.943095,4.94,1,A,A,1,A,A,0,,B,A,,1,1,207,18,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O,0.7511808276176453,0.6266190409660339,73.06086730957031,67.12079620361328,0.54447340965271,1.3037405014038086,0.7915357947349548,0.7254307866096497,0.6910920739173889,0.6019161343574524,GPLDDEEAFEKQVTSSYS,Low,"(4.866, 5.014]",val
5YGD,protein-peptide,Q9VKM1 Q9VQ91,GSKPMEVYVSAVASPTKFWVQLIGPQSKKLASMVQEMTSYYSSAENRAKHVLTAPYVGQIVAAVFKFDEKWYRAEIVDIMPNQYNPKEQVIDLYFVDYGDSEYISPADICELRTDFLTLRFQAVECFLANVKSTIQTEPITWPKSSIAKFEELTEVAHWRKLIARVVTYKERPRATTAVSAAAKEGTPLPGVELFDPADNSELNIADLMITQGFALPLDDSYP,DQGRGRRRPLN,GLY-SER-LYS-PRO-MET-GLU-VAL-TYR-VAL-SER-ALA-VAL-ALA-SER-PRO-THR-LYS-PHE-TRP-VAL-GLN-LEU-ILE-GLY-PRO-GLN-SER-LYS-LYS-LEU-ALA-SER-MET-VAL-GLN-GLU-MET-THR-SER-TYR-TYR-SER-SER-ALA-GLU-ASN-ARG-ALA-LYS-HIS-VAL-LEU-THR-ALA-PRO-TYR-VAL-GLY-GLN-ILE-VAL-ALA-ALA-VAL-PHE-LYS-PHE-ASP-GLU-LYS-TRP-TYR-ARG-ALA-GLU-ILE-VAL-ASP-ILE-MET-PRO-ASN-GLN-TYR-ASN-PRO-LYS-GLU-GLN-VAL-ILE-ASP-LEU-TYR-PHE-VAL-ASP-TYR-GLY-ASP-SER-GLU-TYR-ILE-SER-PRO-ALA-ASP-ILE-CYS-GLU-LEU-ARG-THR-ASP-PHE-LEU-THR-LEU-ARG-PHE-GLN-ALA-VAL-GLU-CYS-PHE-LEU-ALA-ASN-VAL-LYS-SER-THR-ILE-GLN-THR-GLU-PRO-ILE-THR-TRP-PRO-LYS-SER-SER-ILE-ALA-LYS-PHE-GLU-GLU-LEU-THR-GLU-VAL-ALA-HIS-TRP-ARG-LYS-LEU-ILE-ALA-ARG-VAL-VAL-THR-TYR-LYS-GLU-ARG-PRO-ARG-ALA-THR-THR-ALA-VAL-SER-ALA-ALA-ALA-LYS-GLU-GLY-THR-PRO-LEU-PRO-GLY-VAL-GLU-LEU-PHE-ASP-PRO-ALA-ASP-ASN-SER-GLU-LEU-ASN-ILE-ALA-ASP-LEU-MET-ILE-THR-GLN-GLY-PHE-ALA-LEU-PRO-LEU-ASP-ASP-SER-TYR-PRO,ASP-GLN-GLY-ARG-GLY-ARG-2MR-ARG-PRO-LEU-ASN,223,11,CNC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(C)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC,Kd=0.054uM,7.267606,7.27,1,A,A,1,A,A,0,,D,A,,1,1,223,11,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CN=C(NC)NCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CN=C(NC)NCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9237188696861268,0.8940378427505493,92.34237670898438,90.62303924560548,0.3698095977306366,0.5610074400901794,0.9225343465805054,0.9183401465415956,0.8946346044540405,0.887962281703949,DQGRGRRRPLN,Moderate,"(7.049, 7.268]",train
5YGF,protein-peptide,Q9VKM1 Q9VQ91,GSKPMEVYVSAVASPTKFWVQLIGPQSKKLASMVQEMTSYYSSAENRAKHVLTAPYVGQIVAAVFKFDEKWYRAEIVDIMPNQYNPKEQVIDLYFVDYGDSEYISPADICELRTDFLTLRFQAVECFLANVKSTIQTEPITWPKSSIAKFEELTEVAHWRKLIARVVTYKERPRATTAVSAAAKEGTPLPGVELFDPADNSELNIADLMITQGFALPLDDSYP,DQGRGRRRP,GLY-SER-LYS-PRO-MET-GLU-VAL-TYR-VAL-SER-ALA-VAL-ALA-SER-PRO-THR-LYS-PHE-TRP-VAL-GLN-LEU-ILE-GLY-PRO-GLN-SER-LYS-LYS-LEU-ALA-SER-MET-VAL-GLN-GLU-MET-THR-SER-TYR-TYR-SER-SER-ALA-GLU-ASN-ARG-ALA-LYS-HIS-VAL-LEU-THR-ALA-PRO-TYR-VAL-GLY-GLN-ILE-VAL-ALA-ALA-VAL-PHE-LYS-PHE-ASP-GLU-LYS-TRP-TYR-ARG-ALA-GLU-ILE-VAL-ASP-ILE-MET-PRO-ASN-GLN-TYR-ASN-PRO-LYS-GLU-GLN-VAL-ILE-ASP-LEU-TYR-PHE-VAL-ASP-TYR-GLY-ASP-SER-GLU-TYR-ILE-SER-PRO-ALA-ASP-ILE-CYS-GLU-LEU-ARG-THR-ASP-PHE-LEU-THR-LEU-ARG-PHE-GLN-ALA-VAL-GLU-CYS-PHE-LEU-ALA-ASN-VAL-LYS-SER-THR-ILE-GLN-THR-GLU-PRO-ILE-THR-TRP-PRO-LYS-SER-SER-ILE-ALA-LYS-PHE-GLU-GLU-LEU-THR-GLU-VAL-ALA-HIS-TRP-ARG-LYS-LEU-ILE-ALA-ARG-VAL-VAL-THR-TYR-LYS-GLU-ARG-PRO-ARG-ALA-THR-THR-ALA-VAL-SER-ALA-ALA-ALA-LYS-GLU-GLY-THR-PRO-LEU-PRO-GLY-VAL-GLU-LEU-PHE-ASP-PRO-ALA-ASP-ASN-SER-GLU-LEU-ASN-ILE-ALA-ASP-LEU-MET-ILE-THR-GLN-GLY-PHE-ALA-LEU-PRO-LEU-ASP-ASP-SER-TYR-PRO,ASP-GLN-GLY-ARG-GLY-ARG-ARG-ARG-PRO,223,9,NC(=O)CC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@H](CC(=O)O)[NH3+],Kd=0.62uM,6.207608,6.21,1,A,A,1,A,A,0,,D,A,,1,1,223,9,0,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9111748337745668,0.8541884422302246,92.34400939941406,89.63138580322266,0.360012948513031,0.5953022837638855,0.929456889629364,0.904891848564148,0.8823586106300354,0.8415126204490662,DQGRGRRRP,Low,"(6.097, 6.26]",train
5YV5,protein-peptide,I6V0C7 Q8TZJ7,MGSSHHHHHHSSGLVPRGSHLEEDCVHRYGVNAFVLYRLPVVKEGMVVGIVGPNGTGKSTAVKILAGQLIPNLCGDNDSWDGVIRAFRGNELQNYFEKLKNGEIRPVVKPQYVDLIPKAVKGKVIELLKKADETGKLEEVVKALELENVLDREIQHLSGGELQRVAIAAALLRNATFYFFDEPSSYLDIRQRLNAARAIRRLSEEGKSVLVVEHDLAVLDYLSDIIHVVYGEPGVYGIFSQPKGTRNGINEFLRGYLKDENVRFRPYEIKFTKTGERVEIERETLVTYPRLVKDYGSFRLEVEPGEIKKGEVIGIVGPNGIGKTTFVKMLAGVEEPTEGKIEWDLTVAYKPQYIKADYEGTVYELLSKIDASKLNSNFYKTELLKPLGIIDLYDREVNELSGGELQRVAIAATLLRDADIYLLDEPSAYLDVEQRLAVSRAIRHLMEKNEKTALVVEHDVLMIDYVSDRLMVFEGEPGKYGRALPPMGMREGMNRFLASIGITFRRDPDTGRPRANKEGSVKDREQKEKGEYYYIA,EEEVSEEEALAGLSALFG,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-LEU-GLU-GLU-ASP-CYS-VAL-HIS-ARG-TYR-GLY-VAL-ASN-ALA-PHE-VAL-LEU-TYR-ARG-LEU-PRO-VAL-VAL-LYS-GLU-GLY-MET-VAL-VAL-GLY-ILE-VAL-GLY-PRO-ASN-GLY-THR-GLY-LYS-SER-THR-ALA-VAL-LYS-ILE-LEU-ALA-GLY-GLN-LEU-ILE-PRO-ASN-LEU-CYS-GLY-ASP-ASN-ASP-SER-TRP-ASP-GLY-VAL-ILE-ARG-ALA-PHE-ARG-GLY-ASN-GLU-LEU-GLN-ASN-TYR-PHE-GLU-LYS-LEU-LYS-ASN-GLY-GLU-ILE-ARG-PRO-VAL-VAL-LYS-PRO-GLN-TYR-VAL-ASP-LEU-ILE-PRO-LYS-ALA-VAL-LYS-GLY-LYS-VAL-ILE-GLU-LEU-LEU-LYS-LYS-ALA-ASP-GLU-THR-GLY-LYS-LEU-GLU-GLU-VAL-VAL-LYS-ALA-LEU-GLU-LEU-GLU-ASN-VAL-LEU-ASP-ARG-GLU-ILE-GLN-HIS-LEU-SER-GLY-GLY-GLU-LEU-GLN-ARG-VAL-ALA-ILE-ALA-ALA-ALA-LEU-LEU-ARG-ASN-ALA-THR-PHE-TYR-PHE-PHE-ASP-GLU-PRO-SER-SER-TYR-LEU-ASP-ILE-ARG-GLN-ARG-LEU-ASN-ALA-ALA-ARG-ALA-ILE-ARG-ARG-LEU-SER-GLU-GLU-GLY-LYS-SER-VAL-LEU-VAL-VAL-GLU-HIS-ASP-LEU-ALA-VAL-LEU-ASP-TYR-LEU-SER-ASP-ILE-ILE-HIS-VAL-VAL-TYR-GLY-GLU-PRO-GLY-VAL-TYR-GLY-ILE-PHE-SER-GLN-PRO-LYS-GLY-THR-ARG-ASN-GLY-ILE-ASN-GLU-PHE-LEU-ARG-GLY-TYR-LEU-LYS-ASP-GLU-ASN-VAL-ARG-PHE-ARG-PRO-TYR-GLU-ILE-LYS-PHE-THR-LYS-THR-GLY-GLU-ARG-VAL-GLU-ILE-GLU-ARG-GLU-THR-LEU-VAL-THR-TYR-PRO-ARG-LEU-VAL-LYS-ASP-TYR-GLY-SER-PHE-ARG-LEU-GLU-VAL-GLU-PRO-GLY-GLU-ILE-LYS-LYS-GLY-GLU-VAL-ILE-GLY-ILE-VAL-GLY-PRO-ASN-GLY-ILE-GLY-LYS-THR-THR-PHE-VAL-LYS-MET-LEU-ALA-GLY-VAL-GLU-GLU-PRO-THR-GLU-GLY-LYS-ILE-GLU-TRP-ASP-LEU-THR-VAL-ALA-TYR-LYS-PRO-GLN-TYR-ILE-LYS-ALA-ASP-TYR-GLU-GLY-THR-VAL-TYR-GLU-LEU-LEU-SER-LYS-ILE-ASP-ALA-SER-LYS-LEU-ASN-SER-ASN-PHE-TYR-LYS-THR-GLU-LEU-LEU-LYS-PRO-LEU-GLY-ILE-ILE-ASP-LEU-TYR-ASP-ARG-GLU-VAL-ASN-GLU-LEU-SER-GLY-GLY-GLU-LEU-GLN-ARG-VAL-ALA-ILE-ALA-ALA-THR-LEU-LEU-ARG-ASP-ALA-ASP-ILE-TYR-LEU-LEU-ASP-GLU-PRO-SER-ALA-TYR-LEU-ASP-VAL-GLU-GLN-ARG-LEU-ALA-VAL-SER-ARG-ALA-ILE-ARG-HIS-LEU-MET-GLU-LYS-ASN-GLU-LYS-THR-ALA-LEU-VAL-VAL-GLU-HIS-ASP-VAL-LEU-MET-ILE-ASP-TYR-VAL-SER-ASP-ARG-LEU-MET-VAL-PHE-GLU-GLY-GLU-PRO-GLY-LYS-TYR-GLY-ARG-ALA-LEU-PRO-PRO-MET-GLY-MET-ARG-GLU-GLY-MET-ASN-ARG-PHE-LEU-ALA-SER-ILE-GLY-ILE-THR-PHE-ARG-ARG-ASP-PRO-ASP-THR-GLY-ARG-PRO-ARG-ALA-ASN-LYS-GLU-GLY-SER-VAL-LYS-ASP-ARG-GLU-GLN-LYS-GLU-LYS-GLY-GLU-TYR-TYR-TYR-ILE-ALA,GLU-GLU-GLU-VAL-SER-GLU-GLU-GLU-ALA-LEU-ALA-GLY-LEU-SER-ALA-LEU-PHE-GLY,536,18,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccccc1)CC(C)C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)C)C)C)C)C)CC(C)C,Kd=3.9uM,5.408935,5.41,1,A,A,1,A,A,0,,B,A,,1,1,536,18,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,0.7237644791603088,0.6478696465492249,75.65565490722656,73.65924072265625,0.6166800260543823,1.2535662651062012,0.8287211656570435,0.796832799911499,0.6546552181243896,0.5896400213241577,EEEVSEEEALAGLSALFG,Low,"(5.31, 5.463]",train
5YVX,protein-peptide,Q2LAE1 P59226,ESAWVRCDDCFKWRRIPASVVGSIDESSRWICMNNSDKRFADCSKSQEMSNEEINAELGI,ARTKQTARK,GLU-SER-ALA-TRP-VAL-ARG-CYS-ASP-ASP-CYS-PHE-LYS-TRP-ARG-ARG-ILE-PRO-ALA-SER-VAL-VAL-GLY-SER-ILE-ASP-GLU-SER-SER-ARG-TRP-ILE-CYS-MET-ASN-ASN-SER-ASP-LYS-ARG-PHE-ALA-ASP-CYS-SER-LYS-SER-GLN-GLU-MET-SER-ASN-GLU-GLU-ILE-ASN-ALA-GLU-LEU-GLY-ILE,ALA-ARG-THR-MLZ-GLN-THR-ALA-ARG-LYS,60,9,C[NH2+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=1.29uM,5.88941,5.89,1,A,A,1,A,A,0,,C,A,,1,1,60,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CNCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.923659086227417,0.8358672857284546,97.24518585205078,89.19371795654297,0.3239333629608154,0.5803350210189819,0.8872972130775452,0.8706707954406738,0.8512277603149414,0.8271663784980774,ARTKQTARK,Low,"(5.821, 5.959]",train
5YY4,protein-peptide,P51681,EVQLQQSGAELVRPGTSVKMSCKAAGYTFTKYWIGWVKQRPGHGLEWIGDIHPGSFYSNYNEKFKGKATLTADTSSSTAYMQLSSLTSEDSAIYYCARDYYTNYGDWGQGTSVTVSSAGGGGSGGGGSGGGGSGGGGSDIVMTQAAPSVSVTPGESVSISCRSSKSLLHRNGNTYLFWFLQRPGQSPQLLIYRMSNLASGVPDRFSGSGSGTAFTLRISRVEAEDVGVYYCMQHLEYPYTFGSGTKLELKVR,DINYYTSEP,GLU-VAL-GLN-LEU-GLN-GLN-SER-GLY-ALA-GLU-LEU-VAL-ARG-PRO-GLY-THR-SER-VAL-LYS-MET-SER-CYS-LYS-ALA-ALA-GLY-TYR-THR-PHE-THR-LYS-TYR-TRP-ILE-GLY-TRP-VAL-LYS-GLN-ARG-PRO-GLY-HIS-GLY-LEU-GLU-TRP-ILE-GLY-ASP-ILE-HIS-PRO-GLY-SER-PHE-TYR-SER-ASN-TYR-ASN-GLU-LYS-PHE-LYS-GLY-LYS-ALA-THR-LEU-THR-ALA-ASP-THR-SER-SER-SER-THR-ALA-TYR-MET-GLN-LEU-SER-SER-LEU-THR-SER-GLU-ASP-SER-ALA-ILE-TYR-TYR-CYS-ALA-ARG-ASP-TYR-TYR-THR-ASN-TYR-GLY-ASP-TRP-GLY-GLN-GLY-THR-SER-VAL-THR-VAL-SER-SER-ALA-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-SER-ASP-ILE-VAL-MET-THR-GLN-ALA-ALA-PRO-SER-VAL-SER-VAL-THR-PRO-GLY-GLU-SER-VAL-SER-ILE-SER-CYS-ARG-SER-SER-LYS-SER-LEU-LEU-HIS-ARG-ASN-GLY-ASN-THR-TYR-LEU-PHE-TRP-PHE-LEU-GLN-ARG-PRO-GLY-GLN-SER-PRO-GLN-LEU-LEU-ILE-TYR-ARG-MET-SER-ASN-LEU-ALA-SER-GLY-VAL-PRO-ASP-ARG-PHE-SER-GLY-SER-GLY-SER-GLY-THR-ALA-PHE-THR-LEU-ARG-ILE-SER-ARG-VAL-GLU-ALA-GLU-ASP-VAL-GLY-VAL-TYR-TYR-CYS-MET-GLN-HIS-LEU-GLU-TYR-PRO-TYR-THR-PHE-GLY-SER-GLY-THR-LYS-LEU-GLU-LEU-LYS-VAL-ARG,ASP-ILE-ASN-TYS-TYS-THR-SER-GLU-PRO,252,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC(=O)O)CO)[C@H](O)C)Cc1ccc(cc1)OS(O)(O)O)Cc1ccc(cc1)OS(O)(O)O)CC(=O)N)[NH3+])C,Kd=370nM,6.431798,6.43,1,A,A,1,A,A,0,,B,A,,1,1,252,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)C(Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8923504948616028,0.8443979024887085,94.04688262939452,91.15262603759766,0.3515405356884002,0.5621188879013062,0.9305989146232604,0.9085260629653932,0.8612366318702698,0.8258856534957886,DINYYTSEP,Low,"(6.398, 6.523]",train
5YYZ,protein-peptide,P20050 P24719,MGSSHHHHHHSSGENLYFQHMGVAPAHLEVNVGGYNTEQTIPIVKHQLVKVGRNDKECQLVLTNPSISSVHCVFWCVFFDEDSIPMFYVKDCSLNGTYLNGLLLKRDKTYLLKHCDVIELSQGSEENDIKKTRLVFMINDD,QASIQPTQFVSNN,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-GLU-ASN-LEU-TYR-PHE-GLN-HIS-MET-GLY-VAL-ALA-PRO-ALA-HIS-LEU-GLU-VAL-ASN-VAL-GLY-GLY-TYR-ASN-THR-GLU-GLN-THR-ILE-PRO-ILE-VAL-LYS-HIS-GLN-LEU-VAL-LYS-VAL-GLY-ARG-ASN-ASP-LYS-GLU-CYS-GLN-LEU-VAL-LEU-THR-ASN-PRO-SER-ILE-SER-SER-VAL-HIS-CYS-VAL-PHE-TRP-CYS-VAL-PHE-PHE-ASP-GLU-ASP-SER-ILE-PRO-MET-PHE-TYR-VAL-LYS-ASP-CYS-SER-LEU-ASN-GLY-THR-TYR-LEU-ASN-GLY-LEU-LEU-LEU-LYS-ARG-ASP-LYS-THR-TYR-LEU-LEU-LYS-HIS-CYS-ASP-VAL-ILE-GLU-LEU-SER-GLN-GLY-SER-GLU-GLU-ASN-ASP-ILE-LYS-LYS-THR-ARG-LEU-VAL-PHE-MET-ILE-ASN-ASP-ASP,GLN-ALA-SER-ILE-GLN-PRO-TPO-GLN-PHE-VAL-SER-ASN-ASN,141,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccccc1)CCC(=O)N)CCC(=O)N)[NH3+])C,Kd=66.2uM,4.179142,4.18,1,A,A,1,A,A,0,,B,A,,1,1,141,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)OP(=O)(O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)OP(=O)(O)O,0.8486618995666504,0.7695242762565613,80.59974670410156,77.06423950195312,0.5078693628311157,0.8429687023162842,0.818695068359375,0.7636346817016602,0.7425171732902527,0.7089399695396423,QASIQPTQFVSNN,Low,"(4.155, 4.319]",train
5ZNP,protein-peptide,B9H0V2 P59226,SMAKAKAPRRTLDSYTVKPINKTVKPGDCVLMRPSDPSKPSYVAKIERIESDGRGPNVRVRVRWYYRPEESIGGRRQFHGSKEVFLSDHYDTQSADTIEGKCMVHSFKNYTKLDAVGNDDFFCRFEYNSSTGAFNPDRVAVYCKCEMPYNPDDLMVQCEGCSDWFHPACIEMSAEEAKRLDHFFCENCSSEGQKKLQNSHNTRQSDAKAETKRRRR,ARTKQTARKSTGGKA,SER-MET-ALA-LYS-ALA-LYS-ALA-PRO-ARG-ARG-THR-LEU-ASP-SER-TYR-THR-VAL-LYS-PRO-ILE-ASN-LYS-THR-VAL-LYS-PRO-GLY-ASP-CYS-VAL-LEU-MET-ARG-PRO-SER-ASP-PRO-SER-LYS-PRO-SER-TYR-VAL-ALA-LYS-ILE-GLU-ARG-ILE-GLU-SER-ASP-GLY-ARG-GLY-PRO-ASN-VAL-ARG-VAL-ARG-VAL-ARG-TRP-TYR-TYR-ARG-PRO-GLU-GLU-SER-ILE-GLY-GLY-ARG-ARG-GLN-PHE-HIS-GLY-SER-LYS-GLU-VAL-PHE-LEU-SER-ASP-HIS-TYR-ASP-THR-GLN-SER-ALA-ASP-THR-ILE-GLU-GLY-LYS-CYS-MET-VAL-HIS-SER-PHE-LYS-ASN-TYR-THR-LYS-LEU-ASP-ALA-VAL-GLY-ASN-ASP-ASP-PHE-PHE-CYS-ARG-PHE-GLU-TYR-ASN-SER-SER-THR-GLY-ALA-PHE-ASN-PRO-ASP-ARG-VAL-ALA-VAL-TYR-CYS-LYS-CYS-GLU-MET-PRO-TYR-ASN-PRO-ASP-ASP-LEU-MET-VAL-GLN-CYS-GLU-GLY-CYS-SER-ASP-TRP-PHE-HIS-PRO-ALA-CYS-ILE-GLU-MET-SER-ALA-GLU-GLU-ALA-LYS-ARG-LEU-ASP-HIS-PHE-PHE-CYS-GLU-ASN-CYS-SER-SER-GLU-GLY-GLN-LYS-LYS-LEU-GLN-ASN-SER-HIS-ASN-THR-ARG-GLN-SER-ASP-ALA-LYS-ALA-GLU-THR-LYS-ARG-ARG-ARG-ARG,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,216,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=20.6uM,4.686133,4.69,1,A,A,1,A,A,0,,P,A,dimer,1,1,216,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.7863521575927734,0.7207379937171936,75.56188201904297,75.19274139404297,0.5602986216545105,1.168496012687683,0.7757280468940735,0.7477754354476929,0.6726661920547485,0.63585364818573,ARTKQTARKSTGGKA,Low,"(4.606, 4.745]",train
5ZNR,protein-peptide,B9H0V2 P59226,SMAKAKAPRRTLDSYTVKPINKTVKPGDCVLMRPSDPSKPSYVAKIERIESDGRGPNVRVRVRWYYRPEESIGGRRQFHGSKEVFLSDHYDTQSADTIEGKCMVHSFKNYTKLDAVGNDDFFCRFEYNSSTGAFNPDRVAVYCKCEMPYNPDDLMVQCEGCSDWFHPACIEMSAEEAKRLDHFFCENCSSEGQKKLQNSHNTRQSDAKAETKRRRR,LATKAARKSAPATGGVK,SER-MET-ALA-LYS-ALA-LYS-ALA-PRO-ARG-ARG-THR-LEU-ASP-SER-TYR-THR-VAL-LYS-PRO-ILE-ASN-LYS-THR-VAL-LYS-PRO-GLY-ASP-CYS-VAL-LEU-MET-ARG-PRO-SER-ASP-PRO-SER-LYS-PRO-SER-TYR-VAL-ALA-LYS-ILE-GLU-ARG-ILE-GLU-SER-ASP-GLY-ARG-GLY-PRO-ASN-VAL-ARG-VAL-ARG-VAL-ARG-TRP-TYR-TYR-ARG-PRO-GLU-GLU-SER-ILE-GLY-GLY-ARG-ARG-GLN-PHE-HIS-GLY-SER-LYS-GLU-VAL-PHE-LEU-SER-ASP-HIS-TYR-ASP-THR-GLN-SER-ALA-ASP-THR-ILE-GLU-GLY-LYS-CYS-MET-VAL-HIS-SER-PHE-LYS-ASN-TYR-THR-LYS-LEU-ASP-ALA-VAL-GLY-ASN-ASP-ASP-PHE-PHE-CYS-ARG-PHE-GLU-TYR-ASN-SER-SER-THR-GLY-ALA-PHE-ASN-PRO-ASP-ARG-VAL-ALA-VAL-TYR-CYS-LYS-CYS-GLU-MET-PRO-TYR-ASN-PRO-ASP-ASP-LEU-MET-VAL-GLN-CYS-GLU-GLY-CYS-SER-ASP-TRP-PHE-HIS-PRO-ALA-CYS-ILE-GLU-MET-SER-ALA-GLU-GLU-ALA-LYS-ARG-LEU-ASP-HIS-PHE-PHE-CYS-GLU-ASN-CYS-SER-SER-GLU-GLY-GLN-LYS-LYS-LEU-GLN-ASN-SER-HIS-ASN-THR-ARG-GLN-SER-ASP-ALA-LYS-ALA-GLU-THR-LYS-ARG-ARG-ARG-ARG,LEU-ALA-THR-LYS-ALA-ALA-ARG-M3L-SER-ALA-PRO-ALA-THR-GLY-GLY-VAL-LYS,216,17,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])C(C)C)[C@H](O)C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCCC[NH3+])C)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=21.3uM,4.67162,4.67,1,A,A,1,A,A,0,,P,A,,1,1,216,17,0,CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)O,0.7437539100646973,0.7211098074913025,73.24459075927734,75.2085952758789,0.6469056010246277,1.1213444471359253,0.7626754641532898,0.7492215037345886,0.6209977269172668,0.635956883430481,LATKAARKSAPATGGVK,Low,"(4.606, 4.745]",train
5ZOO,protein-peptide,P56524 Q9Y618,AFTTGLVYDTLMLKHQCTCGSSSSHPEHAGRIQSIWSRLQETGLRGKCECIRGRKATLEELQTVHSEAHTLLYGTNPLNRQKLDSKKLLGSLASVFVRLPCGGVGVDSDTIWNEVHSAGAARLAVGCVVELVFKVATGELKNGFAVVRPPGHHAEESTPMGFCYFNSVAVAAKLLQQRLSVSKILIVDWDVHHGNGTQQAFYSDPSVLYMSLHRYDDGNFFPGSGAPDEVGTGPGVGFNVNMAFTGGLDPPMGDAEYLAAFRTVVMPIASEFAPDVVLVSSGFDAVEGHPTPLGGYNLSARCFGYLTKQLMGLAGGRIVLALEGGYDLTAICDASEACVSALLGNELDPLPEKVLQQRPNANAVRSMEKVMEIHSKYWRCLQRTTSTAGRSLIEAQTCENEEA,HIRGSITQGIPRSY,ALA-PHE-THR-THR-GLY-LEU-VAL-TYR-ASP-THR-LEU-MET-LEU-LYS-HIS-GLN-CYS-THR-CYS-GLY-SER-SER-SER-SER-HIS-PRO-GLU-HIS-ALA-GLY-ARG-ILE-GLN-SER-ILE-TRP-SER-ARG-LEU-GLN-GLU-THR-GLY-LEU-ARG-GLY-LYS-CYS-GLU-CYS-ILE-ARG-GLY-ARG-LYS-ALA-THR-LEU-GLU-GLU-LEU-GLN-THR-VAL-HIS-SER-GLU-ALA-HIS-THR-LEU-LEU-TYR-GLY-THR-ASN-PRO-LEU-ASN-ARG-GLN-LYS-LEU-ASP-SER-LYS-LYS-LEU-LEU-GLY-SER-LEU-ALA-SER-VAL-PHE-VAL-ARG-LEU-PRO-CYS-GLY-GLY-VAL-GLY-VAL-ASP-SER-ASP-THR-ILE-TRP-ASN-GLU-VAL-HIS-SER-ALA-GLY-ALA-ALA-ARG-LEU-ALA-VAL-GLY-CYS-VAL-VAL-GLU-LEU-VAL-PHE-LYS-VAL-ALA-THR-GLY-GLU-LEU-LYS-ASN-GLY-PHE-ALA-VAL-VAL-ARG-PRO-PRO-GLY-HIS-HIS-ALA-GLU-GLU-SER-THR-PRO-MET-GLY-PHE-CYS-TYR-PHE-ASN-SER-VAL-ALA-VAL-ALA-ALA-LYS-LEU-LEU-GLN-GLN-ARG-LEU-SER-VAL-SER-LYS-ILE-LEU-ILE-VAL-ASP-TRP-ASP-VAL-HIS-HIS-GLY-ASN-GLY-THR-GLN-GLN-ALA-PHE-TYR-SER-ASP-PRO-SER-VAL-LEU-TYR-MET-SER-LEU-HIS-ARG-TYR-ASP-ASP-GLY-ASN-PHE-PHE-PRO-GLY-SER-GLY-ALA-PRO-ASP-GLU-VAL-GLY-THR-GLY-PRO-GLY-VAL-GLY-PHE-ASN-VAL-ASN-MET-ALA-PHE-THR-GLY-GLY-LEU-ASP-PRO-PRO-MET-GLY-ASP-ALA-GLU-TYR-LEU-ALA-ALA-PHE-ARG-THR-VAL-VAL-MET-PRO-ILE-ALA-SER-GLU-PHE-ALA-PRO-ASP-VAL-VAL-LEU-VAL-SER-SER-GLY-PHE-ASP-ALA-VAL-GLU-GLY-HIS-PRO-THR-PRO-LEU-GLY-GLY-TYR-ASN-LEU-SER-ALA-ARG-CYS-PHE-GLY-TYR-LEU-THR-LYS-GLN-LEU-MET-GLY-LEU-ALA-GLY-GLY-ARG-ILE-VAL-LEU-ALA-LEU-GLU-GLY-GLY-TYR-ASP-LEU-THR-ALA-ILE-CYS-ASP-ALA-SER-GLU-ALA-CYS-VAL-SER-ALA-LEU-LEU-GLY-ASN-GLU-LEU-ASP-PRO-LEU-PRO-GLU-LYS-VAL-LEU-GLN-GLN-ARG-PRO-ASN-ALA-ASN-ALA-VAL-ARG-SER-MET-GLU-LYS-VAL-MET-GLU-ILE-HIS-SER-LYS-TYR-TRP-ARG-CYS-LEU-GLN-ARG-THR-THR-SER-THR-ALA-GLY-ARG-SER-LEU-ILE-GLU-ALA-GLN-THR-CYS-GLU-ASN-GLU-GLU-ALA,HIS-ILE-ARG-GLY-SER-ILE-THR-GLN-GLY-ILE-PRO-ARG-SER-TYR,403,14,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CO)CCC[NH+]=C(N)N)[C@H](CC)C)CCC(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC[NH+]=C(N)N)CO)C,Kd=2.23uM,5.651695,5.65,1,A,A,1,A,A,0,,A,G,,1,1,403,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O,0.7798483371734619,0.5933822989463806,83.96358489990234,82.21556854248047,0.482346773147583,1.0686064958572388,0.909565806388855,0.8300294876098633,0.726435661315918,0.5342205166816711,HIRGSITQGIPRSY,Low,"(5.6, 5.699]",train
5ZUJ,protein-peptide,Q96CG3 Q9Y4K3,MNGIYIWKIGNFGMHLKCQEEEKPVVIHSPGFYTGKPGYKLCMRLHLQLPTAQRCANYISLFVHTMQGEYDSHLPWPFQGTIRLTILDQSEAPVRQNHEEIMDAKPELLAFQRPTIPRNPKGFGYVTFMHLEALRQRTFIKDDTLLVRCEVSTLEHHHHHH,SSQSQSPTEDDENES,MET-ASN-GLY-ILE-TYR-ILE-TRP-LYS-ILE-GLY-ASN-PHE-GLY-MET-HIS-LEU-LYS-CYS-GLN-GLU-GLU-GLU-LYS-PRO-VAL-VAL-ILE-HIS-SER-PRO-GLY-PHE-TYR-THR-GLY-LYS-PRO-GLY-TYR-LYS-LEU-CYS-MET-ARG-LEU-HIS-LEU-GLN-LEU-PRO-THR-ALA-GLN-ARG-CYS-ALA-ASN-TYR-ILE-SER-LEU-PHE-VAL-HIS-THR-MET-GLN-GLY-GLU-TYR-ASP-SER-HIS-LEU-PRO-TRP-PRO-PHE-GLN-GLY-THR-ILE-ARG-LEU-THR-ILE-LEU-ASP-GLN-SER-GLU-ALA-PRO-VAL-ARG-GLN-ASN-HIS-GLU-GLU-ILE-MET-ASP-ALA-LYS-PRO-GLU-LEU-LEU-ALA-PHE-GLN-ARG-PRO-THR-ILE-PRO-ARG-ASN-PRO-LYS-GLY-PHE-GLY-TYR-VAL-THR-PHE-MET-HIS-LEU-GLU-ALA-LEU-ARG-GLN-ARG-THR-PHE-ILE-LYS-ASP-ASP-THR-LEU-LEU-VAL-ARG-CYS-GLU-VAL-SER-THR-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,SER-SER-GLN-SER-GLN-SER-PRO-THR-GLU-ASP-ASP-GLU-ASN-GLU-SER,161,15,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)O)CC(=O)N)CCC(=O)O)CC(=O)O)CC(=O)O)CCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)N,Kd=16.5uM,4.782516,4.78,1,A,A,1,A,A,0,,I,A,,1,1,161,15,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.938517689704895,0.8643388748168945,90.67538452148438,91.03347778320312,0.3368493020534515,0.5896507501602173,0.9287874102592468,0.9034411907196044,0.8876831531524658,0.8545632362365723,SSQSQSPTEDDENES,Low,"(4.745, 4.866]",train
6A6W,protein-peptide,O60158 Q09825,STENEKSRSLPAERNPLYKDDTLDHTPLIPKCRAQVIEFPDGPATFVRLKCTNPESKVPHFLMRMAKDSSISATSMFRSAFPKATQEEEDLEMRWIRDNLNPIEDKRVAGLWVPPADALALAKDYSMTPFINALLEASST,GPLSDNEEFENVVKNGH,SER-THR-GLU-ASN-GLU-LYS-SER-ARG-SER-LEU-PRO-ALA-GLU-ARG-ASN-PRO-LEU-TYR-LYS-ASP-ASP-THR-LEU-ASP-HIS-THR-PRO-LEU-ILE-PRO-LYS-CYS-ARG-ALA-GLN-VAL-ILE-GLU-PHE-PRO-ASP-GLY-PRO-ALA-THR-PHE-VAL-ARG-LEU-LYS-CYS-THR-ASN-PRO-GLU-SER-LYS-VAL-PRO-HIS-PHE-LEU-MET-ARG-MET-ALA-LYS-ASP-SER-SER-ILE-SER-ALA-THR-SER-MET-PHE-ARG-SER-ALA-PHE-PRO-LYS-ALA-THR-GLN-GLU-GLU-GLU-ASP-LEU-GLU-MET-ARG-TRP-ILE-ARG-ASP-ASN-LEU-ASN-PRO-ILE-GLU-ASP-LYS-ARG-VAL-ALA-GLY-LEU-TRP-VAL-PRO-PRO-ALA-ASP-ALA-LEU-ALA-LEU-ALA-LYS-ASP-TYR-SER-MET-THR-PRO-PHE-ILE-ASN-ALA-LEU-LEU-GLU-ALA-SER-SER-THR,GLY-PRO-LEU-SER-ASP-ASN-GLU-GLU-PHE-GLU-ASN-VAL-VAL-LYS-ASN-GLY-HIS,140,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1nc[nH]c1)CC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])CC(C)C)CO)CC(=O)O)CC(=O)N)CCC(=O)O)CCC(=O)O)Cc1ccccc1)CCC(=O)O)CC(=O)N,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,B,A,,1,1,140,17,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9658663272857666,0.7427552342414856,95.30829620361328,88.0306167602539,0.3279416859149933,0.8330274224281311,0.9304152727127076,0.8272132277488708,0.9070538878440856,0.7216407060623169,GPLSDNEEFENVVKNGH,Low,"(5.31, 5.463]",val
6AR2,protein-peptide,Q13188 Q14BN4,MPSALAIFTCRPNSHPFQERHVYLDEPIKIGRSVARCRPAQNNATFDCKVLSRNHALVWFDHKTGKFYLQDTKSSNGTFINSQRLSRGSEESPPCEILSGDIIQFGVDVTENTRKVTHGCIVSTIKLFLPDGMEARLRSD,EEEDGTMKRN,MET-PRO-SER-ALA-LEU-ALA-ILE-PHE-THR-CYS-ARG-PRO-ASN-SER-HIS-PRO-PHE-GLN-GLU-ARG-HIS-VAL-TYR-LEU-ASP-GLU-PRO-ILE-LYS-ILE-GLY-ARG-SER-VAL-ALA-ARG-CYS-ARG-PRO-ALA-GLN-ASN-ASN-ALA-THR-PHE-ASP-CYS-LYS-VAL-LEU-SER-ARG-ASN-HIS-ALA-LEU-VAL-TRP-PHE-ASP-HIS-LYS-THR-GLY-LYS-PHE-TYR-LEU-GLN-ASP-THR-LYS-SER-SER-ASN-GLY-THR-PHE-ILE-ASN-SER-GLN-ARG-LEU-SER-ARG-GLY-SER-GLU-GLU-SER-PRO-PRO-CYS-GLU-ILE-LEU-SER-GLY-ASP-ILE-ILE-GLN-PHE-GLY-VAL-ASP-VAL-THR-GLU-ASN-THR-ARG-LYS-VAL-THR-HIS-GLY-CYS-ILE-VAL-SER-THR-ILE-LYS-LEU-PHE-LEU-PRO-ASP-GLY-MET-GLU-ALA-ARG-LEU-ARG-SER-ASP,GLU-GLU-GLU-ASP-GLY-TPO-MET-LYS-ARG-ASN,140,10,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCCC[NH3+])NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)CNC(=O)[C@H](CC(=O)O)[NH3+],Kd=0.393uM,6.405607,6.41,1,A,A,1,A,A,0,,C,A,dimer,1,1,140,10,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)NC(C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)NC(C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O,0.9317520260810852,0.80937659740448,93.95597076416016,92.95992279052734,0.3235118091106415,0.6605333685874939,0.9343804717063904,0.8873612880706787,0.8894281387329102,0.7898803949356079,EEEDGTMKRN,Low,"(6.398, 6.523]",train
6AXJ,protein-peptide,P53930 P68431,GPLGSRIKTLSVSRPIIYGNTAKKMGSVKPPNAPAEHTHLWTIFVRGPQNEDISYFIKKVVFKLHDTYPNPVRSIEAPPFELTETGWGEFDINIKVYFVEEANEKVLNFYHRLRLHPYANPVPNSDNGNEQNTTDHNSKDAEVSSVYFDEIVFNEPNEEFFKILMSRPG,ATKAARKSAPA,GLY-PRO-LEU-GLY-SER-ARG-ILE-LYS-THR-LEU-SER-VAL-SER-ARG-PRO-ILE-ILE-TYR-GLY-ASN-THR-ALA-LYS-LYS-MET-GLY-SER-VAL-LYS-PRO-PRO-ASN-ALA-PRO-ALA-GLU-HIS-THR-HIS-LEU-TRP-THR-ILE-PHE-VAL-ARG-GLY-PRO-GLN-ASN-GLU-ASP-ILE-SER-TYR-PHE-ILE-LYS-LYS-VAL-VAL-PHE-LYS-LEU-HIS-ASP-THR-TYR-PRO-ASN-PRO-VAL-ARG-SER-ILE-GLU-ALA-PRO-PRO-PHE-GLU-LEU-THR-GLU-THR-GLY-TRP-GLY-GLU-PHE-ASP-ILE-ASN-ILE-LYS-VAL-TYR-PHE-VAL-GLU-GLU-ALA-ASN-GLU-LYS-VAL-LEU-ASN-PHE-TYR-HIS-ARG-LEU-ARG-LEU-HIS-PRO-TYR-ALA-ASN-PRO-VAL-PRO-ASN-SER-ASP-ASN-GLY-ASN-GLU-GLN-ASN-THR-THR-ASP-HIS-ASN-SER-LYS-ASP-ALA-GLU-VAL-SER-SER-VAL-TYR-PHE-ASP-GLU-ILE-VAL-PHE-ASN-GLU-PRO-ASN-GLU-GLU-PHE-PHE-LYS-ILE-LEU-MET-SER-ARG-PRO-GLY,ALA-THR-LYS-ALA-ALA-ARG-ALY-SER-ALA-PRO-ALA,169,11,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@H](CCCCNC(=O)C)[NH3+],Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,E,A,dimer,0,1,169,11,0,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.9292883276939392,0.8613473176956177,78.58365631103516,78.87332916259766,0.4404376447200775,0.696894109249115,0.8577770590782166,0.819713294506073,0.8291105628013611,0.7829984426498413,ATKAARKSAPA,Low,"(4.866, 5.014]",train
6B27,protein-peptide,Q6ZMT1 Q13698,SNANSYVALYKFLPQENNDLALQPGDRIMLVDDSNEDWWKGKIGDRVGFFPANFVQRVRPGENVWRCCQPFSGNKEQGYMSLKENQICVGVGRSKDADGFIRVSSGKKRGLVPVDALTEI,EDEPEIPLSPRPRP,SER-ASN-ALA-ASN-SER-TYR-VAL-ALA-LEU-TYR-LYS-PHE-LEU-PRO-GLN-GLU-ASN-ASN-ASP-LEU-ALA-LEU-GLN-PRO-GLY-ASP-ARG-ILE-MET-LEU-VAL-ASP-ASP-SER-ASN-GLU-ASP-TRP-TRP-LYS-GLY-LYS-ILE-GLY-ASP-ARG-VAL-GLY-PHE-PHE-PRO-ALA-ASN-PHE-VAL-GLN-ARG-VAL-ARG-PRO-GLY-GLU-ASN-VAL-TRP-ARG-CYS-CYS-GLN-PRO-PHE-SER-GLY-ASN-LYS-GLU-GLN-GLY-TYR-MET-SER-LEU-LYS-GLU-ASN-GLN-ILE-CYS-VAL-GLY-VAL-GLY-ARG-SER-LYS-ASP-ALA-ASP-GLY-PHE-ILE-ARG-VAL-SER-SER-GLY-LYS-LYS-ARG-GLY-LEU-VAL-PRO-VAL-ASP-ALA-LEU-THR-GLU-ILE,GLU-ASP-GLU-PRO-GLU-ILE-PRO-LEU-SER-PRO-ARG-PRO-ARG-PRO,120,14,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C/C=C/[NH+]=C(N)N)CO)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)C,Kd=9.3uM,5.031517,5.03,1,A,A,1,A,A,0,,G,A,,1,1,120,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.920779824256897,0.8711109757423401,95.4455337524414,90.57559204101562,0.3417999446392059,0.5349363684654236,0.9100909233093262,0.8955242037773132,0.8581535220146179,0.8650076389312744,EDEPEIPLSPRPRP,Low,"(5.014, 5.105]",train
6BGG,protein-peptide,Q14839 Q15059,GPLGSASASYDSEEEEEGLPMSYDEKRQLSLDINRLPGEKLGRVVHIIQSREPSLRDSNPDEIEIDFETLKPTTLRELERYVKSCLQKKQRKP,KVAPLKIKLGGF,GLY-PRO-LEU-GLY-SER-ALA-SER-ALA-SER-TYR-ASP-SER-GLU-GLU-GLU-GLU-GLU-GLY-LEU-PRO-MET-SER-TYR-ASP-GLU-LYS-ARG-GLN-LEU-SER-LEU-ASP-ILE-ASN-ARG-LEU-PRO-GLY-GLU-LYS-LEU-GLY-ARG-VAL-VAL-HIS-ILE-ILE-GLN-SER-ARG-GLU-PRO-SER-LEU-ARG-ASP-SER-ASN-PRO-ASP-GLU-ILE-GLU-ILE-ASP-PHE-GLU-THR-LEU-LYS-PRO-THR-THR-LEU-ARG-GLU-LEU-GLU-ARG-TYR-VAL-LYS-SER-CYS-LEU-GLN-LYS-LYS-GLN-ARG-LYS-PRO,LYS-VAL-ALA-PRO-LEU-LYS-ILE-LYS-LEU-GLY-GLY-PHE,93,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(C)C)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCC[NH3+])[NH3+])C)CC(C)C)CCCC[NH3+])C,Kd=95uM,4.022276,4.02,1,A,A,1,A,A,0,,A,B,,1,1,93,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9078349471092224,0.9422415494918824,90.35568237304688,85.48176574707031,0.4200818240642547,0.5531491041183472,0.8266580700874329,0.839807391166687,0.7614625096321106,0.8468822836875916,KVAPLKIKLGGF,Low,"(3.924, 4.155]",train
6BHH,protein-peptide,Q15047 P68431,MHHHHHHSSGRENLYFQGGELSKDGDLIVSMRILGKKRTKTWHKGTLIAIQTVGPGKKYKVKFDNKGKSLLSGNHIAYDYHPPADKLYVGSRVVAKYKDGNQVWLYAGIVAETPNVKNKLRFLIFFDDGYASYVTQSELYPICRPLKKTWEDIEDISCRDFIEEYVTAYPNRPMVLLKSGQLIKTEAEGTWWKSRVEEVDGSLVRILFLDDKRCEWIYRGSTRLEPMFSMKTSSASALE,KQTARKSTGGKAPRKQ,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-GLY-GLU-LEU-SER-LYS-ASP-GLY-ASP-LEU-ILE-VAL-SER-MET-ARG-ILE-LEU-GLY-LYS-LYS-ARG-THR-LYS-THR-TRP-HIS-LYS-GLY-THR-LEU-ILE-ALA-ILE-GLN-THR-VAL-GLY-PRO-GLY-LYS-LYS-TYR-LYS-VAL-LYS-PHE-ASP-ASN-LYS-GLY-LYS-SER-LEU-LEU-SER-GLY-ASN-HIS-ILE-ALA-TYR-ASP-TYR-HIS-PRO-PRO-ALA-ASP-LYS-LEU-TYR-VAL-GLY-SER-ARG-VAL-VAL-ALA-LYS-TYR-LYS-ASP-GLY-ASN-GLN-VAL-TRP-LEU-TYR-ALA-GLY-ILE-VAL-ALA-GLU-THR-PRO-ASN-VAL-LYS-ASN-LYS-LEU-ARG-PHE-LEU-ILE-PHE-PHE-ASP-ASP-GLY-TYR-ALA-SER-TYR-VAL-THR-GLN-SER-GLU-LEU-TYR-PRO-ILE-CYS-ARG-PRO-LEU-LYS-LYS-THR-TRP-GLU-ASP-ILE-GLU-ASP-ILE-SER-CYS-ARG-ASP-PHE-ILE-GLU-GLU-TYR-VAL-THR-ALA-TYR-PRO-ASN-ARG-PRO-MET-VAL-LEU-LEU-LYS-SER-GLY-GLN-LEU-ILE-LYS-THR-GLU-ALA-GLU-GLY-THR-TRP-TRP-LYS-SER-ARG-VAL-GLU-GLU-VAL-ASP-GLY-SER-LEU-VAL-ARG-ILE-LEU-PHE-LEU-ASP-ASP-LYS-ARG-CYS-GLU-TRP-ILE-TYR-ARG-GLY-SER-THR-ARG-LEU-GLU-PRO-MET-PHE-SER-MET-LYS-THR-SER-SER-ALA-SER-ALA-LEU-GLU,ACE-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN-NH2,239,18,CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)C)C)CCCCNC(=O)C)C)C,Kd=174uM,3.759451,3.76,1,A,A,1,A,A,0,,B,A,,1,1,239,18,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.8332690596580505,0.7597530484199524,81.30084991455078,79.24080657958984,0.4870595335960388,0.9716731309890748,0.8464292287826538,0.8104733228683472,0.7466456890106201,0.6947717070579529,KQTARKSTGGKAPRKQ,Low,"(3.548, 3.924]",train
6BNH,protein-peptide,Q6NYC1 O60885,SEEEDKCKPMSYEEKRQLSLDINKLPGEKLGRVVHIIQSREPSLKNSNPDEIEIDFETLKPSTLRELERYVTSCLRKKRKPQA,KWTLERLKRKYRN,SER-GLU-GLU-GLU-ASP-LYS-CYS-LYS-PRO-MET-SER-TYR-GLU-GLU-LYS-ARG-GLN-LEU-SER-LEU-ASP-ILE-ASN-LYS-LEU-PRO-GLY-GLU-LYS-LEU-GLY-ARG-VAL-VAL-HIS-ILE-ILE-GLN-SER-ARG-GLU-PRO-SER-LEU-LYS-ASN-SER-ASN-PRO-ASP-GLU-ILE-GLU-ILE-ASP-PHE-GLU-THR-LEU-LYS-PRO-SER-THR-LEU-ARG-GLU-LEU-GLU-ARG-TYR-VAL-THR-SER-CYS-LEU-ARG-LYS-LYS-ARG-LYS-PRO-GLN-ALA,LYS-TRP-THR-LEU-GLU-ARG-LEU-LYS-ARG-LYS-TYR-ARG-ASN,83,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])Cc1c[nH]c2c1cccc2)CC(C)C)CCC(=O)O)CCC[NH+]=C(N)N)CC(C)C,Kd=158uM,3.801343,3.8,1,A,A,1,A,A,0,,B,A,,1,1,83,13,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.8967771530151367,0.7718662619590759,94.49305725097656,83.8188705444336,0.3991366028785705,0.7189322113990784,0.8545220494270325,0.806023895740509,0.809684693813324,0.7482666373252869,KWTLERLKRKYRN,Low,"(3.548, 3.924]",train
6C4U,protein-peptide,P22216 P01106,GENIVFRVISTTGQIPIRDFSADISQVLKEKRSIKKVWTFGRNPACDYHLGNILPVSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSYQLLSQGDEITVRTDPTGTILSLVIFINDKFKQSLEQNKVDR,KLLPTPPLS,GLY-GLU-ASN-ILE-VAL-PHE-ARG-VAL-ILE-SER-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-PHE-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-LEU-PRO-VAL-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-TYR-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-ARG-THR-ASP-PRO-THR-GLY-THR-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-SER-LEU-GLU-GLN-ASN-LYS-VAL-ASP-ARG,LYS-LEU-LEU-PRO-TPO-PRO-PRO-LEU-SER,134,9,CC(C[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)[NH3+])C,Kd=798nM,6.097997,6.1,1,A,A,1,A,A,0,,G,A,,1,1,134,9,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,0.811302125453949,0.7478851079940796,85.02195739746094,91.68864440917967,0.3597025871276855,0.6408057808876038,0.9231035709381104,0.8483989238739014,0.7440161108970642,0.7227566838264465,KLLPTPPLS,Low,"(6.097, 6.26]",train
6CDG,protein-peptide,Q8IVV7,GSGSKFRGHQKSKGNSYDVEVVLQHVDTGNSYLCGYLKIKGLTEEYPTLTTFFEGEIISKKHPFLTRKWDADEDVDRKHWGKFLAFYQYAKSFNSDDFDYEELKNGDYVFMRWKEQFLVPDHTIKDISGASFAGFYYICFQKSAASIEGYYYHRSSEWYQSLNLTHV,PGLWKS,GLY-SER-GLY-SER-LYS-PHE-ARG-GLY-HIS-GLN-LYS-SER-LYS-GLY-ASN-SER-TYR-ASP-VAL-GLU-VAL-VAL-LEU-GLN-HIS-VAL-ASP-THR-GLY-ASN-SER-TYR-LEU-CYS-GLY-TYR-LEU-LYS-ILE-LYS-GLY-LEU-THR-GLU-GLU-TYR-PRO-THR-LEU-THR-THR-PHE-PHE-GLU-GLY-GLU-ILE-ILE-SER-LYS-LYS-HIS-PRO-PHE-LEU-THR-ARG-LYS-TRP-ASP-ALA-ASP-GLU-ASP-VAL-ASP-ARG-LYS-HIS-TRP-GLY-LYS-PHE-LEU-ALA-PHE-TYR-GLN-TYR-ALA-LYS-SER-PHE-ASN-SER-ASP-ASP-PHE-ASP-TYR-GLU-GLU-LEU-LYS-ASN-GLY-ASP-TYR-VAL-PHE-MET-ARG-TRP-LYS-GLU-GLN-PHE-LEU-VAL-PRO-ASP-HIS-THR-ILE-LYS-ASP-ILE-SER-GLY-ALA-SER-PHE-ALA-GLY-PHE-TYR-TYR-ILE-CYS-PHE-GLN-LYS-SER-ALA-ALA-SER-ILE-GLU-GLY-TYR-TYR-TYR-HIS-ARG-SER-SER-GLU-TRP-TYR-GLN-SER-LEU-ASN-LEU-THR-HIS-VAL,PRO-GLY-LEU-TRP-LYS-SER,167,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCC[NH2+]1)CC(C)C,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,B,A,,1,1,167,6,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,0.9373353719711304,0.892261266708374,95.15264129638672,93.2284164428711,0.3528617918491363,0.4717311561107635,0.9285809993743896,0.9334526658058168,0.9178476929664612,0.8819633722305298,PGLWKS,Low,"(5.699, 5.821]",train
6CF6,protein-peptide,Q6PFX9 Q9NTX7,GKSALDLADPSAKAVLTGEYKKDELLEAARSGNEEKLMALLTPLNVNCHASDGRKSTPLHLAAGYNRVRIVQLLLQHGADVHAKDKGGLVPLHNACSYGHYEVTELLLKHGACVNAMDLWQFTPLHEAASKNRVEVCSLLLSHGADPTLVNCHGKSAVDMAPTPELRERLTYEFKGHSLLQAAREADLAKVKKTLALEIINFKQPQSHETALHCAVASLHPKRKQVAELLLRKGANVNEKNKDFMTPLHVAAERAHNDVMEVLHKHGAKMNALDSLGQTALHRAALAGHLQTCRLLLSYGSDPSIISLQGFTAAQMGNEAVQQILSESTPMRTSDVDYRLLEASKAGD,NLARESSADGADS,GLY-LYS-SER-ALA-LEU-ASP-LEU-ALA-ASP-PRO-SER-ALA-LYS-ALA-VAL-LEU-THR-GLY-GLU-TYR-LYS-LYS-ASP-GLU-LEU-LEU-GLU-ALA-ALA-ARG-SER-GLY-ASN-GLU-GLU-LYS-LEU-MET-ALA-LEU-LEU-THR-PRO-LEU-ASN-VAL-ASN-CYS-HIS-ALA-SER-ASP-GLY-ARG-LYS-SER-THR-PRO-LEU-HIS-LEU-ALA-ALA-GLY-TYR-ASN-ARG-VAL-ARG-ILE-VAL-GLN-LEU-LEU-LEU-GLN-HIS-GLY-ALA-ASP-VAL-HIS-ALA-LYS-ASP-LYS-GLY-GLY-LEU-VAL-PRO-LEU-HIS-ASN-ALA-CYS-SER-TYR-GLY-HIS-TYR-GLU-VAL-THR-GLU-LEU-LEU-LEU-LYS-HIS-GLY-ALA-CYS-VAL-ASN-ALA-MET-ASP-LEU-TRP-GLN-PHE-THR-PRO-LEU-HIS-GLU-ALA-ALA-SER-LYS-ASN-ARG-VAL-GLU-VAL-CYS-SER-LEU-LEU-LEU-SER-HIS-GLY-ALA-ASP-PRO-THR-LEU-VAL-ASN-CYS-HIS-GLY-LYS-SER-ALA-VAL-ASP-MET-ALA-PRO-THR-PRO-GLU-LEU-ARG-GLU-ARG-LEU-THR-TYR-GLU-PHE-LYS-GLY-HIS-SER-LEU-LEU-GLN-ALA-ALA-ARG-GLU-ALA-ASP-LEU-ALA-LYS-VAL-LYS-LYS-THR-LEU-ALA-LEU-GLU-ILE-ILE-ASN-PHE-LYS-GLN-PRO-GLN-SER-HIS-GLU-THR-ALA-LEU-HIS-CYS-ALA-VAL-ALA-SER-LEU-HIS-PRO-LYS-ARG-LYS-GLN-VAL-ALA-GLU-LEU-LEU-LEU-ARG-LYS-GLY-ALA-ASN-VAL-ASN-GLU-LYS-ASN-LYS-ASP-PHE-MET-THR-PRO-LEU-HIS-VAL-ALA-ALA-GLU-ARG-ALA-HIS-ASN-ASP-VAL-MET-GLU-VAL-LEU-HIS-LYS-HIS-GLY-ALA-LYS-MET-ASN-ALA-LEU-ASP-SER-LEU-GLY-GLN-THR-ALA-LEU-HIS-ARG-ALA-ALA-LEU-ALA-GLY-HIS-LEU-GLN-THR-CYS-ARG-LEU-LEU-LEU-SER-TYR-GLY-SER-ASP-PRO-SER-ILE-ILE-SER-LEU-GLN-GLY-PHE-THR-ALA-ALA-GLN-MET-GLY-ASN-GLU-ALA-VAL-GLN-GLN-ILE-LEU-SER-GLU-SER-THR-PRO-MET-ARG-THR-SER-ASP-VAL-ASP-TYR-ARG-LEU-LEU-GLU-ALA-SER-LYS-ALA-GLY-ASP,ASN-LEU-ALA-ARG-GLU-SER-SER-ALA-ASP-GLY-ALA-ASP-SER,348,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)O)C)CC(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCC[NH+]=C(N)N)CCC(=O)O)CO,Kd=5.8uM,5.236572,5.24,1,A,A,1,A,A,0,,C,A,,0,1,348,13,0,CC(C)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.881407618522644,0.764680027961731,75.50968933105469,75.29081726074219,0.4246861934661865,0.7915705442428589,0.8131932616233826,0.8011849522590637,0.8517159819602966,0.7322059869766235,NLARESSADGADS,Low,"(5.222, 5.31]",train
6CO4,protein-peptide,Q99460 Q16186,GPGSMTTSGALFPSLVPGSRGASNKYLVEFRAGKMSLKGTTVTPDKRKGLVYIQQTDDSLIHFCWKDRTSGNVEDDLIIFPDDCEFKRVPQCPSGRVYVLKFKAGSKRLFFWMQEPKTDQDEEHCRKVNEYLNNPPMPGALGASGSSGHELSAL,GPGSQEPEPPEPFEYIDD,GLY-PRO-GLY-SER-MET-THR-THR-SER-GLY-ALA-LEU-PHE-PRO-SER-LEU-VAL-PRO-GLY-SER-ARG-GLY-ALA-SER-ASN-LYS-TYR-LEU-VAL-GLU-PHE-ARG-ALA-GLY-LYS-MET-SER-LEU-LYS-GLY-THR-THR-VAL-THR-PRO-ASP-LYS-ARG-LYS-GLY-LEU-VAL-TYR-ILE-GLN-GLN-THR-ASP-ASP-SER-LEU-ILE-HIS-PHE-CYS-TRP-LYS-ASP-ARG-THR-SER-GLY-ASN-VAL-GLU-ASP-ASP-LEU-ILE-ILE-PHE-PRO-ASP-ASP-CYS-GLU-PHE-LYS-ARG-VAL-PRO-GLN-CYS-PRO-SER-GLY-ARG-VAL-TYR-VAL-LEU-LYS-PHE-LYS-ALA-GLY-SER-LYS-ARG-LEU-PHE-PHE-TRP-MET-GLN-GLU-PRO-LYS-THR-ASP-GLN-ASP-GLU-GLU-HIS-CYS-ARG-LYS-VAL-ASN-GLU-TYR-LEU-ASN-ASN-PRO-PRO-MET-PRO-GLY-ALA-LEU-GLY-ALA-SER-GLY-SER-SER-GLY-HIS-GLU-LEU-SER-ALA-LEU,GLY-PRO-GLY-SER-GLN-GLU-PRO-GLU-PRO-PRO-GLU-PRO-PHE-GLU-TYR-ILE-ASP-ASP,154,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O)Cc1ccccc1)CCC(=O)O)Cc1ccc(cc1)O)C,Kd=27nM,7.568636,7.57,1,A,A,1,A,A,0,,B,A,,1,1,154,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9705364108085632,0.9181056618690492,73.57066345214844,76.48619842529297,0.4972246289253235,0.6698697209358215,0.7563594579696655,0.7929651141166687,0.8205922842025757,0.8032869100570679,GPGSQEPEPPEPFEYIDD,Moderate,"(7.523, 7.921]",train
6D1U,protein-peptide,O60894 Q16602 Q7Z4H4,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFTTACQEANYGALLRELCLTQFQVDMEAVGETLWCDWGRTIRSYRELADCTWHMAEKLGCFWPNAEVDRFFLAVHGRYFRSCPISGRAVGSAGSAGSAEDSIQLGVTRNKIMTAQYECYQKIMQDPIQQAEGVYCNRTWDGWLCWNDVAAGTESMQLCPDYFQDFDPSEKVTKICDQDGNWFRHPASNRTWTNYTQCNVNTHEKVKTALNLFYLHHHHHH,GPAGRQDSAPVDPSSPHSY,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-THR-THR-ALA-CYS-GLN-GLU-ALA-ASN-TYR-GLY-ALA-LEU-LEU-ARG-GLU-LEU-CYS-LEU-THR-GLN-PHE-GLN-VAL-ASP-MET-GLU-ALA-VAL-GLY-GLU-THR-LEU-TRP-CYS-ASP-TRP-GLY-ARG-THR-ILE-ARG-SER-TYR-ARG-GLU-LEU-ALA-ASP-CYS-THR-TRP-HIS-MET-ALA-GLU-LYS-LEU-GLY-CYS-PHE-TRP-PRO-ASN-ALA-GLU-VAL-ASP-ARG-PHE-PHE-LEU-ALA-VAL-HIS-GLY-ARG-TYR-PHE-ARG-SER-CYS-PRO-ILE-SER-GLY-ARG-ALA-VAL-GLY-SER-ALA-GLY-SER-ALA-GLY-SER-ALA-GLU-ASP-SER-ILE-GLN-LEU-GLY-VAL-THR-ARG-ASN-LYS-ILE-MET-THR-ALA-GLN-TYR-GLU-CYS-TYR-GLN-LYS-ILE-MET-GLN-ASP-PRO-ILE-GLN-GLN-ALA-GLU-GLY-VAL-TYR-CYS-ASN-ARG-THR-TRP-ASP-GLY-TRP-LEU-CYS-TRP-ASN-ASP-VAL-ALA-ALA-GLY-THR-GLU-SER-MET-GLN-LEU-CYS-PRO-ASP-TYR-PHE-GLN-ASP-PHE-ASP-PRO-SER-GLU-LYS-VAL-THR-LYS-ILE-CYS-ASP-GLN-ASP-GLY-ASN-TRP-PHE-ARG-HIS-PRO-ALA-SER-ASN-ARG-THR-TRP-THR-ASN-TYR-THR-GLN-CYS-ASN-VAL-ASN-THR-HIS-GLU-LYS-VAL-LYS-THR-ALA-LEU-ASN-LEU-PHE-TYR-LEU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-PRO-ALA-GLY-ARG-GLN-ASP-SER-ALA-PRO-VAL-ASP-PRO-SER-SER-PRO-HIS-SER-TYR-NH2,593,20,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)CO)Cc1nc[nH]c1)CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CO)C)CC(=O)O,Ki=3.63uM,5.440093,5.44,1,A,A,1,A,A,0,,D,A,,1,1,593,20,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O,0.5637958645820618,0.6107668876647949,53.12076568603516,55.56730651855469,0.8833461999893188,1.444568753242493,0.6241259574890137,0.7073155641555786,0.5211397409439087,0.5866296887397766,GPAGRQDSAPVDPSSPHSY,Low,"(5.31, 5.463]",train
6DO3,protein-peptide,Q9Y6D0 Q9Y2U9,SMADGNEDLRADDLPGPAFESYESMELACPAERSGHVAVSDGRHMFVWGGYKSNQVRGLYDFYLPREELWIYNMETGRWKKINTEGDVPPSMSGSCAVCVDRVLYLFGGHHSRGNTNKFYMLDSRSTDRVLQWERIDCQGIPPSSKDKLGVWVYKNKLIFFGGYGYLPEDKVLGTFEFDETSFWNSSHPRGWNDHVHILDTETFTWSQPITTGKAPSPRAAHACATVGNRGFVFGGRYRDARMNDLHYLNLDTWEWNELIPQGICPVGRSWHSLTPVSSDHLFLFGGFTTDKQPLSDAWTYCISKNEWIQFNHPYTEKPRLWHTACASDEGEVIVFGGCANNLLVHHRAAHSNEILIFSVQPK,PPPMAGG,SER-MET-ALA-ASP-GLY-ASN-GLU-ASP-LEU-ARG-ALA-ASP-ASP-LEU-PRO-GLY-PRO-ALA-PHE-GLU-SER-TYR-GLU-SER-MET-GLU-LEU-ALA-CYS-PRO-ALA-GLU-ARG-SER-GLY-HIS-VAL-ALA-VAL-SER-ASP-GLY-ARG-HIS-MET-PHE-VAL-TRP-GLY-GLY-TYR-LYS-SER-ASN-GLN-VAL-ARG-GLY-LEU-TYR-ASP-PHE-TYR-LEU-PRO-ARG-GLU-GLU-LEU-TRP-ILE-TYR-ASN-MET-GLU-THR-GLY-ARG-TRP-LYS-LYS-ILE-ASN-THR-GLU-GLY-ASP-VAL-PRO-PRO-SER-MET-SER-GLY-SER-CYS-ALA-VAL-CYS-VAL-ASP-ARG-VAL-LEU-TYR-LEU-PHE-GLY-GLY-HIS-HIS-SER-ARG-GLY-ASN-THR-ASN-LYS-PHE-TYR-MET-LEU-ASP-SER-ARG-SER-THR-ASP-ARG-VAL-LEU-GLN-TRP-GLU-ARG-ILE-ASP-CYS-GLN-GLY-ILE-PRO-PRO-SER-SER-LYS-ASP-LYS-LEU-GLY-VAL-TRP-VAL-TYR-LYS-ASN-LYS-LEU-ILE-PHE-PHE-GLY-GLY-TYR-GLY-TYR-LEU-PRO-GLU-ASP-LYS-VAL-LEU-GLY-THR-PHE-GLU-PHE-ASP-GLU-THR-SER-PHE-TRP-ASN-SER-SER-HIS-PRO-ARG-GLY-TRP-ASN-ASP-HIS-VAL-HIS-ILE-LEU-ASP-THR-GLU-THR-PHE-THR-TRP-SER-GLN-PRO-ILE-THR-THR-GLY-LYS-ALA-PRO-SER-PRO-ARG-ALA-ALA-HIS-ALA-CYS-ALA-THR-VAL-GLY-ASN-ARG-GLY-PHE-VAL-PHE-GLY-GLY-ARG-TYR-ARG-ASP-ALA-ARG-MET-ASN-ASP-LEU-HIS-TYR-LEU-ASN-LEU-ASP-THR-TRP-GLU-TRP-ASN-GLU-LEU-ILE-PRO-GLN-GLY-ILE-CYS-PRO-VAL-GLY-ARG-SER-TRP-HIS-SER-LEU-THR-PRO-VAL-SER-SER-ASP-HIS-LEU-PHE-LEU-PHE-GLY-GLY-PHE-THR-THR-ASP-LYS-GLN-PRO-LEU-SER-ASP-ALA-TRP-THR-TYR-CYS-ILE-SER-LYS-ASN-GLU-TRP-ILE-GLN-PHE-ASN-HIS-PRO-TYR-THR-GLU-LYS-PRO-ARG-LEU-TRP-HIS-THR-ALA-CYS-ALA-SER-ASP-GLU-GLY-GLU-VAL-ILE-VAL-PHE-GLY-GLY-CYS-ALA-ASN-ASN-LEU-LEU-VAL-HIS-HIS-ARG-ALA-ALA-HIS-SER-ASN-GLU-ILE-LEU-ILE-PHE-SER-VAL-GLN-PRO-LYS,PRO-PRO-PRO-MET-ALA-GLY-GLY,363,7,CSCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1,IC50=0.0094uM,8.026872,8.03,1,A,A,1,A,A,0,,C,A,,1,1,363,7,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O,0.9174203276634216,0.9129868149757384,84.99949645996094,85.77005767822266,0.4442633390426636,0.5289823412895203,0.8784624338150024,0.8799266815185547,0.8747949600219727,0.8816512227058411,PPPMAGG,Moderate,"(7.921, 8.383]",val
6DO4,protein-peptide,Q9BQE4 Q9Y2U9,SMADGNEDLRADDLPGPAFESYESMELACPAERSGHVAVSDGRHMFVWGGYKSNQVRGLYDFYLPREELWIYNMETGRWKKINTEGDVPPSMSGSCAVCVDRVLYLFGGHHSRGNTNKFYMLDSRSTDRVLQWERIDCQGIPPSSKDKLGVWVYKNKLIFFGGYGYLPEDKVLGTFEFDETSFWNSSHPRGWNDHVHILDTETFTWSQPITTGKAPSPRAAHACATVGNRGFVFGGRYRDARMNDLHYLNLDTWEWNELIPQGICPVGRSWHSLTPVSSDHLFLFGGFTTDKQPLSDAWTYCISKNEWIQFNHPYTEKPRLWHTACASDEGEVIVFGGCANNLLVHHRAAHSNEILIFSVQPK,GPSSGG,SER-MET-ALA-ASP-GLY-ASN-GLU-ASP-LEU-ARG-ALA-ASP-ASP-LEU-PRO-GLY-PRO-ALA-PHE-GLU-SER-TYR-GLU-SER-MET-GLU-LEU-ALA-CYS-PRO-ALA-GLU-ARG-SER-GLY-HIS-VAL-ALA-VAL-SER-ASP-GLY-ARG-HIS-MET-PHE-VAL-TRP-GLY-GLY-TYR-LYS-SER-ASN-GLN-VAL-ARG-GLY-LEU-TYR-ASP-PHE-TYR-LEU-PRO-ARG-GLU-GLU-LEU-TRP-ILE-TYR-ASN-MET-GLU-THR-GLY-ARG-TRP-LYS-LYS-ILE-ASN-THR-GLU-GLY-ASP-VAL-PRO-PRO-SER-MET-SER-GLY-SER-CYS-ALA-VAL-CYS-VAL-ASP-ARG-VAL-LEU-TYR-LEU-PHE-GLY-GLY-HIS-HIS-SER-ARG-GLY-ASN-THR-ASN-LYS-PHE-TYR-MET-LEU-ASP-SER-ARG-SER-THR-ASP-ARG-VAL-LEU-GLN-TRP-GLU-ARG-ILE-ASP-CYS-GLN-GLY-ILE-PRO-PRO-SER-SER-LYS-ASP-LYS-LEU-GLY-VAL-TRP-VAL-TYR-LYS-ASN-LYS-LEU-ILE-PHE-PHE-GLY-GLY-TYR-GLY-TYR-LEU-PRO-GLU-ASP-LYS-VAL-LEU-GLY-THR-PHE-GLU-PHE-ASP-GLU-THR-SER-PHE-TRP-ASN-SER-SER-HIS-PRO-ARG-GLY-TRP-ASN-ASP-HIS-VAL-HIS-ILE-LEU-ASP-THR-GLU-THR-PHE-THR-TRP-SER-GLN-PRO-ILE-THR-THR-GLY-LYS-ALA-PRO-SER-PRO-ARG-ALA-ALA-HIS-ALA-CYS-ALA-THR-VAL-GLY-ASN-ARG-GLY-PHE-VAL-PHE-GLY-GLY-ARG-TYR-ARG-ASP-ALA-ARG-MET-ASN-ASP-LEU-HIS-TYR-LEU-ASN-LEU-ASP-THR-TRP-GLU-TRP-ASN-GLU-LEU-ILE-PRO-GLN-GLY-ILE-CYS-PRO-VAL-GLY-ARG-SER-TRP-HIS-SER-LEU-THR-PRO-VAL-SER-SER-ASP-HIS-LEU-PHE-LEU-PHE-GLY-GLY-PHE-THR-THR-ASP-LYS-GLN-PRO-LEU-SER-ASP-ALA-TRP-THR-TYR-CYS-ILE-SER-LYS-ASN-GLU-TRP-ILE-GLN-PHE-ASN-HIS-PRO-TYR-THR-GLU-LYS-PRO-ARG-LEU-TRP-HIS-THR-ALA-CYS-ALA-SER-ASP-GLU-GLY-GLU-VAL-ILE-VAL-PHE-GLY-GLY-CYS-ALA-ASN-ASN-LEU-LEU-VAL-HIS-HIS-ARG-ALA-ALA-HIS-SER-ASN-GLU-ILE-LEU-ILE-PHE-SER-VAL-GLN-PRO-LYS,GLY-PRO-SER-SER-GLY-GLY,363,6,OC[C@@H](C(=O)NCC(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])CO,IC50=0.021uM,7.677781,7.68,1,A,A,1,A,A,0,,C,A,,0,1,363,6,0,NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)O,O=C(O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1,O=C(O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1,0.905211329460144,0.949269473552704,84.7929916381836,85.7330322265625,0.4489806592464447,0.4871176779270172,0.8802353143692017,0.8773808479309082,0.8606422543525696,0.925919234752655,GPSSGG,Moderate,"(7.523, 7.921]",val
6DO5,protein-peptide,O94782 Q9Y2U9,SMADGNEDLRADDLPGPAFESYESMELACPAERSGHVAVSDGRHMFVWGGYKSNQVRGLYDFYLPREELWIYNMETGRWKKINTEGDVPPSMSGSCAVCVDRVLYLFGGHHSRGNTNKFYMLDSRSTDRVLQWERIDCQGIPPSSKDKLGVWVYKNKLIFFGGYGYLPEDKVLGTFEFDETSFWNSSHPRGWNDHVHILDTETFTWSQPITTGKAPSPRAAHACATVGNRGFVFGGRYRDARMNDLHYLNLDTWEWNELIPQGICPVGRSWHSLTPVSSDHLFLFGGFTTDKQPLSDAWTYCISKNEWIQFNHPYTEKPRLWHTACASDEGEVIVFGGCANNLLVHHRAAHSNEILIFSVQPK,IGLLGG,SER-MET-ALA-ASP-GLY-ASN-GLU-ASP-LEU-ARG-ALA-ASP-ASP-LEU-PRO-GLY-PRO-ALA-PHE-GLU-SER-TYR-GLU-SER-MET-GLU-LEU-ALA-CYS-PRO-ALA-GLU-ARG-SER-GLY-HIS-VAL-ALA-VAL-SER-ASP-GLY-ARG-HIS-MET-PHE-VAL-TRP-GLY-GLY-TYR-LYS-SER-ASN-GLN-VAL-ARG-GLY-LEU-TYR-ASP-PHE-TYR-LEU-PRO-ARG-GLU-GLU-LEU-TRP-ILE-TYR-ASN-MET-GLU-THR-GLY-ARG-TRP-LYS-LYS-ILE-ASN-THR-GLU-GLY-ASP-VAL-PRO-PRO-SER-MET-SER-GLY-SER-CYS-ALA-VAL-CYS-VAL-ASP-ARG-VAL-LEU-TYR-LEU-PHE-GLY-GLY-HIS-HIS-SER-ARG-GLY-ASN-THR-ASN-LYS-PHE-TYR-MET-LEU-ASP-SER-ARG-SER-THR-ASP-ARG-VAL-LEU-GLN-TRP-GLU-ARG-ILE-ASP-CYS-GLN-GLY-ILE-PRO-PRO-SER-SER-LYS-ASP-LYS-LEU-GLY-VAL-TRP-VAL-TYR-LYS-ASN-LYS-LEU-ILE-PHE-PHE-GLY-GLY-TYR-GLY-TYR-LEU-PRO-GLU-ASP-LYS-VAL-LEU-GLY-THR-PHE-GLU-PHE-ASP-GLU-THR-SER-PHE-TRP-ASN-SER-SER-HIS-PRO-ARG-GLY-TRP-ASN-ASP-HIS-VAL-HIS-ILE-LEU-ASP-THR-GLU-THR-PHE-THR-TRP-SER-GLN-PRO-ILE-THR-THR-GLY-LYS-ALA-PRO-SER-PRO-ARG-ALA-ALA-HIS-ALA-CYS-ALA-THR-VAL-GLY-ASN-ARG-GLY-PHE-VAL-PHE-GLY-GLY-ARG-TYR-ARG-ASP-ALA-ARG-MET-ASN-ASP-LEU-HIS-TYR-LEU-ASN-LEU-ASP-THR-TRP-GLU-TRP-ASN-GLU-LEU-ILE-PRO-GLN-GLY-ILE-CYS-PRO-VAL-GLY-ARG-SER-TRP-HIS-SER-LEU-THR-PRO-VAL-SER-SER-ASP-HIS-LEU-PHE-LEU-PHE-GLY-GLY-PHE-THR-THR-ASP-LYS-GLN-PRO-LEU-SER-ASP-ALA-TRP-THR-TYR-CYS-ILE-SER-LYS-ASN-GLU-TRP-ILE-GLN-PHE-ASN-HIS-PRO-TYR-THR-GLU-LYS-PRO-ARG-LEU-TRP-HIS-THR-ALA-CYS-ALA-SER-ASP-GLU-GLY-GLU-VAL-ILE-VAL-PHE-GLY-GLY-CYS-ALA-ASN-ASN-LEU-LEU-VAL-HIS-HIS-ARG-ALA-ALA-HIS-SER-ASN-GLU-ILE-LEU-ILE-PHE-SER-VAL-GLN-PRO-LYS,ILE-GLY-LEU-LEU-GLY-GLY,363,6,CC(C[C@@H](C(=O)NCC(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]([NH3+])C)CC(C)C)C,IC50=0.0695uM,7.158015,7.16,1,A,A,1,A,A,0,,C,A,,0,1,363,6,0,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CN)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CN)C(=O)O,0.980346381664276,0.9351139664649964,85.26750183105469,85.78780364990234,0.4033643901348114,0.5072352886199951,0.8935071229934692,0.8801037073135376,0.9512431025505066,0.907544195652008,IGLLGG,Moderate,"(7.049, 7.268]",train
6DRT,protein-peptide,P00970 P04525,MKLSKDTTALLKNFATINSGIMLKSGQFIMTRAVNGTTYAEANISDVIDFDVAIYDLNGFLGILSLVNDDAEISQSEDGNIKIADARSTIFWPAADPSTVVAPNKPIPFPVASAVTEIKAEDLQQLLRVSRGLQIDTIAITVKEGKIVINGFNKVEDSALTRVKYSLTLGDYDGENTFNFIINMANMKMQPGNYKLLLWAKGKQGAAKFEGEHANYVVALEADSTHDFLEHHHHHH,KKEPEGLDFLFDA,MET-LYS-LEU-SER-LYS-ASP-THR-THR-ALA-LEU-LEU-LYS-ASN-PHE-ALA-THR-ILE-ASN-SER-GLY-ILE-MET-LEU-LYS-SER-GLY-GLN-PHE-ILE-MET-THR-ARG-ALA-VAL-ASN-GLY-THR-THR-TYR-ALA-GLU-ALA-ASN-ILE-SER-ASP-VAL-ILE-ASP-PHE-ASP-VAL-ALA-ILE-TYR-ASP-LEU-ASN-GLY-PHE-LEU-GLY-ILE-LEU-SER-LEU-VAL-ASN-ASP-ASP-ALA-GLU-ILE-SER-GLN-SER-GLU-ASP-GLY-ASN-ILE-LYS-ILE-ALA-ASP-ALA-ARG-SER-THR-ILE-PHE-TRP-PRO-ALA-ALA-ASP-PRO-SER-THR-VAL-VAL-ALA-PRO-ASN-LYS-PRO-ILE-PRO-PHE-PRO-VAL-ALA-SER-ALA-VAL-THR-GLU-ILE-LYS-ALA-GLU-ASP-LEU-GLN-GLN-LEU-LEU-ARG-VAL-SER-ARG-GLY-LEU-GLN-ILE-ASP-THR-ILE-ALA-ILE-THR-VAL-LYS-GLU-GLY-LYS-ILE-VAL-ILE-ASN-GLY-PHE-ASN-LYS-VAL-GLU-ASP-SER-ALA-LEU-THR-ARG-VAL-LYS-TYR-SER-LEU-THR-LEU-GLY-ASP-TYR-ASP-GLY-GLU-ASN-THR-PHE-ASN-PHE-ILE-ILE-ASN-MET-ALA-ASN-MET-LYS-MET-GLN-PRO-GLY-ASN-TYR-LYS-LEU-LEU-LEU-TRP-ALA-LYS-GLY-LYS-GLN-GLY-ALA-ALA-LYS-PHE-GLU-GLY-GLU-HIS-ALA-ASN-TYR-VAL-VAL-ALA-LEU-GLU-ALA-ASP-SER-THR-HIS-ASP-PHE-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,LYS-LYS-GLU-PRO-GLU-GLY-LEU-ASP-PHE-LEU-PHE-ASP-ALA,236,13,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)[NH3+])CC(C)C)CC(=O)O)Cc1ccccc1)C,Kd=10.7uM,4.970616,4.97,1,A,A,1,A,A,0,,D,A,,1,1,236,13,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7994809150695801,0.6506292819976807,84.95881652832031,71.90016174316406,0.4827761650085449,1.0486966371536257,0.8619465827941895,0.7550163865089417,0.7311536073684692,0.603346049785614,KKEPEGLDFLFDA,Low,"(4.866, 5.014]",train
6.00E+49,protein-peptide,P07271 P15873,MGSSHHHHHHSQDPMLEAKFEEASLFKRIIDGFKDCVQLVNFQCKEDGIIAQAVDDSRVLLVSLEIGVEAFQEYRCDHPVTLGMDLTSLSKILRCGNNTDTLTLIADNTPDSIILLFEDTKKDRIAEYSLKLMDIDADFLKIEELQYDSTLSLPSSEFSKIVRDLSQLSDSINIMITKETIKFVADGDIGSGSVIIKPFVDMEHPETSIKLEMDQPVDLTFGAKYLLDIIKGSSLSDRVGIRLSSEAPALFQFDLKSGFLQFFLAPKFNDEE,NGIAAMLQRHSRKRFQL,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-MET-LEU-GLU-ALA-LYS-PHE-GLU-GLU-ALA-SER-LEU-PHE-LYS-ARG-ILE-ILE-ASP-GLY-PHE-LYS-ASP-CYS-VAL-GLN-LEU-VAL-ASN-PHE-GLN-CYS-LYS-GLU-ASP-GLY-ILE-ILE-ALA-GLN-ALA-VAL-ASP-ASP-SER-ARG-VAL-LEU-LEU-VAL-SER-LEU-GLU-ILE-GLY-VAL-GLU-ALA-PHE-GLN-GLU-TYR-ARG-CYS-ASP-HIS-PRO-VAL-THR-LEU-GLY-MET-ASP-LEU-THR-SER-LEU-SER-LYS-ILE-LEU-ARG-CYS-GLY-ASN-ASN-THR-ASP-THR-LEU-THR-LEU-ILE-ALA-ASP-ASN-THR-PRO-ASP-SER-ILE-ILE-LEU-LEU-PHE-GLU-ASP-THR-LYS-LYS-ASP-ARG-ILE-ALA-GLU-TYR-SER-LEU-LYS-LEU-MET-ASP-ILE-ASP-ALA-ASP-PHE-LEU-LYS-ILE-GLU-GLU-LEU-GLN-TYR-ASP-SER-THR-LEU-SER-LEU-PRO-SER-SER-GLU-PHE-SER-LYS-ILE-VAL-ARG-ASP-LEU-SER-GLN-LEU-SER-ASP-SER-ILE-ASN-ILE-MET-ILE-THR-LYS-GLU-THR-ILE-LYS-PHE-VAL-ALA-ASP-GLY-ASP-ILE-GLY-SER-GLY-SER-VAL-ILE-ILE-LYS-PRO-PHE-VAL-ASP-MET-GLU-HIS-PRO-GLU-THR-SER-ILE-LYS-LEU-GLU-MET-ASP-GLN-PRO-VAL-ASP-LEU-THR-PHE-GLY-ALA-LYS-TYR-LEU-LEU-ASP-ILE-ILE-LYS-GLY-SER-SER-LEU-SER-ASP-ARG-VAL-GLY-ILE-ARG-LEU-SER-SER-GLU-ALA-PRO-ALA-LEU-PHE-GLN-PHE-ASP-LEU-LYS-SER-GLY-PHE-LEU-GLN-PHE-PHE-LEU-ALA-PRO-LYS-PHE-ASN-ASP-GLU-GLU,ASN-GLY-ILE-ALA-ALA-MET-LEU-GLN-ARG-HIS-SER-ARG-LYS-ARG-PHE-GLN-LEU,272,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC(=O)N)Cc1ccccc1)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)CNC(=O)[C@H](CC(=O)N)[NH3+])C)C)CCSC)CC(C)C)CCC(=O)N)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CO)CCC[NH+]=C(N)N,Kd=19uM,4.721246,4.72,1,A,A,1,A,A,0,,D,A,,0,0,272,17,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,0.8486467003822327,0.6892171502113342,82.7075424194336,78.53086853027344,0.4779790043830871,0.9758979082107544,0.8733479380607605,0.8100168108940125,0.7819177508354187,0.633741557598114,NGIAAMLQRHSRKRFQL,Low,"(4.606, 4.745]",train
6.00E+83,protein-peptide,Q8IYH5 P68431,GPLGSVQHVGFKCDNCGIEPIQGVRWHCQDCPPEMSLDFCDSCSDCLHETDIHKEDHQLEPIYR,ARTKQTARKSTG,GLY-PRO-LEU-GLY-SER-VAL-GLN-HIS-VAL-GLY-PHE-LYS-CYS-ASP-ASN-CYS-GLY-ILE-GLU-PRO-ILE-GLN-GLY-VAL-ARG-TRP-HIS-CYS-GLN-ASP-CYS-PRO-PRO-GLU-MET-SER-LEU-ASP-PHE-CYS-ASP-SER-CYS-SER-ASP-CYS-LEU-HIS-GLU-THR-ASP-ILE-HIS-LYS-GLU-ASP-HIS-GLN-LEU-GLU-PRO-ILE-TYR-ARG,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,64,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=29uM,4.537602,4.54,1,A,A,1,A,A,0,,A,B,,0,0,64,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7573506832122803,0.7149210572242737,92.64312744140624,86.5865707397461,0.4314979612827301,0.7367919087409973,0.8217132091522217,0.7930033206939697,0.6425758004188538,0.6954004764556885,ARTKQTARKSTG,Low,"(4.456, 4.606]",val
6.00E+86,protein-peptide,Q8IYH5 P68431,GPLGSVQHVGFKCDNCGIEPIQGVRWHCQDCPPEMSLDFCDSCSDCLHETDIHKEDHQLEPIYR,ARTKQTAR,GLY-PRO-LEU-GLY-SER-VAL-GLN-HIS-VAL-GLY-PHE-LYS-CYS-ASP-ASN-CYS-GLY-ILE-GLU-PRO-ILE-GLN-GLY-VAL-ARG-TRP-HIS-CYS-GLN-ASP-CYS-PRO-PRO-GLU-MET-SER-LEU-ASP-PHE-CYS-ASP-SER-CYS-SER-ASP-CYS-LEU-HIS-GLU-THR-ASP-ILE-HIS-LYS-GLU-ASP-HIS-GLN-LEU-GLU-PRO-ILE-TYR-ARG,ALA-ARG-THR-ALY-GLN-THR-ALA-ARG,64,8,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCCNC(=O)C,Kd=8.2uM,5.086186,5.09,1,A,A,1,A,A,0,,A,B,,0,0,64,8,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.8144449591636658,0.7224087715148926,93.738037109375,87.33875274658203,0.3713340163230896,0.6948428750038147,0.864319384098053,0.8060827851295471,0.7325318455696106,0.7014902234077454,ARTKQTAR,Low,"(5.014, 5.105]",val
6E8K,protein-peptide,D3HJY4 P14784,GAMEAMQKNELNSKIPIIFGLINSYQIHNLLEQHNAKTKESKAVFLIRDSSTYPGLLTISYYCQEQDIVKHIRFGLTDKGWKTAPKPPHEPLKSDSPEIKEKYTLDKIKFERKMKQFINTAKKLFEQHIRAESFKTLIMELKIHEFNLEGLIKPTRSQASQEKHFTDYV,YFTYDPYSEEDPD,GLY-ALA-MET-GLU-ALA-MET-GLN-LYS-ASN-GLU-LEU-ASN-SER-LYS-ILE-PRO-ILE-ILE-PHE-GLY-LEU-ILE-ASN-SER-TYR-GLN-ILE-HIS-ASN-LEU-LEU-GLU-GLN-HIS-ASN-ALA-LYS-THR-LYS-GLU-SER-LYS-ALA-VAL-PHE-LEU-ILE-ARG-ASP-SER-SER-THR-TYR-PRO-GLY-LEU-LEU-THR-ILE-SER-TYR-TYR-CYS-GLN-GLU-GLN-ASP-ILE-VAL-LYS-HIS-ILE-ARG-PHE-GLY-LEU-THR-ASP-LYS-GLY-TRP-LYS-THR-ALA-PRO-LYS-PRO-PRO-HIS-GLU-PRO-LEU-LYS-SER-ASP-SER-PRO-GLU-ILE-LYS-GLU-LYS-TYR-THR-LEU-ASP-LYS-ILE-LYS-PHE-GLU-ARG-LYS-MET-LYS-GLN-PHE-ILE-ASN-THR-ALA-LYS-LYS-LEU-PHE-GLU-GLN-HIS-ILE-ARG-ALA-GLU-SER-PHE-LYS-THR-LEU-ILE-MET-GLU-LEU-LYS-ILE-HIS-GLU-PHE-ASN-LEU-GLU-GLY-LEU-ILE-LYS-PRO-THR-ARG-SER-GLN-ALA-SER-GLN-GLU-LYS-HIS-PHE-THR-ASP-TYR-VAL,TYR-PHE-THR-TYR-ASP-PRO-PTR-SER-GLU-GLU-ASP-PRO-ASP,169,13,OC[C@@H](C(=O)O)NC(=O)[C@H](Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H]1CCC[NH2+]1,Kd=0.91uM,6.040959,6.04,1,A,A,1,A,A,0,,B,A,,1,1,169,13,0,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7237441539764404,0.7886582612991333,53.32101058959961,67.91045379638672,1.055329203605652,0.8398961424827576,0.671690046787262,0.7959433794021606,0.6715103983879089,0.7868369221687317,YFTYDPYSEEDPD,Low,"(5.959, 6.097]",train
6EVN,protein-peptide,O15460,MHHHHHHMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEE,PPGPAGPPG,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-SER-VAL-ASP-ASP-CYS-PHE-GLY-MET-GLY-ARG-SER-ALA-TYR-ASN-GLU-GLY-ASP-TYR-TYR-HIS-THR-VAL-LEU-TRP-MET-GLU-GLN-VAL-LEU-LYS-GLN-LEU-ASP-ALA-GLY-GLU-GLU-ALA-THR-THR-THR-LYS-SER-GLN-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-PHE-GLN-LEU-GLY-ASP-LEU-HIS-ARG-ALA-LEU-GLU-LEU-THR-ARG-ARG-LEU-LEU-SER-LEU-ASP-PRO-SER-HIS-GLU-ARG-ALA-GLY-GLY-ASN-LEU-ARG-TYR-PHE-GLU-GLN-LEU-LEU-GLU-GLU-GLU,PRO-PRO-GLY-PRO-ALA-GLY-PRO-PRO-GLY,102,9,OC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)C,Kd=19.7uM,4.705534,4.71,1,A,A,1,A,A,0,,C,A,,1,1,102,9,0,C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)O,C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O,C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O,0.9808537364006042,0.890731155872345,94.60858154296876,93.17523956298828,0.2974388897418976,0.3824734091758728,0.9199622869491576,0.9067145586013794,0.900355875492096,0.8806079030036926,PPGPAGPPG,Low,"(4.606, 4.745]",train
6EVO,protein-peptide,O15460,MHHHHHHMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEE,PPGPRGPPG,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-SER-VAL-ASP-ASP-CYS-PHE-GLY-MET-GLY-ARG-SER-ALA-TYR-ASN-GLU-GLY-ASP-TYR-TYR-HIS-THR-VAL-LEU-TRP-MET-GLU-GLN-VAL-LEU-LYS-GLN-LEU-ASP-ALA-GLY-GLU-GLU-ALA-THR-THR-THR-LYS-SER-GLN-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-PHE-GLN-LEU-GLY-ASP-LEU-HIS-ARG-ALA-LEU-GLU-LEU-THR-ARG-ARG-LEU-LEU-SER-LEU-ASP-PRO-SER-HIS-GLU-ARG-ALA-GLY-GLY-ASN-LEU-ARG-TYR-PHE-GLU-GLN-LEU-LEU-GLU-GLU-GLU,PRO-PRO-GLY-PRO-ARG-GLY-PRO-PRO-GLY,102,9,OC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N,Kd=6.8uM,5.167491,5.17,1,A,A,1,A,A,0,,C,A,,1,1,102,9,0,N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O,N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O,0.9822741746902466,0.907310664653778,95.485107421875,93.07547760009766,0.2963827550411224,0.3962751030921936,0.9211527109146118,0.918647050857544,0.9018337726593018,0.8983491063117981,PPGPRGPPG,Low,"(5.105, 5.222]",train
6EVP,protein-peptide,O15460,MHHHHHHMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEE,PPGPEGPPG,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-SER-VAL-ASP-ASP-CYS-PHE-GLY-MET-GLY-ARG-SER-ALA-TYR-ASN-GLU-GLY-ASP-TYR-TYR-HIS-THR-VAL-LEU-TRP-MET-GLU-GLN-VAL-LEU-LYS-GLN-LEU-ASP-ALA-GLY-GLU-GLU-ALA-THR-THR-THR-LYS-SER-GLN-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-PHE-GLN-LEU-GLY-ASP-LEU-HIS-ARG-ALA-LEU-GLU-LEU-THR-ARG-ARG-LEU-LEU-SER-LEU-ASP-PRO-SER-HIS-GLU-ARG-ALA-GLY-GLY-ASN-LEU-ARG-TYR-PHE-GLU-GLN-LEU-LEU-GLU-GLU-GLU,PRO-PRO-GLY-PRO-GLU-GLY-PRO-PRO-GLY,102,9,OC(=O)CC[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC[NH2+]1,Kd=29.2uM,4.534617,4.53,1,A,A,1,A,A,0,,C,A,,1,1,102,9,0,O=C(O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)O,O=C(O)CNC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,O=C(O)CNC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,0.9816603064537048,0.8696593642234802,94.48307800292967,92.3865203857422,0.2971280515193939,0.4478290975093841,0.9195806980133056,0.8924493193626404,0.9014594554901124,0.8394520878791809,PPGPEGPPG,Low,"(4.456, 4.606]",train
6EZI,protein-peptide,Q16348 Q5T2W1,SMHKPKLCRLAKGENGYGFHLNAIRGLPGSFIKEVQKGGPADLAGLEDEDVIIEVNGVNVLDEPYEKVVDRIQSSGKNVTLLVCGKKAY,IKLETKKTKL,SER-MET-HIS-LYS-PRO-LYS-LEU-CYS-ARG-LEU-ALA-LYS-GLY-GLU-ASN-GLY-TYR-GLY-PHE-HIS-LEU-ASN-ALA-ILE-ARG-GLY-LEU-PRO-GLY-SER-PHE-ILE-LYS-GLU-VAL-GLN-LYS-GLY-GLY-PRO-ALA-ASP-LEU-ALA-GLY-LEU-GLU-ASP-GLU-ASP-VAL-ILE-ILE-GLU-VAL-ASN-GLY-VAL-ASN-VAL-LEU-ASP-GLU-PRO-TYR-GLU-LYS-VAL-VAL-ASP-ARG-ILE-GLN-SER-SER-GLY-LYS-ASN-VAL-THR-LEU-LEU-VAL-CYS-GLY-LYS-LYS-ALA-TYR,ILE-LYS-LEU-GLU-THR-LYS-LYS-THR-LYS-LEU,89,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCCC[NH3+])[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)C[NH3+])CC)CCCC[NH3+],Kd=4.9uM,5.309804,5.31,1,A,A,1,A,A,0,,B,A,,1,1,89,10,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O,0.9443913102149964,0.8690842390060425,96.81426239013672,93.4311981201172,0.3068709969520569,0.5172504186630249,0.9208273887634276,0.9015424251556396,0.8871509432792664,0.8609697222709656,IKLETKKTKL,Low,"(5.222, 5.31]",train
6F09,protein-peptide,P40818 P63104,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTS,KLKRSYSSPDITQ,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,LYS-LEU-LYS-ARG-SER-TYR-SEP-SER-PRO-ASP-ILE-THR-GLN,230,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO)Cc1ccc(cc1)O)COP(O)(O)O)CO)CC(=O)O)C,Kd=1.07uM,5.970616,5.97,1,A,A,1,A,A,0,,A,P,,1,1,230,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9268759489059448,0.8079321384429932,92.28739166259766,90.89608001708984,0.323517233133316,0.6820060014724731,0.9412544369697572,0.8971680998802185,0.8898451328277588,0.7856230735778809,KLKRSYSSPDITQ,Low,"(5.959, 6.097]",train
6F0Y,protein-peptide,Q07794 P32447,GAMGSIVSLLGIKVLNNPAKFTDPYEFEITFECLESLKHDLEWKLTYVGSSRSLDHDQELDSILVGPVPVGVNKFVFSADPPSAELIPASELVSVTVILLSCSYDGREFVRVGYYVNNEYDEEELRENPPAKVQVDHIVRNILAEKPRVTRFNIVWDNENEGDLYPPEQPGV,LAITMLKPRKKAKAL,GLY-ALA-MET-GLY-SER-ILE-VAL-SER-LEU-LEU-GLY-ILE-LYS-VAL-LEU-ASN-ASN-PRO-ALA-LYS-PHE-THR-ASP-PRO-TYR-GLU-PHE-GLU-ILE-THR-PHE-GLU-CYS-LEU-GLU-SER-LEU-LYS-HIS-ASP-LEU-GLU-TRP-LYS-LEU-THR-TYR-VAL-GLY-SER-SER-ARG-SER-LEU-ASP-HIS-ASP-GLN-GLU-LEU-ASP-SER-ILE-LEU-VAL-GLY-PRO-VAL-PRO-VAL-GLY-VAL-ASN-LYS-PHE-VAL-PHE-SER-ALA-ASP-PRO-PRO-SER-ALA-GLU-LEU-ILE-PRO-ALA-SER-GLU-LEU-VAL-SER-VAL-THR-VAL-ILE-LEU-LEU-SER-CYS-SER-TYR-ASP-GLY-ARG-GLU-PHE-VAL-ARG-VAL-GLY-TYR-TYR-VAL-ASN-ASN-GLU-TYR-ASP-GLU-GLU-GLU-LEU-ARG-GLU-ASN-PRO-PRO-ALA-LYS-VAL-GLN-VAL-ASP-HIS-ILE-VAL-ARG-ASN-ILE-LEU-ALA-GLU-LYS-PRO-ARG-VAL-THR-ARG-PHE-ASN-ILE-VAL-TRP-ASP-ASN-GLU-ASN-GLU-GLY-ASP-LEU-TYR-PRO-PRO-GLU-GLN-PRO-GLY-VAL,LEU-ALA-ILE-THR-MET-LEU-LYS-PRO-ARG-LYS-LYS-ALA-LYS-ALA-LEU,172,15,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)C)CCCC[NH3+])C)CCCC[NH3+])CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C)CCSC)CC(C)C,Kd=7.78uM,5.10902,5.11,1,A,A,1,A,A,0,,B,A,,1,1,172,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9714823365211488,0.8477522730827332,84.80807495117188,84.82695007324219,0.3862752616405487,0.7184371948242188,0.8968890905380249,0.8519365787506104,0.88652104139328,0.7885665893554688,LAITMLKPRKKAKAL,Low,"(5.105, 5.222]",train
6F55,protein-peptide,A0A1D5PXA5 Q1G1I6,MKVPGVRVRALYDYTGQEADELSFKAGEELMKISEEDEQGWCKGRLLTGHVGLYPANYVEKVGLAAA,TKGPAPNPPPILKVW,MET-LYS-VAL-PRO-GLY-VAL-ARG-VAL-ARG-ALA-LEU-TYR-ASP-TYR-THR-GLY-GLN-GLU-ALA-ASP-GLU-LEU-SER-PHE-LYS-ALA-GLY-GLU-GLU-LEU-MET-LYS-ILE-SER-GLU-GLU-ASP-GLU-GLN-GLY-TRP-CYS-LYS-GLY-ARG-LEU-LEU-THR-GLY-HIS-VAL-GLY-LEU-TYR-PRO-ALA-ASN-TYR-VAL-GLU-LYS-VAL-GLY-LEU-ALA-ALA-ALA,THR-LYS-GLY-PRO-ALA-PRO-ASN-PRO-PRO-PRO-ILE-LEU-LYS-VAL-TRP,67,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[NH3+])C)CC(=O)N)CC(C)C,Kd=68.6uM,4.163676,4.16,1,A,A,1,A,A,0,,B,A,,1,1,67,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C,0.89103102684021,0.7302836179733276,94.76576232910156,84.48516845703125,0.3519247174263,0.6307551264762878,0.8471160531044006,0.7889664173126221,0.7876805067062378,0.7156128883361816,TKGPAPNPPPILKVW,Low,"(4.155, 4.319]",train
6F6D,protein-peptide,O15054 P68431,MDVVRASRNAKVKGKFRESYLSPAQSVKPKINTEEKLPREKLNPPTPSIYLESKRDAFSPVLLQFCTDPRNPITVIRGLAGSLRLNLGLFSTKTLVEASGEHTVEVRTQVQQPSDENWDLTGTRQIWPCESSRSHTTIAKYAQYQASSFQESLQEEKESEDEESEEPDSTTGTPPSSAPDPKNHHIIKFGTNIDLSDAKRWKPQLQELLKLPAFMRVTSTGNMLSHVGHTILGMNTVQLYMKVPGSRTPGHQENNNFCSVNINIGPGDCEWFAVHEHYWETISAFCDRHGVDYLTGSWWPILDDLYASNIPVYRFVQRPGDLVWINAGTVHWVQATGWCNNIAWNVGPLTAYQYQLALERYEWNEVKNVKSIVPMIHVSWNVARTVKISDPDLFKMIKFCLLQSMKHCQVQRESLVRAGKKIAYQGRVKDEPAYYCNECDVEVFNILFVTSENGSRNTYLVHCEGCARRRSAGLQGVVVLEQYRTEELAQAYDAFTLAPASTSRHHHHHH,RIQLMTKAARKSAPATG,MET-ASP-VAL-VAL-ARG-ALA-SER-ARG-ASN-ALA-LYS-VAL-LYS-GLY-LYS-PHE-ARG-GLU-SER-TYR-LEU-SER-PRO-ALA-GLN-SER-VAL-LYS-PRO-LYS-ILE-ASN-THR-GLU-GLU-LYS-LEU-PRO-ARG-GLU-LYS-LEU-ASN-PRO-PRO-THR-PRO-SER-ILE-TYR-LEU-GLU-SER-LYS-ARG-ASP-ALA-PHE-SER-PRO-VAL-LEU-LEU-GLN-PHE-CYS-THR-ASP-PRO-ARG-ASN-PRO-ILE-THR-VAL-ILE-ARG-GLY-LEU-ALA-GLY-SER-LEU-ARG-LEU-ASN-LEU-GLY-LEU-PHE-SER-THR-LYS-THR-LEU-VAL-GLU-ALA-SER-GLY-GLU-HIS-THR-VAL-GLU-VAL-ARG-THR-GLN-VAL-GLN-GLN-PRO-SER-ASP-GLU-ASN-TRP-ASP-LEU-THR-GLY-THR-ARG-GLN-ILE-TRP-PRO-CYS-GLU-SER-SER-ARG-SER-HIS-THR-THR-ILE-ALA-LYS-TYR-ALA-GLN-TYR-GLN-ALA-SER-SER-PHE-GLN-GLU-SER-LEU-GLN-GLU-GLU-LYS-GLU-SER-GLU-ASP-GLU-GLU-SER-GLU-GLU-PRO-ASP-SER-THR-THR-GLY-THR-PRO-PRO-SER-SER-ALA-PRO-ASP-PRO-LYS-ASN-HIS-HIS-ILE-ILE-LYS-PHE-GLY-THR-ASN-ILE-ASP-LEU-SER-ASP-ALA-LYS-ARG-TRP-LYS-PRO-GLN-LEU-GLN-GLU-LEU-LEU-LYS-LEU-PRO-ALA-PHE-MET-ARG-VAL-THR-SER-THR-GLY-ASN-MET-LEU-SER-HIS-VAL-GLY-HIS-THR-ILE-LEU-GLY-MET-ASN-THR-VAL-GLN-LEU-TYR-MET-LYS-VAL-PRO-GLY-SER-ARG-THR-PRO-GLY-HIS-GLN-GLU-ASN-ASN-ASN-PHE-CYS-SER-VAL-ASN-ILE-ASN-ILE-GLY-PRO-GLY-ASP-CYS-GLU-TRP-PHE-ALA-VAL-HIS-GLU-HIS-TYR-TRP-GLU-THR-ILE-SER-ALA-PHE-CYS-ASP-ARG-HIS-GLY-VAL-ASP-TYR-LEU-THR-GLY-SER-TRP-TRP-PRO-ILE-LEU-ASP-ASP-LEU-TYR-ALA-SER-ASN-ILE-PRO-VAL-TYR-ARG-PHE-VAL-GLN-ARG-PRO-GLY-ASP-LEU-VAL-TRP-ILE-ASN-ALA-GLY-THR-VAL-HIS-TRP-VAL-GLN-ALA-THR-GLY-TRP-CYS-ASN-ASN-ILE-ALA-TRP-ASN-VAL-GLY-PRO-LEU-THR-ALA-TYR-GLN-TYR-GLN-LEU-ALA-LEU-GLU-ARG-TYR-GLU-TRP-ASN-GLU-VAL-LYS-ASN-VAL-LYS-SER-ILE-VAL-PRO-MET-ILE-HIS-VAL-SER-TRP-ASN-VAL-ALA-ARG-THR-VAL-LYS-ILE-SER-ASP-PRO-ASP-LEU-PHE-LYS-MET-ILE-LYS-PHE-CYS-LEU-LEU-GLN-SER-MET-LYS-HIS-CYS-GLN-VAL-GLN-ARG-GLU-SER-LEU-VAL-ARG-ALA-GLY-LYS-LYS-ILE-ALA-TYR-GLN-GLY-ARG-VAL-LYS-ASP-GLU-PRO-ALA-TYR-TYR-CYS-ASN-GLU-CYS-ASP-VAL-GLU-VAL-PHE-ASN-ILE-LEU-PHE-VAL-THR-SER-GLU-ASN-GLY-SER-ARG-ASN-THR-TYR-LEU-VAL-HIS-CYS-GLU-GLY-CYS-ALA-ARG-ARG-ARG-SER-ALA-GLY-LEU-GLN-GLY-VAL-VAL-VAL-LEU-GLU-GLN-TYR-ARG-THR-GLU-GLU-LEU-ALA-GLN-ALA-TYR-ASP-ALA-PHE-THR-LEU-ALA-PRO-ALA-SER-THR-SER-ARG-HIS-HIS-HIS-HIS-HIS-HIS,ARG-ILE-GLN-LEU-MET-THR-LYS-ALA-ALA-ARG-LYS-SER-ALA-PRO-ALA-THR-GLY,510,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)C)C)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC(=O)N)CC(C)C)CCSC,IC50=79.4uM,4.100179,4.1,1,A,A,1,A,A,0,,B,A,,1,1,510,17,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.8737844228744507,0.7463722825050354,77.67959594726562,76.55406188964844,0.627306342124939,1.034312129020691,0.8481486439704895,0.8239409923553467,0.8149656653404236,0.6804114580154419,RIQLMTKAARKSAPATG,Low,"(3.924, 4.155]",train
6FBW,protein-peptide,P31947 P10636,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,RTPSLPG,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,ARG-THR-PRO-SEP-LEU-PRO-GLY,236,7,COc1cccc(c1)[C@@H]([C@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])COP(O)(O)O)CC(C)C)c1ccccc1,Kd=16.5uM,4.782516,4.78,1,A,A,1,A,A,0,,B,A,,1,1,236,7,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)O,0.9652473330497742,0.8711879253387451,93.35973358154295,91.66297912597656,0.3129798769950866,0.480621874332428,0.9466103315353394,0.9242494106292723,0.951902449131012,0.8579225540161133,RTPSLPG,Low,"(4.745, 4.866]",train
6FC6,protein-peptide,P11709 P40013,GPMDRYQRKIGCFIQIPNLGRGQLKYVGPVDTKAGMFAGVDLLANIGKNDGSFMGKKYFQTEYPQSGLFIQLQKVASLIEKASISQTSRRTTMEPLSIPKNR,SNNLIIDEETF,GLY-PRO-MET-ASP-ARG-TYR-GLN-ARG-LYS-ILE-GLY-CYS-PHE-ILE-GLN-ILE-PRO-ASN-LEU-GLY-ARG-GLY-GLN-LEU-LYS-TYR-VAL-GLY-PRO-VAL-ASP-THR-LYS-ALA-GLY-MET-PHE-ALA-GLY-VAL-ASP-LEU-LEU-ALA-ASN-ILE-GLY-LYS-ASN-ASP-GLY-SER-PHE-MET-GLY-LYS-LYS-TYR-PHE-GLN-THR-GLU-TYR-PRO-GLN-SER-GLY-LEU-PHE-ILE-GLN-LEU-GLN-LYS-VAL-ALA-SER-LEU-ILE-GLU-LYS-ALA-SER-ILE-SER-GLN-THR-SER-ARG-ARG-THR-THR-MET-GLU-PRO-LEU-SER-ILE-PRO-LYS-ASN-ARG,SER-ASN-ASN-LEU-ILE-ILE-ASP-GLU-GLU-THR-PHE,102,11,C[C@H]([C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H]([NH3+])C)O,Kd=5.6uM,5.251812,5.25,1,A,A,1,A,A,0,,B,A,,1,1,102,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC,0.9643635749816896,0.9198457598686218,87.30390167236328,83.89496612548828,0.3656861186027527,0.5940117835998535,0.8562602996826172,0.8418002128601074,0.8420530557632446,0.8290629982948303,SNNLIIDEETF,Low,"(5.222, 5.31]",train
6FDP,protein-peptide,Q9H6T3 P07900,GPHMQAISEKDRGNGFFKEGKYERAIECYTRGIAADGANALLPANRAMAYLKIQKYEEAEKDCTQAILLDGSYSKAFARRGTARTFLGKLNEAKQDFETVLLLEPGNKQAVTELSKIKKK,DTSRMEEVD,GLY-PRO-HIS-MET-GLN-ALA-ILE-SER-GLU-LYS-ASP-ARG-GLY-ASN-GLY-PHE-PHE-LYS-GLU-GLY-LYS-TYR-GLU-ARG-ALA-ILE-GLU-CYS-TYR-THR-ARG-GLY-ILE-ALA-ALA-ASP-GLY-ALA-ASN-ALA-LEU-LEU-PRO-ALA-ASN-ARG-ALA-MET-ALA-TYR-LEU-LYS-ILE-GLN-LYS-TYR-GLU-GLU-ALA-GLU-LYS-ASP-CYS-THR-GLN-ALA-ILE-LEU-LEU-ASP-GLY-SER-TYR-SER-LYS-ALA-PHE-ALA-ARG-ARG-GLY-THR-ALA-ARG-THR-PHE-LEU-GLY-LYS-LEU-ASN-GLU-ALA-LYS-GLN-ASP-PHE-GLU-THR-VAL-LEU-LEU-LEU-GLU-PRO-GLY-ASN-LYS-GLN-ALA-VAL-THR-GLU-LEU-SER-LYS-ILE-LYS-LYS-LYS,ASP-THR-SER-ARG-MET-GLU-GLU-VAL-ASP,120,9,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])CO)CCC[NH+]=C(N)N,Kd=5.5uM,5.259637,5.26,1,A,A,1,A,A,0,,B,A,,1,1,120,9,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,0.9644955396652222,0.8676616549491882,95.34757232666016,93.3309555053711,0.2854580283164978,0.5458089113235474,0.9456086754798888,0.91334331035614,0.9256125688552856,0.8562411665916443,DTSRMEEVD,Low,"(5.222, 5.31]",train
6FDT,protein-peptide,P0DMV9 Q9H6T3,GPHMQAISEKDRGNGFFKEGKYERAIECYTRGIAADGANALLPANRAMAYLKIQKYEEAEKDCTQAILLDGSYSKAFARRGTARTFLGKLNEAKQDFETVLLLEPGNKQAVTELSKIKKK,SGPTIEEVD,GLY-PRO-HIS-MET-GLN-ALA-ILE-SER-GLU-LYS-ASP-ARG-GLY-ASN-GLY-PHE-PHE-LYS-GLU-GLY-LYS-TYR-GLU-ARG-ALA-ILE-GLU-CYS-TYR-THR-ARG-GLY-ILE-ALA-ALA-ASP-GLY-ALA-ASN-ALA-LEU-LEU-PRO-ALA-ASN-ARG-ALA-MET-ALA-TYR-LEU-LYS-ILE-GLN-LYS-TYR-GLU-GLU-ALA-GLU-LYS-ASP-CYS-THR-GLN-ALA-ILE-LEU-LEU-ASP-GLY-SER-TYR-SER-LYS-ALA-PHE-ALA-ARG-ARG-GLY-THR-ALA-ARG-THR-PHE-LEU-GLY-LYS-LEU-ASN-GLU-ALA-LYS-GLN-ASP-PHE-GLU-THR-VAL-LEU-LEU-LEU-GLU-PRO-GLY-ASN-LYS-GLN-ALA-VAL-THR-GLU-LEU-SER-LYS-ILE-LYS-LYS-LYS,SER-GLY-PRO-THR-ILE-GLU-GLU-VAL-ASP,120,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)[NH3+])C,Kd=50.5uM,4.296709,4.3,1,A,A,1,A,A,0,,B,A,,1,1,120,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9586094617843628,0.8931140899658203,93.9391632080078,93.8970718383789,0.2836794257164001,0.4663074314594269,0.9466764330863952,0.9261897206306458,0.9179880619049072,0.8848451375961304,SGPTIEEVD,Low,"(4.155, 4.319]",val
6FEL,protein-peptide,P61981 Q96RR4,GHMVDREQLVQKARLAEQAERYDDMAAAMKNVTELNEPLSNEERNLLSVAYKNVVGARRSSWRVISSIEQKTSADGNEKKIEMVRAYREKIEKELEAVCQDVLSLLDNYLIKNCSETQYESKVFYLKMKGDYYRYLAEVATGEKRATVVESSEKAYSEAHEISKEHMQPTHPIRLGLALNYSVFYYEIQNAPEQACHLAKTAFDDAIAELDTLNEDSYKDSTLIMQLLRDNLTLWT,RSLSAPGN,GLY-HIS-MET-VAL-ASP-ARG-GLU-GLN-LEU-VAL-GLN-LYS-ALA-ARG-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-ALA-MET-LYS-ASN-VAL-THR-GLU-LEU-ASN-GLU-PRO-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-ILE-SER-SER-ILE-GLU-GLN-LYS-THR-SER-ALA-ASP-GLY-ASN-GLU-LYS-LYS-ILE-GLU-MET-VAL-ARG-ALA-TYR-ARG-GLU-LYS-ILE-GLU-LYS-GLU-LEU-GLU-ALA-VAL-CYS-GLN-ASP-VAL-LEU-SER-LEU-LEU-ASP-ASN-TYR-LEU-ILE-LYS-ASN-CYS-SER-GLU-THR-GLN-TYR-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-GLU-LYS-ARG-ALA-THR-VAL-VAL-GLU-SER-SER-GLU-LYS-ALA-TYR-SER-GLU-ALA-HIS-GLU-ILE-SER-LYS-GLU-HIS-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-TYR-SER-VAL-PHE-TYR-TYR-GLU-ILE-GLN-ASN-ALA-PRO-GLU-GLN-ALA-CYS-HIS-LEU-ALA-LYS-THR-ALA-PHE-ASP-ASP-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-ASN-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,ARG-SER-LEU-SEP-ALA-PRO-GLY-ASN,236,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)COP(O)(O)O)CC(C)C)NC(=O)[C@@H]([NH3+])C,Kd=0.4uM,6.39794,6.4,1,A,A,1,A,A,0,,E,A,,1,1,236,8,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O,0.962020754814148,0.8645911812782288,90.67549896240234,89.95188903808594,0.3094514310359955,0.5037664771080017,0.9458486437797546,0.9256892800331116,0.945572018623352,0.8493166565895081,RSLSAPGN,Low,"(6.26, 6.398]",train
6FI4,protein-peptide,P31947,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,PSLPV,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,PRO-SEP-LEU-PRO-DVA,236,5,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)N1CCC[C@H]1C(c1ccccc1)c1ccccc1)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)COP(O)(O)O)C,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,B,A,,1,1,236,5,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(C(=O)O)C(C)C,0.9150953888893129,0.8849562406539917,93.10810089111328,93.7581787109375,0.2978233695030212,0.4284884035587311,0.9538686871528624,0.928186297416687,0.8924352526664734,0.8741486668586731,PSLPV,Low,"(5.6, 5.699]",train
6FI5,protein-peptide,P31947 P10636,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,TPSLPA,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,THR-PRO-SEP-LEU-PRO-DAL,236,6,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)N1CCC[C@H]1C(c1ccccc1)c1ccccc1)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)[NH3+])COP(O)(O)O)C,Kd=3.0uM,5.522879,5.52,1,A,A,1,A,A,0,,B,A,,1,1,236,6,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(C)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(C)C(=O)O,0.8496271967887878,0.8907263278961182,92.28922271728516,93.1221923828125,0.3262726068496704,0.4424960613250732,0.944935142993927,0.929222583770752,0.8103043437004089,0.8811022043228149,TPSLPA,Low,"(5.463, 5.6]",train
6FKP,protein-peptide,Q9UIF9,HMSVNKVTCLVCRKGDNDEFLLLCDGCDRGCHIYCHRPKMEAVPEGDWFCTVCLAQQV,ARTAATARKS,HIS-MET-SER-VAL-ASN-LYS-VAL-THR-CYS-LEU-VAL-CYS-ARG-LYS-GLY-ASP-ASN-ASP-GLU-PHE-LEU-LEU-LEU-CYS-ASP-GLY-CYS-ASP-ARG-GLY-CYS-HIS-ILE-TYR-CYS-HIS-ARG-PRO-LYS-MET-GLU-ALA-VAL-PRO-GLU-GLY-ASP-TRP-PHE-CYS-THR-VAL-CYS-LEU-ALA-GLN-GLN-VAL,ALA-ARG-THR-ALA-ALA-THR-ALA-ARG-LYS-SER,58,10,CC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH3+])C)C)C,IC50=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,E,A,,1,1,58,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9044859409332277,0.770733118057251,90.52141571044922,85.06815338134766,0.3812427818775177,0.7256055474281311,0.8197503089904785,0.790092945098877,0.8337579965591431,0.7227896451950073,ARTAATARKS,Low,"(6.398, 6.523]",train
6FKQ,protein-peptide,O95631 Q8NBI3,DPCSDENGHPRRCIPDFVNAAFGKDVRVSSTCGRPPARYCVVSERGEERLRSCHLCNASDPKKAHPPAFLTDLNNPHNLTCWQSENYLQFPHNVTLTLSLGKKFEVTYVSLQFCSPRPESMAIYKSMDYGRTWVPFQFYSTQCRKMYNRPHRAPITKQNEQEAVCTDSHTDMRPLSGGLIAFSTLDGRPSAHDFDNSPVLQDWVTATDIRVAFSRLHTFGDENEDDSELARDSYFYAVSDLQVGGRCKCNGHAARCVRDRDDSLVCDCRHNTAGPECDRCKPFHYDRPWQRATAREANECVACNCNLHARRCRFNMELYKLSGRKSGGVCLNCRHNTAGRHCHYCKEGYYRDMGKPITHRKACKACDCHPVGAAGKTCNQTTGQCPCKDGVTGITCNRCAKGYQQSRSPIAPCIK,MPTLDMALFDWTDYEDLKP,ASP-PRO-CYS-SER-ASP-GLU-ASN-GLY-HIS-PRO-ARG-ARG-CYS-ILE-PRO-ASP-PHE-VAL-ASN-ALA-ALA-PHE-GLY-LYS-ASP-VAL-ARG-VAL-SER-SER-THR-CYS-GLY-ARG-PRO-PRO-ALA-ARG-TYR-CYS-VAL-VAL-SER-GLU-ARG-GLY-GLU-GLU-ARG-LEU-ARG-SER-CYS-HIS-LEU-CYS-ASN-ALA-SER-ASP-PRO-LYS-LYS-ALA-HIS-PRO-PRO-ALA-PHE-LEU-THR-ASP-LEU-ASN-ASN-PRO-HIS-ASN-LEU-THR-CYS-TRP-GLN-SER-GLU-ASN-TYR-LEU-GLN-PHE-PRO-HIS-ASN-VAL-THR-LEU-THR-LEU-SER-LEU-GLY-LYS-LYS-PHE-GLU-VAL-THR-TYR-VAL-SER-LEU-GLN-PHE-CYS-SER-PRO-ARG-PRO-GLU-SER-MET-ALA-ILE-TYR-LYS-SER-MET-ASP-TYR-GLY-ARG-THR-TRP-VAL-PRO-PHE-GLN-PHE-TYR-SER-THR-GLN-CYS-ARG-LYS-MET-TYR-ASN-ARG-PRO-HIS-ARG-ALA-PRO-ILE-THR-LYS-GLN-ASN-GLU-GLN-GLU-ALA-VAL-CYS-THR-ASP-SER-HIS-THR-ASP-MET-ARG-PRO-LEU-SER-GLY-GLY-LEU-ILE-ALA-PHE-SER-THR-LEU-ASP-GLY-ARG-PRO-SER-ALA-HIS-ASP-PHE-ASP-ASN-SER-PRO-VAL-LEU-GLN-ASP-TRP-VAL-THR-ALA-THR-ASP-ILE-ARG-VAL-ALA-PHE-SER-ARG-LEU-HIS-THR-PHE-GLY-ASP-GLU-ASN-GLU-ASP-ASP-SER-GLU-LEU-ALA-ARG-ASP-SER-TYR-PHE-TYR-ALA-VAL-SER-ASP-LEU-GLN-VAL-GLY-GLY-ARG-CYS-LYS-CYS-ASN-GLY-HIS-ALA-ALA-ARG-CYS-VAL-ARG-ASP-ARG-ASP-ASP-SER-LEU-VAL-CYS-ASP-CYS-ARG-HIS-ASN-THR-ALA-GLY-PRO-GLU-CYS-ASP-ARG-CYS-LYS-PRO-PHE-HIS-TYR-ASP-ARG-PRO-TRP-GLN-ARG-ALA-THR-ALA-ARG-GLU-ALA-ASN-GLU-CYS-VAL-ALA-CYS-ASN-CYS-ASN-LEU-HIS-ALA-ARG-ARG-CYS-ARG-PHE-ASN-MET-GLU-LEU-TYR-LYS-LEU-SER-GLY-ARG-LYS-SER-GLY-GLY-VAL-CYS-LEU-ASN-CYS-ARG-HIS-ASN-THR-ALA-GLY-ARG-HIS-CYS-HIS-TYR-CYS-LYS-GLU-GLY-TYR-TYR-ARG-ASP-MET-GLY-LYS-PRO-ILE-THR-HIS-ARG-LYS-ALA-CYS-LYS-ALA-CYS-ASP-CYS-HIS-PRO-VAL-GLY-ALA-ALA-GLY-LYS-THR-CYS-ASN-GLN-THR-THR-GLY-GLN-CYS-PRO-CYS-LYS-ASP-GLY-VAL-THR-GLY-ILE-THR-CYS-ASN-ARG-CYS-ALA-LYS-GLY-TYR-GLN-GLN-SER-ARG-SER-PRO-ILE-ALA-PRO-CYS-ILE-LYS,MET-PRO-THR-LEU-ASP-MET-ALA-LEU-PHE-ASP-TRP-THR-ASP-TYR-GLU-ASP-LEU-LYS-PRO,415,19,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)[NH3+])CC(C)C)CC(=O)O)CCSC)C)CC(C)C)Cc1ccccc1)CC(=O)O)CC(=O)O)Cc1ccc(cc1)O)CCC(=O)O)CC(=O)O)CC(C)C,Kd=10nM,8.0,8.0,1,A,A,1,A,A,0,,B,A,,1,1,415,19,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,0.6697497367858887,0.5736182332038879,74.25798034667969,73.65484619140625,0.5726696848869324,1.380776286125183,0.8007124662399292,0.76174396276474,0.609647274017334,0.5265867710113525,MPTLDMALFDWTDYEDLKP,Moderate,"(7.921, 8.383]",train
6G0Q,protein-peptide,P15976 O60885,SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,ASGKGKKKRGY,SER-MET-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,ALA-SER-GLY-ALY-GLY-LYS-ALY-LYS-ARG-GLY-TYR,127,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)[NH3+])CCCCNC(=O)C)CCCC[NH3+])CCCCNC(=O)C,Kd=24.6uM,4.609065,4.61,1,A,A,1,A,A,0,,B,A,,1,1,127,11,0,C[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,0.8863937854766846,0.7269161939620972,93.24282836914062,93.14990234375,0.3185127079486847,0.8118215799331665,0.9334334135055542,0.8412058353424072,0.824815034866333,0.6983437538146973,ASGKGKKKRGY,Low,"(4.606, 4.745]",train
6G86,protein-peptide,P38634 Q00684,MRRSVYLDNTIEFLRGRVYLGAYDYTPEDTDELVFFTVEDAIFYNSFHLDFGPMNIGHLYRFAVIFHEILNDPENANKAVVFYSSASTRQRANAACMLCCYMILVQAWTPHQVLQPLAQVDPPFMPFRDAGYSNADFEITIQDVVYGVWRAKEKGLIDLHSFNLESYEKYEHVEFGDFNVLTPDFIAFASPQEDHPKGYLATKSSHLNQPFKSVLNFFANNNVQLVVRLNSHLYNKKHFEDIGIQHLDLIFEDGTCPDLSIVKNFVGAAETIIKRGGKIAVHCKAGLGRTGCLIGAHLIYTYGFTANECIGFLRFIRPGMVVGPQQHWLYLHQNDFREWKYTTRISLKPSEAIGGLYPLISLEEYRLQKKKLKD,PSTTKSFKNAPLLAPP,MET-ARG-ARG-SER-VAL-TYR-LEU-ASP-ASN-THR-ILE-GLU-PHE-LEU-ARG-GLY-ARG-VAL-TYR-LEU-GLY-ALA-TYR-ASP-TYR-THR-PRO-GLU-ASP-THR-ASP-GLU-LEU-VAL-PHE-PHE-THR-VAL-GLU-ASP-ALA-ILE-PHE-TYR-ASN-SER-PHE-HIS-LEU-ASP-PHE-GLY-PRO-MET-ASN-ILE-GLY-HIS-LEU-TYR-ARG-PHE-ALA-VAL-ILE-PHE-HIS-GLU-ILE-LEU-ASN-ASP-PRO-GLU-ASN-ALA-ASN-LYS-ALA-VAL-VAL-PHE-TYR-SER-SER-ALA-SER-THR-ARG-GLN-ARG-ALA-ASN-ALA-ALA-CYS-MET-LEU-CYS-CYS-TYR-MET-ILE-LEU-VAL-GLN-ALA-TRP-THR-PRO-HIS-GLN-VAL-LEU-GLN-PRO-LEU-ALA-GLN-VAL-ASP-PRO-PRO-PHE-MET-PRO-PHE-ARG-ASP-ALA-GLY-TYR-SER-ASN-ALA-ASP-PHE-GLU-ILE-THR-ILE-GLN-ASP-VAL-VAL-TYR-GLY-VAL-TRP-ARG-ALA-LYS-GLU-LYS-GLY-LEU-ILE-ASP-LEU-HIS-SER-PHE-ASN-LEU-GLU-SER-TYR-GLU-LYS-TYR-GLU-HIS-VAL-GLU-PHE-GLY-ASP-PHE-ASN-VAL-LEU-THR-PRO-ASP-PHE-ILE-ALA-PHE-ALA-SER-PRO-GLN-GLU-ASP-HIS-PRO-LYS-GLY-TYR-LEU-ALA-THR-LYS-SER-SER-HIS-LEU-ASN-GLN-PRO-PHE-LYS-SER-VAL-LEU-ASN-PHE-PHE-ALA-ASN-ASN-ASN-VAL-GLN-LEU-VAL-VAL-ARG-LEU-ASN-SER-HIS-LEU-TYR-ASN-LYS-LYS-HIS-PHE-GLU-ASP-ILE-GLY-ILE-GLN-HIS-LEU-ASP-LEU-ILE-PHE-GLU-ASP-GLY-THR-CYS-PRO-ASP-LEU-SER-ILE-VAL-LYS-ASN-PHE-VAL-GLY-ALA-ALA-GLU-THR-ILE-ILE-LYS-ARG-GLY-GLY-LYS-ILE-ALA-VAL-HIS-CYS-LYS-ALA-GLY-LEU-GLY-ARG-THR-GLY-CYS-LEU-ILE-GLY-ALA-HIS-LEU-ILE-TYR-THR-TYR-GLY-PHE-THR-ALA-ASN-GLU-CYS-ILE-GLY-PHE-LEU-ARG-PHE-ILE-ARG-PRO-GLY-MET-VAL-VAL-GLY-PRO-GLN-GLN-HIS-TRP-LEU-TYR-LEU-HIS-GLN-ASN-ASP-PHE-ARG-GLU-TRP-LYS-TYR-THR-THR-ARG-ILE-SER-LEU-LYS-PRO-SER-GLU-ALA-ILE-GLY-GLY-LEU-TYR-PRO-LEU-ILE-SER-LEU-GLU-GLU-TYR-ARG-LEU-GLN-LYS-LYS-LYS-LEU-LYS-ASP,PRO-SER-THR-THR-LYS-SER-PHE-LYS-ASN-ALA-PRO-LEU-LEU-ALA-PRO-PRO,374,16,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)C)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])C)C)C)C,Kd=32.2uM,4.492144,4.49,1,A,A,1,A,A,0,,C,A,,0,1,374,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.7236735820770264,0.6717407703399658,83.92761993408203,82.5810546875,0.5092878341674805,1.0976219177246094,0.8918427228927612,0.8412206172943115,0.6559902429580688,0.6293708086013794,PSTTKSFKNAPLLAPP,Low,"(4.456, 4.606]",train
6GBE,protein-peptide,Q16513 Q64512,TPHVKDYSFVTEDNTFEVKLFKNSSGLGFSFSREDNLIPEQINGSIVRVKKLFPGQPAAESGKIDVGDVILKVNGAPLKGLSQQDVISALRGTAPEVSLLLCRPAPGVLPEIDTPGNSS,MFRDFDYIADWC,THR-PRO-HIS-VAL-LYS-ASP-TYR-SER-PHE-VAL-THR-GLU-ASP-ASN-THR-PHE-GLU-VAL-LYS-LEU-PHE-LYS-ASN-SER-SER-GLY-LEU-GLY-PHE-SER-PHE-SER-ARG-GLU-ASP-ASN-LEU-ILE-PRO-GLU-GLN-ILE-ASN-GLY-SER-ILE-VAL-ARG-VAL-LYS-LYS-LEU-PHE-PRO-GLY-GLN-PRO-ALA-ALA-GLU-SER-GLY-LYS-ILE-ASP-VAL-GLY-ASP-VAL-ILE-LEU-LYS-VAL-ASN-GLY-ALA-PRO-LEU-LYS-GLY-LEU-SER-GLN-GLN-ASP-VAL-ILE-SER-ALA-LEU-ARG-GLY-THR-ALA-PRO-GLU-VAL-SER-LEU-LEU-LEU-CYS-ARG-PRO-ALA-PRO-GLY-VAL-LEU-PRO-GLU-ILE-ASP-THR-PRO-GLY-ASN-SER-SER,MET-PHE-ARG-ASP-PHE-ASP-TYR-ILE-ALA-ASP-TRP-CYS,119,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)Cc1c[nH]c2c1cccc2)CC(=O)O)C)[C@H](CC)C)Cc1ccc(cc1)O)CC(=O)O)Cc1ccccc1)CC(=O)O)CCC[NH+]=C(N)N)Cc1ccccc1)[NH3+],Kd=318uM,3.497573,3.5,1,A,A,1,A,A,0,,B,A,,1,1,119,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(=O)O,0.9169970750808716,0.8423970341682434,80.46894836425781,82.65009307861328,0.5064226388931274,0.6935359835624695,0.8126533627510071,0.8663367033004761,0.7665563225746155,0.7943952679634094,MFRDFDYIADWC,Low,"(2.044, 3.548]",train
6GZL,protein-peptide,P20917 P63167,SMCDRKAVIKNADMSEEMQQDSVECATQALEKYNIEKDIAAHIKKEFDKKYNPTWHCIVGRNFGSYVTHETKHFIYFYLGQVAILLFKSG,KRPTKDSYTLTEELAEY,SER-MET-CYS-ASP-ARG-LYS-ALA-VAL-ILE-LYS-ASN-ALA-ASP-MET-SER-GLU-GLU-MET-GLN-GLN-ASP-SER-VAL-GLU-CYS-ALA-THR-GLN-ALA-LEU-GLU-LYS-TYR-ASN-ILE-GLU-LYS-ASP-ILE-ALA-ALA-HIS-ILE-LYS-LYS-GLU-PHE-ASP-LYS-LYS-TYR-ASN-PRO-THR-TRP-HIS-CYS-ILE-VAL-GLY-ARG-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-THR-LYS-HIS-PHE-ILE-TYR-PHE-TYR-LEU-GLY-GLN-VAL-ALA-ILE-LEU-LEU-PHE-LYS-SER-GLY,LYS-ARG-PRO-THR-LYS-ASP-SER-TYR-THR-LEU-THR-GLU-GLU-LEU-ALA-GLU-TYR,90,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC(=O)O)CCC(=O)O)[C@H](O)C)CC(C)C)[C@H](O)C)Cc1ccc(cc1)O)CO)CC(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]1[NH2+]CCC1,Kd=7.3uM,5.136677,5.14,1,A,A,1,A,A,0,,B,A,,1,1,90,17,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9604581594467164,0.6950415372848511,96.28472900390624,90.36760711669922,0.3065147995948791,0.7096484303474426,0.9292076230049132,0.782860279083252,0.8689716458320618,0.6730868220329285,KRPTKDSYTLTEELAEY,Low,"(5.105, 5.222]",train
6H0B,protein-peptide,Q8N4A0,MAVRWTWAGKSCLLLAFLTVAYIFVELLVSTFHASAGAGRARELGSRRLSDLQKNTEDLSRPLYKKPPADSRALGEWGKASKLQLNEDELKQQEELIERYAINIYLSDRISLHRHIEDKRMYECKSQKFNYRTLPTTSVIIAFYNEAWSTLLRTIHSVLETSPAVLLKEIILVDDLSDRVYLKTQLETYISNLDRVRLIRTNKREGLVRARLIGATFATGDVLTFLDCHCECNSGWLEPLLERIGRDETAVVCPVIDTIDWNTFEFYMQIGEPMIGGFDWRLTFQWHSVPKQERDRRISRIDPIRSPTMAGGLFAVSKKYFQYLGTYDTGMEVWGGENLELSFRVWQCGGKLEIHPCSHVGHVFPKRAPYARPNFLQNTARAAEVWMDEYKEHFYNRNPPARKEAYGDISERKLLRERLRCKSFDWYLKNVFPNLHVPEDRPGWHGAIRSRGISSECLDYNSPDNNPTGANLSLFGCHGQGGNQFFEYTSNKEIRFNSVTELCAEVPEQKNYVGMQNCPKDGFPVPANIIWHFKEDGTIFHPHSGLCLSAYRTPEGRPDVQMRTCDALDKNQIWSFEK,GATGAGAGAGTTPGPG,MET-ALA-VAL-ARG-TRP-THR-TRP-ALA-GLY-LYS-SER-CYS-LEU-LEU-LEU-ALA-PHE-LEU-THR-VAL-ALA-TYR-ILE-PHE-VAL-GLU-LEU-LEU-VAL-SER-THR-PHE-HIS-ALA-SER-ALA-GLY-ALA-GLY-ARG-ALA-ARG-GLU-LEU-GLY-SER-ARG-ARG-LEU-SER-ASP-LEU-GLN-LYS-ASN-THR-GLU-ASP-LEU-SER-ARG-PRO-LEU-TYR-LYS-LYS-PRO-PRO-ALA-ASP-SER-ARG-ALA-LEU-GLY-GLU-TRP-GLY-LYS-ALA-SER-LYS-LEU-GLN-LEU-ASN-GLU-ASP-GLU-LEU-LYS-GLN-GLN-GLU-GLU-LEU-ILE-GLU-ARG-TYR-ALA-ILE-ASN-ILE-TYR-LEU-SER-ASP-ARG-ILE-SER-LEU-HIS-ARG-HIS-ILE-GLU-ASP-LYS-ARG-MET-TYR-GLU-CYS-LYS-SER-GLN-LYS-PHE-ASN-TYR-ARG-THR-LEU-PRO-THR-THR-SER-VAL-ILE-ILE-ALA-PHE-TYR-ASN-GLU-ALA-TRP-SER-THR-LEU-LEU-ARG-THR-ILE-HIS-SER-VAL-LEU-GLU-THR-SER-PRO-ALA-VAL-LEU-LEU-LYS-GLU-ILE-ILE-LEU-VAL-ASP-ASP-LEU-SER-ASP-ARG-VAL-TYR-LEU-LYS-THR-GLN-LEU-GLU-THR-TYR-ILE-SER-ASN-LEU-ASP-ARG-VAL-ARG-LEU-ILE-ARG-THR-ASN-LYS-ARG-GLU-GLY-LEU-VAL-ARG-ALA-ARG-LEU-ILE-GLY-ALA-THR-PHE-ALA-THR-GLY-ASP-VAL-LEU-THR-PHE-LEU-ASP-CYS-HIS-CYS-GLU-CYS-ASN-SER-GLY-TRP-LEU-GLU-PRO-LEU-LEU-GLU-ARG-ILE-GLY-ARG-ASP-GLU-THR-ALA-VAL-VAL-CYS-PRO-VAL-ILE-ASP-THR-ILE-ASP-TRP-ASN-THR-PHE-GLU-PHE-TYR-MET-GLN-ILE-GLY-GLU-PRO-MET-ILE-GLY-GLY-PHE-ASP-TRP-ARG-LEU-THR-PHE-GLN-TRP-HIS-SER-VAL-PRO-LYS-GLN-GLU-ARG-ASP-ARG-ARG-ILE-SER-ARG-ILE-ASP-PRO-ILE-ARG-SER-PRO-THR-MET-ALA-GLY-GLY-LEU-PHE-ALA-VAL-SER-LYS-LYS-TYR-PHE-GLN-TYR-LEU-GLY-THR-TYR-ASP-THR-GLY-MET-GLU-VAL-TRP-GLY-GLY-GLU-ASN-LEU-GLU-LEU-SER-PHE-ARG-VAL-TRP-GLN-CYS-GLY-GLY-LYS-LEU-GLU-ILE-HIS-PRO-CYS-SER-HIS-VAL-GLY-HIS-VAL-PHE-PRO-LYS-ARG-ALA-PRO-TYR-ALA-ARG-PRO-ASN-PHE-LEU-GLN-ASN-THR-ALA-ARG-ALA-ALA-GLU-VAL-TRP-MET-ASP-GLU-TYR-LYS-GLU-HIS-PHE-TYR-ASN-ARG-ASN-PRO-PRO-ALA-ARG-LYS-GLU-ALA-TYR-GLY-ASP-ILE-SER-GLU-ARG-LYS-LEU-LEU-ARG-GLU-ARG-LEU-ARG-CYS-LYS-SER-PHE-ASP-TRP-TYR-LEU-LYS-ASN-VAL-PHE-PRO-ASN-LEU-HIS-VAL-PRO-GLU-ASP-ARG-PRO-GLY-TRP-HIS-GLY-ALA-ILE-ARG-SER-ARG-GLY-ILE-SER-SER-GLU-CYS-LEU-ASP-TYR-ASN-SER-PRO-ASP-ASN-ASN-PRO-THR-GLY-ALA-ASN-LEU-SER-LEU-PHE-GLY-CYS-HIS-GLY-GLN-GLY-GLY-ASN-GLN-PHE-PHE-GLU-TYR-THR-SER-ASN-LYS-GLU-ILE-ARG-PHE-ASN-SER-VAL-THR-GLU-LEU-CYS-ALA-GLU-VAL-PRO-GLU-GLN-LYS-ASN-TYR-VAL-GLY-MET-GLN-ASN-CYS-PRO-LYS-ASP-GLY-PHE-PRO-VAL-PRO-ALA-ASN-ILE-ILE-TRP-HIS-PHE-LYS-GLU-ASP-GLY-THR-ILE-PHE-HIS-PRO-HIS-SER-GLY-LEU-CYS-LEU-SER-ALA-TYR-ARG-THR-PRO-GLU-GLY-ARG-PRO-ASP-VAL-GLN-MET-ARG-THR-CYS-ASP-ALA-LEU-ASP-LYS-ASN-GLN-ILE-TRP-SER-PHE-GLU-LYS,GLY-ALA-THR-GLY-ALA-GLY-ALA-GLY-ALA-GLY-THR-THR-PRO-GLY-PRO-GLY,578,16,O=C(N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)O)[C@H](O)C)[C@H](O)C)C)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)C)C,Kd=70uM,4.154902,4.15,1,A,A,1,A,A,0,,F,A,,0,1,578,16,0,C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H]1C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)O)[C@@H](C)O,C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)O)[C@@H](C)O,0.7259319424629211,0.7246310114860535,67.4035873413086,69.94902038574219,0.6152684092521667,0.9752654433250428,0.814171552658081,0.8110624551773071,0.6460016369819641,0.6554452776908875,GATGAGAGAGTTPGPG,Low,"(3.924, 4.155]",train
6H41,protein-peptide,Q01344,KISLLPPVNFTIKVTGLAQVLLQWKPNPDQEQRNVNLEYQVKINAPKEDDYETRITESKAVTILHKGFSASVRTILQNDHSLLASSWASAELHAPPGSPGTSIVNLTCTTNTTEDNYSRLRSYQVSLHCTWLVGTDAPEDTQYFLYYRYGSWTEECQEYSKDTLGRNIACWFPRTFILSKGRDWLAVLVNGSSKHSAIRPFDQLFALHAIDQINPPLNVTAEIEGTRLSIQWEKPVSAFPIHCFDYEVKIHNTRNGYLQIEKLMTNAFISIIDDLSKYDVQVRAAVSSMCREAGLWSEWSQPIYVGFSR,VDECWRIIASHTWFCAEE,LYS-ILE-SER-LEU-LEU-PRO-PRO-VAL-ASN-PHE-THR-ILE-LYS-VAL-THR-GLY-LEU-ALA-GLN-VAL-LEU-LEU-GLN-TRP-LYS-PRO-ASN-PRO-ASP-GLN-GLU-GLN-ARG-ASN-VAL-ASN-LEU-GLU-TYR-GLN-VAL-LYS-ILE-ASN-ALA-PRO-LYS-GLU-ASP-ASP-TYR-GLU-THR-ARG-ILE-THR-GLU-SER-LYS-ALA-VAL-THR-ILE-LEU-HIS-LYS-GLY-PHE-SER-ALA-SER-VAL-ARG-THR-ILE-LEU-GLN-ASN-ASP-HIS-SER-LEU-LEU-ALA-SER-SER-TRP-ALA-SER-ALA-GLU-LEU-HIS-ALA-PRO-PRO-GLY-SER-PRO-GLY-THR-SER-ILE-VAL-ASN-LEU-THR-CYS-THR-THR-ASN-THR-THR-GLU-ASP-ASN-TYR-SER-ARG-LEU-ARG-SER-TYR-GLN-VAL-SER-LEU-HIS-CYS-THR-TRP-LEU-VAL-GLY-THR-ASP-ALA-PRO-GLU-ASP-THR-GLN-TYR-PHE-LEU-TYR-TYR-ARG-TYR-GLY-SER-TRP-THR-GLU-GLU-CYS-GLN-GLU-TYR-SER-LYS-ASP-THR-LEU-GLY-ARG-ASN-ILE-ALA-CYS-TRP-PHE-PRO-ARG-THR-PHE-ILE-LEU-SER-LYS-GLY-ARG-ASP-TRP-LEU-ALA-VAL-LEU-VAL-ASN-GLY-SER-SER-LYS-HIS-SER-ALA-ILE-ARG-PRO-PHE-ASP-GLN-LEU-PHE-ALA-LEU-HIS-ALA-ILE-ASP-GLN-ILE-ASN-PRO-PRO-LEU-ASN-VAL-THR-ALA-GLU-ILE-GLU-GLY-THR-ARG-LEU-SER-ILE-GLN-TRP-GLU-LYS-PRO-VAL-SER-ALA-PHE-PRO-ILE-HIS-CYS-PHE-ASP-TYR-GLU-VAL-LYS-ILE-HIS-ASN-THR-ARG-ASN-GLY-TYR-LEU-GLN-ILE-GLU-LYS-LEU-MET-THR-ASN-ALA-PHE-ILE-SER-ILE-ILE-ASP-ASP-LEU-SER-LYS-TYR-ASP-VAL-GLN-VAL-ARG-ALA-ALA-VAL-SER-SER-MET-CYS-ARG-GLU-ALA-GLY-LEU-TRP-SER-GLU-TRP-SER-GLN-PRO-ILE-TYR-VAL-GLY-PHE-SER-ARG,VAL-ASP-GLU-CYS-TRP-ARG-ILE-ILE-ALA-SER-HIS-THR-TRP-PHE-CYS-ALA-GLU-GLU,309,18,OC[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]cn1)[C@H](O)C)Cc1c[nH]c2c1cccc2)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCC(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CC(=O)O)CCC(=O)O)Cc1c[nH]c2c1cccc2)[C@H](CC)C)[C@H](CC)C,Kd=90nM,7.045757,7.05,1,A,A,1,A,A,0,,B,A,,1,1,309,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,0.8358417749404907,0.615104079246521,83.11054229736328,75.13174438476562,0.4799533486366272,1.1513477563858032,0.8521971106529236,0.7583868503570557,0.7973492741584778,0.5792833566665649,VDECWRIIASHTWFCAEE,Moderate,"(6.824, 7.049]",train
6HM4,protein-peptide,O14079 P32372,MGSSKPLKGFVICCTSIDLKQRTEISTKATKLGAAYRSDFTKDVTHLIAGDFDTPKYKFAAKSRPDIKIMSSEWIPVLYESWVQGEDLDDGLLVDKHFLPTLFKCRVCLTNIGQPERSRIENYVLKHGGTFCPDLTRDVTHLIAGTSSGRKYEYALKWKINVVCVEWLWQSIQRNAVLEPQYFQLD,GVMTVPNTPQKPNLQ,MET-GLY-SER-SER-LYS-PRO-LEU-LYS-GLY-PHE-VAL-ILE-CYS-CYS-THR-SER-ILE-ASP-LEU-LYS-GLN-ARG-THR-GLU-ILE-SER-THR-LYS-ALA-THR-LYS-LEU-GLY-ALA-ALA-TYR-ARG-SER-ASP-PHE-THR-LYS-ASP-VAL-THR-HIS-LEU-ILE-ALA-GLY-ASP-PHE-ASP-THR-PRO-LYS-TYR-LYS-PHE-ALA-ALA-LYS-SER-ARG-PRO-ASP-ILE-LYS-ILE-MET-SER-SER-GLU-TRP-ILE-PRO-VAL-LEU-TYR-GLU-SER-TRP-VAL-GLN-GLY-GLU-ASP-LEU-ASP-ASP-GLY-LEU-LEU-VAL-ASP-LYS-HIS-PHE-LEU-PRO-THR-LEU-PHE-LYS-CYS-ARG-VAL-CYS-LEU-THR-ASN-ILE-GLY-GLN-PRO-GLU-ARG-SER-ARG-ILE-GLU-ASN-TYR-VAL-LEU-LYS-HIS-GLY-GLY-THR-PHE-CYS-PRO-ASP-LEU-THR-ARG-ASP-VAL-THR-HIS-LEU-ILE-ALA-GLY-THR-SER-SER-GLY-ARG-LYS-TYR-GLU-TYR-ALA-LEU-LYS-TRP-LYS-ILE-ASN-VAL-VAL-CSO-VAL-GLU-TRP-LEU-TRP-GLN-SER-ILE-GLN-ARG-ASN-ALA-VAL-LEU-GLU-PRO-GLN-TYR-PHE-GLN-LEU-ASP,GLY-VAL-MET-THR-VAL-PRO-ASN-TPO-PRO-GLN-LYS-PRO-ASN-LEU-GLN,186,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](OP(O)(O)O)C)CC(=O)N)C(C)C)[C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)C[NH3+],Kd=2.12uM,5.673664,5.67,1,A,A,1,A,A,0,,B,A,,1,1,186,15,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)OP(=O)(O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)OP(=O)(O)O)C(C)C,0.845416784286499,0.67289137840271,90.21566009521484,91.42414855957033,0.3517976999282837,0.9188613891601562,0.9078603982925416,0.810460090637207,0.7831640839576721,0.6384991407394409,GVMTVPNTPQKPNLQ,Low,"(5.6, 5.699]",train
6RMM,protein-peptide,Q92547 Q12888,HSTEEGLFSQKSFLVLGFSNENESNIANIIKENAGKIMSLLSRTVADYAVVPLLGCEVEATVGEVVTNTWLVTCIDYQTLFDPKSNPLFTPVPVMTGMTPLEDCVISFSQCAGAEKESLTFLANLLGASVQEYFVRKSNAKKGMFASTHLILKERGGSKYEAAKKWNLPAVTIAWLLETARTGKRADESHFLIENS,SSDLVAPSPDAFRST,HIS-SER-THR-GLU-GLU-GLY-LEU-PHE-SER-GLN-LYS-SER-PHE-LEU-VAL-LEU-GLY-PHE-SER-ASN-GLU-ASN-GLU-SER-ASN-ILE-ALA-ASN-ILE-ILE-LYS-GLU-ASN-ALA-GLY-LYS-ILE-MET-SER-LEU-LEU-SER-ARG-THR-VAL-ALA-ASP-TYR-ALA-VAL-VAL-PRO-LEU-LEU-GLY-CYS-GLU-VAL-GLU-ALA-THR-VAL-GLY-GLU-VAL-VAL-THR-ASN-THR-TRP-LEU-VAL-THR-CYS-ILE-ASP-TYR-GLN-THR-LEU-PHE-ASP-PRO-LYS-SER-ASN-PRO-LEU-PHE-THR-PRO-VAL-PRO-VAL-MET-THR-GLY-MET-THR-PRO-LEU-GLU-ASP-CYS-VAL-ILE-SER-PHE-SER-GLN-CYS-ALA-GLY-ALA-GLU-LYS-GLU-SER-LEU-THR-PHE-LEU-ALA-ASN-LEU-LEU-GLY-ALA-SER-VAL-GLN-GLU-TYR-PHE-VAL-ARG-LYS-SER-ASN-ALA-LYS-LYS-GLY-MET-PHE-ALA-SER-THR-HIS-LEU-ILE-LEU-LYS-GLU-ARG-GLY-GLY-SER-LYS-TYR-GLU-ALA-ALA-LYS-LYS-TRP-ASN-LEU-PRO-ALA-VAL-THR-ILE-ALA-TRP-LEU-LEU-GLU-THR-ALA-ARG-THR-GLY-LYS-ARG-ALA-ASP-GLU-SER-HIS-PHE-LEU-ILE-GLU-ASN-SER,SER-SER-ASP-LEU-VAL-ALA-PRO-SEP-PRO-ASP-ALA-PHE-ARG-SER-THR,196,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)COP(O)(O)O)C)C(C)C)CC(C)C)CC(=O)O)[NH3+],Kd=20.6uM,4.686133,4.69,1,A,A,1,A,A,0,,P,A,,0,1,196,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](C)C(=O)O,0.7878068089485168,0.7234600186347961,89.36343383789062,87.5750961303711,0.412085086107254,0.891708254814148,0.8841238021850586,0.8342804312705994,0.7192962169647217,0.695754885673523,SSDLVAPSPDAFRST,Low,"(4.606, 4.745]",train
6RML,protein-peptide,Q92547 Q12888,GPMSRNDKEPFFVKFLKSSDNSKCFFKALESIKEFQSEEYLQIITEEEALKIKENDRSLYICDPFSGVVFDHLKKLGCRIVGPQVVIFCMHHQRCVPRAEHPVYNMVMSDVTISCTSLEKEKREEVHKYVQMMGGRVYRDLNVSVTHLIAGEVGSKKYLVAANLKKPILLPSWIKTLWEKSQEKKITRYTDINMEDFKCPIFLGCIICVTGLCGLDRKEVQQLTVKHGGQYMGQLKMNECTHLIVQEPKGQKYECAKRWNVHCVTTQWFFDSIEKGFCQDESIYKTEPRPEA,EVEEIPETPCESQGE,GLY-PRO-MET-SER-ARG-ASN-ASP-LYS-GLU-PRO-PHE-PHE-VAL-LYS-PHE-LEU-LYS-SER-SER-ASP-ASN-SER-LYS-CYS-PHE-PHE-LYS-ALA-LEU-GLU-SER-ILE-LYS-GLU-PHE-GLN-SER-GLU-GLU-TYR-LEU-GLN-ILE-ILE-THR-GLU-GLU-GLU-ALA-LEU-LYS-ILE-LYS-GLU-ASN-ASP-ARG-SER-LEU-TYR-ILE-CYS-ASP-PRO-PHE-SER-GLY-VAL-VAL-PHE-ASP-HIS-LEU-LYS-LYS-LEU-GLY-CYS-ARG-ILE-VAL-GLY-PRO-GLN-VAL-VAL-ILE-PHE-CYS-MET-HIS-HIS-GLN-ARG-CYS-VAL-PRO-ARG-ALA-GLU-HIS-PRO-VAL-TYR-ASN-MET-VAL-MET-SER-ASP-VAL-THR-ILE-SER-CYS-THR-SER-LEU-GLU-LYS-GLU-LYS-ARG-GLU-GLU-VAL-HIS-LYS-TYR-VAL-GLN-MET-MET-GLY-GLY-ARG-VAL-TYR-ARG-ASP-LEU-ASN-VAL-SER-VAL-THR-HIS-LEU-ILE-ALA-GLY-GLU-VAL-GLY-SER-LYS-LYS-TYR-LEU-VAL-ALA-ALA-ASN-LEU-LYS-LYS-PRO-ILE-LEU-LEU-PRO-SER-TRP-ILE-LYS-THR-LEU-TRP-GLU-LYS-SER-GLN-GLU-LYS-LYS-ILE-THR-ARG-TYR-THR-ASP-ILE-ASN-MET-GLU-ASP-PHE-LYS-CYS-PRO-ILE-PHE-LEU-GLY-CYS-ILE-ILE-CYS-VAL-THR-GLY-LEU-CYS-GLY-LEU-ASP-ARG-LYS-GLU-VAL-GLN-GLN-LEU-THR-VAL-LYS-HIS-GLY-GLY-GLN-TYR-MET-GLY-GLN-LEU-LYS-MET-ASN-GLU-CYS-THR-HIS-LEU-ILE-VAL-GLN-GLU-PRO-LYS-GLY-GLN-LYS-TYR-GLU-CYS-ALA-LYS-ARG-TRP-ASN-VAL-HIS-CYS-VAL-THR-THR-GLN-TRP-PHE-PHE-ASP-SER-ILE-GLU-LYS-GLY-PHE-CYS-GLN-ASP-GLU-SER-ILE-TYR-LYS-THR-GLU-PRO-ARG-PRO-GLU-ALA,GLU-VAL-GLU-GLU-ILE-PRO-GLU-TPO-PRO-CYS-GLU-SER-GLN-GLY-GLU,292,15,SC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)CCC(=O)O,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,C,A,,0,1,292,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O,0.6175079345703125,0.6664237976074219,80.81649017333984,82.66703033447266,0.6389656662940979,1.1485437154769895,0.8385903239250183,0.804781436920166,0.5133773684501648,0.6318343877792358,EVEEIPETPCESQGE,Low,"(5.821, 5.959]",train
6R8I,protein-peptide,Q6IN85,SMTDTRRRVKVYTLNEDRQWDDRGTGHVSSGYVERLKGMSLLVRAESDGSLLLESKINPNTAYQKQQDTLIVWSEAENYDLALSFQEKAGCDEIWEKICQVQGKDPSVDITQDLVDES,SLPFTFKVPAPPPSLPPSW,SER-MET-THR-ASP-THR-ARG-ARG-ARG-VAL-LYS-VAL-TYR-THR-LEU-ASN-GLU-ASP-ARG-GLN-TRP-ASP-ASP-ARG-GLY-THR-GLY-HIS-VAL-SER-SER-GLY-TYR-VAL-GLU-ARG-LEU-LYS-GLY-MET-SER-LEU-LEU-VAL-ARG-ALA-GLU-SER-ASP-GLY-SER-LEU-LEU-LEU-GLU-SER-LYS-ILE-ASN-PRO-ASN-THR-ALA-TYR-GLN-LYS-GLN-GLN-ASP-THR-LEU-ILE-VAL-TRP-SER-GLU-ALA-GLU-ASN-TYR-ASP-LEU-ALA-LEU-SER-PHE-GLN-GLU-LYS-ALA-GLY-CYS-ASP-GLU-ILE-TRP-GLU-LYS-ILE-CYS-GLN-VAL-GLN-GLY-LYS-ASP-PRO-SER-VAL-ASP-ILE-THR-GLN-ASP-LEU-VAL-ASP-GLU-SER,SER-LEU-PRO-PHE-THR-PHE-LYS-VAL-PRO-ALA-PRO-PRO-PRO-SER-LEU-PRO-PRO-SER-TRP,118,19,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CCCC[NH3+])C,Kd=0.94uM,6.026872,6.03,1,A,A,1,A,A,0,,B,A,,1,1,118,19,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)[C@@H](C)O,0.908747375011444,0.8286118507385254,94.0115203857422,87.98909759521484,0.3805051445960998,0.6218099594116211,0.901036500930786,0.8676329255104065,0.7920619249343872,0.80826336145401,SLPFTFKVPAPPPSLPPSW,Low,"(5.959, 6.097]",train
6QZR,protein-peptide,P31947 Q12778,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWTADNAGEEGGEAPQEPQS,RPRSCTWPLPR,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CSO-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-ALA-ASP-ASN-ALA-GLY-GLU-GLU-GLY-GLY-GLU-ALA-PRO-GLN-GLU-PRO-GLN-SER,ARG-PRO-ARG-SER-CYS-TPO-TRP-PRO-LEU-PRO-ARG,253,11,SC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)CC(C)C)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO,Kd=30.0nM,7.522879,7.52,1,A,A,1,A,A,0,,J,A,,0,1,253,11,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9588245749473572,0.8905796408653259,86.38082885742188,85.68968963623047,0.3660313487052917,0.5561255812644958,0.905509352684021,0.8948152661323547,0.9129677414894104,0.8574060797691345,RPRSCTWPLPR,Moderate,"(7.268, 7.523]",train
6QTX,protein-peptide,P43254 Q9SK53,GAMTFTRYSRLRVIAEIRHGDIFHSANIVSSIEFDRDDELFATAGVSRCIKVFDFSSVVNEPADMQCPIVEMSTRSKLSCLSWNKHEKNHIASSDYEGIVTVWDVTTRQSLMEYEEHEKRAWSVDFSRTEPSMLVSGSDDCKVKVWCTRQEASVINIDMKANICCVKYNPGSSNYIAVGSADHHIHYYDLRNISQPLHVFSGHKKAVSYVKFLSNNELASASTDSTLRLWDVKDNLPVRTFRGHTNEKNFVGLTVNSEYLACGSETNEVYVYHKEITRPVTSHRFGSPDMDDAEEEAGSYFISAVCWKSDSPTMLTANSQGTIKVLVLAA,GFGVVPSFY,GLY-ALA-MET-THR-PHE-THR-ARG-TYR-SER-ARG-LEU-ARG-VAL-ILE-ALA-GLU-ILE-ARG-HIS-GLY-ASP-ILE-PHE-HIS-SER-ALA-ASN-ILE-VAL-SER-SER-ILE-GLU-PHE-ASP-ARG-ASP-ASP-GLU-LEU-PHE-ALA-THR-ALA-GLY-VAL-SER-ARG-CYS-ILE-LYS-VAL-PHE-ASP-PHE-SER-SER-VAL-VAL-ASN-GLU-PRO-ALA-ASP-MET-GLN-CYS-PRO-ILE-VAL-GLU-MET-SER-THR-ARG-SER-LYS-LEU-SER-CYS-LEU-SER-TRP-ASN-LYS-HIS-GLU-LYS-ASN-HIS-ILE-ALA-SER-SER-ASP-TYR-GLU-GLY-ILE-VAL-THR-VAL-TRP-ASP-VAL-THR-THR-ARG-GLN-SER-LEU-MET-GLU-TYR-GLU-GLU-HIS-GLU-LYS-ARG-ALA-TRP-SER-VAL-ASP-PHE-SER-ARG-THR-GLU-PRO-SER-MET-LEU-VAL-SER-GLY-SER-ASP-ASP-CYS-LYS-VAL-LYS-VAL-TRP-CSO-THR-ARG-GLN-GLU-ALA-SER-VAL-ILE-ASN-ILE-ASP-MET-LYS-ALA-ASN-ILE-CYS-CSO-VAL-LYS-TYR-ASN-PRO-GLY-SER-SER-ASN-TYR-ILE-ALA-VAL-GLY-SER-ALA-ASP-HIS-HIS-ILE-HIS-TYR-TYR-ASP-LEU-ARG-ASN-ILE-SER-GLN-PRO-LEU-HIS-VAL-PHE-SER-GLY-HIS-LYS-LYS-ALA-VAL-SER-TYR-VAL-LYS-PHE-LEU-SER-ASN-ASN-GLU-LEU-ALA-SER-ALA-SER-THR-ASP-SER-THR-LEU-ARG-LEU-TRP-ASP-VAL-LYS-ASP-ASN-LEU-PRO-VAL-ARG-THR-PHE-ARG-GLY-HIS-THR-ASN-GLU-LYS-ASN-PHE-VAL-GLY-LEU-THR-VAL-ASN-SER-GLU-TYR-LEU-ALA-CYS-GLY-SER-GLU-THR-ASN-GLU-VAL-TYR-VAL-TYR-HIS-LYS-GLU-ILE-THR-ARG-PRO-VAL-THR-SER-HIS-ARG-PHE-GLY-SER-PRO-ASP-MET-ASP-ASP-ALA-GLU-GLU-GLU-ALA-GLY-SER-TYR-PHE-ILE-SER-ALA-VAL-CYS-TRP-LYS-SER-ASP-SER-PRO-THR-MET-LEU-THR-ALA-ASN-SER-GLN-GLY-THR-ILE-LYS-VAL-LEU-VAL-LEU-ALA-ALA,ACE-GLY-PHE-GLY-VAL-VAL-PRO-SER-PHE-TYR,330,10,[NH3+]CC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CO)C(C)C)C(C)C)Cc1ccccc1,Kd=39uM,4.408935,4.41,1,A,A,1,A,A,0,,B,A,,1,1,330,10,0,CC(C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,,CC(C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)C,0.887627124786377,0.8268698453903198,92.81385040283205,90.95720672607422,0.3841694593429565,0.6154811382293701,0.92471843957901,0.893257737159729,0.8617613911628723,0.8102728128433228,GFGVVPSFY,Low,"(4.319, 4.456]",train
6QTW,protein-peptide,Q43125 P43254,GAMTFTRYSRLRVIAEIRHGDIFHSANIVSSIEFDRDDELFATAGVSRCIKVFDFSSVVNEPADMQCPIVEMSTRSKLSCLSWNKHEKNHIASSDYEGIVTVWDVTTRQSLMEYEEHEKRAWSVDFSRTEPSMLVSGSDDCKVKVWCTRQEASVINIDMKANICCVKYNPGSSNYIAVGSADHHIHYYDLRNISQPLHVFSGHKKAVSYVKFLSNNELASASTDSTLRLWDVKDNLPVRTFRGHTNEKNFVGLTVNSEYLACGSETNEVYVYHKEITRPVTSHRFGSPDMDDAEEEAGSYFISAVCWKSDSPTMLTANSQGTIKVLVLAA,EDQMVPSITY,GLY-ALA-MET-THR-PHE-THR-ARG-TYR-SER-ARG-LEU-ARG-VAL-ILE-ALA-GLU-ILE-ARG-HIS-GLY-ASP-ILE-PHE-HIS-SER-ALA-ASN-ILE-VAL-SER-SER-ILE-GLU-PHE-ASP-ARG-ASP-ASP-GLU-LEU-PHE-ALA-THR-ALA-GLY-VAL-SER-ARG-CYS-ILE-LYS-VAL-PHE-ASP-PHE-SER-SER-VAL-VAL-ASN-GLU-PRO-ALA-ASP-MET-GLN-CYS-PRO-ILE-VAL-GLU-MET-SER-THR-ARG-SER-LYS-LEU-SER-CYS-LEU-SER-TRP-ASN-LYS-HIS-GLU-LYS-ASN-HIS-ILE-ALA-SER-SER-ASP-TYR-GLU-GLY-ILE-VAL-THR-VAL-TRP-ASP-VAL-THR-THR-ARG-GLN-SER-LEU-MET-GLU-TYR-GLU-GLU-HIS-GLU-LYS-ARG-ALA-TRP-SER-VAL-ASP-PHE-SER-ARG-THR-GLU-PRO-SER-MET-LEU-VAL-SER-GLY-SER-ASP-ASP-CYS-LYS-VAL-LYS-VAL-TRP-CSO-THR-ARG-GLN-GLU-ALA-SER-VAL-ILE-ASN-ILE-ASP-MET-LYS-ALA-ASN-ILE-CYS-CSO-VAL-LYS-TYR-ASN-PRO-GLY-SER-SER-ASN-TYR-ILE-ALA-VAL-GLY-SER-ALA-ASP-HIS-HIS-ILE-HIS-TYR-TYR-ASP-LEU-ARG-ASN-ILE-SER-GLN-PRO-LEU-HIS-VAL-PHE-SER-GLY-HIS-LYS-LYS-ALA-VAL-SER-TYR-VAL-LYS-PHE-LEU-SER-ASN-ASN-GLU-LEU-ALA-SER-ALA-SER-THR-ASP-SER-THR-LEU-ARG-LEU-TRP-ASP-VAL-LYS-ASP-ASN-LEU-PRO-VAL-ARG-THR-PHE-ARG-GLY-HIS-THR-ASN-GLU-LYS-ASN-PHE-VAL-GLY-LEU-THR-VAL-ASN-SER-GLU-TYR-LEU-ALA-CYS-GLY-SER-GLU-THR-ASN-GLU-VAL-TYR-VAL-TYR-HIS-LYS-GLU-ILE-THR-ARG-PRO-VAL-THR-SER-HIS-ARG-PHE-GLY-SER-PRO-ASP-MET-ASP-ASP-ALA-GLU-GLU-GLU-ALA-GLY-SER-TYR-PHE-ILE-SER-ALA-VAL-CYS-TRP-LYS-SER-ASP-SER-PRO-THR-MET-LEU-THR-ALA-ASN-SER-GLN-GLY-THR-ILE-LYS-VAL-LEU-VAL-LEU-ALA-ALA,ACE-GLU-ASP-GLN-MET-VAL-PRO-SER-ILE-THR-TYR,330,11,CSCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CCC(=O)N,Kd=3.0uM,5.522879,5.52,1,A,A,1,A,A,0,,B,A,,1,1,330,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,0.8743433952331543,0.8630748987197876,91.87400817871094,91.41917419433594,0.3941535949707031,0.564666211605072,0.9213441610336304,0.9045276045799256,0.8442108035087585,0.8527117371559143,EDQMVPSITY,Low,"(5.463, 5.6]",val
6QTS,protein-peptide,Q9FN03 P43254,GAMTFTRYSRLRVIAEIRHGDIFHSANIVSSIEFSDRDDELFATAGVSRCIKVFDFSSVVNEPADMQCPIVEMSTRSKLSCLSWNKHEKNHIASSDYEGIVTVWDVTTRQSLMEYEEHEKRAWSVDFSRTEPSMLVSGSDDCKVKVWCTRQEASVINIDMKANICCVKYNPGSSNYIAVGSADHHIHYYDLRNISQPLHVFSGHKKAVSYVKFLSNNELASASTDSTLRLWDVKDNLPVRTFRGHTNEKNFVGLTVNSEYLACGSETNEVYVYHKEITRPVTSHRFGSPDMDDAEEEAGSYFISAVCWKSDSPTMLTANSQGTIKVLVLAA,RYAVVPDE,GLY-ALA-MET-THR-PHE-THR-ARG-TYR-SER-ARG-LEU-ARG-VAL-ILE-ALA-GLU-ILE-ARG-HIS-GLY-ASP-ILE-PHE-HIS-SER-ALA-ASN-ILE-VAL-SER-SER-ILE-GLU-PHE-SER-ASP-ARG-ASP-ASP-GLU-LEU-PHE-ALA-THR-ALA-GLY-VAL-SER-ARG-CME-ILE-LYS-VAL-PHE-ASP-PHE-SER-SER-VAL-VAL-ASN-GLU-PRO-ALA-ASP-MET-GLN-CME-PRO-ILE-VAL-GLU-MET-SER-THR-ARG-SER-LYS-LEU-SER-CSO-LEU-SER-TRP-ASN-LYS-HIS-GLU-LYS-ASN-HIS-ILE-ALA-SER-SER-ASP-TYR-GLU-GLY-ILE-VAL-THR-VAL-TRP-ASP-VAL-THR-THR-ARG-GLN-SER-LEU-MET-GLU-TYR-GLU-GLU-HIS-GLU-LYS-ARG-ALA-TRP-SER-VAL-ASP-PHE-SER-ARG-THR-GLU-PRO-SER-MET-LEU-VAL-SER-GLY-SER-ASP-ASP-CSO-LYS-VAL-LYS-VAL-TRP-CSO-THR-ARG-GLN-GLU-ALA-SER-VAL-ILE-ASN-ILE-ASP-MET-LYS-ALA-ASN-ILE-CYS-CSO-VAL-LYS-TYR-ASN-PRO-GLY-SER-SER-ASN-TYR-ILE-ALA-VAL-GLY-SER-ALA-ASP-HIS-HIS-ILE-HIS-TYR-TYR-ASP-LEU-ARG-ASN-ILE-SER-GLN-PRO-LEU-HIS-VAL-PHE-SER-GLY-HIS-LYS-LYS-ALA-VAL-SER-TYR-VAL-LYS-PHE-LEU-SER-ASN-ASN-GLU-LEU-ALA-SER-ALA-SER-THR-ASP-SER-THR-LEU-ARG-LEU-TRP-ASP-VAL-LYS-ASP-ASN-LEU-PRO-VAL-ARG-THR-PHE-ARG-GLY-HIS-THR-ASN-GLU-LYS-ASN-PHE-VAL-GLY-LEU-THR-VAL-ASN-SER-GLU-TYR-LEU-ALA-CYS-GLY-SER-GLU-THR-ASN-GLU-VAL-TYR-VAL-TYR-HIS-LYS-GLU-ILE-THR-ARG-PRO-VAL-THR-SER-HIS-ARG-PHE-GLY-SER-PRO-ASP-MET-ASP-ASP-ALA-GLU-GLU-GLU-ALA-GLY-SER-TYR-PHE-ILE-SER-ALA-VAL-CYS-TRP-LYS-SER-ASP-SER-PRO-THR-MET-LEU-THR-ALA-ASN-SER-GLN-GLY-THR-ILE-LYS-VAL-LEU-VAL-LEU-ALA-ALA,ACE-ARG-TYR-ALA-VAL-VAL-PRO-ASP-GLU,331,9,OC(=O)C[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C,Kd=16uM,4.79588,4.8,1,A,A,1,A,A,0,,B,A,,1,1,331,9,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,0.9122061133384703,0.9148225784301758,93.2539291381836,91.04389190673828,0.3793505728244781,0.4811626672744751,0.9299399256706238,0.9211326241493224,0.8930233716964722,0.9132450819015504,RYAVVPDE,Low,"(4.745, 4.866]",train
6QTQ,protein-peptide,Q9FN03 P43254,GAMTFTRYSRLRVIAEIRHGDIFHSANIVSSIEFDRDDELFATAGVSRCIKVFDFSSVVNEPADMQCPIVEMSTRSKLSCLSWNKHEKNHIASSDYEGIVTVWDVTTRQSLMEYEEHEKRAWSVDFSRTEPSMLVSGSDDCKVKVWCTRQEASVINIDMKANICCVKYNPGSSNYIAVGSADHHIHYYDLRNISQPLHVFSGHKKAVSYVKFLSNNELASASTDSTLRLWDVKDNLPVRTFRGHTNEKNFVGLTVNSEYLACGSETNEVYVYHKEITRPVTSHRFGSPDMDDAEEEAGSYFISAVCWKSDSPTMLTANSQGTIKVLVLAA,RYAVVPDE,GLY-ALA-MET-THR-PHE-THR-ARG-TYR-SER-ARG-LEU-ARG-VAL-ILE-ALA-GLU-ILE-ARG-HIS-GLY-ASP-ILE-PHE-HIS-SER-ALA-ASN-ILE-VAL-SER-SER-ILE-GLU-PHE-ASP-ARG-ASP-ASP-GLU-LEU-PHE-ALA-THR-ALA-GLY-VAL-SER-ARG-CSO-ILE-LYS-VAL-PHE-ASP-PHE-SER-SER-VAL-VAL-ASN-GLU-PRO-ALA-ASP-MET-GLN-CYS-PRO-ILE-VAL-GLU-MET-SER-THR-ARG-SER-LYS-LEU-SER-CSO-LEU-SER-TRP-ASN-LYS-HIS-GLU-LYS-ASN-HIS-ILE-ALA-SER-SER-ASP-TYR-GLU-GLY-ILE-VAL-THR-VAL-TRP-ASP-VAL-THR-THR-ARG-GLN-SER-LEU-MET-GLU-TYR-GLU-GLU-HIS-GLU-LYS-ARG-ALA-TRP-SER-VAL-ASP-PHE-SER-ARG-THR-GLU-PRO-SER-MET-LEU-VAL-SER-GLY-SER-ASP-ASP-CYS-LYS-VAL-LYS-VAL-TRP-CSO-THR-ARG-GLN-GLU-ALA-SER-VAL-ILE-ASN-ILE-ASP-MET-LYS-ALA-ASN-ILE-CYS-CSO-VAL-LYS-TYR-ASN-PRO-GLY-SER-SER-ASN-TYR-ILE-ALA-VAL-GLY-SER-ALA-ASP-HIS-HIS-ILE-HIS-TYR-TYR-ASP-LEU-ARG-ASN-ILE-SER-GLN-PRO-LEU-HIS-VAL-PHE-SER-GLY-HIS-LYS-LYS-ALA-VAL-SER-TYR-VAL-LYS-PHE-LEU-SER-ASN-ASN-GLU-LEU-ALA-SER-ALA-SER-THR-ASP-SER-THR-LEU-ARG-LEU-TRP-ASP-VAL-LYS-ASP-ASN-LEU-PRO-VAL-ARG-THR-PHE-ARG-GLY-HIS-THR-ASN-GLU-LYS-ASN-PHE-VAL-GLY-LEU-THR-VAL-ASN-SER-GLU-TYR-LEU-ALA-CYS-GLY-SER-GLU-THR-ASN-GLU-VAL-TYR-VAL-TYR-HIS-LYS-GLU-ILE-THR-ARG-PRO-VAL-THR-SER-HIS-ARG-PHE-GLY-SER-PRO-ASP-MET-ASP-ASP-ALA-GLU-GLU-GLU-ALA-GLY-SER-TYR-PHE-ILE-SER-ALA-VAL-CYS-TRP-LYS-SER-ASP-SER-PRO-THR-MET-LEU-THR-ALA-ASN-SER-GLN-GLY-THR-ILE-LYS-VAL-LEU-VAL-LEU-ALA-ALA,ACE-ARG-TYR-ALA-VAL-VAL-PRO-ASP-GLU,330,9,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C)C(C)C)C)Cc1ccc(cc1)O)[NH3+])N,Kd=190uM,3.721246,3.72,1,A,A,1,A,A,0,,B,A,,1,1,330,9,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,0.9117922782897948,0.8939864635467529,93.56050872802734,92.00406646728516,0.367749959230423,0.5175006985664368,0.9293426871299744,0.9133803248405457,0.8926117420196533,0.8891379833221436,RYAVVPDE,Low,"(3.548, 3.924]",train
6QTM,protein-peptide,P11978 O42838,GPKPKNTKENLSKSSWRQEWLANLKLISVSLVDEFPSELSDSDRQIINEKMQLLKDIFANNLKSAISNNFRESDIIILKGEIEDYPMSSEIKIYYNELQNKPDAKKARFWSFMKTQRFVSNMGFDIQ,ESPPSLDSSPPNTSFNA,GLY-PRO-LYS-PRO-LYS-ASN-THR-LYS-GLU-ASN-LEU-SER-LYS-SER-SER-TRP-ARG-GLN-GLU-TRP-LEU-ALA-ASN-LEU-LYS-LEU-ILE-SER-VAL-SER-LEU-VAL-ASP-GLU-PHE-PRO-SER-GLU-LEU-SER-ASP-SER-ASP-ARG-GLN-ILE-ILE-ASN-GLU-LYS-MSE-GLN-LEU-LEU-LYS-ASP-ILE-PHE-ALA-ASN-ASN-LEU-LYS-SER-ALA-ILE-SER-ASN-ASN-PHE-ARG-GLU-SER-ASP-ILE-ILE-ILE-LEU-LYS-GLY-GLU-ILE-GLU-ASP-TYR-PRO-MSE-SER-SER-GLU-ILE-LYS-ILE-TYR-TYR-ASN-GLU-LEU-GLN-ASN-LYS-PRO-ASP-ALA-LYS-LYS-ALA-ARG-PHE-TRP-SER-PHE-MSE-LYS-THR-GLN-ARG-PHE-VAL-SER-ASN-MSE-GLY-PHE-ASP-ILE-GLN,GLU-SER-PRO-PRO-SER-LEU-ASP-SER-SEP-PRO-PRO-ASN-THR-SER-PHE-ASN-ALA,127,17,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@H](O)C)CC(=O)N)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CC(=O)O,Kd=5.57uM,5.254145,5.25,1,A,A,1,A,A,0,,D,A,,0,1,127,17,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,0.912151038646698,0.8299055099487305,83.10476684570312,88.89336395263672,0.3835146129131317,0.7051222920417786,0.8845596313476562,0.8438417315483093,0.784500241279602,0.7772088646888733,ESPPSLDSSPPNTSFNA,Low,"(5.222, 5.31]",train
6QS1,protein-peptide,P12821,LDPGLQPGQFSADEAGAQLFAQSYQSSAEQVLFQSVAASWAHDTNITAENARRQEEAALLSQEFAEAWGQKAKELYEPIWQQFTDPQLRRIIGAVRTLGSANLPLAKRQQYNALLSQMSRIYSTAKVCLPQKTATCWSLDPDLTNILASSRSYAMLLFAWEGWHNAAGIPLKPLYEDFTALSNEAYKQDGFTDTGAYWRSWYNSPTFEDDLEHLYQQLEPLYLNLHAFVRRALHRRYGDRYINLRGPIPAHLLGDMWAQSWENIYDMVVPFPDKPNLDVTSTMLQQGWQATHMFRVAEEFFTSLELSPMPPEFWEGSMLEKPADGREVVCHASAWDFYNRKDFRIKQCTRVTMDQLSTVHHEMGHIQYYLQYKDLPVSLRRGANPGFHEAIGDVLALSVSTPEHLHKIGLLDRVTNDTESDINYLLKMALEKIAFLPFGYLVDQWRWGVFSGRTPPSRYNFDWWYLRTKYQGICPPVTRNETHFDAGAKFHVPNVTPYIRYFVSFVLQFQFHEALCKEAGYEGPLHQCDIYRSTKAGAKLRKVLRAGSSRPWQEVLKDMVGLDALDAQPLLKYFQLVTQWLQEQNQQNGEVLGWPEYQWHPPLPDNYPEGIDLVTDEAEASKFVEEYDL,QGLPPRPKIPP,LEU-ASP-PRO-GLY-LEU-GLN-PRO-GLY-GLN-PHE-SER-ALA-ASP-GLU-ALA-GLY-ALA-GLN-LEU-PHE-ALA-GLN-SER-TYR-GLN-SER-SER-ALA-GLU-GLN-VAL-LEU-PHE-GLN-SER-VAL-ALA-ALA-SER-TRP-ALA-HIS-ASP-THR-ASN-ILE-THR-ALA-GLU-ASN-ALA-ARG-ARG-GLN-GLU-GLU-ALA-ALA-LEU-LEU-SER-GLN-GLU-PHE-ALA-GLU-ALA-TRP-GLY-GLN-LYS-ALA-LYS-GLU-LEU-TYR-GLU-PRO-ILE-TRP-GLN-GLN-PHE-THR-ASP-PRO-GLN-LEU-ARG-ARG-ILE-ILE-GLY-ALA-VAL-ARG-THR-LEU-GLY-SER-ALA-ASN-LEU-PRO-LEU-ALA-LYS-ARG-GLN-GLN-TYR-ASN-ALA-LEU-LEU-SER-GLN-MET-SER-ARG-ILE-TYR-SER-THR-ALA-LYS-VAL-CYS-LEU-PRO-GLN-LYS-THR-ALA-THR-CYS-TRP-SER-LEU-ASP-PRO-ASP-LEU-THR-ASN-ILE-LEU-ALA-SER-SER-ARG-SER-TYR-ALA-MET-LEU-LEU-PHE-ALA-TRP-GLU-GLY-TRP-HIS-ASN-ALA-ALA-GLY-ILE-PRO-LEU-LYS-PRO-LEU-TYR-GLU-ASP-PHE-THR-ALA-LEU-SER-ASN-GLU-ALA-TYR-LYS-GLN-ASP-GLY-PHE-THR-ASP-THR-GLY-ALA-TYR-TRP-ARG-SER-TRP-TYR-ASN-SER-PRO-THR-PHE-GLU-ASP-ASP-LEU-GLU-HIS-LEU-TYR-GLN-GLN-LEU-GLU-PRO-LEU-TYR-LEU-ASN-LEU-HIS-ALA-PHE-VAL-ARG-ARG-ALA-LEU-HIS-ARG-ARG-TYR-GLY-ASP-ARG-TYR-ILE-ASN-LEU-ARG-GLY-PRO-ILE-PRO-ALA-HIS-LEU-LEU-GLY-ASP-MET-TRP-ALA-GLN-SER-TRP-GLU-ASN-ILE-TYR-ASP-MET-VAL-VAL-PRO-PHE-PRO-ASP-LYS-PRO-ASN-LEU-ASP-VAL-THR-SER-THR-MET-LEU-GLN-GLN-GLY-TRP-GLN-ALA-THR-HIS-MET-PHE-ARG-VAL-ALA-GLU-GLU-PHE-PHE-THR-SER-LEU-GLU-LEU-SER-PRO-MET-PRO-PRO-GLU-PHE-TRP-GLU-GLY-SER-MET-LEU-GLU-LYS-PRO-ALA-ASP-GLY-ARG-GLU-VAL-VAL-CYS-HIS-ALA-SER-ALA-TRP-ASP-PHE-TYR-ASN-ARG-LYS-ASP-PHE-ARG-ILE-LYS-GLN-CYS-THR-ARG-VAL-THR-MET-ASP-GLN-LEU-SER-THR-VAL-HIS-HIS-GLU-MET-GLY-HIS-ILE-GLN-TYR-TYR-LEU-GLN-TYR-LYS-ASP-LEU-PRO-VAL-SER-LEU-ARG-ARG-GLY-ALA-ASN-PRO-GLY-PHE-HIS-GLU-ALA-ILE-GLY-ASP-VAL-LEU-ALA-LEU-SER-VAL-SER-THR-PRO-GLU-HIS-LEU-HIS-LYS-ILE-GLY-LEU-LEU-ASP-ARG-VAL-THR-ASN-ASP-THR-GLU-SER-ASP-ILE-ASN-TYR-LEU-LEU-LYS-MET-ALA-LEU-GLU-LYS-ILE-ALA-PHE-LEU-PRO-PHE-GLY-TYR-LEU-VAL-ASP-GLN-TRP-ARG-TRP-GLY-VAL-PHE-SER-GLY-ARG-THR-PRO-PRO-SER-ARG-TYR-ASN-PHE-ASP-TRP-TRP-TYR-LEU-ARG-THR-LYS-TYR-GLN-GLY-ILE-CYS-PRO-PRO-VAL-THR-ARG-ASN-GLU-THR-HIS-PHE-ASP-ALA-GLY-ALA-LYS-PHE-HIS-VAL-PRO-ASN-VAL-THR-PRO-TYR-ILE-ARG-TYR-PHE-VAL-SER-PHE-VAL-LEU-GLN-PHE-GLN-PHE-HIS-GLU-ALA-LEU-CYS-LYS-GLU-ALA-GLY-TYR-GLU-GLY-PRO-LEU-HIS-GLN-CYS-ASP-ILE-TYR-ARG-SER-THR-LYS-ALA-GLY-ALA-LYS-LEU-ARG-LYS-VAL-LEU-ARG-ALA-GLY-SER-SER-ARG-PRO-TRP-GLN-GLU-VAL-LEU-LYS-ASP-MET-VAL-GLY-LEU-ASP-ALA-LEU-ASP-ALA-GLN-PRO-LEU-LEU-LYS-TYR-PHE-GLN-LEU-VAL-THR-GLN-TRP-LEU-GLN-GLU-GLN-ASN-GLN-GLN-ASN-GLY-GLU-VAL-LEU-GLY-TRP-PRO-GLU-TYR-GLN-TRP-HIS-PRO-PRO-LEU-PRO-ASP-ASN-TYR-PRO-GLU-GLY-ILE-ASP-LEU-VAL-THR-ASP-GLU-ALA-GLU-ALA-SER-LYS-PHE-VAL-GLU-GLU-TYR-ASP-LEU,PCA-GLY-LEU-PRO-PRO-ARG-PRO-LYS-ILE-PRO-PRO,629,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCC(=O)N1)CC(C)C)CCC[NH+]=C(N)N,Ki=2430nM,5.614394,5.61,1,A,A,1,A,A,0,,E,A,,1,1,629,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1CCC(=O)N1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C1CCC(=O)N1)C(=O)O,0.8939023017883301,0.860817551612854,90.20895385742188,88.49752044677734,0.4031489789485931,0.564490556716919,0.9279464483261108,0.917784869670868,0.8746490478515625,0.8465756773948669,QGLPPRPKIPP,Low,"(5.6, 5.699]",train
6QCG,protein-peptide,Q9H211 P12004,GPMFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,MEQRRVTDFFARRR,GLY-PRO-MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,MET-GLU-GLN-ARG-ARG-VAL-THR-ASP-PHE-PHE-ALA-ARG-ARG-ARG,263,14,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=7200nM,5.142668,5.14,1,A,A,1,A,A,0,,G,A,dimer,0,1,263,14,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(C)C)C(=O)O)C(=O)O,0.9436368942260742,0.759296178817749,89.8353042602539,85.1025619506836,0.4029089510440826,0.8855229616165161,0.913424551486969,0.8563724756240845,0.9196015000343324,0.7350270748138428,MEQRRVTDFFARRR,Low,"(5.105, 5.222]",train
6QC0,protein-peptide,Q9NZJ0 P12004,GPMFEARLVQGSILKKVLEALKDLINEACWDISSSGVNLQSMDSSHVSLVQLTLRSEGFDTYRCDRNLAMGVNLTSMSKILKCAGNEDIITLRAEDNADTLALVFEAPNQEKVSDYEMKLMDLDVEQLGIPEQEYSCVVKMPSGEFARICRDLSHIGDAVVISCAKDGVKFSASGELGNGNIKLSQTSNVDKEEEAVTIEMNEPVQLTFALRYLNFFTKATPLSSTVTLSMSADVPLVVEYKIADMGHLKYYLAPKIEDEEGS,SSMRKICTYFHRKS,GLY-PRO-MET-PHE-GLU-ALA-ARG-LEU-VAL-GLN-GLY-SER-ILE-LEU-LYS-LYS-VAL-LEU-GLU-ALA-LEU-LYS-ASP-LEU-ILE-ASN-GLU-ALA-CYS-TRP-ASP-ILE-SER-SER-SER-GLY-VAL-ASN-LEU-GLN-SER-MET-ASP-SER-SER-HIS-VAL-SER-LEU-VAL-GLN-LEU-THR-LEU-ARG-SER-GLU-GLY-PHE-ASP-THR-TYR-ARG-CYS-ASP-ARG-ASN-LEU-ALA-MET-GLY-VAL-ASN-LEU-THR-SER-MET-SER-LYS-ILE-LEU-LYS-CYS-ALA-GLY-ASN-GLU-ASP-ILE-ILE-THR-LEU-ARG-ALA-GLU-ASP-ASN-ALA-ASP-THR-LEU-ALA-LEU-VAL-PHE-GLU-ALA-PRO-ASN-GLN-GLU-LYS-VAL-SER-ASP-TYR-GLU-MET-LYS-LEU-MET-ASP-LEU-ASP-VAL-GLU-GLN-LEU-GLY-ILE-PRO-GLU-GLN-GLU-TYR-SER-CYS-VAL-VAL-LYS-MET-PRO-SER-GLY-GLU-PHE-ALA-ARG-ILE-CYS-ARG-ASP-LEU-SER-HIS-ILE-GLY-ASP-ALA-VAL-VAL-ILE-SER-CYS-ALA-LYS-ASP-GLY-VAL-LYS-PHE-SER-ALA-SER-GLY-GLU-LEU-GLY-ASN-GLY-ASN-ILE-LYS-LEU-SER-GLN-THR-SER-ASN-VAL-ASP-LYS-GLU-GLU-GLU-ALA-VAL-THR-ILE-GLU-MET-ASN-GLU-PRO-VAL-GLN-LEU-THR-PHE-ALA-LEU-ARG-TYR-LEU-ASN-PHE-PHE-THR-LYS-ALA-THR-PRO-LEU-SER-SER-THR-VAL-THR-LEU-SER-MET-SER-ALA-ASP-VAL-PRO-LEU-VAL-VAL-GLU-TYR-LYS-ILE-ALA-ASP-MET-GLY-HIS-LEU-LYS-TYR-TYR-LEU-ALA-PRO-LYS-ILE-GLU-ASP-GLU-GLU-GLY-SER,SER-SER-MET-ARG-LYS-ILE-CYS-THR-TYR-PHE-HIS-ARG-LYS-SER,263,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1cnc[nH]1)Cc1ccccc1)Cc1ccc(cc1)O)[C@H](O)C)CS)[C@H](CC)C)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)[C@H](CO)[NH3+],Kd=57nM,7.244125,7.24,1,A,A,1,A,A,0,,B,A,,1,1,263,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,0.9238032698631288,0.7476643919944763,86.81707000732422,85.34719848632812,0.4045479595661163,0.8641237616539001,0.913334310054779,0.8549221158027649,0.8948320746421814,0.7208499312400818,SSMRKICTYFHRKS,Moderate,"(7.049, 7.268]",train
6Q4Q,protein-peptide,P68400,GPVPSRARVYTDVNTHRPSEYWDYESHVVEWGNQDDYQLVRKLGRGKYSEVFEAINITNNEKVVVKILKPVKKKKIKREIKILENLRGGPNIITLADIVKDPVSRTPALVFEHVNNTDFKQLYQTLTDYDIRFYMYEILKALDYCHSMGIMHRDVKPHNVMIDHEHRKLRLIDWGLAEFYHPGQEYNVRVASRYFKGPELLVDYQMYDYSLDMWSLGCMLASMIFRKEPFFHGHDNYDQLVRIAKVLGTEDLYDYIDKYNIELDPRFNDILGRHSRKRWERFVHSENQHLVSPEALDFLDKLLRYDHQSRLTAREAMEHPYFYTVVK,RLYGFKWH,GLY-PRO-VAL-PRO-SER-ARG-ALA-ARG-VAL-TYR-THR-ASP-VAL-ASN-THR-HIS-ARG-PRO-SER-GLU-TYR-TRP-ASP-TYR-GLU-SER-HIS-VAL-VAL-GLU-TRP-GLY-ASN-GLN-ASP-ASP-TYR-GLN-LEU-VAL-ARG-LYS-LEU-GLY-ARG-GLY-LYS-TYR-SER-GLU-VAL-PHE-GLU-ALA-ILE-ASN-ILE-THR-ASN-ASN-GLU-LYS-VAL-VAL-VAL-LYS-ILE-LEU-LYS-PRO-VAL-LYS-LYS-LYS-LYS-ILE-LYS-ARG-GLU-ILE-LYS-ILE-LEU-GLU-ASN-LEU-ARG-GLY-GLY-PRO-ASN-ILE-ILE-THR-LEU-ALA-ASP-ILE-VAL-LYS-ASP-PRO-VAL-SER-ARG-THR-PRO-ALA-LEU-VAL-PHE-GLU-HIS-VAL-ASN-ASN-THR-ASP-PHE-LYS-GLN-LEU-TYR-GLN-THR-LEU-THR-ASP-TYR-ASP-ILE-ARG-PHE-TYR-MET-TYR-GLU-ILE-LEU-LYS-ALA-LEU-ASP-TYR-CYS-HIS-SER-MET-GLY-ILE-MET-HIS-ARG-ASP-VAL-LYS-PRO-HIS-ASN-VAL-MET-ILE-ASP-HIS-GLU-HIS-ARG-LYS-LEU-ARG-LEU-ILE-ASP-TRP-GLY-LEU-ALA-GLU-PHE-TYR-HIS-PRO-GLY-GLN-GLU-TYR-ASN-VAL-ARG-VAL-ALA-SER-ARG-TYR-PHE-LYS-GLY-PRO-GLU-LEU-LEU-VAL-ASP-TYR-GLN-MET-TYR-ASP-TYR-SER-LEU-ASP-MET-TRP-SER-LEU-GLY-CYS-MET-LEU-ALA-SER-MET-ILE-PHE-ARG-LYS-GLU-PRO-PHE-PHE-HIS-GLY-HIS-ASP-ASN-TYR-ASP-GLN-LEU-VAL-ARG-ILE-ALA-LYS-VAL-LEU-GLY-THR-GLU-ASP-LEU-TYR-ASP-TYR-ILE-ASP-LYS-TYR-ASN-ILE-GLU-LEU-ASP-PRO-ARG-PHE-ASN-ASP-ILE-LEU-GLY-ARG-HIS-SER-ARG-LYS-ARG-TRP-GLU-ARG-PHE-VAL-HIS-SER-GLU-ASN-GLN-HIS-LEU-VAL-SER-PRO-GLU-ALA-LEU-ASP-PHE-LEU-ASP-LYS-LEU-LEU-ARG-TYR-ASP-HIS-GLN-SER-ARG-LEU-THR-ALA-ARG-GLU-ALA-MET-GLU-HIS-PRO-TYR-PHE-TYR-THR-VAL-VAL-LYS,ARG-LEU-TYR-GLY-PHE-LYS-TRP-HIS,327,8,[NH3+]CCCC[C@@H]1NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)CNC(=O)C)Cn2cc(c3cc(c4cn(C[C@H]([N@H+]5[C@@]([C@@H](NC(=O)[C@@H](NC1=O)Cc1c[nH]c6c1cccc6)Cc1c[nH]cn1)(O)O5)C(=O)NCC(=O)NCC(=O)N)nn4)cc(c3)C(=O)O)nn2)Cc1ccccc1,Kd=150nM,6.823909,6.82,1,A,A,1,A,A,0,,C,A,,1,1,327,8,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.948148787021637,0.8408119678497314,90.4613037109375,87.94989013671875,0.3484449088573456,0.6659506559371948,0.9399224519729614,0.9246021509170532,0.935279905796051,0.8198643922805786,RLYGFKWH,Low,"(6.696, 6.824]",val
6PXC,protein-peptide,Q9NRY4 P20936,GSTAPPTNQWYHGKLDRTIAEERLRQAGKSGSYLIRESDRRPGSFVLSFLSQMNVVNHFRIIAMSGDYYIGGRRFSSLSDLIGYYSHVSSLLKGEKLLYPVAPPEPVED,EEENIYSVPHDST,GLY-SER-THR-ALA-PRO-PRO-THR-ASN-GLN-TRP-TYR-HIS-GLY-LYS-LEU-ASP-ARG-THR-ILE-ALA-GLU-GLU-ARG-LEU-ARG-GLN-ALA-GLY-LYS-SER-GLY-SER-TYR-LEU-ILE-ARG-GLU-SER-ASP-ARG-ARG-PRO-GLY-SER-PHE-VAL-LEU-SER-PHE-LEU-SER-GLN-MET-ASN-VAL-VAL-ASN-HIS-PHE-ARG-ILE-ILE-ALA-MET-SER-GLY-ASP-TYR-TYR-ILE-GLY-GLY-ARG-ARG-PHE-SER-SER-LEU-SER-ASP-LEU-ILE-GLY-TYR-TYR-SER-HIS-VAL-SER-SER-LEU-LEU-LYS-GLY-GLU-LYS-LEU-LEU-TYR-PRO-VAL-ALA-PRO-PRO-GLU-PRO-VAL-GLU-ASP,ACE-GLU-GLU-GLU-ASN-ILE-PTR-SER-VAL-PRO-HIS-ASP-SER-THR,109,14,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)O)Cc1nc[nH]c1)C(C)C)CO)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)N)C,Kd=0.335uM,6.474955,6.47,1,A,A,1,A,A,0,,U,A,,1,1,109,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,0.9341728091239928,0.8763476014137268,95.43526458740234,93.69407653808594,0.3199833929538727,0.5489492416381836,0.9336591362953186,0.908811330795288,0.867702841758728,0.8682316541671753,EEENIYSVPHDST,Low,"(6.398, 6.523]",train
6PEU,protein-peptide,Q58256 Q58494,MDIKYKLASYRICSPEETFEKIQEALKKIETVEIKNIQHLDKVNIPVYYLKRRVVVDGKEGIAIHYGKGANDIQAKVSACMEAIERFSASYDKNKVKEKPDNPINVEDLILPQYADKNVKEWVEGIDIINNETIDVPADAVFYPTSGKLFRGNTNGLASGNNLDEAILHATLEIIERDAWSLADLARKIPTKINPEDAKNPLIHELIEKYEKAGVKIILKDLTSEFEIPVVAAISDDLSKNPLMLCVGVGCHLHPEIAILRALTEVAQSRASQLHGFRRDAKLREEFTSKIPYERLKRIHRKWFEFEGEINIADMPNNARYDLKKDLKFIKDKLSEFGFDKLIYVDLNKVGVDAVRVIIPKMEVYTIDRDRLSRRAFERVKKLYY,GRLGFYGYDLQD,MET-ASP-ILE-LYS-TYR-LYS-LEU-ALA-SER-TYR-ARG-ILE-CYS-SER-PRO-GLU-GLU-THR-PHE-GLU-LYS-ILE-GLN-GLU-ALA-LEU-LYS-LYS-ILE-GLU-THR-VAL-GLU-ILE-LYS-ASN-ILE-GLN-HIS-LEU-ASP-LYS-VAL-ASN-ILE-PRO-VAL-TYR-TYR-LEU-LYS-ARG-ARG-VAL-VAL-VAL-ASP-GLY-LYS-GLU-GLY-ILE-ALA-ILE-HIS-TYR-GLY-LYS-GLY-ALA-ASN-ASP-ILE-GLN-ALA-LYS-VAL-SER-ALA-CYS-MET-GLU-ALA-ILE-GLU-ARG-PHE-SER-ALA-SER-TYR-ASP-LYS-ASN-LYS-VAL-LYS-GLU-LYS-PRO-ASP-ASN-PRO-ILE-ASN-VAL-GLU-ASP-LEU-ILE-LEU-PRO-GLN-TYR-ALA-ASP-LYS-ASN-VAL-LYS-GLU-TRP-VAL-GLU-GLY-ILE-ASP-ILE-ILE-ASN-ASN-GLU-THR-ILE-ASP-VAL-PRO-ALA-ASP-ALA-VAL-PHE-TYR-PRO-THR-SER-GLY-LYS-LEU-PHE-ARG-GLY-ASN-THR-ASN-GLY-LEU-ALA-SER-GLY-ASN-ASN-LEU-ASP-GLU-ALA-ILE-LEU-HIS-ALA-THR-LEU-GLU-ILE-ILE-GLU-ARG-ASP-ALA-TRP-SER-LEU-ALA-ASP-LEU-ALA-ARG-LYS-ILE-PRO-THR-LYS-ILE-ASN-PRO-GLU-ASP-ALA-LYS-ASN-PRO-LEU-ILE-HIS-GLU-LEU-ILE-GLU-LYS-TYR-GLU-LYS-ALA-GLY-VAL-LYS-ILE-ILE-LEU-LYS-ASP-LEU-THR-SER-GLU-PHE-GLU-ILE-PRO-VAL-VAL-ALA-ALA-ILE-SER-ASP-ASP-LEU-SER-LYS-ASN-PRO-LEU-MET-LEU-CYS-VAL-GLY-VAL-GLY-CYS-HIS-LEU-HIS-PRO-GLU-ILE-ALA-ILE-LEU-ARG-ALA-LEU-THR-GLU-VAL-ALA-GLN-SER-ARG-ALA-SER-GLN-LEU-HIS-GLY-PHE-ARG-ARG-ASP-ALA-LYS-LEU-ARG-GLU-GLU-PHE-THR-SER-LYS-ILE-PRO-TYR-GLU-ARG-LEU-LYS-ARG-ILE-HIS-ARG-LYS-TRP-PHE-GLU-PHE-GLU-GLY-GLU-ILE-ASN-ILE-ALA-ASP-MET-PRO-ASN-ASN-ALA-ARG-TYR-ASP-LEU-LYS-LYS-ASP-LEU-LYS-PHE-ILE-LYS-ASP-LYS-LEU-SER-GLU-PHE-GLY-PHE-ASP-LYS-LEU-ILE-TYR-VAL-ASP-LEU-ASN-LYS-VAL-GLY-VAL-ASP-ALA-VAL-ARG-VAL-ILE-ILE-PRO-LYS-MET-GLU-VAL-TYR-THR-ILE-ASP-ARG-ASP-ARG-LEU-SER-ARG-ARG-ALA-PHE-GLU-ARG-VAL-LYS-LYS-LEU-TYR-TYR,GLY-ARG-LEU-GLY-PHE-TYR-GLY-TYR-ASP-LEU-GLN-ASP,385,12,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)N)CC(C)C)CC(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)Cc1ccccc1)CC(C)C)CCC[NH+]=C(N)N,Ki=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,M,A,dimer,1,1,385,12,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.8350481390953064,0.7610853910446167,82.75904846191406,76.40568542480469,0.5644973516464233,0.9401493668556212,0.8843193054199219,0.8588290810585022,0.8038386702537537,0.7366494536399841,GRLGFYGYDLQD,Low,"(5.821, 5.959]",train
6OM4,protein-peptide,Q47506,MDYILGRYVKIARYGSGGLVGGGGKEQYVENLVLWENIIKTAYCFITPSSYTAALETANIPEKDFSNCFRFLKENFFIIPSEYNNSTENNRYSRNFLHYQSYGANPVLVQDKLKNAKVVILGCGGIGNHVSVILATSGIGEIILIDNDQIENTNLTRQVLFSEDDVGKNKTEVIKRELLKRNSEISVSEIALNINDYTDLHKVPEADIWVVSADHPFNLINWVNKYCVRANQPYINAGYVNDIAVFGPLYVPGKTGCYECQKVVADLYGAEKENIDHKIKLINSRFKPATFAPVNNVAAALCAADVIKFIGKYSEPLSLNKRIGIWSDEIKIHSQNMGRSPVCSVCGN,MRTGNAD,MET-ASP-TYR-ILE-LEU-GLY-ARG-TYR-VAL-LYS-ILE-ALA-ARG-TYR-GLY-SER-GLY-GLY-LEU-VAL-GLY-GLY-GLY-GLY-LYS-GLU-GLN-TYR-VAL-GLU-ASN-LEU-VAL-LEU-TRP-GLU-ASN-ILE-ILE-LYS-THR-ALA-TYR-CYS-PHE-ILE-THR-PRO-SER-SER-TYR-THR-ALA-ALA-LEU-GLU-THR-ALA-ASN-ILE-PRO-GLU-LYS-ASP-PHE-SER-ASN-CYS-PHE-ARG-PHE-LEU-LYS-GLU-ASN-PHE-PHE-ILE-ILE-PRO-SER-GLU-TYR-ASN-ASN-SER-THR-GLU-ASN-ASN-ARG-TYR-SER-ARG-ASN-PHE-LEU-HIS-TYR-GLN-SER-TYR-GLY-ALA-ASN-PRO-VAL-LEU-VAL-GLN-ASP-LYS-LEU-LYS-ASN-ALA-LYS-VAL-VAL-ILE-LEU-GLY-CYS-GLY-GLY-ILE-GLY-ASN-HIS-VAL-SER-VAL-ILE-LEU-ALA-THR-SER-GLY-ILE-GLY-GLU-ILE-ILE-LEU-ILE-ASP-ASN-ASP-GLN-ILE-GLU-ASN-THR-ASN-LEU-THR-ARG-GLN-VAL-LEU-PHE-SER-GLU-ASP-ASP-VAL-GLY-LYS-ASN-LYS-THR-GLU-VAL-ILE-LYS-ARG-GLU-LEU-LEU-LYS-ARG-ASN-SER-GLU-ILE-SER-VAL-SER-GLU-ILE-ALA-LEU-ASN-ILE-ASN-ASP-TYR-THR-ASP-LEU-HIS-LYS-VAL-PRO-GLU-ALA-ASP-ILE-TRP-VAL-VAL-SER-ALA-ASP-HIS-PRO-PHE-ASN-LEU-ILE-ASN-TRP-VAL-ASN-LYS-TYR-CYS-VAL-ARG-ALA-ASN-GLN-PRO-TYR-ILE-ASN-ALA-GLY-TYR-VAL-ASN-ASP-ILE-ALA-VAL-PHE-GLY-PRO-LEU-TYR-VAL-PRO-GLY-LYS-THR-GLY-CYS-TYR-GLU-CYS-GLN-LYS-VAL-VAL-ALA-ASP-LEU-TYR-GLY-ALA-GLU-LYS-GLU-ASN-ILE-ASP-HIS-LYS-ILE-LYS-LEU-ILE-ASN-SER-ARG-PHE-LYS-PRO-ALA-THR-PHE-ALA-PRO-VAL-ASN-ASN-VAL-ALA-ALA-ALA-LEU-CYS-ALA-ALA-ASP-VAL-ILE-LYS-PHE-ILE-GLY-LYS-TYR-SER-GLU-PRO-LEU-SER-LEU-ASN-LYS-ARG-ILE-GLY-ILE-TRP-SER-ASP-GLU-ILE-LYS-ILE-HIS-SER-GLN-ASN-MET-GLY-ARG-SER-PRO-VAL-CYS-SER-VAL-CYS-GLY-ASN,FME-ARG-THR-GLY-ASN-ALA-ASP,348,7,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NP(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)(O)O)CC(=O)O)C)CC(=O)N)[C@H](O)C)CCC[NH+]=C(N)N)NC=O,Kd=3.58uM,5.446117,5.45,1,A,A,1,A,A,0,,C,A,dimer,1,1,348,7,0,CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCCC(NC=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCCC(NC=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,0.6345750689506531,0.780269980430603,83.65174102783203,80.92154693603516,0.593483030796051,0.7677352428436279,0.8558858633041382,0.8621916770935059,0.5493177771568298,0.7597895264625549,MRTGNAD,Low,"(5.31, 5.463]",train
6O3Y,protein-peptide,P53617 Q00416,MGSSHHHHHHSSGLVPRGSHMDFQNFVATLESFKDLKSGISGSRIKKLTTYALDHIDIESKIISLIIDYSRLCPDSHKLGSLYIIDSIGRAYLDETRSNSNSSSNKPGTCAHAINTLGEVIQELLSDAIAKSNQDHKEKIRMLLDIWDRSGLFQKSYLNAIRSKCFAMDISN,EAEDPYDLNPHPQ,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ASP-PHE-GLN-ASN-PHE-VAL-ALA-THR-LEU-GLU-SER-PHE-LYS-ASP-LEU-LYS-SER-GLY-ILE-SER-GLY-SER-ARG-ILE-LYS-LYS-LEU-THR-THR-TYR-ALA-LEU-ASP-HIS-ILE-ASP-ILE-GLU-SER-LYS-ILE-ILE-SER-LEU-ILE-ILE-ASP-TYR-SER-ARG-LEU-CYS-PRO-ASP-SER-HIS-LYS-LEU-GLY-SER-LEU-TYR-ILE-ILE-ASP-SER-ILE-GLY-ARG-ALA-TYR-LEU-ASP-GLU-THR-ARG-SER-ASN-SER-ASN-SER-SER-SER-ASN-LYS-PRO-GLY-THR-CYS-ALA-HIS-ALA-ILE-ASN-THR-LEU-GLY-GLU-VAL-ILE-GLN-GLU-LEU-LEU-SER-ASP-ALA-ILE-ALA-LYS-SER-ASN-GLN-ASP-HIS-LYS-GLU-LYS-ILE-ARG-MET-LEU-LEU-ASP-ILE-TRP-ASP-ARG-SER-GLY-LEU-PHE-GLN-LYS-SER-TYR-LEU-ASN-ALA-ILE-ARG-SER-LYS-CYS-PHE-ALA-MET-ASP-ILE-SER-ASN,GLU-ALA-GLU-ASP-PRO-TYR-ASP-LEU-ASN-PRO-HIS-PRO-GLN,172,13,CC(C[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)Cc1ccc(cc1)O)CC(=O)O)C,Kd=38.4uM,4.415669,4.42,1,A,A,1,A,A,0,,D,A,,1,1,172,13,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8722459077835083,0.8566540479660034,74.69318389892578,77.19869232177734,0.4760990440845489,0.7136246562004089,0.8298981785774231,0.8288686275482178,0.7747246623039246,0.790925920009613,EAEDPYDLNPHPQ,Low,"(4.319, 4.456]",train
6O3X,protein-peptide,P53617 Q00416,MGSSHHHHHHSSGLVPRGSHMDFQNFVATLESFKDLKSGISGSRIKKLTTYALDHIDIESKIISLIIDYSRLCPDSHKLGSLYIIDSIGRAYLDETRSNSNSSSNKPGTCAHAINTLGEVIQELLSDAIAKSNQDHKEKIRMLLDIWDRSGLFQKSYLNAIRSKCFAMDISN,DDEDDYTPSISD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ASP-PHE-GLN-ASN-PHE-VAL-ALA-THR-LEU-GLU-SER-PHE-LYS-ASP-LEU-LYS-SER-GLY-ILE-SER-GLY-SER-ARG-ILE-LYS-LYS-LEU-THR-THR-TYR-ALA-LEU-ASP-HIS-ILE-ASP-ILE-GLU-SER-LYS-ILE-ILE-SER-LEU-ILE-ILE-ASP-TYR-SER-ARG-LEU-CYS-PRO-ASP-SER-HIS-LYS-LEU-GLY-SER-LEU-TYR-ILE-ILE-ASP-SER-ILE-GLY-ARG-ALA-TYR-LEU-ASP-GLU-THR-ARG-SER-ASN-SER-ASN-SER-SER-SER-ASN-LYS-PRO-GLY-THR-CYS-ALA-HIS-ALA-ILE-ASN-THR-LEU-GLY-GLU-VAL-ILE-GLN-GLU-LEU-LEU-SER-ASP-ALA-ILE-ALA-LYS-SER-ASN-GLN-ASP-HIS-LYS-GLU-LYS-ILE-ARG-MET-LEU-LEU-ASP-ILE-TRP-ASP-ARG-SER-GLY-LEU-PHE-GLN-LYS-SER-TYR-LEU-ASN-ALA-ILE-ARG-SER-LYS-CYS-PHE-ALA-MET-ASP-ILE-SER-ASN,ASP-ASP-GLU-ASP-ASP-TYR-THR-PRO-SER-ILE-SER-ASP,172,12,OC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)Cc1ccc(cc1)O,Kd=0.56uM,6.251812,6.25,1,A,A,1,A,A,0,,D,A,,1,1,172,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9136102199554444,0.8762206435203552,78.75048065185547,77.43344116210938,0.4464471042156219,0.6899617910385132,0.8429542183876038,0.8436210751533508,0.8225786089897156,0.8116960525512695,DDEDDYTPSISD,Low,"(6.097, 6.26]",train
6O21,protein-peptide,Q9Y5K2,IINGEDCSPHSQPWQAALVMENELFCSGVLVHPQWVLSAAHCFQNSYTIGLGLHSLEADQEPGSQMVEASLSVRHPEYNRPLLANDLMLIKLDESVSESDTIRSISIASQCPTAGNSCLVSGWGLLANGRMPTVLQCVNVSVVSEEVCSKLYDPLYHPSMFCAGGGQDQKDSCNGDSGGPLICNGYLQGLVSFGKAPCGQVGVPGVYTNLCKFTEWIEKTVQA,GFCQRSIPPICFPN,ILE-ILE-ASN-GLY-GLU-ASP-CYS-SER-PRO-HIS-SER-GLN-PRO-TRP-GLN-ALA-ALA-LEU-VAL-MET-GLU-ASN-GLU-LEU-PHE-CYS-SER-GLY-VAL-LEU-VAL-HIS-PRO-GLN-TRP-VAL-LEU-SER-ALA-ALA-HIS-CYS-PHE-GLN-ASN-SER-TYR-THR-ILE-GLY-LEU-GLY-LEU-HIS-SER-LEU-GLU-ALA-ASP-GLN-GLU-PRO-GLY-SER-GLN-MET-VAL-GLU-ALA-SER-LEU-SER-VAL-ARG-HIS-PRO-GLU-TYR-ASN-ARG-PRO-LEU-LEU-ALA-ASN-ASP-LEU-MET-LEU-ILE-LYS-LEU-ASP-GLU-SER-VAL-SER-GLU-SER-ASP-THR-ILE-ARG-SER-ILE-SER-ILE-ALA-SER-GLN-CYS-PRO-THR-ALA-GLY-ASN-SER-CYS-LEU-VAL-SER-GLY-TRP-GLY-LEU-LEU-ALA-ASN-GLY-ARG-MET-PRO-THR-VAL-LEU-GLN-CYS-VAL-ASN-VAL-SER-VAL-VAL-SER-GLU-GLU-VAL-CYS-SER-LYS-LEU-TYR-ASP-PRO-LEU-TYR-HIS-PRO-SER-MET-PHE-CYS-ALA-GLY-GLY-GLY-GLN-ASP-GLN-LYS-ASP-SER-CYS-ASN-GLY-ASP-SER-GLY-GLY-PRO-LEU-ILE-CYS-ASN-GLY-TYR-LEU-GLN-GLY-LEU-VAL-SER-PHE-GLY-LYS-ALA-PRO-CYS-GLY-GLN-VAL-GLY-VAL-PRO-GLY-VAL-TYR-THR-ASN-LEU-CYS-LYS-PHE-THR-GLU-TRP-ILE-GLU-LYS-THR-VAL-GLN-ALA,GLY-PHE-CYS-GLN-ARG-SER-ILE-PRO-PRO-ILE-CYS-PHE-PRO-ASN,223,14,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC(=O)N)CSSC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]1[NH2+]CCC1)Cc1ccccc1,Ki=3.48nM,8.458421,8.46,1,A,A,1,A,A,0,,B,A,,0,1,223,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.976259708404541,0.8040529489517212,94.70116424560548,92.2912826538086,0.3187605142593384,0.608331024646759,0.9567821025848388,0.9013651013374328,0.9442092180252076,0.7797248363494873,GFCQRSIPPICFPN,Moderate,"(8.383, 8.824]",train
6NSX,protein-peptide,O43719,MRHERVVIIKNMFHPMDFEDDPLVLNEIREDLRVECSKFGQIRKLLLFDRHPDGVASVSFRDPEEADYCIQTLDGRWFGGRQITAQAWDGTTDY,SRWDVK,MET-ARG-HIS-GLU-ARG-VAL-VAL-ILE-ILE-LYS-ASN-MET-PHE-HIS-PRO-MET-ASP-PHE-GLU-ASP-ASP-PRO-LEU-VAL-LEU-ASN-GLU-ILE-ARG-GLU-ASP-LEU-ARG-VAL-GLU-CYS-SER-LYS-PHE-GLY-GLN-ILE-ARG-LYS-LEU-LEU-LEU-PHE-ASP-ARG-HIS-PRO-ASP-GLY-VAL-ALA-SER-VAL-SER-PHE-ARG-ASP-PRO-GLU-GLU-ALA-ASP-TYR-CYS-ILE-GLN-THR-LEU-ASP-GLY-ARG-TRP-PHE-GLY-GLY-ARG-GLN-ILE-THR-ALA-GLN-ALA-TRP-ASP-GLY-THR-THR-ASP-TYR,SER-ARG-TRP-ASP-VAL-LYS,94,6,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C(C)C)CC(=O)O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)[NH3+],Kd=229nM,6.640165,6.64,1,A,A,1,A,A,0,,B,A,,1,1,94,6,0,CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9247530698776244,0.8474598526954651,97.68460845947266,94.5305404663086,0.3024144768714905,0.5296434164047241,0.926440417766571,0.8957902193069458,0.8868312835693359,0.8353772759437561,SRWDVK,Low,"(6.523, 6.696]",val
6NSV,protein-peptide,Q9UNE7,SPSAQELKEQGNRLFVGRKYPEAAACYGRAITRNPLVAVYYTNRALCYLKMQQHEQALADCRRALELDGQSVKAHFFLGQCQLEMESYDEAIANLQRAYSLAKEQRLNFGDDIPSALRIAKKKRWNSIEE,LWWPD,SER-PRO-SER-ALA-GLN-GLU-LEU-LYS-GLU-GLN-GLY-ASN-ARG-LEU-PHE-VAL-GLY-ARG-LYS-TYR-PRO-GLU-ALA-ALA-ALA-CYS-TYR-GLY-ARG-ALA-ILE-THR-ARG-ASN-PRO-LEU-VAL-ALA-VAL-TYR-TYR-THR-ASN-ARG-ALA-LEU-CYS-TYR-LEU-LYS-MET-GLN-GLN-HIS-GLU-GLN-ALA-LEU-ALA-ASP-CYS-ARG-ARG-ALA-LEU-GLU-LEU-ASP-GLY-GLN-SER-VAL-LYS-ALA-HIS-PHE-PHE-LEU-GLY-GLN-CYS-GLN-LEU-GLU-MET-GLU-SER-TYR-ASP-GLU-ALA-ILE-ALA-ASN-LEU-GLN-ARG-ALA-TYR-SER-LEU-ALA-LYS-GLU-GLN-ARG-LEU-ASN-PHE-GLY-ASP-ASP-ILE-PRO-SER-ALA-LEU-ARG-ILE-ALA-LYS-LYS-LYS-ARG-TRP-ASN-SER-ILE-GLU-GLU,ACE-LEU-TRP-TRP-PRO-ASP,130,6,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)NC(=O)C)C,Kd=15.8nM,7.801343,7.8,1,A,A,1,A,A,0,,C,A,dimer,1,1,130,6,0,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,,CC(C)C[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9793739914894104,0.9139630794525146,97.0344009399414,96.43251037597656,0.2697302997112274,0.4086931049823761,0.952731430530548,0.9368987679481506,0.9628865122795104,0.908229112625122,LWWPD,Moderate,"(7.523, 7.921]",val
6N9T,protein-peptide,Q6MZV7,THTCPPCPAPELLGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALPAPIEKTISKAKGQPREPQVYTLPPSREEMTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPG,DCAWHLGELFWCT,THR-HIS-THR-CYS-PRO-PRO-CYS-PRO-ALA-PRO-GLU-LEU-LEU-GLY-GLY-PRO-SER-VAL-PHE-LEU-PHE-PRO-PRO-LYS-PRO-LYS-ASP-THR-LEU-MET-ILE-SER-ARG-THR-PRO-GLU-VAL-THR-CYS-VAL-VAL-VAL-ASP-VAL-SER-HIS-GLU-ASP-PRO-GLU-VAL-LYS-PHE-ASN-TRP-TYR-VAL-ASP-GLY-VAL-GLU-VAL-HIS-ASN-ALA-LYS-THR-LYS-PRO-ARG-GLU-GLU-GLN-TYR-ASN-SER-THR-TYR-ARG-VAL-VAL-SER-VAL-LEU-THR-VAL-LEU-HIS-GLN-ASP-TRP-LEU-ASN-GLY-LYS-GLU-TYR-LYS-CYS-LYS-VAL-SER-ASN-LYS-ALA-LEU-PRO-ALA-PRO-ILE-GLU-LYS-THR-ILE-SER-LYS-ALA-LYS-GLY-GLN-PRO-ARG-GLU-PRO-GLN-VAL-TYR-THR-LEU-PRO-PRO-SER-ARG-GLU-GLU-MET-THR-LYS-ASN-GLN-VAL-SER-LEU-THR-CYS-LEU-VAL-LYS-GLY-PHE-TYR-PRO-SER-ASP-ILE-ALA-VAL-GLU-TRP-GLU-SER-ASN-GLY-GLN-PRO-GLU-ASN-ASN-TYR-LYS-THR-THR-PRO-PRO-VAL-LEU-ASP-SER-ASP-GLY-SER-PHE-PHE-LEU-TYR-SER-LYS-LEU-THR-VAL-ASP-LYS-SER-ARG-TRP-GLN-GLN-GLY-ASN-VAL-PHE-SER-CYS-SER-VAL-MET-HIS-GLU-ALA-LEU-HIS-ASN-HIS-TYR-THR-GLN-LYS-SER-LEU-SER-LEU-SER-PRO-GLY,ASP-CYS-ALA-TRP-HIS-LEU-GLY-GLU-LEU-PBF-TRP-CYS-THR,224,13,OC(=O)CC[C@@H]1NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2nc[nH]c2)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(C)C)Cc1ccc(cc1)[C@H](c1ccccc1)O)Cc1c[nH]c2c1cccc2)C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])Cc1c[nH]c2c1cccc2,Kd=70uM,4.154902,4.15,1,A,A,1,A,A,0,,E,A,,1,1,224,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(Cc1ccc(C(=O)c2ccccc2)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C(Cc1ccc(C(=O)c2ccccc2)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8179472088813782,0.7736688852310181,76.36947631835938,80.50641632080078,0.4608656167984009,0.8925132751464844,0.8011167645454407,0.7987840175628662,0.7509523034095764,0.7283275723457336,DCAWHLGELFWCT,Low,"(3.924, 4.155]",train
6N87,protein-peptide,Q1PBJ5,GNYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSNTTFLKPVATGNQDLKDGGFAFPPTNPLISPMTLNGMRDFYKNNEYVKNLDELTLCSRHAGNMNPDNDKNSNYKYPAVYDYNDKKCHILYIAAQENNGPRYCNKDQSKRNSMFCFRPAKDKLFENYTYLSKNVVDNWEEVCPRKNLENAKFGLWVDGNCEDIPHVNEFSANDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNASMIKSAFLPTGAFKADRYKSHGKGYNWGNYNRETQKCEIFNVKPTCLINNSSYIATTALSHPIEVE,CWTTRMSPPMQIP,GLY-ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-ASN-THR-THR-PHE-LEU-LYS-PRO-VAL-ALA-THR-GLY-ASN-GLN-ASP-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-ASN-PRO-LEU-ILE-SER-PRO-MET-THR-LEU-ASN-GLY-MET-ARG-ASP-PHE-TYR-LYS-ASN-ASN-GLU-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ASN-PRO-ASP-ASN-ASP-LYS-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-TYR-ASN-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLN-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-LYS-LEU-PHE-GLU-ASN-TYR-THR-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-GLU-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLU-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-SER-ALA-ASN-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-SER-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-ARG-GLU-THR-GLN-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASN-SER-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU,CYS-TRP-THR-THR-ARG-MET-SER-PRO-PRO-MET-GLN-ILE-PRO,336,13,CSCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([N@@H+]2[C@]([C@H]3N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)[C@H](CC)C)CCC3)(O)O2)CSSCC1=CC([N](=O)C1(C)C)(C)C)Cc1c[nH]c2c1cccc2)[C@H](O)C)[C@H](O)C,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,C,A,,1,1,336,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7802813053131104,0.8026362061500549,78.45855712890625,76.77684783935547,0.5884886980056763,0.8154600262641907,0.8826963901519775,0.8652160167694092,0.7260242104530334,0.7814109325408936,CWTTRMSPPMQIP,Low,"(5.6, 5.699]",train
6N7Q,protein-peptide,Q1PBJ5,GNYMGNPWTEYMAKYDIEEVHGSGIRVDLGEDAEVAGTQYRLPSGKCPVFGKGIIIENSNTTFLKPVATGNQDLKDGGFAFPPTNPLISPMTLNGMRDFYKNNEYVKNLDELTLCSRHAGNMNPDNDKNSNYKYPAVYDYNDKKCHILYIAAQENNGPRYCNKDESKRNSMFCFRPAKDKLFENYTYLSKNVVDNWEEVCPRKNLENAKFGLWVDGNCEDIPHVNEFSANDLFECNKLVFELSASDQPKQYEQHLTDYEKIKEGFKNKNASMIKSAFLPTGAFKADRYKSHGKGYNWGNYNRETQKCEIFNVKPTCLINNSSYIATTALSHPIEVE,CWTTRMSPPMQIP,GLY-ASN-TYR-MET-GLY-ASN-PRO-TRP-THR-GLU-TYR-MET-ALA-LYS-TYR-ASP-ILE-GLU-GLU-VAL-HIS-GLY-SER-GLY-ILE-ARG-VAL-ASP-LEU-GLY-GLU-ASP-ALA-GLU-VAL-ALA-GLY-THR-GLN-TYR-ARG-LEU-PRO-SER-GLY-LYS-CYS-PRO-VAL-PHE-GLY-LYS-GLY-ILE-ILE-ILE-GLU-ASN-SER-ASN-THR-THR-PHE-LEU-LYS-PRO-VAL-ALA-THR-GLY-ASN-GLN-ASP-LEU-LYS-ASP-GLY-GLY-PHE-ALA-PHE-PRO-PRO-THR-ASN-PRO-LEU-ILE-SER-PRO-MET-THR-LEU-ASN-GLY-MET-ARG-ASP-PHE-TYR-LYS-ASN-ASN-GLU-TYR-VAL-LYS-ASN-LEU-ASP-GLU-LEU-THR-LEU-CYS-SER-ARG-HIS-ALA-GLY-ASN-MET-ASN-PRO-ASP-ASN-ASP-LYS-ASN-SER-ASN-TYR-LYS-TYR-PRO-ALA-VAL-TYR-ASP-TYR-ASN-ASP-LYS-LYS-CYS-HIS-ILE-LEU-TYR-ILE-ALA-ALA-GLN-GLU-ASN-ASN-GLY-PRO-ARG-TYR-CYS-ASN-LYS-ASP-GLU-SER-LYS-ARG-ASN-SER-MET-PHE-CYS-PHE-ARG-PRO-ALA-LYS-ASP-LYS-LEU-PHE-GLU-ASN-TYR-THR-TYR-LEU-SER-LYS-ASN-VAL-VAL-ASP-ASN-TRP-GLU-GLU-VAL-CYS-PRO-ARG-LYS-ASN-LEU-GLU-ASN-ALA-LYS-PHE-GLY-LEU-TRP-VAL-ASP-GLY-ASN-CYS-GLU-ASP-ILE-PRO-HIS-VAL-ASN-GLU-PHE-SER-ALA-ASN-ASP-LEU-PHE-GLU-CYS-ASN-LYS-LEU-VAL-PHE-GLU-LEU-SER-ALA-SER-ASP-GLN-PRO-LYS-GLN-TYR-GLU-GLN-HIS-LEU-THR-ASP-TYR-GLU-LYS-ILE-LYS-GLU-GLY-PHE-LYS-ASN-LYS-ASN-ALA-SER-MET-ILE-LYS-SER-ALA-PHE-LEU-PRO-THR-GLY-ALA-PHE-LYS-ALA-ASP-ARG-TYR-LYS-SER-HIS-GLY-LYS-GLY-TYR-ASN-TRP-GLY-ASN-TYR-ASN-ARG-GLU-THR-GLN-LYS-CYS-GLU-ILE-PHE-ASN-VAL-LYS-PRO-THR-CYS-LEU-ILE-ASN-ASN-SER-SER-TYR-ILE-ALA-THR-THR-ALA-LEU-SER-HIS-PRO-ILE-GLU-VAL-GLU,CYS-TRP-THR-THR-ARG-MET-SER-PRO-PRO-MET-GLN-ILE-PRO,336,13,CSCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2c[nH]c3c2cccc3)NC(=O)[C@]2(CS)ON2C(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@H]3N(C(=O)[C@@H](NC1=O)CO)CCC3)CCC2)CCSC)CCC(=O)N)[C@H](CC)C)[C@H](O)C)[C@H](O)C,Kd=7.0uM,5.154902,5.15,1,A,A,1,A,A,0,,C,A,,1,1,336,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CS)[C@@H](C)O)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7411370277404785,0.8161231279373169,73.9671401977539,77.89752960205078,0.6603179574012756,0.744954526424408,0.8249103426933289,0.8719481229782104,0.6915403604507446,0.7965865135192871,CWTTRMSPPMQIP,Low,"(5.105, 5.222]",train
6N3E,protein-peptide,O75533 O43719,GSMRHERVVIIKNMFHPMDFEDDPLVLNEIREDLRVECSKFGQIRKLLLFDRHPDGVASVSFRDPEEADYCIQTLDGRWFGGRQITAQAWDGTTDY,NRWDETP,GLY-SER-MET-ARG-HIS-GLU-ARG-VAL-VAL-ILE-ILE-LYS-ASN-MET-PHE-HIS-PRO-MET-ASP-PHE-GLU-ASP-ASP-PRO-LEU-VAL-LEU-ASN-GLU-ILE-ARG-GLU-ASP-LEU-ARG-VAL-GLU-CYS-SER-LYS-PHE-GLY-GLN-ILE-ARG-LYS-LEU-LEU-LEU-PHE-ASP-ARG-HIS-PRO-ASP-GLY-VAL-ALA-SER-VAL-SER-PHE-ARG-ASP-PRO-GLU-GLU-ALA-ASP-TYR-CYS-ILE-GLN-THR-LEU-ASP-GLY-ARG-TRP-PHE-GLY-GLY-ARG-GLN-ILE-THR-ALA-GLN-ALA-TRP-ASP-GLY-THR-THR-ASP-TYR,ASN-ARG-TRP-ASP-GLU-THR-PRO,96,7,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N,Kd=18.9uM,4.723538,4.72,1,A,A,1,A,A,0,,B,A,,1,1,96,7,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N1CCC[C@H]1C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,0.9233984351158142,0.8748937845230103,97.52401733398438,96.90379333496094,0.3171834945678711,0.4957887530326843,0.9164968132972716,0.9048412442207336,0.8826480507850647,0.867406964302063,NRWDETP,Low,"(4.606, 4.745]",val
6MM5,protein-peptide,E9Q401 P05132,SNAVKEFLAKAKEDFLKKWETPSQNTAQLDQFDRIKTLGTGSFGRVMLVKHKESGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVAGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,LYNRTRRISQTS,SER-ASN-ALA-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-ASP-PHE-LEU-LYS-LYS-TRP-GLU-THR-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-GLN-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-SER-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-ALA-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SER-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,LEU-TYR-ASN-ARG-THR-ARG-ARG-ILE-SER-GLN-THR-SER,339,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@H](O)C)CCC(=O)N)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])Cc1ccc(cc1)O)CC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C,Kd=29.1uM,4.536107,4.54,1,A,A,1,A,A,0,,C,E,,1,1,339,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.9331592917442322,0.8226146697998047,89.78461456298828,85.83985137939453,0.3327870965003967,0.719852089881897,0.950276255607605,0.9122636318206788,0.9075124859809875,0.8002023696899414,LYNRTRRISQTS,Low,"(4.456, 4.606]",train
6KMJ,protein-peptide,P32597 P61830,SLGIFPTVEKLVEEMREQLDEVDSHPRTSIFEKLPSKRDYPDYFKVIEKPMAIDIILKNCKNGTYKTLEEVRQALQTMFENARFYNEEGSWVYVDADKLNEFTDEWFKEHSS,TARKSTGGKAPRKQLAY,SER-LEU-GLY-ILE-PHE-PRO-THR-VAL-GLU-LYS-LEU-VAL-GLU-GLU-MET-ARG-GLU-GLN-LEU-ASP-GLU-VAL-ASP-SER-HIS-PRO-ARG-THR-SER-ILE-PHE-GLU-LYS-LEU-PRO-SER-LYS-ARG-ASP-TYR-PRO-ASP-TYR-PHE-LYS-VAL-ILE-GLU-LYS-PRO-MET-ALA-ILE-ASP-ILE-ILE-LEU-LYS-ASN-CYS-LYS-ASN-GLY-THR-TYR-LYS-THR-LEU-GLU-GLU-VAL-ARG-GLN-ALA-LEU-GLN-THR-MET-PHE-GLU-ASN-ALA-ARG-PHE-TYR-ASN-GLU-GLU-GLY-SER-TRP-VAL-TYR-VAL-ASP-ALA-ASP-LYS-LEU-ASN-GLU-PHE-THR-ASP-GLU-TRP-PHE-LYS-GLU-HIS-SER-SER,THR-ALA-ARG-LYS-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN-LEU-ALA-TYR,112,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)C)CC(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])C)CCC[NH+]=C(N)N)CCCC[NH3+])CO)CCCCNC(=O)C)C)CCC[NH+]=C(N)N,Kd=16.3uM,4.787812,4.79,1,A,A,1,A,A,0,,C,A,,1,1,112,17,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.911380410194397,0.6956419944763184,94.25865173339844,91.8330307006836,0.3404001295566559,0.8122096061706543,0.924713134765625,0.7926151752471924,0.8256828784942627,0.6713986992835999,TARKSTGGKAPRKQLAY,Low,"(4.745, 4.866]",train
6K5T,protein-peptide,P19893 P63165,YIKLKVIGQDSSEIHFKVKMTTHLKKLKESYCQRQGVPMNSLRFLFEGQRIADNHTPKELGMEEEDVIEVYQEQTGG,DTAGCIVISDSE,TYR-ILE-LYS-LEU-LYS-VAL-ILE-GLY-GLN-ASP-SER-SER-GLU-ILE-HIS-PHE-LYS-VAL-LYS-MET-THR-THR-HIS-LEU-LYS-LYS-LEU-LYS-GLU-SER-TYR-CYS-GLN-ARG-GLN-GLY-VAL-PRO-MET-ASN-SER-LEU-ARG-PHE-LEU-PHE-GLU-GLY-GLN-ARG-ILE-ALA-ASP-ASN-HIS-THR-PRO-LYS-GLU-LEU-GLY-MET-GLU-GLU-GLU-ASP-VAL-ILE-GLU-VAL-TYR-GLN-GLU-GLN-THR-GLY-GLY,ASP-THR-ALA-GLY-CYS-ILE-VAL-ILE-SEP-ASP-SEP-GLU,77,12,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)COP(O)(O)O)CC(=O)O)COP(O)(O)O)[C@H](CC)C)C(C)C)[C@H](CC)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=58.2uM,4.235077,4.24,1,A,A,1,A,A,0,,B,A,,1,1,77,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,0.9271959066390992,0.8535538911819458,95.96090698242188,91.94924926757812,0.3281680643558502,0.5168107748031616,0.8980754017829895,0.8789869546890259,0.8502063751220703,0.8471956253051758,DTAGCIVISDSE,Low,"(4.155, 4.319]",train
6K5R,protein-peptide,P55854 P19893,DHINLKVAGQDGSVVQFKIKRHTPLSKLMKAYCERQGLSMRQIRFRFDGQPINETDTPAQLEMEDEDTIDVFQQQTG,DTAGCIVISDSE,ASP-HIS-ILE-ASN-LEU-LYS-VAL-ALA-GLY-GLN-ASP-GLY-SER-VAL-VAL-GLN-PHE-LYS-ILE-LYS-ARG-HIS-THR-PRO-LEU-SER-LYS-LEU-MET-LYS-ALA-TYR-CYS-GLU-ARG-GLN-GLY-LEU-SER-MET-ARG-GLN-ILE-ARG-PHE-ARG-PHE-ASP-GLY-GLN-PRO-ILE-ASN-GLU-THR-ASP-THR-PRO-ALA-GLN-LEU-GLU-MET-GLU-ASP-GLU-ASP-THR-ILE-ASP-VAL-PHE-GLN-GLN-GLN-THR-GLY,ASP-THR-ALA-GLY-CYS-ILE-VAL-ILE-SEP-ASP-SEP-GLU,77,12,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)COP(O)(O)O)CC(=O)O)COP(O)(O)O)[C@H](CC)C)C(C)C)[C@H](CC)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=53.5uM,4.271646,4.27,1,A,A,1,A,A,0,,B,A,,1,1,77,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(C)C,0.9440847635269164,0.8202756643295288,96.94083404541016,90.55237579345705,0.3157714605331421,0.5452120900154114,0.908624529838562,0.8635374903678894,0.8686801791191101,0.8094601631164551,DTAGCIVISDSE,Low,"(4.155, 4.319]",train
6IM4,protein-peptide,O64094,MELIRIAMKKDLENDNSLMNKWATVAGLKNPNPLYDFLNHDGKTFNEFSSIVNIVKSQYPDREYELMKDYCLNLDVKTKAARSALEYADANMFFEIEDVLIDSMISCSNMKSKEYGKVYKIHRELSNSVITEFEAVKRLGKLNIKTPEMNSFSRLLLLYHYLSTGNFSPMAQLIKQIDLSEISENMYIRNTYQTRVHVLMSNIKLNENSLEECREYSKKALESTNILRFQVFSYLTIGNSLLFSNYELAQENFLKGLSISVQNENYNMIFQQALCFLNNVWRKENKWINFESDSIMDLQEQAHCFINFNENSKAKEVLDKLDLLVHNDNELAMHYYLKGRLEQNKACFYSSIEYFKKSNDKFLIRLPLLELQKMGENQKLLELLLLLEYA,GMPRGA,MET-GLU-LEU-ILE-ARG-ILE-ALA-MET-LYS-LYS-ASP-LEU-GLU-ASN-ASP-ASN-SER-LEU-MET-ASN-LYS-TRP-ALA-THR-VAL-ALA-GLY-LEU-LYS-ASN-PRO-ASN-PRO-LEU-TYR-ASP-PHE-LEU-ASN-HIS-ASP-GLY-LYS-THR-PHE-ASN-GLU-PHE-SER-SER-ILE-VAL-ASN-ILE-VAL-LYS-SER-GLN-TYR-PRO-ASP-ARG-GLU-TYR-GLU-LEU-MET-LYS-ASP-TYR-CYS-LEU-ASN-LEU-ASP-VAL-LYS-THR-LYS-ALA-ALA-ARG-SER-ALA-LEU-GLU-TYR-ALA-ASP-ALA-ASN-MET-PHE-PHE-GLU-ILE-GLU-ASP-VAL-LEU-ILE-ASP-SER-MET-ILE-SER-CYS-SER-ASN-MET-LYS-SER-LYS-GLU-TYR-GLY-LYS-VAL-TYR-LYS-ILE-HIS-ARG-GLU-LEU-SER-ASN-SER-VAL-ILE-THR-GLU-PHE-GLU-ALA-VAL-LYS-ARG-LEU-GLY-LYS-LEU-ASN-ILE-LYS-THR-PRO-GLU-MET-ASN-SER-PHE-SER-ARG-LEU-LEU-LEU-LEU-TYR-HIS-TYR-LEU-SER-THR-GLY-ASN-PHE-SER-PRO-MET-ALA-GLN-LEU-ILE-LYS-GLN-ILE-ASP-LEU-SER-GLU-ILE-SER-GLU-ASN-MET-TYR-ILE-ARG-ASN-THR-TYR-GLN-THR-ARG-VAL-HIS-VAL-LEU-MET-SER-ASN-ILE-LYS-LEU-ASN-GLU-ASN-SER-LEU-GLU-GLU-CYS-ARG-GLU-TYR-SER-LYS-LYS-ALA-LEU-GLU-SER-THR-ASN-ILE-LEU-ARG-PHE-GLN-VAL-PHE-SER-TYR-LEU-THR-ILE-GLY-ASN-SER-LEU-LEU-PHE-SER-ASN-TYR-GLU-LEU-ALA-GLN-GLU-ASN-PHE-LEU-LYS-GLY-LEU-SER-ILE-SER-VAL-GLN-ASN-GLU-ASN-TYR-ASN-MET-ILE-PHE-GLN-GLN-ALA-LEU-CYS-PHE-LEU-ASN-ASN-VAL-TRP-ARG-LYS-GLU-ASN-LYS-TRP-ILE-ASN-PHE-GLU-SER-ASP-SER-ILE-MET-ASP-LEU-GLN-GLU-GLN-ALA-HIS-CYS-PHE-ILE-ASN-PHE-ASN-GLU-ASN-SER-LYS-ALA-LYS-GLU-VAL-LEU-ASP-LYS-LEU-ASP-LEU-LEU-VAL-HIS-ASN-ASP-ASN-GLU-LEU-ALA-MET-HIS-TYR-TYR-LEU-LYS-GLY-ARG-LEU-GLU-GLN-ASN-LYS-ALA-CYS-PHE-TYR-SER-SER-ILE-GLU-TYR-PHE-LYS-LYS-SER-ASN-ASP-LYS-PHE-LEU-ILE-ARG-LEU-PRO-LEU-LEU-GLU-LEU-GLN-LYS-MET-GLY-GLU-ASN-GLN-LYS-LEU-LEU-GLU-LEU-LEU-LEU-LEU-LEU-GLU-TYR-ALA,GLY-MET-PRO-ARG-GLY-ALA,390,6,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)NC(=O)C[NH3+],Kd=40nM,7.39794,7.4,1,A,A,1,A,A,0,,C,A,,0,1,390,6,0,CSCC[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.968183159828186,0.9231315851211548,89.58206939697266,83.44635009765625,0.3364756405353546,0.4382979571819305,0.9309411644935608,0.9060314297676086,0.968023955821991,0.92740660905838,GMPRGA,Moderate,"(7.268, 7.523]",train
6IIW,protein-peptide,Q96T88 Q15004,GPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRND,VRTKADSVPG,GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP,VAL-ARG-THR-LYS-ALA-ASP-SER-VAL-PRO-GLY,68,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CCC[NH+]=C(N)N,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,B,A,,1,1,68,10,0,CC(C)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)C(C)C)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(=O)O,0.8640716671943665,0.8708304762840271,92.39554595947266,90.16653442382812,0.4331034421920776,0.5585153698921204,0.7968751192092896,0.865364670753479,0.7927297949790955,0.8170498609542847,VRTKADSVPG,Low,"(5.6, 5.699]",train
6I7A,protein-peptide,Q15059 O43791,GAMASGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAMESQRAYRFVQGKDWGFKKFIRRNFLLDEANGLLPDDKLTLFCEVSVVQD,KADTTTPTT,GLY-ALA-MET-ALA-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-MET-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-ASN-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,LYS-ALA-ASP-THR-THR-THR-PRO-THR-THR,145,9,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)[C@H](O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=55uM,4.259637,4.26,1,A,A,1,A,A,0,,B,A,,1,1,145,9,0,C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9236246347427368,0.8465234637260437,90.3933563232422,93.02994537353516,0.3344348669052124,0.520143449306488,0.9311509728431702,0.9119191765785216,0.8446326851844788,0.8301745057106018,KADTTTPTT,Low,"(4.155, 4.319]",val
6I68,protein-peptide,Q15059 O43791,GAMASGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAVESQRAYRFVQGKDWGFKKFIRRDFLLDEANGLLPDDKLTLFCEVSVVQD,KADTTTPTT,GLY-ALA-MET-ALA-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-VAL-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-ASP-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,LYS-ALA-ASP-THR-THR-THR-PRO-THR-THR,145,9,CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)[C@H](O)C)[C@H](O)C)CC(=O)O)C)[NH3+],Kd=13uM,4.886057,4.89,1,A,A,1,A,A,0,,B,A,,1,1,145,9,0,C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8949999213218689,0.8638668060302734,91.57048034667967,91.4232940673828,0.3333370387554168,0.4988750517368316,0.9351308345794678,0.9158021211624146,0.8484412431716919,0.8508829474449158,KADTTTPTT,Low,"(4.866, 5.014]",train
6I41,protein-peptide,Q15059 O43791,GAMASGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAMESQRAYRFVQGKDWGFKKFIRRDFLLDEANGLLPDDKLTLFCEVSVVQD,KADTTTPTT,GLY-ALA-MET-ALA-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-MET-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-ASP-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,LYS-ALA-ASP-THR-THR-THR-PRO-THR-THR,145,9,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)[C@H](O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=61uM,4.21467,4.21,1,A,A,1,A,A,0,,B,A,,1,1,145,9,0,C[C@H](NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8887096047401428,0.8291649222373962,90.6729965209961,91.08295440673828,0.338645875453949,0.5489335656166077,0.9323762059211732,0.8989229202270508,0.841266930103302,0.811725378036499,KADTTTPTT,Low,"(4.155, 4.319]",train
6HY7,protein-peptide,P0C1D0 Q9UGM1,ADGKYAQKLFNDLFEDYSNALRPVEDTDKVLNVTLQITLSQIKDMDERNQILTAYLWIRQIWHDAYLTWDRDQYDGLDSIRIPSDLVWRPDIVLYNKADDESSEPVNTNVVLRYDGLITWDAPAITKSSCVVDVTYFPFDNQQCNLTFGSWTYNGNQVDIFNALDSGDLSDFIEDVEWEVHGMPAVKNVISYGCCSEPYPDVTFTLLLKRRSHHHHHH,GCCSDPRCRYRCR,ALA-ASP-GLY-LYS-TYR-ALA-GLN-LYS-LEU-PHE-ASN-ASP-LEU-PHE-GLU-ASP-TYR-SER-ASN-ALA-LEU-ARG-PRO-VAL-GLU-ASP-THR-ASP-LYS-VAL-LEU-ASN-VAL-THR-LEU-GLN-ILE-THR-LEU-SER-GLN-ILE-LYS-ASP-MET-ASP-GLU-ARG-ASN-GLN-ILE-LEU-THR-ALA-TYR-LEU-TRP-ILE-ARG-GLN-ILE-TRP-HIS-ASP-ALA-TYR-LEU-THR-TRP-ASP-ARG-ASP-GLN-TYR-ASP-GLY-LEU-ASP-SER-ILE-ARG-ILE-PRO-SER-ASP-LEU-VAL-TRP-ARG-PRO-ASP-ILE-VAL-LEU-TYR-ASN-LYS-ALA-ASP-ASP-GLU-SER-SER-GLU-PRO-VAL-ASN-THR-ASN-VAL-VAL-LEU-ARG-TYR-ASP-GLY-LEU-ILE-THR-TRP-ASP-ALA-PRO-ALA-ILE-THR-LYS-SER-SER-CYS-VAL-VAL-ASP-VAL-THR-TYR-PHE-PRO-PHE-ASP-ASN-GLN-GLN-CYS-ASN-LEU-THR-PHE-GLY-SER-TRP-THR-TYR-ASN-GLY-ASN-GLN-VAL-ASP-ILE-PHE-ASN-ALA-LEU-ASP-SER-GLY-ASP-LEU-SER-ASP-PHE-ILE-GLU-ASP-VAL-GLU-TRP-GLU-VAL-HIS-GLY-MET-PRO-ALA-VAL-LYS-ASN-VAL-ILE-SER-TYR-GLY-CYS-CYS-SER-GLU-PRO-TYR-PRO-ASP-VAL-THR-PHE-THR-LEU-LEU-LEU-LYS-ARG-ARG-SER-HIS-HIS-HIS-HIS-HIS-HIS,GLY-CYS-CYS-SER-ASP-PRO-ARG-CYS-ARG-TYR-ARG-CYS-AAR,218,13,[NH3+]CC(=O)N[C@H]1CSSC[C@@H]2NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H]3N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CSSC[C@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CCC[NH+]=C(N)N)CC1=CCC(=O)C=C1)C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CO)CC(=O)O)CCC3,Ki=2.7uM,5.568636,5.57,1,A,A,1,A,A,0,,B,A,,1,1,218,13,0,N=C(N)NCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)O,N=C(N)NCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(CCC[NH+]=C(N)N)C(N)=O,N=C(N)NCCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NC(CCC[NH+]=C(N)N)C(N)=O,0.8497251272201538,0.666272759437561,92.27822875976562,85.7359619140625,0.4210521876811981,0.95082026720047,0.8921796083450317,0.8116940855979919,0.8039383292198181,0.6299174427986145,GCCSDPRCRYRCR,Low,"(5.463, 5.6]",train
6HY2,protein-peptide,P0A722,MIDKSAFVHPTAIVEEGASIGANAHIGPFCIVGPHVEIGEGTVLKSHVVVNGHTKIGRDNEIYQFASIGEVNQDLKYAGEPTRVEIGDRNRIRESVTIHRGTVQGGGLTKVGSDNLLMINAHIAHDCTVGNRCILANNATLAGHVSVDDFAIIGGMTAVHQFCIIGAHVMVGGCSGVAQDVPPYVIAQGNHATPFGVNIEGLKRRGFSREAITAIRNAYKLIYRSGKTLDEVKPEIAELAETYPEVKAFTDFFARSTRGLIR,WMLDPIAGKWSR,MET-ILE-ASP-LYS-SER-ALA-PHE-VAL-HIS-PRO-THR-ALA-ILE-VAL-GLU-GLU-GLY-ALA-SER-ILE-GLY-ALA-ASN-ALA-HIS-ILE-GLY-PRO-PHE-CYS-ILE-VAL-GLY-PRO-HIS-VAL-GLU-ILE-GLY-GLU-GLY-THR-VAL-LEU-LYS-SER-HIS-VAL-VAL-VAL-ASN-GLY-HIS-THR-LYS-ILE-GLY-ARG-ASP-ASN-GLU-ILE-TYR-GLN-PHE-ALA-SER-ILE-GLY-GLU-VAL-ASN-GLN-ASP-LEU-LYS-TYR-ALA-GLY-GLU-PRO-THR-ARG-VAL-GLU-ILE-GLY-ASP-ARG-ASN-ARG-ILE-ARG-GLU-SER-VAL-THR-ILE-HIS-ARG-GLY-THR-VAL-GLN-GLY-GLY-GLY-LEU-THR-LYS-VAL-GLY-SER-ASP-ASN-LEU-LEU-MET-ILE-ASN-ALA-HIS-ILE-ALA-HIS-ASP-CYS-THR-VAL-GLY-ASN-ARG-CYS-ILE-LEU-ALA-ASN-ASN-ALA-THR-LEU-ALA-GLY-HIS-VAL-SER-VAL-ASP-ASP-PHE-ALA-ILE-ILE-GLY-GLY-MET-THR-ALA-VAL-HIS-GLN-PHE-CYS-ILE-ILE-GLY-ALA-HIS-VAL-MET-VAL-GLY-GLY-CYS-SER-GLY-VAL-ALA-GLN-ASP-VAL-PRO-PRO-TYR-VAL-ILE-ALA-GLN-GLY-ASN-HIS-ALA-THR-PRO-PHE-GLY-VAL-ASN-ILE-GLU-GLY-LEU-LYS-ARG-ARG-GLY-PHE-SER-ARG-GLU-ALA-ILE-THR-ALA-ILE-ARG-ASN-ALA-TYR-LYS-LEU-ILE-TYR-ARG-SER-GLY-LYS-THR-LEU-ASP-GLU-VAL-LYS-PRO-GLU-ILE-ALA-GLU-LEU-ALA-GLU-THR-TYR-PRO-GLU-VAL-LYS-ALA-PHE-THR-ASP-PHE-PHE-ALA-ARG-SER-THR-ARG-GLY-LEU-ILE-ARG,TRP-MET-LEU-ASP-PRO-ILE-ALA-GLY-LYS-TRP-SER-ARG,262,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CO)Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)[NH3+])CCSC)CC(C)C)CC(=O)O)C,IC50=50nM,7.30103,7.3,1,A,A,1,A,A,0,,A,X,,1,1,262,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8131547570228577,0.7395630478858948,93.24823760986328,94.63026428222656,0.3420123755931854,0.737473726272583,0.9393470883369446,0.8796951174736023,0.7542343735694885,0.7045300006866455,WMLDPIAGKWSR,Moderate,"(7.268, 7.523]",train
6HV2,protein-peptide,,EYNVFPRTLKWSKMNLTYRIVNYTPDMTHSEVEKAFKKAFKVWSDVTPLNFTRLHDGIADIMISFGIKEHGDFYPFDGPSGLLAHAFPPGPNYGGDAHFDDDETWTSSSKGYNLFLVAAHEFGHSLGLDHSKDPGALMFPIYTYTGKSHFMLPDDDVQGIQSLYGPGD,IMISF,GLU-TYR-ASN-VAL-PHE-PRO-ARG-THR-LEU-LYS-TRP-SER-LYS-MET-ASN-LEU-THR-TYR-ARG-ILE-VAL-ASN-TYR-THR-PRO-ASP-MET-THR-HIS-SER-GLU-VAL-GLU-LYS-ALA-PHE-LYS-LYS-ALA-PHE-LYS-VAL-TRP-SER-ASP-VAL-THR-PRO-LEU-ASN-PHE-THR-ARG-LEU-HIS-ASP-GLY-ILE-ALA-ASP-ILE-MET-ILE-SER-PHE-GLY-ILE-LYS-GLU-HIS-GLY-ASP-PHE-TYR-PRO-PHE-ASP-GLY-PRO-SER-GLY-LEU-LEU-ALA-HIS-ALA-PHE-PRO-PRO-GLY-PRO-ASN-TYR-GLY-GLY-ASP-ALA-HIS-PHE-ASP-ASP-ASP-GLU-THR-TRP-THR-SER-SER-SER-LYS-GLY-TYR-ASN-LEU-PHE-LEU-VAL-ALA-ALA-HIS-GLU-PHE-GLY-HIS-SER-LEU-GLY-LEU-ASP-HIS-SER-LYS-ASP-PRO-GLY-ALA-LEU-MET-PHE-PRO-ILE-TYR-THR-TYR-THR-GLY-LYS-SER-HIS-PHE-MET-LEU-PRO-ASP-ASP-ASP-VAL-GLN-GLY-ILE-GLN-SER-LEU-TYR-GLY-PRO-GLY-ASP,ILE-MET-ILE-SER-PHE,168,5,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CO)[C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)[NH3+],IC50=52uM,4.283997,4.28,1,A,A,1,A,A,0,,B,A,,1,1,168,5,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)CC)C(=O)O,0.9523017406463624,0.9199849367141724,89.01049041748047,89.49478912353516,0.3613226115703583,0.4458456635475158,0.9432307481765748,0.937438666820526,0.9003787040710449,0.9156215190887452,IMISF,Low,"(4.155, 4.319]",train
6HP5,protein-peptide,O31927,MELIRIAMKKDLENDNSLMNKWATVAGLKNPNPLYDFLNHDGKTFNEFSSIVNIVKSQYPDREYELMKDYCLNLDVKTKAARSALEYADANMFFEIEDVLIDSMISCSNMKSKEYGKVYKIHRELSNSVITEFEAVKRLGKLNIKTPEMNSFSRLLLLYHYLSTGNFSPMAQLIKQIDLSEISENMYIRNTYQTRVHVLMSNIKLNENSLEECREYSKKALESTNILRFQVFSYLTIGNSLLFSNYELAQENFLKGLSISVQNENYNMIFQQALCFLNNVWRKENKWINFESDSIMDLQEQAHCFINFNENSKAKEVLDKLDLLVHNDNELAMHYYLKGRLEQNKACFYSSIEYFKKSNDKFLIRLPLLELQKMGENQKLLELLLL,GMPRGA,MSE-GLU-LEU-ILE-ARG-ILE-ALA-MSE-LYS-LYS-ASP-LEU-GLU-ASN-ASP-ASN-SER-LEU-MSE-ASN-LYS-TRP-ALA-THR-VAL-ALA-GLY-LEU-LYS-ASN-PRO-ASN-PRO-LEU-TYR-ASP-PHE-LEU-ASN-HIS-ASP-GLY-LYS-THR-PHE-ASN-GLU-PHE-SER-SER-ILE-VAL-ASN-ILE-VAL-LYS-SER-GLN-TYR-PRO-ASP-ARG-GLU-TYR-GLU-LEU-MSE-LYS-ASP-TYR-CYS-LEU-ASN-LEU-ASP-VAL-LYS-THR-LYS-ALA-ALA-ARG-SER-ALA-LEU-GLU-TYR-ALA-ASP-ALA-ASN-MSE-PHE-PHE-GLU-ILE-GLU-ASP-VAL-LEU-ILE-ASP-SER-MSE-ILE-SER-CYS-SER-ASN-MSE-LYS-SER-LYS-GLU-TYR-GLY-LYS-VAL-TYR-LYS-ILE-HIS-ARG-GLU-LEU-SER-ASN-SER-VAL-ILE-THR-GLU-PHE-GLU-ALA-VAL-LYS-ARG-LEU-GLY-LYS-LEU-ASN-ILE-LYS-THR-PRO-GLU-MSE-ASN-SER-PHE-SER-ARG-LEU-LEU-LEU-LEU-TYR-HIS-TYR-LEU-SER-THR-GLY-ASN-PHE-SER-PRO-MSE-ALA-GLN-LEU-ILE-LYS-GLN-ILE-ASP-LEU-SER-GLU-ILE-SER-GLU-ASN-MSE-TYR-ILE-ARG-ASN-THR-TYR-GLN-THR-ARG-VAL-HIS-VAL-LEU-MSE-SER-ASN-ILE-LYS-LEU-ASN-GLU-ASN-SER-LEU-GLU-GLU-CYS-ARG-GLU-TYR-SER-LYS-LYS-ALA-LEU-GLU-SER-THR-ASN-ILE-LEU-ARG-PHE-GLN-VAL-PHE-SER-TYR-LEU-THR-ILE-GLY-ASN-SER-LEU-LEU-PHE-SER-ASN-TYR-GLU-LEU-ALA-GLN-GLU-ASN-PHE-LEU-LYS-GLY-LEU-SER-ILE-SER-VAL-GLN-ASN-GLU-ASN-TYR-ASN-MSE-ILE-PHE-GLN-GLN-ALA-LEU-CYS-PHE-LEU-ASN-ASN-VAL-TRP-ARG-LYS-GLU-ASN-LYS-TRP-ILE-ASN-PHE-GLU-SER-ASP-SER-ILE-MSE-ASP-LEU-GLN-GLU-GLN-ALA-HIS-CYS-PHE-ILE-ASN-PHE-ASN-GLU-ASN-SER-LYS-ALA-LYS-GLU-VAL-LEU-ASP-LYS-LEU-ASP-LEU-LEU-VAL-HIS-ASN-ASP-ASN-GLU-LEU-ALA-MSE-HIS-TYR-TYR-LEU-LYS-GLY-ARG-LEU-GLU-GLN-ASN-LYS-ALA-CYS-PHE-TYR-SER-SER-ILE-GLU-TYR-PHE-LYS-LYS-SER-ASN-ASP-LYS-PHE-LEU-ILE-ARG-LEU-PRO-LEU-LEU-GLU-LEU-GLN-LYS-MSE-GLY-GLU-ASN-GLN-LYS-LEU-LEU-GLU-LEU-LEU-LEU-LEU,GLY-MET-PRO-ARG-GLY-ALA,386,6,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)NC(=O)C[NH3+],Kd=53.8nM,7.269218,7.27,1,A,A,1,A,A,0,,C,A,,0,1,386,6,0,CSCC[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.9674228429794312,0.9486570358276368,90.08704376220705,88.4954605102539,0.330156147480011,0.3731549382209778,0.934177815914154,0.9445311427116394,0.9661677479743958,0.94968843460083,GMPRGA,Moderate,"(7.268, 7.523]",train
6HOL,protein-peptide,Q6ZNE5 Q9H0R8,GPTMGSMKFQYKEDHPFEYRKKEGEKIRKKYPDRVPVIVEKAPKARVPDLDKRKYLVPSDLTVGQFYFLIRKRIHLRPEDALFFFVNNTIPPTSATMGQLYEDNHEEDYFLYVAYSDESVYGK,TDLGTDWENLPSPRF,GLY-PRO-THR-MET-GLY-SER-MET-LYS-PHE-GLN-TYR-LYS-GLU-ASP-HIS-PRO-PHE-GLU-TYR-ARG-LYS-LYS-GLU-GLY-GLU-LYS-ILE-ARG-LYS-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-ALA-ARG-VAL-PRO-ASP-LEU-ASP-LYS-ARG-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-HIS-LEU-ARG-PRO-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-THR-ILE-PRO-PRO-THR-SER-ALA-THR-MET-GLY-GLN-LEU-TYR-GLU-ASP-ASN-HIS-GLU-GLU-ASP-TYR-PHE-LEU-TYR-VAL-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR-GLY-LYS,THR-ASP-LEU-GLY-THR-ASP-TRP-GLU-ASN-LEU-PRO-SER-PRO-ARG-PHE,123,15,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1c[nH]c2c1cccc2)CCC(=O)O)CC(=O)N)CC(C)C,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,C,A,,1,1,123,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.9333110451698304,0.7306520938873291,91.57978057861328,89.39729309082031,0.3427573144435882,0.7564859986305237,0.9277549386024476,0.820853590965271,0.8667652606964111,0.7081016898155212,TDLGTDWENLPSPRF,Low,"(5.699, 5.821]",val
6HOI,protein-peptide,Q9H0R8 Q14457,GPTMGSMKFQYKEDHPFEYRKKEGEKIRKKYPDRVPVIVEKAPKARVPDLDKRKYLVPSDLTVGQFYFLIRKRIHLRPEDALFFFVNNTIPPTSATMGQLYEDNHEEDYFLYVAYSDESVYGK,SANSFTLIGE,GLY-PRO-THR-MET-GLY-SER-MET-LYS-PHE-GLN-TYR-LYS-GLU-ASP-HIS-PRO-PHE-GLU-TYR-ARG-LYS-LYS-GLU-GLY-GLU-LYS-ILE-ARG-LYS-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-ALA-ARG-VAL-PRO-ASP-LEU-ASP-LYS-ARG-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-HIS-LEU-ARG-PRO-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-THR-ILE-PRO-PRO-THR-SER-ALA-THR-MET-GLY-GLN-LEU-TYR-GLU-ASP-ASN-HIS-GLU-GLU-ASP-TYR-PHE-LEU-TYR-VAL-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR-GLY-LYS,SER-ALA-ASN-SER-PHE-THR-LEU-ILE-GLY-GLU,123,10,CC[C@@H]([C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CO)CC(C)C)C,Kd=7.95uM,5.099633,5.1,1,A,A,1,A,A,0,,F,A,,0,1,123,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9696473479270936,0.8180334568023682,95.3755111694336,90.93970489501952,0.3066270649433136,0.5643956065177917,0.9418137669563292,0.8849902749061584,0.92961323261261,0.801294207572937,SANSFTLIGE,Low,"(5.014, 5.105]",train
6HKS,protein-peptide,P26045 P03126,GAMGSSTEDASQYYCDKNDNGDSYLVLIRITPDEDGKFGFNLKGGVDQKMPLVVSRINPESPADTCIPKLNEGDQIVLINGRDISEHTHDQVVMFIKASRESHSRELALVIRRR,RSSRTRRETQL,GLY-ALA-MET-GLY-SER-SER-THR-GLU-ASP-ALA-SER-GLN-TYR-TYR-CYS-ASP-LYS-ASN-ASP-ASN-GLY-ASP-SER-TYR-LEU-VAL-LEU-ILE-ARG-ILE-THR-PRO-ASP-GLU-ASP-GLY-LYS-PHE-GLY-PHE-ASN-LEU-LYS-GLY-GLY-VAL-ASP-GLN-LYS-MET-PRO-LEU-VAL-VAL-SER-ARG-ILE-ASN-PRO-GLU-SER-PRO-ALA-ASP-THR-CYS-ILE-PRO-LYS-LEU-ASN-GLU-GLY-ASP-GLN-ILE-VAL-LEU-ILE-ASN-GLY-ARG-ASP-ILE-SER-GLU-HIS-THR-HIS-ASP-GLN-VAL-VAL-MET-PHE-ILE-LYS-ALA-SER-ARG-GLU-SER-HIS-SER-ARG-GLU-LEU-ALA-LEU-VAL-ILE-ARG-ARG-ARG,ARG-SER-SER-ARG-THR-ARG-ARG-GLU-THR-GLN-LEU,114,11,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC(=O)O)CCC(=O)N)C,Kd=53uM,4.275724,4.28,1,A,A,1,A,A,0,,G,A,,1,1,114,11,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.9893954992294312,0.8736077547073364,88.5841293334961,85.76446533203125,0.3713704943656921,0.5999221801757812,0.8551093935966492,0.8546236753463745,0.857966959476471,0.801599383354187,RSSRTRRETQL,Low,"(4.155, 4.319]",train
6H8C,protein-peptide,P60520 Q9GZZ9,MGWMFKEDHSLEHRCVESAKIRAKYPDRVPVIVEKVSGSQIVDIDKRKYLVPSDITVAQFMWIIRKRIQLPSEKAIFLFVDKTVPQSSLTMGQLYEKEKDEDGFLYVAYSGENTFG,GAMEIIHEDNEWGIELVSE,MET-GLY-TRP-MET-PHE-LYS-GLU-ASP-HIS-SER-LEU-GLU-HIS-ARG-CYS-VAL-GLU-SER-ALA-LYS-ILE-ARG-ALA-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-VAL-SER-GLY-SER-GLN-ILE-VAL-ASP-ILE-ASP-LYS-ARG-LYS-TYR-LEU-VAL-PRO-SER-ASP-ILE-THR-VAL-ALA-GLN-PHE-MET-TRP-ILE-ILE-ARG-LYS-ARG-ILE-GLN-LEU-PRO-SER-GLU-LYS-ALA-ILE-PHE-LEU-PHE-VAL-ASP-LYS-THR-VAL-PRO-GLN-SER-SER-LEU-THR-MET-GLY-GLN-LEU-TYR-GLU-LYS-GLU-LYS-ASP-GLU-ASP-GLY-PHE-LEU-TYR-VAL-ALA-TYR-SER-GLY-GLU-ASN-THR-PHE-GLY,GLY-ALA-MET-GLU-ILE-ILE-HIS-GLU-ASP-ASN-GLU-TRP-GLY-ILE-GLU-LEU-VAL-SER-GLU,116,19,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CO)C(C)C)CC(C)C)CCC(=O)O)[C@H](CC)C)Cc1c[nH]c2c1cccc2)CCC(=O)O)CC(=O)N)CC(=O)O)CCC(=O)O)Cc1[nH]cnc1)[C@H](CC)C)[C@H](CC)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)C[NH3+])C,Kd=1.4uM,5.853872,5.85,1,A,A,1,A,A,0,,B,A,,1,1,116,19,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CC[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O,0.9449825882911682,0.7127777934074402,91.44738006591795,86.9502182006836,0.3866594731807709,0.8267521262168884,0.8883805871009827,0.8023791909217834,0.8711700439453125,0.690377414226532,GAMEIIHEDNEWGIELVSE,Low,"(5.821, 5.959]",train
6GY5,protein-peptide,P53355 Q9Y2M5,SMQGPRTRPRKPIRCGEVLFAVGGWCSGDAISSVERYDPQTNEWRMVASMSKRRCGVGVSVLDDLLYAVGGHDGSSYLNSVERYDPKTNQWSSDVAPTSTCRTSVGVAVLGGFLYAVGGQDGVSCLNIVERYDPKENKWTRVASMSTRRLGVAVAVLGGFLYAVGGSDGTSPLNTVERYNPQENRWHTIAPMGTRRKHLGCAVYQDMIYAVGGRDDTTELSSAERYNPRTNQWSPVVAMTSRRSGVGLAVVNGQLMAVGGFDGTTYLKTIEVFDPDANTWRLYGGMNYRRLGGGVGVIKMTHCE,LGLPDLVAKYN,SER-MET-GLN-GLY-PRO-ARG-THR-ARG-PRO-ARG-LYS-PRO-ILE-ARG-CYS-GLY-GLU-VAL-LEU-PHE-ALA-VAL-GLY-GLY-TRP-CYS-SER-GLY-ASP-ALA-ILE-SER-SER-VAL-GLU-ARG-TYR-ASP-PRO-GLN-THR-ASN-GLU-TRP-ARG-MET-VAL-ALA-SER-MET-SER-LYS-ARG-ARG-CYS-GLY-VAL-GLY-VAL-SER-VAL-LEU-ASP-ASP-LEU-LEU-TYR-ALA-VAL-GLY-GLY-HIS-ASP-GLY-SER-SER-TYR-LEU-ASN-SER-VAL-GLU-ARG-TYR-ASP-PRO-LYS-THR-ASN-GLN-TRP-SER-SER-ASP-VAL-ALA-PRO-THR-SER-THR-CYS-ARG-THR-SER-VAL-GLY-VAL-ALA-VAL-LEU-GLY-GLY-PHE-LEU-TYR-ALA-VAL-GLY-GLY-GLN-ASP-GLY-VAL-SER-CYS-LEU-ASN-ILE-VAL-GLU-ARG-TYR-ASP-PRO-LYS-GLU-ASN-LYS-TRP-THR-ARG-VAL-ALA-SER-MET-SER-THR-ARG-ARG-LEU-GLY-VAL-ALA-VAL-ALA-VAL-LEU-GLY-GLY-PHE-LEU-TYR-ALA-VAL-GLY-GLY-SER-ASP-GLY-THR-SER-PRO-LEU-ASN-THR-VAL-GLU-ARG-TYR-ASN-PRO-GLN-GLU-ASN-ARG-TRP-HIS-THR-ILE-ALA-PRO-MET-GLY-THR-ARG-ARG-LYS-HIS-LEU-GLY-CYS-ALA-VAL-TYR-GLN-ASP-MET-ILE-TYR-ALA-VAL-GLY-GLY-ARG-ASP-ASP-THR-THR-GLU-LEU-SER-SER-ALA-GLU-ARG-TYR-ASN-PRO-ARG-THR-ASN-GLN-TRP-SER-PRO-VAL-VAL-ALA-MET-THR-SER-ARG-ARG-SER-GLY-VAL-GLY-LEU-ALA-VAL-VAL-ASN-GLY-GLN-LEU-MET-ALA-VAL-GLY-GLY-PHE-ASP-GLY-THR-THR-TYR-LEU-LYS-THR-ILE-GLU-VAL-PHE-ASP-PRO-ASP-ALA-ASN-THR-TRP-ARG-LEU-TYR-GLY-GLY-MET-ASN-TYR-ARG-ARG-LEU-GLY-GLY-GLY-VAL-GLY-VAL-ILE-LYS-MET-THR-HIS-CYS-GLU,LEU-GLY-LEU-PRO-ASP-LEU-VAL-ALA-LYS-TYR-ASN,304,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CC(=O)O)CC(C)C)C,Kd=13.7uM,4.863279,4.86,1,A,A,1,A,A,0,,U,A,,1,1,304,11,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9288286566734314,0.7612190246582031,89.01438903808594,88.0360336303711,0.3825331926345825,0.811256468296051,0.9074651002883912,0.8652164340019226,0.8905187249183655,0.7126045227050781,LGLPDLVAKYN,Low,"(4.745, 4.866]",train
6G8K,protein-peptide,P31947 P46937,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,RAHSSPASLQ,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CYS-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,ACE-ARG-ALA-HIS-SEP-SER-PRO-ALA-BSE-LEU-GLN,236,11,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]([NH3+])C)COP(O)(O)O,IC50=35.4uM,4.450997,4.45,1,A,A,1,A,A,0,,P,A,,1,1,236,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9710941314697266,0.8244292140007019,94.37779998779295,89.63849639892578,0.3213866949081421,0.6101281642913818,0.945016384124756,0.9060910940170288,0.952207088470459,0.804013729095459,RAHSSPASLQ,Low,"(4.319, 4.456]",train
6FZP,protein-peptide,P37231 Q9UBK2,QLNPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY,EEPSLLKKLLLAPA,GLN-LEU-ASN-PRO-GLU-SER-ALA-ASP-LEU-ARG-ALA-LEU-ALA-LYS-HIS-LEU-TYR-ASP-SER-TYR-ILE-LYS-SER-PHE-PRO-LEU-THR-LYS-ALA-LYS-ALA-ARG-ALA-ILE-LEU-THR-GLY-LYS-THR-THR-ASP-LYS-SER-PRO-PHE-VAL-ILE-TYR-ASP-MET-ASN-SER-LEU-MET-MET-GLY-GLU-ASP-LYS-ILE-LYS-PHE-LYS-HIS-ILE-THR-PRO-LEU-GLN-GLU-GLN-SER-LYS-GLU-VAL-ALA-ILE-ARG-ILE-PHE-GLN-GLY-CYS-GLN-PHE-ARG-SER-VAL-GLU-ALA-VAL-GLN-GLU-ILE-THR-GLU-TYR-ALA-LYS-SER-ILE-PRO-GLY-PHE-VAL-ASN-LEU-ASP-LEU-ASN-ASP-GLN-VAL-THR-LEU-LEU-LYS-TYR-GLY-VAL-HIS-GLU-ILE-ILE-TYR-THR-MET-LEU-ALA-SER-LEU-MET-ASN-LYS-ASP-GLY-VAL-LEU-ILE-SER-GLU-GLY-GLN-GLY-PHE-MET-THR-ARG-GLU-PHE-LEU-LYS-SER-LEU-ARG-LYS-PRO-PHE-GLY-ASP-PHE-MET-GLU-PRO-LYS-PHE-GLU-PHE-ALA-VAL-LYS-PHE-ASN-ALA-LEU-GLU-LEU-ASP-ASP-SER-ASP-LEU-ALA-ILE-PHE-ILE-ALA-VAL-ILE-ILE-LEU-SER-GLY-ASP-ARG-PRO-GLY-LEU-LEU-ASN-VAL-LYS-PRO-ILE-GLU-ASP-ILE-GLN-ASP-ASN-LEU-LEU-GLN-ALA-LEU-GLU-LEU-GLN-LEU-LYS-LEU-ASN-HIS-PRO-GLU-SER-SER-GLN-LEU-PHE-ALA-LYS-LEU-LEU-GLN-LYS-MET-THR-ASP-LEU-ARG-GLN-ILE-VAL-THR-GLU-HIS-VAL-GLN-LEU-LEU-GLN-VAL-ILE-LYS-LYS-THR-GLU-THR-ASP-MET-SER-LEU-HIS-PRO-LEU-LEU-GLN-GLU-ILE-TYR-LYS-ASP-LEU-TYR,GLU-GLU-PRO-SER-LEU-LEU-LYS-LYS-LEU-LEU-LEU-ALA-PRO-ALA,275,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(C)C)CC(C)C)CCCC[NH3+],Kd=0.38uM,6.420216,6.42,1,A,A,1,A,A,0,,C,A,,1,1,275,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.9490441679954528,0.7692409753799438,90.28260040283205,83.21015167236328,0.3565287292003631,0.848961591720581,0.9349781274795532,0.859873354434967,0.9222838282585144,0.7465828657150269,EEPSLLKKLLLAPA,Low,"(6.398, 6.523]",train
6FZJ,protein-peptide,P37231,QLNPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDINSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY,EEPSLLKKLLLAPA,GLN-LEU-ASN-PRO-GLU-SER-ALA-ASP-LEU-ARG-ALA-LEU-ALA-LYS-HIS-LEU-TYR-ASP-SER-TYR-ILE-LYS-SER-PHE-PRO-LEU-THR-LYS-ALA-LYS-ALA-ARG-ALA-ILE-LEU-THR-GLY-LYS-THR-THR-ASP-LYS-SER-PRO-PHE-VAL-ILE-TYR-ASP-ILE-ASN-SER-LEU-MET-MET-GLY-GLU-ASP-LYS-ILE-LYS-PHE-LYS-HIS-ILE-THR-PRO-LEU-GLN-GLU-GLN-SER-LYS-GLU-VAL-ALA-ILE-ARG-ILE-PHE-GLN-GLY-CYS-GLN-PHE-ARG-SER-VAL-GLU-ALA-VAL-GLN-GLU-ILE-THR-GLU-TYR-ALA-LYS-SER-ILE-PRO-GLY-PHE-VAL-ASN-LEU-ASP-LEU-ASN-ASP-GLN-VAL-THR-LEU-LEU-LYS-TYR-GLY-VAL-HIS-GLU-ILE-ILE-TYR-THR-MET-LEU-ALA-SER-LEU-MET-ASN-LYS-ASP-GLY-VAL-LEU-ILE-SER-GLU-GLY-GLN-GLY-PHE-MET-THR-ARG-GLU-PHE-LEU-LYS-SER-LEU-ARG-LYS-PRO-PHE-GLY-ASP-PHE-MET-GLU-PRO-LYS-PHE-GLU-PHE-ALA-VAL-LYS-PHE-ASN-ALA-LEU-GLU-LEU-ASP-ASP-SER-ASP-LEU-ALA-ILE-PHE-ILE-ALA-VAL-ILE-ILE-LEU-SER-GLY-ASP-ARG-PRO-GLY-LEU-LEU-ASN-VAL-LYS-PRO-ILE-GLU-ASP-ILE-GLN-ASP-ASN-LEU-LEU-GLN-ALA-LEU-GLU-LEU-GLN-LEU-LYS-LEU-ASN-HIS-PRO-GLU-SER-SER-GLN-LEU-PHE-ALA-LYS-LEU-LEU-GLN-LYS-MET-THR-ASP-LEU-ARG-GLN-ILE-VAL-THR-GLU-HIS-VAL-GLN-LEU-LEU-GLN-VAL-ILE-LYS-LYS-THR-GLU-THR-ASP-MET-SER-LEU-HIS-PRO-LEU-LEU-GLN-GLU-ILE-TYR-LYS-ASP-LEU-TYR,GLU-GLU-PRO-SER-LEU-LEU-LYS-LYS-LEU-LEU-LEU-ALA-PRO-ALA,275,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CO)CC(C)C)CC(C)C)CCCC[NH3+],Kd=0.47uM,6.327902,6.33,1,A,A,1,A,A,0,,C,A,,1,1,275,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.9399459958076476,0.7730395793914795,90.2853775024414,83.73597717285156,0.3631497919559479,0.8629135489463806,0.9339293241500854,0.8620138764381409,0.9111732840538024,0.7507959604263306,EEPSLLKKLLLAPA,Low,"(6.26, 6.398]",train
6FZF,protein-peptide,P37231 Q9UBK2,GSHMQLNPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVMEHVQLLQVIKKTETDMSLHPLLQEIYKDLY,EEPSLLKKLLLAPA,GLY-SER-HIS-MET-GLN-LEU-ASN-PRO-GLU-SER-ALA-ASP-LEU-ARG-ALA-LEU-ALA-LYS-HIS-LEU-TYR-ASP-SER-TYR-ILE-LYS-SER-PHE-PRO-LEU-THR-LYS-ALA-LYS-ALA-ARG-ALA-ILE-LEU-THR-GLY-LYS-THR-THR-ASP-LYS-SER-PRO-PHE-VAL-ILE-TYR-ASP-MET-ASN-SER-LEU-MET-MET-GLY-GLU-ASP-LYS-ILE-LYS-PHE-LYS-HIS-ILE-THR-PRO-LEU-GLN-GLU-GLN-SER-LYS-GLU-VAL-ALA-ILE-ARG-ILE-PHE-GLN-GLY-CYS-GLN-PHE-ARG-SER-VAL-GLU-ALA-VAL-GLN-GLU-ILE-THR-GLU-TYR-ALA-LYS-SER-ILE-PRO-GLY-PHE-VAL-ASN-LEU-ASP-LEU-ASN-ASP-GLN-VAL-THR-LEU-LEU-LYS-TYR-GLY-VAL-HIS-GLU-ILE-ILE-TYR-THR-MET-LEU-ALA-SER-LEU-MET-ASN-LYS-ASP-GLY-VAL-LEU-ILE-SER-GLU-GLY-GLN-GLY-PHE-MET-THR-ARG-GLU-PHE-LEU-LYS-SER-LEU-ARG-LYS-PRO-PHE-GLY-ASP-PHE-MET-GLU-PRO-LYS-PHE-GLU-PHE-ALA-VAL-LYS-PHE-ASN-ALA-LEU-GLU-LEU-ASP-ASP-SER-ASP-LEU-ALA-ILE-PHE-ILE-ALA-VAL-ILE-ILE-LEU-SER-GLY-ASP-ARG-PRO-GLY-LEU-LEU-ASN-VAL-LYS-PRO-ILE-GLU-ASP-ILE-GLN-ASP-ASN-LEU-LEU-GLN-ALA-LEU-GLU-LEU-GLN-LEU-LYS-LEU-ASN-HIS-PRO-GLU-SER-SER-GLN-LEU-PHE-ALA-LYS-LEU-LEU-GLN-LYS-MET-THR-ASP-LEU-ARG-GLN-ILE-VAL-MET-GLU-HIS-VAL-GLN-LEU-LEU-GLN-VAL-ILE-LYS-LYS-THR-GLU-THR-ASP-MET-SER-LEU-HIS-PRO-LEU-LEU-GLN-GLU-ILE-TYR-LYS-ASP-LEU-TYR,GLU-GLU-PRO-SER-LEU-LEU-LYS-LYS-LEU-LEU-LEU-ALA-PRO-ALA,279,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)[NH3+])CO)CC(C)C)CC(C)C)CCCC[NH3+],Kd=0.15uM,6.823909,6.82,1,A,A,1,A,A,0,,C,A,,1,1,279,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.9231936931610109,0.7864881753921509,88.5677261352539,83.34100341796875,0.4284865856170654,0.8316695690155029,0.9045630693435668,0.8612242341041565,0.883056104183197,0.7521231174468994,EEPSLLKKLLLAPA,Low,"(6.696, 6.824]",train
6FVO,protein-peptide,,MDAATTRVGLTDLTFRLLRESFADAVSWVAKNLPARPAVPVLSGVLLTGSDNGLTISGFDYEVSAEAQVGAEIVSPGSVLVSGRLLSDITRALPNKPVDVHVEGNRVALTCGNARFSLPTMPVEDYPTLPTLPEETGLLPAELFAEAISQVAIAAGRDDTLPMLTGIRVEILGETVVLAATDRFRLAVRELKWSASSPDIEAAVLVPAKTLAEAAKAGIGGSDVRLSLGTGPGVGKDGLLGISGNGKRSTTRLLDAEFPKFRQLLPTEHTAVATMDVAELIEAIKLVALVADRGAQVRMEFADGSVRLSAGADDVGRAEEDLVVDYAGEPLTIAFNPTYLTDGLSSLRSERVSFGFTTAGKSALLRPVSGDDRPVAGLNGNGPFPAVSTDYVYLLMPVRLPG,QADLF,MET-ASP-ALA-ALA-THR-THR-ARG-VAL-GLY-LEU-THR-ASP-LEU-THR-PHE-ARG-LEU-LEU-ARG-GLU-SER-PHE-ALA-ASP-ALA-VAL-SER-TRP-VAL-ALA-LYS-ASN-LEU-PRO-ALA-ARG-PRO-ALA-VAL-PRO-VAL-LEU-SER-GLY-VAL-LEU-LEU-THR-GLY-SER-ASP-ASN-GLY-LEU-THR-ILE-SER-GLY-PHE-ASP-TYR-GLU-VAL-SER-ALA-GLU-ALA-GLN-VAL-GLY-ALA-GLU-ILE-VAL-SER-PRO-GLY-SER-VAL-LEU-VAL-SER-GLY-ARG-LEU-LEU-SER-ASP-ILE-THR-ARG-ALA-LEU-PRO-ASN-LYS-PRO-VAL-ASP-VAL-HIS-VAL-GLU-GLY-ASN-ARG-VAL-ALA-LEU-THR-CYS-GLY-ASN-ALA-ARG-PHE-SER-LEU-PRO-THR-MET-PRO-VAL-GLU-ASP-TYR-PRO-THR-LEU-PRO-THR-LEU-PRO-GLU-GLU-THR-GLY-LEU-LEU-PRO-ALA-GLU-LEU-PHE-ALA-GLU-ALA-ILE-SER-GLN-VAL-ALA-ILE-ALA-ALA-GLY-ARG-ASP-ASP-THR-LEU-PRO-MET-LEU-THR-GLY-ILE-ARG-VAL-GLU-ILE-LEU-GLY-GLU-THR-VAL-VAL-LEU-ALA-ALA-THR-ASP-ARG-PHE-ARG-LEU-ALA-VAL-ARG-GLU-LEU-LYS-TRP-SER-ALA-SER-SER-PRO-ASP-ILE-GLU-ALA-ALA-VAL-LEU-VAL-PRO-ALA-LYS-THR-LEU-ALA-GLU-ALA-ALA-LYS-ALA-GLY-ILE-GLY-GLY-SER-ASP-VAL-ARG-LEU-SER-LEU-GLY-THR-GLY-PRO-GLY-VAL-GLY-LYS-ASP-GLY-LEU-LEU-GLY-ILE-SER-GLY-ASN-GLY-LYS-ARG-SER-THR-THR-ARG-LEU-LEU-ASP-ALA-GLU-PHE-PRO-LYS-PHE-ARG-GLN-LEU-LEU-PRO-THR-GLU-HIS-THR-ALA-VAL-ALA-THR-MET-ASP-VAL-ALA-GLU-LEU-ILE-GLU-ALA-ILE-LYS-LEU-VAL-ALA-LEU-VAL-ALA-ASP-ARG-GLY-ALA-GLN-VAL-ARG-MET-GLU-PHE-ALA-ASP-GLY-SER-VAL-ARG-LEU-SER-ALA-GLY-ALA-ASP-ASP-VAL-GLY-ARG-ALA-GLU-GLU-ASP-LEU-VAL-VAL-ASP-TYR-ALA-GLY-GLU-PRO-LEU-THR-ILE-ALA-PHE-ASN-PRO-THR-TYR-LEU-THR-ASP-GLY-LEU-SER-SER-LEU-ARG-SER-GLU-ARG-VAL-SER-PHE-GLY-PHE-THR-THR-ALA-GLY-LYS-SER-ALA-LEU-LEU-ARG-PRO-VAL-SER-GLY-ASP-ASP-ARG-PRO-VAL-ALA-GLY-LEU-ASN-GLY-ASN-GLY-PRO-PHE-PRO-ALA-VAL-SER-THR-ASP-TYR-VAL-TYR-LEU-LEU-MET-PRO-VAL-ARG-LEU-PRO-GLY,ACE-GLN-ALC-ASP-LEU-PHE,402,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC1CCCCC1)CC(=O)O)C,Kd=2.84uM,5.546682,5.55,1,A,A,1,A,A,0,,H,A,,1,1,402,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.8967214822769165,0.8865188360214233,73.72742462158203,73.68497467041016,0.5315103530883789,0.6121857166290283,0.833690881729126,0.8357003927230835,0.8909803628921509,0.8836761713027954,QADLF,Low,"(5.463, 5.6]",train
6FVM,protein-peptide,,SHMKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSPVQIEDAASQSAAYVVMPMRL,QADLF,SER-HIS-MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-PRO-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-ALC-ASP-LEU-PHE,368,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC1CCCCC1)CC(=O)O)C,Kd=0.25uM,6.60206,6.6,1,A,A,1,A,A,0,,H,A,,1,1,368,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9120092391967772,0.9007202982902528,90.21414947509766,88.80943298339844,0.36891770362854,0.4693828225135803,0.9123091101646424,0.9080495238304138,0.903556227684021,0.8988879323005676,QADLF,Low,"(6.523, 6.696]",train
6FVL,protein-peptide,P0A988,SHMKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QADLF,SER-HIS-MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-ALC-ASP-LEU-PHE,368,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC1CCCCC1)CC(=O)O)C,Kd=0.16uM,6.79588,6.8,1,A,A,1,A,A,0,,H,A,,1,1,368,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9132728576660156,0.909311830997467,90.09508514404295,87.30619049072266,0.3722113072872162,0.4610059559345245,0.909536063671112,0.9075385928153992,0.9058289527893066,0.9097551703453064,QADLF,Low,"(6.696, 6.824]",train
6FRJ,protein-peptide,,QVQLQESGGGLVQPGGSMKLSCVASGFTFSNYWMNWVRQSPEKGLEWVAEIRLKSNNYATHYAESVKGRFTISRDDSKSSVYLQMNNLRAEDTGIYYCTGVGQFAYWGQGTTVTVSSSSGGGGSGGGGGSSGSSDIVVTQESALTTSPGETVTLTCRSSTGAVTTSNYANWVQEKPDHLFTGLIGGTNNRAPGVPARFSGSLIGDKAALTITGAQTEDEAIYFCALWYSNHWVFGGGTKLTVLG,APDTRP,GLN-VAL-GLN-LEU-GLN-GLU-SER-GLY-GLY-GLY-LEU-VAL-GLN-PRO-GLY-GLY-SER-MET-LYS-LEU-SER-CYS-VAL-ALA-SER-GLY-PHE-THR-PHE-SER-ASN-TYR-TRP-MET-ASN-TRP-VAL-ARG-GLN-SER-PRO-GLU-LYS-GLY-LEU-GLU-TRP-VAL-ALA-GLU-ILE-ARG-LEU-LYS-SER-ASN-ASN-TYR-ALA-THR-HIS-TYR-ALA-GLU-SER-VAL-LYS-GLY-ARG-PHE-THR-ILE-SER-ARG-ASP-ASP-SER-LYS-SER-SER-VAL-TYR-LEU-GLN-MET-ASN-ASN-LEU-ARG-ALA-GLU-ASP-THR-GLY-ILE-TYR-TYR-CYS-THR-GLY-VAL-GLY-GLN-PHE-ALA-TYR-TRP-GLY-GLN-GLY-THR-THR-VAL-THR-VAL-SER-SER-SER-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-GLY-SER-SER-GLY-SER-SER-ASP-ILE-VAL-VAL-THR-GLN-GLU-SER-ALA-LEU-THR-THR-SER-PRO-GLY-GLU-THR-VAL-THR-LEU-THR-CYS-ARG-SER-SER-THR-GLY-ALA-VAL-THR-THR-SER-ASN-TYR-ALA-ASN-TRP-VAL-GLN-GLU-LYS-PRO-ASP-HIS-LEU-PHE-THR-GLY-LEU-ILE-GLY-GLY-THR-ASN-ASN-ARG-ALA-PRO-GLY-VAL-PRO-ALA-ARG-PHE-SER-GLY-SER-LEU-ILE-GLY-ASP-LYS-ALA-ALA-LEU-THR-ILE-THR-GLY-ALA-GLN-THR-GLU-ASP-GLU-ALA-ILE-TYR-PHE-CYS-ALA-LEU-TRP-TYR-SER-ASN-HIS-TRP-VAL-PHE-GLY-GLY-GLY-THR-LYS-LEU-THR-VAL-LEU-GLY,ALA-PRO-ASP-T9E-ARG-PRO-NH2,244,7,OC[C@H]1O[C@H]([SeH4][C@@H]([C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])C)CC(=O)O)C)[C@@H]([C@H]([C@H]1O)O)NC(=O)C,Kd=193uM,3.714443,3.71,1,A,A,1,A,A,0,,B,H,,1,1,244,7,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC([SeH])C(NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC([SeH])C(NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9582434296607972,0.8396391272544861,94.34950256347656,92.9121551513672,0.3350629806518554,0.5657516121864319,0.933667004108429,0.9000034928321838,0.9118874669075012,0.781002938747406,APDTRP,Low,"(3.548, 3.924]",train
6E5X,protein-peptide,Q77DJ5 Q7Z6E9,PKITLLTLIKTAEHWARQDIRTIEDSKLRALLTLCAVMTRKFSKSQLSLLCETHLRREGLGQDQAEPVLEVYQRLHSDKGGSFEAALWQQWDRQSLIMFITAFLNIALQLPCESSAVVVSGLRTLVP,PVFVPVPPPPLYPPP,PRO-LYS-ILE-THR-LEU-LEU-THR-LEU-ILE-LYS-THR-ALA-GLU-HIS-TRP-ALA-ARG-GLN-ASP-ILE-ARG-THR-ILE-GLU-ASP-SER-LYS-LEU-ARG-ALA-LEU-LEU-THR-LEU-CYS-ALA-VAL-MET-THR-ARG-LYS-PHE-SER-LYS-SER-GLN-LEU-SER-LEU-LEU-CYS-GLU-THR-HIS-LEU-ARG-ARG-GLU-GLY-LEU-GLY-GLN-ASP-GLN-ALA-GLU-PRO-VAL-LEU-GLU-VAL-TYR-GLN-ARG-LEU-HIS-SER-ASP-LYS-GLY-GLY-SER-PHE-GLU-ALA-ALA-LEU-TRP-GLN-GLN-TRP-ASP-ARG-GLN-SER-LEU-ILE-MET-PHE-ILE-THR-ALA-PHE-LEU-ASN-ILE-ALA-LEU-GLN-LEU-PRO-CYS-GLU-SER-SER-ALA-VAL-VAL-VAL-SER-GLY-LEU-ARG-THR-LEU-VAL-PRO,PRO-VAL-PHE-VAL-PRO-VAL-PRO-PRO-PRO-PRO-LEU-TYR-PRO-PRO-PRO,127,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccccc1)[NH3+])C,Kd=0.75uM,6.124939,6.12,1,A,A,1,A,A,0,,B,A,,1,1,127,15,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9107708930969238,0.7184196710586548,93.4577178955078,84.17414093017578,0.4062061011791229,0.8096533417701721,0.8861315846443176,0.7715854644775391,0.8112968802452087,0.7051282525062561,PVFVPVPPPPLYPPP,Low,"(6.097, 6.26]",train
6DQL,protein-peptide,D3KVD8,NVDEFLFISNNFKQYKEFIDMDTAKHYFECRNIEGLNHILDSYKDSKSTKEKNLFALVKVLLATLTEEDCLTERTYLSNYLINIETWSHYETVLFNNCMFIFESCFIEMVFSKVILNLDKYNTLRYYGNESIRMFVNMLILFIQRQEYDKASEILAKIEDYQLNDDCLYERCCVSFFDGIIGLINGKEGAEQKCVQILEIFQLLNCKTIHHMFQTYLEAIKHKLSLEHHHHHH,MWLLLLFL,ASN-VAL-ASP-GLU-PHE-LEU-PHE-ILE-SER-ASN-ASN-PHE-LYS-GLN-TYR-LYS-GLU-PHE-ILE-ASP-MET-ASP-THR-ALA-LYS-HIS-TYR-PHE-GLU-CYS-ARG-ASN-ILE-GLU-GLY-LEU-ASN-HIS-ILE-LEU-ASP-SER-TYR-LYS-ASP-SER-LYS-SER-THR-LYS-GLU-LYS-ASN-LEU-PHE-ALA-LEU-VAL-LYS-VAL-LEU-LEU-ALA-THR-LEU-THR-GLU-GLU-ASP-CYS-LEU-THR-GLU-ARG-THR-TYR-LEU-SER-ASN-TYR-LEU-ILE-ASN-ILE-GLU-THR-TRP-SER-HIS-TYR-GLU-THR-VAL-LEU-PHE-ASN-ASN-CYS-MET-PHE-ILE-PHE-GLU-SER-CYS-PHE-ILE-GLU-MET-VAL-PHE-SER-LYS-VAL-ILE-LEU-ASN-LEU-ASP-LYS-TYR-ASN-THR-LEU-ARG-TYR-TYR-GLY-ASN-GLU-SER-ILE-ARG-MET-PHE-VAL-ASN-MET-LEU-ILE-LEU-PHE-ILE-GLN-ARG-GLN-GLU-TYR-ASP-LYS-ALA-SER-GLU-ILE-LEU-ALA-LYS-ILE-GLU-ASP-TYR-GLN-LEU-ASN-ASP-ASP-CYS-LEU-TYR-GLU-ARG-CYS-CYS-VAL-SER-PHE-PHE-ASP-GLY-ILE-ILE-GLY-LEU-ILE-ASN-GLY-LYS-GLU-GLY-ALA-GLU-GLN-LYS-CYS-VAL-GLN-ILE-LEU-GLU-ILE-PHE-GLN-LEU-LEU-ASN-CYS-LYS-THR-ILE-HIS-HIS-MET-PHE-GLN-THR-TYR-LEU-GLU-ALA-ILE-LYS-HIS-LYS-LEU-SER-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,MET-TRP-LEU-LEU-LEU-LEU-PHE-LEU,233,8,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)CC(C)C)CC(C)C)CC(C)C)CC(C)C)Cc1c[nH]c2c1cccc2)[NH3+],Kd=13nM,7.886057,7.89,1,A,A,1,A,A,0,,C,A,,1,1,233,8,0,CSCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(=O)O,0.8811858296394348,0.8736077547073364,75.88330841064453,76.5489501953125,0.4783626496791839,0.6527673006057739,0.856717050075531,0.8695623278617859,0.8484026193618774,0.8504774570465088,MWLLLLFL,Moderate,"(7.523, 7.921]",train
6D40,protein-peptide,Q4GWU5 P00747,PSFDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRTRFGMHFCGGTLISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVNLEPHVQEIEVSRLFLEPTRKDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGAGLLKEAQLPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDSGGPLVCFEKDKYILQGVTSWGLGCARPNKPGVYVRVSRFVTWIEGVMRNN,GRCYKSIPPICFPD,PRO-SER-PHE-ASP-CYS-GLY-LYS-PRO-GLN-VAL-GLU-PRO-LYS-LYS-CYS-PRO-GLY-ARG-VAL-VAL-GLY-GLY-CYS-VAL-ALA-HIS-PRO-HIS-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-ARG-THR-ARG-PHE-GLY-MET-HIS-PHE-CYS-GLY-GLY-THR-LEU-ILE-SER-PRO-GLU-TRP-VAL-LEU-THR-ALA-ALA-HIS-CYS-LEU-GLU-LYS-SER-PRO-ARG-PRO-SER-SER-TYR-LYS-VAL-ILE-LEU-GLY-ALA-HIS-GLN-GLU-VAL-ASN-LEU-GLU-PRO-HIS-VAL-GLN-GLU-ILE-GLU-VAL-SER-ARG-LEU-PHE-LEU-GLU-PRO-THR-ARG-LYS-ASP-ILE-ALA-LEU-LEU-LYS-LEU-SER-SER-PRO-ALA-VAL-ILE-THR-ASP-LYS-VAL-ILE-PRO-ALA-CYS-LEU-PRO-SER-PRO-ASN-TYR-VAL-VAL-ALA-ASP-ARG-THR-GLU-CYS-PHE-ILE-THR-GLY-TRP-GLY-GLU-THR-GLN-GLY-THR-PHE-GLY-ALA-GLY-LEU-LEU-LYS-GLU-ALA-GLN-LEU-PRO-VAL-ILE-GLU-ASN-LYS-VAL-CYS-ASN-ARG-TYR-GLU-PHE-LEU-ASN-GLY-ARG-VAL-GLN-SER-THR-GLU-LEU-CYS-ALA-GLY-HIS-LEU-ALA-GLY-GLY-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-PHE-GLU-LYS-ASP-LYS-TYR-ILE-LEU-GLN-GLY-VAL-THR-SER-TRP-GLY-LEU-GLY-CYS-ALA-ARG-PRO-ASN-LYS-PRO-GLY-VAL-TYR-VAL-ARG-VAL-SER-ARG-PHE-VAL-THR-TRP-ILE-GLU-GLY-VAL-MET-ARG-ASN-ASN,GLY-ARG-CYS-TYR-LYS-SER-ILE-PRO-PRO-ILE-CYS-PHE-PRO-ASP,248,14,[NH3+]CCCC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)[C@H](CC)C)CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N2)CCC[NH+]=C(N)N)O1)CC(=O)O,Ki=0.14nM,9.853872,9.85,1,A,A,1,A,A,0,,C,A,,1,1,248,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9609413146972656,0.8378206491470337,94.8953857421875,92.45533752441406,0.4148022532463074,0.6476256847381592,0.9436029195785522,0.9045344591140748,0.9318789839744568,0.8211421966552734,GRCYKSIPPICFPD,High,"(8.824, 12.12]",val
6D3Z,protein-peptide,Q4GWU5 P00747,FDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRTRFGMHFCGGTLISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVNLEPHVQEIEVSRLFLEPTRKDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGAGLLKEAQLPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDAGGPLVCFEKDKYILQGVTSWGLGCARPNKPGVYVRVSRFVTWIEGVMRNN,GRCYKSRPPICFPN,PHE-ASP-CYS-GLY-LYS-PRO-GLN-VAL-GLU-PRO-LYS-LYS-CYS-PRO-GLY-ARG-VAL-VAL-GLY-GLY-CYS-VAL-ALA-HIS-PRO-HIS-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-ARG-THR-ARG-PHE-GLY-MET-HIS-PHE-CYS-GLY-GLY-THR-LEU-ILE-SER-PRO-GLU-TRP-VAL-LEU-THR-ALA-ALA-HIS-CYS-LEU-GLU-LYS-SER-PRO-ARG-PRO-SER-SER-TYR-LYS-VAL-ILE-LEU-GLY-ALA-HIS-GLN-GLU-VAL-ASN-LEU-GLU-PRO-HIS-VAL-GLN-GLU-ILE-GLU-VAL-SER-ARG-LEU-PHE-LEU-GLU-PRO-THR-ARG-LYS-ASP-ILE-ALA-LEU-LEU-LYS-LEU-SER-SER-PRO-ALA-VAL-ILE-THR-ASP-LYS-VAL-ILE-PRO-ALA-CYS-LEU-PRO-SER-PRO-ASN-TYR-VAL-VAL-ALA-ASP-ARG-THR-GLU-CYS-PHE-ILE-THR-GLY-TRP-GLY-GLU-THR-GLN-GLY-THR-PHE-GLY-ALA-GLY-LEU-LEU-LYS-GLU-ALA-GLN-LEU-PRO-VAL-ILE-GLU-ASN-LYS-VAL-CYS-ASN-ARG-TYR-GLU-PHE-LEU-ASN-GLY-ARG-VAL-GLN-SER-THR-GLU-LEU-CYS-ALA-GLY-HIS-LEU-ALA-GLY-GLY-THR-ASP-SER-CYS-GLN-GLY-ASP-ALA-GLY-GLY-PRO-LEU-VAL-CYS-PHE-GLU-LYS-ASP-LYS-TYR-ILE-LEU-GLN-GLY-VAL-THR-SER-TRP-GLY-LEU-GLY-CYS-ALA-ARG-PRO-ASN-LYS-PRO-GLY-VAL-TYR-VAL-ARG-VAL-SER-ARG-PHE-VAL-THR-TRP-ILE-GLU-GLY-VAL-MET-ARG-ASN-ASN,GLY-ARG-CYS-TYR-LYS-SER-ARG-PRO-PRO-ILE-CYS-PHE-PRO-ASN,246,14,[NH3+]CCCC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)CCC[NH+]=C(N)N)CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N2)CCC[NH+]=C(N)N)O1)CC(=O)N,Ki=1.2nM,8.920819,8.92,1,A,A,1,A,A,0,,C,A,,1,1,246,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.947806179523468,0.8146921396255493,95.20974731445312,92.43724822998048,0.4351451694965362,0.6933556199073792,0.94125497341156,0.8946382403373718,0.9157901406288148,0.7947055697441101,GRCYKSRPPICFPN,Moderate,"(8.824, 12.12]",train
6D3Y,protein-peptide,Q4GWU5 P00747,SFDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRTRFGMHFCGGTLISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVNLEPHVQEIEVSRLFLEPTRKDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGAGLLKEAQLPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDSGGPLVCFEKDKYILQGVTSWGLGCARPNKPGVYVRVSRFVTWIEGVMRNN,GRCTKSRPPICFPD,SER-PHE-ASP-CYS-GLY-LYS-PRO-GLN-VAL-GLU-PRO-LYS-LYS-CYS-PRO-GLY-ARG-VAL-VAL-GLY-GLY-CYS-VAL-ALA-HIS-PRO-HIS-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-ARG-THR-ARG-PHE-GLY-MET-HIS-PHE-CYS-GLY-GLY-THR-LEU-ILE-SER-PRO-GLU-TRP-VAL-LEU-THR-ALA-ALA-HIS-CYS-LEU-GLU-LYS-SER-PRO-ARG-PRO-SER-SER-TYR-LYS-VAL-ILE-LEU-GLY-ALA-HIS-GLN-GLU-VAL-ASN-LEU-GLU-PRO-HIS-VAL-GLN-GLU-ILE-GLU-VAL-SER-ARG-LEU-PHE-LEU-GLU-PRO-THR-ARG-LYS-ASP-ILE-ALA-LEU-LEU-LYS-LEU-SER-SER-PRO-ALA-VAL-ILE-THR-ASP-LYS-VAL-ILE-PRO-ALA-CYS-LEU-PRO-SER-PRO-ASN-TYR-VAL-VAL-ALA-ASP-ARG-THR-GLU-CYS-PHE-ILE-THR-GLY-TRP-GLY-GLU-THR-GLN-GLY-THR-PHE-GLY-ALA-GLY-LEU-LEU-LYS-GLU-ALA-GLN-LEU-PRO-VAL-ILE-GLU-ASN-LYS-VAL-CYS-ASN-ARG-TYR-GLU-PHE-LEU-ASN-GLY-ARG-VAL-GLN-SER-THR-GLU-LEU-CYS-ALA-GLY-HIS-LEU-ALA-GLY-GLY-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-PHE-GLU-LYS-ASP-LYS-TYR-ILE-LEU-GLN-GLY-VAL-THR-SER-TRP-GLY-LEU-GLY-CYS-ALA-ARG-PRO-ASN-LYS-PRO-GLY-VAL-TYR-VAL-ARG-VAL-SER-ARG-PHE-VAL-THR-TRP-ILE-GLU-GLY-VAL-MET-ARG-ASN-ASN,GLY-ARG-CYS-THR-LYS-SER-ARG-PRO-PRO-ILE-CYS-PHE-PRO-ASP,247,14,[NH3+]CCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)CCC[NH+]=C(N)N)CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N2)CCC[NH+]=C(N)N)O1)CC(=O)O)[C@H](O)C,Ki=2.0nM,8.69897,8.7,1,A,A,1,A,A,0,,C,A,,1,1,247,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9600297808647156,0.8264268040657043,95.58800506591795,91.6575698852539,0.4094845950603485,0.6504560112953186,0.9461715817451476,0.9022576212882996,0.9299693703651428,0.8074690699577332,GRCTKSRPPICFPD,Moderate,"(8.383, 8.824]",train
6D3X,protein-peptide,Q4GWU5 P00747,FDCGKPQVEPKKCPGRVVGGCVAHPHSWPWQVSLRTRFGMHFCGGTLISPEWVLTAAHCLEKSPRPSSYKVILGAHQEVNLEPHVQEIEVSRLFLEPTRKDIALLKLSSPAVITDKVIPACLPSPNYVVADRTECFITGWGETQGTFGAGLLKEAQLPVIENKVCNRYEFLNGRVQSTELCAGHLAGGTDSCQGDSGGPLVCFEKDKYILQGVTSWGLGCARPNKPGVYVRVSRFVTWIEGVMRNN,GRCYKSKPPICFPD,PHE-ASP-CYS-GLY-LYS-PRO-GLN-VAL-GLU-PRO-LYS-LYS-CYS-PRO-GLY-ARG-VAL-VAL-GLY-GLY-CYS-VAL-ALA-HIS-PRO-HIS-SER-TRP-PRO-TRP-GLN-VAL-SER-LEU-ARG-THR-ARG-PHE-GLY-MET-HIS-PHE-CYS-GLY-GLY-THR-LEU-ILE-SER-PRO-GLU-TRP-VAL-LEU-THR-ALA-ALA-HIS-CYS-LEU-GLU-LYS-SER-PRO-ARG-PRO-SER-SER-TYR-LYS-VAL-ILE-LEU-GLY-ALA-HIS-GLN-GLU-VAL-ASN-LEU-GLU-PRO-HIS-VAL-GLN-GLU-ILE-GLU-VAL-SER-ARG-LEU-PHE-LEU-GLU-PRO-THR-ARG-LYS-ASP-ILE-ALA-LEU-LEU-LYS-LEU-SER-SER-PRO-ALA-VAL-ILE-THR-ASP-LYS-VAL-ILE-PRO-ALA-CYS-LEU-PRO-SER-PRO-ASN-TYR-VAL-VAL-ALA-ASP-ARG-THR-GLU-CYS-PHE-ILE-THR-GLY-TRP-GLY-GLU-THR-GLN-GLY-THR-PHE-GLY-ALA-GLY-LEU-LEU-LYS-GLU-ALA-GLN-LEU-PRO-VAL-ILE-GLU-ASN-LYS-VAL-CYS-ASN-ARG-TYR-GLU-PHE-LEU-ASN-GLY-ARG-VAL-GLN-SER-THR-GLU-LEU-CYS-ALA-GLY-HIS-LEU-ALA-GLY-GLY-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-PHE-GLU-LYS-ASP-LYS-TYR-ILE-LEU-GLN-GLY-VAL-THR-SER-TRP-GLY-LEU-GLY-CYS-ALA-ARG-PRO-ASN-LYS-PRO-GLY-VAL-TYR-VAL-ARG-VAL-SER-ARG-PHE-VAL-THR-TRP-ILE-GLU-GLY-VAL-MET-ARG-ASN-ASN,GLY-ARG-CYS-TYR-LYS-SER-LYS-PRO-PRO-ILE-CYS-PHE-PRO-ASP,246,14,[NH3+]CCCC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CO)CCCC[NH3+])CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N2)CCC[NH+]=C(N)N)O1)CC(=O)O,Ki=0.051nM,10.29243,10.29,1,A,A,1,A,A,0,,C,A,dimer,1,1,246,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9441192150115968,0.8174538016319275,95.14451599121094,93.03305053710938,0.4482289552688598,0.6832872033119202,0.9385315775871276,0.8977149724960327,0.9118622541427612,0.7973884344100952,GRCYKSKPPICFPD,High,"(8.824, 12.12]",val
6D07,protein-peptide,P83916 P68431,GEYVVEKVLDRRVVKGKVEYLLKWKGFSDEDNTWEPEENLDCPDLIAEFLQSQKT,ARTKQTARKSTGGKA,GLY-GLU-TYR-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-VAL-VAL-LYS-GLY-LYS-VAL-GLU-TYR-LEU-LEU-LYS-TRP-LYS-GLY-PHE-SER-ASP-GLU-ASP-ASN-THR-TRP-GLU-PRO-GLU-GLU-ASN-LEU-ASP-CYS-PRO-ASP-LEU-ILE-ALA-GLU-PHE-LEU-GLN-SER-GLN-LYS-THR,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA-NH2,55,16,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)N)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=5.2uM,5.283997,5.28,1,A,A,1,A,A,0,,C,A,,1,1,55,16,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.954145848751068,0.7387640476226807,94.61522674560548,91.6614227294922,0.3259502053260803,0.7051772475242615,0.8850493431091309,0.7981290221214294,0.8374913930892944,0.7239227294921875,ARTKQTARKSTGGKA,Low,"(5.222, 5.31]",val
6BYK,protein-peptide,P31946,MDKSELVQKAKLAEQAERYDDMAAAMKAVTEQGHELSNEERNLLSVAYKNVVGARRSSWRVISSIEQKTERNEKKQQMGKEYREKIEAELQDICNDVLELLDKYLIPNATQPESKVFYLKMKGDYFRYLSEVASGDNKQTTVSNSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLNEESYKDSTLIMQLLRDNLTLWTS,ATPPVSQASSTT,MET-ASP-LYS-SER-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-ALA-MET-LYS-ALA-VAL-THR-GLU-GLN-GLY-HIS-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-ILE-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-ARG-ASN-GLU-LYS-LYS-GLN-GLN-MET-GLY-LYS-GLU-TYR-ARG-GLU-LYS-ILE-GLU-ALA-GLU-LEU-GLN-ASP-ILE-CYS-ASN-ASP-VAL-LEU-GLU-LEU-LEU-ASP-LYS-TYR-LEU-ILE-PRO-ASN-ALA-THR-GLN-PRO-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-PHE-ARG-TYR-LEU-SER-GLU-VAL-ALA-SER-GLY-ASP-ASN-LYS-GLN-THR-THR-VAL-SER-ASN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-ASN-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER,ALA-THR-PRO-PRO-VAL-SER-GLN-ALA-SER-SER-THR-THR,230,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCC[NH2+]1,Kd=390uM,3.408935,3.41,1,A,A,1,A,A,0,,G,A,,0,1,230,12,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9506895542144777,0.8305029273033142,91.84497833251952,91.30461883544922,0.3068914413452148,0.602750837802887,0.947679877281189,0.9092143177986144,0.9204502105712892,0.8108250498771667,ATPPVSQASSTT,Low,"(2.044, 3.548]",val
6BW4,protein-peptide,Q9HAZ2 Q09028,GSMADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,MRSKARARKLAK,GLY-SER-MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,MET-ARG-SER-LYS-ALA-ARG-ALA-ARG-LYS-LEU-ALA-LYS,427,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC)CCCC[NH3+])CC)C)CCC[NH+]=C(N)N)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCS)[NH3+])CCC[NH+]=C(N)N)C,Kd=3.15uM,5.501689,5.5,1,A,A,1,A,A,0,,B,A,,0,1,427,12,0,CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)O,0.7891457676887512,0.6863753795623779,84.61614227294922,83.7057113647461,0.5644234418869019,1.0741002559661863,0.8641668558120728,0.8357176780700684,0.7234086990356445,0.6065924763679504,MRSKARARKLAK,Low,"(5.463, 5.6]",train
6BW3,protein-peptide,Q03112 Q09028,GSMADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,MRSKGRARKLAT,GLY-SER-MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,MET-ARG-SER-LYS-GLY-ARG-ALA-ARG-LYS-LEU-ALA-THR,427,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])CC)C)CCC[NH+]=C(N)N)CCCC[NH3+])CO)CCC[NH+]=C(N)N)[NH3+],Kd=2.96uM,5.528708,5.53,1,A,A,1,A,A,0,,B,A,,0,1,427,12,0,CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,0.8451663851737976,0.7151944637298584,84.83069610595703,83.95130157470703,0.5119805335998535,0.9875632524490356,0.8740049600601196,0.8528855443000793,0.7753143310546875,0.6529613137245178,MRSKGRARKLAT,Low,"(5.463, 5.6]",train
6BVH,protein-peptide,Q4GWU5 P00760,IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN,GTCTRSIPPICNPN,ILE-VAL-GLY-GLY-TYR-THR-CYS-GLY-ALA-ASN-THR-VAL-PRO-TYR-GLN-VAL-SER-LEU-ASN-SER-GLY-TYR-HIS-PHE-CYS-GLY-GLY-SER-LEU-ILE-ASN-SER-GLN-TRP-VAL-VAL-SER-ALA-ALA-HIS-CYS-TYR-LYS-SER-GLY-ILE-GLN-VAL-ARG-LEU-GLY-GLU-ASP-ASN-ILE-ASN-VAL-VAL-GLU-GLY-ASN-GLU-GLN-PHE-ILE-SER-ALA-SER-LYS-SER-ILE-VAL-HIS-PRO-SER-TYR-ASN-SER-ASN-THR-LEU-ASN-ASN-ASP-ILE-MET-LEU-ILE-LYS-LEU-LYS-SER-ALA-ALA-SER-LEU-ASN-SER-ARG-VAL-ALA-SER-ILE-SER-LEU-PRO-THR-SER-CYS-ALA-SER-ALA-GLY-THR-GLN-CYS-LEU-ILE-SER-GLY-TRP-GLY-ASN-THR-LYS-SER-SER-GLY-THR-SER-TYR-PRO-ASP-VAL-LEU-LYS-CYS-LEU-LYS-ALA-PRO-ILE-LEU-SER-ASP-SER-SER-CYS-LYS-SER-ALA-TYR-PRO-GLY-GLN-ILE-THR-SER-ASN-MET-PHE-CYS-ALA-GLY-TYR-LEU-GLU-GLY-GLY-LYS-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-VAL-VAL-CYS-SER-GLY-LYS-LEU-GLN-GLY-ILE-VAL-SER-TRP-GLY-SER-GLY-CYS-ALA-GLN-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-LYS-VAL-CYS-ASN-TYR-VAL-SER-TRP-ILE-LYS-GLN-THR-ILE-ALA-SER-ASN,GLY-THR-CYS-THR-ARG-SER-ILE-PRO-PRO-ILE-CYS-ASN-PRO-ASN,223,14,OC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H]3N(C(=O)[C@H]4N(C(=O)[C@@H](NC1=O)[C@H](CC)C)CCC4)CCC3)[C@H](CC)C)C(=O)N[C@@H](CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)N2)[C@H](O)C)O1)CC(=O)N)[C@H](O)C,Ki=0.7nM,9.154902,9.15,1,A,A,1,A,A,0,,I,A,,1,1,223,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9686540365219116,0.7270022630691528,96.86957550048828,94.1637725830078,0.3044998943805694,0.6830838322639465,0.9614508152008056,0.877715528011322,0.9335349202156068,0.689323902130127,GTCTRSIPPICNPN,High,"(8.824, 12.12]",train
6BNT,protein-peptide,P35568 Q96CW1,MGSSHHHHHHSSGLVPRGSHMASMTGGQQMGRGSEFGRPGWRREGIKYRRNELFLDVLESVNLLMSPQGQVLSAHVSGRVVMKSYLSGMPECKFGMNDKIVIEKQGKGTADETSKSGKQSIAIDDCTFHQCVRLSKFDSERSISFIPPDGEFELMRYRTTKDIILPFRVIPLVREVGRTKLEVKVVIKSNFKPSLLAQKIEVRIPTPLNTSGVQVICMKGKAKYKASENAIVWKIKRMAGMKESQISAEIELLPTNDKKKWARPPISMNFEVPFAPSGLKVRYLKVFEPKLNYSDHDVIKWVRYIGRSGIYETRC,CHTDDGYMPMSPGVA,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-SER-MET-THR-GLY-GLY-GLN-GLN-MET-GLY-ARG-GLY-SER-GLU-PHE-GLY-ARG-PRO-GLY-TRP-ARG-ARG-GLU-GLY-ILE-LYS-TYR-ARG-ARG-ASN-GLU-LEU-PHE-LEU-ASP-VAL-LEU-GLU-SER-VAL-ASN-LEU-LEU-MET-SER-PRO-GLN-GLY-GLN-VAL-LEU-SER-ALA-HIS-VAL-SER-GLY-ARG-VAL-VAL-MET-LYS-SER-TYR-LEU-SER-GLY-MET-PRO-GLU-CYS-LYS-PHE-GLY-MET-ASN-ASP-LYS-ILE-VAL-ILE-GLU-LYS-GLN-GLY-LYS-GLY-THR-ALA-ASP-GLU-THR-SER-LYS-SER-GLY-LYS-GLN-SER-ILE-ALA-ILE-ASP-ASP-CYS-THR-PHE-HIS-GLN-CYS-VAL-ARG-LEU-SER-LYS-PHE-ASP-SER-GLU-ARG-SER-ILE-SER-PHE-ILE-PRO-PRO-ASP-GLY-GLU-PHE-GLU-LEU-MET-ARG-TYR-ARG-THR-THR-LYS-ASP-ILE-ILE-LEU-PRO-PHE-ARG-VAL-ILE-PRO-LEU-VAL-ARG-GLU-VAL-GLY-ARG-THR-LYS-LEU-GLU-VAL-LYS-VAL-VAL-ILE-LYS-SER-ASN-PHE-LYS-PRO-SER-LEU-LEU-ALA-GLN-LYS-ILE-GLU-VAL-ARG-ILE-PRO-THR-PRO-LEU-ASN-THR-SER-GLY-VAL-GLN-VAL-ILE-CYS-MET-LYS-GLY-LYS-ALA-LYS-TYR-LYS-ALA-SER-GLU-ASN-ALA-ILE-VAL-TRP-LYS-ILE-LYS-ARG-MET-ALA-GLY-MET-LYS-GLU-SER-GLN-ILE-SER-ALA-GLU-ILE-GLU-LEU-LEU-PRO-THR-ASN-ASP-LYS-LYS-LYS-TRP-ALA-ARG-PRO-PRO-ILE-SER-MET-ASN-PHE-GLU-VAL-PRO-PHE-ALA-PRO-SER-GLY-LEU-LYS-VAL-ARG-TYR-LEU-LYS-VAL-PHE-GLU-PRO-LYS-LEU-ASN-TYR-SER-ASP-HIS-ASP-VAL-ILE-LYS-TRP-VAL-ARG-TYR-ILE-GLY-ARG-SER-GLY-ILE-TYR-GLU-THR-ARG-CYS,CYS-HIS-THR-ASP-ASP-GLY-TYR-MET-PRO-MET-SEP-PRO-GLY-VAL-ALA,315,15,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)COP(O)(O)O)CCSC)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@H](CC(=O)O)[NH3+],Kd=0.28uM,6.552842,6.55,1,A,A,1,A,A,0,,B,A,,1,1,315,15,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.8647739887237549,0.6084479689598083,77.78489685058594,72.00548553466797,0.6010202169418335,1.3346984386444092,0.7614886164665222,0.6847842335700989,0.7731711268424988,0.4782527685165405,CHTDDGYMPMSPGVA,Low,"(6.523, 6.696]",train
6A8N,protein-peptide,P06869,IVGGEFTEVENQPWFAAIYQKNKGGSPPSFKCGGSLISPCWVASAAHCFIQLPKKENYVVYLGQSKESSYNPGEMKFEVEQLILHEYYREDSLAYHNDIALLKIRTSTGQCAQPSRSIQTIALPPRFTDAPFGSDCEITGFGKESESDYLYPKNLKMSVVKLVSHEQCMQPHYYGSEINYKMLCAADPEWKTDSCKGDSGGPLICNIEGRPTLSGIVSWGRGCAEKNKPGVYTRVSHFLDWIQSHIG,CPAYSRYIGC,ILE-VAL-GLY-GLY-GLU-PHE-THR-GLU-VAL-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-GLN-LYS-ASN-LYS-GLY-GLY-SER-PRO-PRO-SER-PHE-LYS-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ALA-SER-ALA-ALA-HIS-CYS-PHE-ILE-GLN-LEU-PRO-LYS-LYS-GLU-ASN-TYR-VAL-VAL-TYR-LEU-GLY-GLN-SER-LYS-GLU-SER-SER-TYR-ASN-PRO-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-GLN-LEU-ILE-LEU-HIS-GLU-TYR-TYR-ARG-GLU-ASP-SER-LEU-ALA-TYR-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-THR-SER-THR-GLY-GLN-CYS-ALA-GLN-PRO-SER-ARG-SER-ILE-GLN-THR-ILE-ALA-LEU-PRO-PRO-ARG-PHE-THR-ASP-ALA-PRO-PHE-GLY-SER-ASP-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-SER-GLU-SER-ASP-TYR-LEU-TYR-PRO-LYS-ASN-LEU-LYS-MET-SER-VAL-VAL-LYS-LEU-VAL-SER-HIS-GLU-GLN-CYS-MET-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-ILE-ASN-TYR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLU-TRP-LYS-THR-ASP-SER-CYS-LYS-GLY-ASP-SER-GLY-GLY-PRO-LEU-ILE-CYS-ASN-ILE-GLU-GLY-ARG-PRO-THR-LEU-SER-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-GLU-LYS-ASN-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-ASP-TRP-ILE-GLN-SER-HIS-ILE-GLY,CYS-PRO-ALA-TYR-SER-ARG-TYR-ILE-GLY-CYS,247,10,OC[C@@H]1NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)[C@H](CC)C)C(=O)O,Ki=15.3nM,7.815309,7.82,1,A,A,1,A,A,0,,C,A,,0,1,247,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CS)C(=O)O,0.9723383784294128,0.8258940577507019,92.76551055908205,91.10159301757812,0.3519453406333923,0.6350189447402954,0.9501790404319764,0.9172570109367372,0.9535591006278992,0.8030533194541931,CPAYSRYIGC,Moderate,"(7.523, 7.921]",train
6A30,protein-peptide,P63045 Q62768,ERFVKLLDQLHNSLRIDLSMYRNNFPASSPERLQDLKSTVDLLTSITFFRMKVQELQSPPRASQVVKDCVKACLNSTYEYIFNNCHELYGREYQTDPAKKGEVPPEEQGPSIKNLDFWSKLITLIVSIIEEDKNSYTPCLNQFPQELNVGKISAEVMWSLFAQDMKYAMEEHDKHRLCKSADYMNLHFKVKWLYNEYVAELPTFKDRVPEYPAWFEPFVIQWLDENEEVSRDFLHGALERDKKDGFQQTSEHALFSCSVVDVFSQLNQSFEIIKKLECPDPQIVGHYMRRFAKTISNVLLQYADIVSKDFASYCSKEKEKVPCILMNNTQQLRVQLEKMFEAMGGKELDAEASGTLKELQVKLNNVLDELSHVFATSFQPHIEECVRQMGDILSQVKGTGNVPASACSSVAQDADNVLQPIMDLLDSNLTLFAKICEKTVLKRVLKELWKLVMNTMERTIVLPPEFSKLKDHMVREEAKSLTPKQCAVVELALDTIKQYFHAGGVGLKKTFLEKSPDLQSLRYALSLYTQATDLLIK,KYWWKN,GLU-ARG-PHE-VAL-LYS-LEU-LEU-ASP-GLN-LEU-HIS-ASN-SER-LEU-ARG-ILE-ASP-LEU-SER-MET-TYR-ARG-ASN-ASN-PHE-PRO-ALA-SER-SER-PRO-GLU-ARG-LEU-GLN-ASP-LEU-LYS-SER-THR-VAL-ASP-LEU-LEU-THR-SER-ILE-THR-PHE-PHE-ARG-MET-LYS-VAL-GLN-GLU-LEU-GLN-SER-PRO-PRO-ARG-ALA-SER-GLN-VAL-VAL-LYS-ASP-CYS-VAL-LYS-ALA-CYS-LEU-ASN-SER-THR-TYR-GLU-TYR-ILE-PHE-ASN-ASN-CYS-HIS-GLU-LEU-TYR-GLY-ARG-GLU-TYR-GLN-THR-ASP-PRO-ALA-LYS-LYS-GLY-GLU-VAL-PRO-PRO-GLU-GLU-GLN-GLY-PRO-SER-ILE-LYS-ASN-LEU-ASP-PHE-TRP-SER-LYS-LEU-ILE-THR-LEU-ILE-VAL-SER-ILE-ILE-GLU-GLU-ASP-LYS-ASN-SER-TYR-THR-PRO-CYS-LEU-ASN-GLN-PHE-PRO-GLN-GLU-LEU-ASN-VAL-GLY-LYS-ILE-SER-ALA-GLU-VAL-MET-TRP-SER-LEU-PHE-ALA-GLN-ASP-MET-LYS-TYR-ALA-MET-GLU-GLU-HIS-ASP-LYS-HIS-ARG-LEU-CYS-LYS-SER-ALA-ASP-TYR-MET-ASN-LEU-HIS-PHE-LYS-VAL-LYS-TRP-LEU-TYR-ASN-GLU-TYR-VAL-ALA-GLU-LEU-PRO-THR-PHE-LYS-ASP-ARG-VAL-PRO-GLU-TYR-PRO-ALA-TRP-PHE-GLU-PRO-PHE-VAL-ILE-GLN-TRP-LEU-ASP-GLU-ASN-GLU-GLU-VAL-SER-ARG-ASP-PHE-LEU-HIS-GLY-ALA-LEU-GLU-ARG-ASP-LYS-LYS-ASP-GLY-PHE-GLN-GLN-THR-SER-GLU-HIS-ALA-LEU-PHE-SER-CYS-SER-VAL-VAL-ASP-VAL-PHE-SER-GLN-LEU-ASN-GLN-SER-PHE-GLU-ILE-ILE-LYS-LYS-LEU-GLU-CYS-PRO-ASP-PRO-GLN-ILE-VAL-GLY-HIS-TYR-MET-ARG-ARG-PHE-ALA-LYS-THR-ILE-SER-ASN-VAL-LEU-LEU-GLN-TYR-ALA-ASP-ILE-VAL-SER-LYS-ASP-PHE-ALA-SER-TYR-CYS-SER-LYS-GLU-LYS-GLU-LYS-VAL-PRO-CYS-ILE-LEU-MET-ASN-ASN-THR-GLN-GLN-LEU-ARG-VAL-GLN-LEU-GLU-LYS-MET-PHE-GLU-ALA-MET-GLY-GLY-LYS-GLU-LEU-ASP-ALA-GLU-ALA-SER-GLY-THR-LEU-LYS-GLU-LEU-GLN-VAL-LYS-LEU-ASN-ASN-VAL-LEU-ASP-GLU-LEU-SER-HIS-VAL-PHE-ALA-THR-SER-PHE-GLN-PRO-HIS-ILE-GLU-GLU-CYS-VAL-ARG-GLN-MET-GLY-ASP-ILE-LEU-SER-GLN-VAL-LYS-GLY-THR-GLY-ASN-VAL-PRO-ALA-SER-ALA-CYS-SER-SER-VAL-ALA-GLN-ASP-ALA-ASP-ASN-VAL-LEU-GLN-PRO-ILE-MET-ASP-LEU-LEU-ASP-SER-ASN-LEU-THR-LEU-PHE-ALA-LYS-ILE-CYS-GLU-LYS-THR-VAL-LEU-LYS-ARG-VAL-LEU-LYS-GLU-LEU-TRP-LYS-LEU-VAL-MET-ASN-THR-MET-GLU-ARG-THR-ILE-VAL-LEU-PRO-PRO-GLU-PHE-SER-LYS-LEU-LYS-ASP-HIS-MET-VAL-ARG-GLU-GLU-ALA-LYS-SER-LEU-THR-PRO-LYS-GLN-CYS-ALA-VAL-VAL-GLU-LEU-ALA-LEU-ASP-THR-ILE-LYS-GLN-TYR-PHE-HIS-ALA-GLY-GLY-VAL-GLY-LEU-LYS-LYS-THR-PHE-LEU-GLU-LYS-SER-PRO-ASP-LEU-GLN-SER-LEU-ARG-TYR-ALA-LEU-SER-LEU-TYR-THR-GLN-ALA-THR-ASP-LEU-LEU-ILE-LYS,LYS-TYR-TRP-TRP-LYS-ASN,537,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])Cc1ccc(cc1)O,Kd=12.9uM,4.88941,4.89,1,A,A,1,A,A,0,,P,A,,1,1,537,6,0,NCCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(N)=O)C(=O)O,NCCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(N)=O)C(=O)O,0.5503081679344177,0.7250152230262756,75.40056610107422,73.78582763671875,0.5460745692253113,0.928805947303772,0.8271125555038452,0.8133675456047058,0.4742009341716766,0.7029271125793457,KYWWKN,Low,"(4.866, 5.014]",train
5ZYS,protein-peptide,Q6RHR9,GPGSIPDYQEQDIFLWRKETGFGFRILGGNEPGEPIYIGHIVPLGAADTDGRLRSGDELICVDGTPVIGKSHQLVVQLMQQAAKQGHVNLTVRRKVV,LPFELRGHLV,GLY-PRO-GLY-SER-ILE-PRO-ASP-TYR-GLN-GLU-GLN-ASP-ILE-PHE-LEU-TRP-ARG-LYS-GLU-THR-GLY-PHE-GLY-PHE-ARG-ILE-LEU-GLY-GLY-ASN-GLU-PRO-GLY-GLU-PRO-ILE-TYR-ILE-GLY-HIS-ILE-VAL-PRO-LEU-GLY-ALA-ALA-ASP-THR-ASP-GLY-ARG-LEU-ARG-SER-GLY-ASP-GLU-LEU-ILE-CYS-VAL-ASP-GLY-THR-PRO-VAL-ILE-GLY-LYS-SER-HIS-GLN-LEU-VAL-VAL-GLN-LEU-MET-GLN-GLN-ALA-ALA-LYS-GLN-GLY-HIS-VAL-ASN-LEU-THR-VAL-ARG-ARG-LYS-VAL-VAL,LEU-PRO-PHE-GLU-LEU-ARG-GLY-HIS-LEU-VAL,97,10,CC(C[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCC(=O)O)C,Kd=0.54uM,6.267606,6.27,1,A,A,1,A,A,0,,B,A,,1,1,97,10,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,1.0021755695343018,0.807734489440918,96.20297241210938,92.90632629394533,0.2992563247680664,0.6283025741577148,0.9218012690544128,0.8537866473197937,0.9112879037857056,0.7962214350700378,LPFELRGHLV,Low,"(6.26, 6.398]",train
5ZW6,protein-peptide,O64094,MELIRIAMKKDLENDNSLMNKWATVAGLKNPNPLYDFLNHDGKTFNEFSSIVNIVKSQYPDREYELMKDYCLNLDVKTKAARSALEYADANMFFEIEDVLIDSMISCSNMKSKEYGKVYKIHRELSNSVITEFEAVKRLGKLNIKTPEMNSFSRLLLLYHYLSTGNFSPMAQLIKQIDLSEISENMYIRNTYQTRVHVLMSNIKLNENSLEECREYSKKALESTNILRFQVFSYLTIGNSLLFSNYELAQENFLKGLSISVQNENYNMIFQQALCFLNNVWRKENKWINFESDSIMDLQEQAHCFINFNENSKAKEVLDKLDLLVHNDNELAMHYYLKGRLEQNKACFYSSIEYFKKSNDKFLIRLPLLELQKMGENQKLLELLLLLEHHH,GMPRGA,MET-GLU-LEU-ILE-ARG-ILE-ALA-MET-LYS-LYS-ASP-LEU-GLU-ASN-ASP-ASN-SER-LEU-MET-ASN-LYS-TRP-ALA-THR-VAL-ALA-GLY-LEU-LYS-ASN-PRO-ASN-PRO-LEU-TYR-ASP-PHE-LEU-ASN-HIS-ASP-GLY-LYS-THR-PHE-ASN-GLU-PHE-SER-SER-ILE-VAL-ASN-ILE-VAL-LYS-SER-GLN-TYR-PRO-ASP-ARG-GLU-TYR-GLU-LEU-MET-LYS-ASP-TYR-CYS-LEU-ASN-LEU-ASP-VAL-LYS-THR-LYS-ALA-ALA-ARG-SER-ALA-LEU-GLU-TYR-ALA-ASP-ALA-ASN-MET-PHE-PHE-GLU-ILE-GLU-ASP-VAL-LEU-ILE-ASP-SER-MET-ILE-SER-CYS-SER-ASN-MET-LYS-SER-LYS-GLU-TYR-GLY-LYS-VAL-TYR-LYS-ILE-HIS-ARG-GLU-LEU-SER-ASN-SER-VAL-ILE-THR-GLU-PHE-GLU-ALA-VAL-LYS-ARG-LEU-GLY-LYS-LEU-ASN-ILE-LYS-THR-PRO-GLU-MET-ASN-SER-PHE-SER-ARG-LEU-LEU-LEU-LEU-TYR-HIS-TYR-LEU-SER-THR-GLY-ASN-PHE-SER-PRO-MET-ALA-GLN-LEU-ILE-LYS-GLN-ILE-ASP-LEU-SER-GLU-ILE-SER-GLU-ASN-MET-TYR-ILE-ARG-ASN-THR-TYR-GLN-THR-ARG-VAL-HIS-VAL-LEU-MET-SER-ASN-ILE-LYS-LEU-ASN-GLU-ASN-SER-LEU-GLU-GLU-CYS-ARG-GLU-TYR-SER-LYS-LYS-ALA-LEU-GLU-SER-THR-ASN-ILE-LEU-ARG-PHE-GLN-VAL-PHE-SER-TYR-LEU-THR-ILE-GLY-ASN-SER-LEU-LEU-PHE-SER-ASN-TYR-GLU-LEU-ALA-GLN-GLU-ASN-PHE-LEU-LYS-GLY-LEU-SER-ILE-SER-VAL-GLN-ASN-GLU-ASN-TYR-ASN-MET-ILE-PHE-GLN-GLN-ALA-LEU-CYS-PHE-LEU-ASN-ASN-VAL-TRP-ARG-LYS-GLU-ASN-LYS-TRP-ILE-ASN-PHE-GLU-SER-ASP-SER-ILE-MET-ASP-LEU-GLN-GLU-GLN-ALA-HIS-CYS-PHE-ILE-ASN-PHE-ASN-GLU-ASN-SER-LYS-ALA-LYS-GLU-VAL-LEU-ASP-LYS-LEU-ASP-LEU-LEU-VAL-HIS-ASN-ASP-ASN-GLU-LEU-ALA-MET-HIS-TYR-TYR-LEU-LYS-GLY-ARG-LEU-GLU-GLN-ASN-LYS-ALA-CYS-PHE-TYR-SER-SER-ILE-GLU-TYR-PHE-LYS-LYS-SER-ASN-ASP-LYS-PHE-LEU-ILE-ARG-LEU-PRO-LEU-LEU-GLU-LEU-GLN-LYS-MET-GLY-GLU-ASN-GLN-LYS-LEU-LEU-GLU-LEU-LEU-LEU-LEU-LEU-GLU-HIS-HIS-HIS,GLY-MET-PRO-ARG-GLY-ALA,391,6,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)NC(=O)C[NH3+],Kd=10nM,8.0,8.0,1,A,A,1,A,A,0,,C,A,,1,1,391,6,0,CSCC[C@H](NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,0.9725188612937928,0.9486641883850098,88.37161254882812,86.73927307128906,0.3365919291973114,0.3985004723072052,0.930511236190796,0.9288777709007264,0.9688519835472108,0.9488153457641602,GMPRGA,Moderate,"(7.921, 8.383]",val
5ZVW,protein-peptide,P0DOE3,MIKNECEKDNQLAARLAKLAGYEKVNGFYKFVNTPEKEMENLGGLLKIVKNLFPDSEEQLLSEYFLELDPNKKCARQSVEYSDINQWDTLTDKIIINLCNSKNSTSQEWGKVYSLHRKLNKNEISLNDAIRESGKCKIKSAEMLFFSNAMLMYAYLNIGEFGLMKSTSKLLEFDDLPEGFIKESFKSRVSMLEANISLNENSLLEARQHSNRAIENSNVNRICFFAYLTIGNTLIFEDYDEAKKAYIKGQKYAKNPVHQEMLDGALCFLSNIWKKENQWVNYNSDNIKYLQLRAFYYINQGNIEEATEILDELSSRDQDENELGFYYYYKGLISQDKTDYAKSIRYFKKSDDKYFIQLPLLQLERMGADLELLNLISI,SAIRGA,MET-ILE-LYS-ASN-GLU-CYS-GLU-LYS-ASP-ASN-GLN-LEU-ALA-ALA-ARG-LEU-ALA-LYS-LEU-ALA-GLY-TYR-GLU-LYS-VAL-ASN-GLY-PHE-TYR-LYS-PHE-VAL-ASN-THR-PRO-GLU-LYS-GLU-MET-GLU-ASN-LEU-GLY-GLY-LEU-LEU-LYS-ILE-VAL-LYS-ASN-LEU-PHE-PRO-ASP-SER-GLU-GLU-GLN-LEU-LEU-SER-GLU-TYR-PHE-LEU-GLU-LEU-ASP-PRO-ASN-LYS-LYS-CYS-ALA-ARG-GLN-SER-VAL-GLU-TYR-SER-ASP-ILE-ASN-GLN-TRP-ASP-THR-LEU-THR-ASP-LYS-ILE-ILE-ILE-ASN-LEU-CYS-ASN-SER-LYS-ASN-SER-THR-SER-GLN-GLU-TRP-GLY-LYS-VAL-TYR-SER-LEU-HIS-ARG-LYS-LEU-ASN-LYS-ASN-GLU-ILE-SER-LEU-ASN-ASP-ALA-ILE-ARG-GLU-SER-GLY-LYS-CYS-LYS-ILE-LYS-SER-ALA-GLU-MET-LEU-PHE-PHE-SER-ASN-ALA-MET-LEU-MET-TYR-ALA-TYR-LEU-ASN-ILE-GLY-GLU-PHE-GLY-LEU-MET-LYS-SER-THR-SER-LYS-LEU-LEU-GLU-PHE-ASP-ASP-LEU-PRO-GLU-GLY-PHE-ILE-LYS-GLU-SER-PHE-LYS-SER-ARG-VAL-SER-MET-LEU-GLU-ALA-ASN-ILE-SER-LEU-ASN-GLU-ASN-SER-LEU-LEU-GLU-ALA-ARG-GLN-HIS-SER-ASN-ARG-ALA-ILE-GLU-ASN-SER-ASN-VAL-ASN-ARG-ILE-CYS-PHE-PHE-ALA-TYR-LEU-THR-ILE-GLY-ASN-THR-LEU-ILE-PHE-GLU-ASP-TYR-ASP-GLU-ALA-LYS-LYS-ALA-TYR-ILE-LYS-GLY-GLN-LYS-TYR-ALA-LYS-ASN-PRO-VAL-HIS-GLN-GLU-MET-LEU-ASP-GLY-ALA-LEU-CYS-PHE-LEU-SER-ASN-ILE-TRP-LYS-LYS-GLU-ASN-GLN-TRP-VAL-ASN-TYR-ASN-SER-ASP-ASN-ILE-LYS-TYR-LEU-GLN-LEU-ARG-ALA-PHE-TYR-TYR-ILE-ASN-GLN-GLY-ASN-ILE-GLU-GLU-ALA-THR-GLU-ILE-LEU-ASP-GLU-LEU-SER-SER-ARG-ASP-GLN-ASP-GLU-ASN-GLU-LEU-GLY-PHE-TYR-TYR-TYR-TYR-LYS-GLY-LEU-ILE-SER-GLN-ASP-LYS-THR-ASP-TYR-ALA-LYS-SER-ILE-ARG-TYR-PHE-LYS-LYS-SER-ASP-ASP-LYS-TYR-PHE-ILE-GLN-LEU-PRO-LEU-LEU-GLN-LEU-GLU-ARG-MET-GLY-ALA-ASP-LEU-GLU-LEU-LEU-ASN-LEU-ILE-SER-ILE,SER-ALA-ILE-ARG-GLY-ALA,378,6,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])C)C,Kd=2.4nM,8.619789,8.62,1,A,A,1,A,A,0,,B,A,,1,1,378,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,0.9164113998413086,0.917926013469696,78.96214294433594,77.53546142578125,0.438660055398941,0.4971221387386322,0.8768892288208008,0.8769705295562744,0.9165263175964355,0.928164839744568,SAIRGA,Moderate,"(8.383, 8.824]",val
5ZOP,protein-peptide,P56524 Q9Y618,FTTGLVYDTLMLKHQCTCGSSSSHPEHAGRIQSIWSRLQETGLRGKCECIRGRKATLEELQTVHSEAHTLLYGTNPLNRQKLDSKKLLGSLASVFVRLPCGGVGVDSDTIWNEVHSAGAARLAVGCVVELVFKVATGELKNGFAVVRPPGHHAEESTPMGFCYFNSVAVAAKLLQQRLSVSKILIVDWDVHHGNGTQQAFYSDPSVLYMSLHRYDDGNFFPGSGAPDEVGTGPGVGFNVNMAFTGGLDPPMGDAEYLAAFRTVVMPIASEFAPDVVLVSSGFDAVEGHPTPLGGYNLSARCFGYLTKQLMGLAGGRIVLALEGGYDLTAICDASEACVSALLGNELDPLPEKVLQQRPNANAVRSMEKVMEIHSKYWRCLQRTTSTAGRSLIEAQTCEN,EGSITQGTPLKY,PHE-THR-THR-GLY-LEU-VAL-TYR-ASP-THR-LEU-MET-LEU-LYS-HIS-GLN-CYS-THR-CYS-GLY-SER-SER-SER-SER-HIS-PRO-GLU-HIS-ALA-GLY-ARG-ILE-GLN-SER-ILE-TRP-SER-ARG-LEU-GLN-GLU-THR-GLY-LEU-ARG-GLY-LYS-CYS-GLU-CYS-ILE-ARG-GLY-ARG-LYS-ALA-THR-LEU-GLU-GLU-LEU-GLN-THR-VAL-HIS-SER-GLU-ALA-HIS-THR-LEU-LEU-TYR-GLY-THR-ASN-PRO-LEU-ASN-ARG-GLN-LYS-LEU-ASP-SER-LYS-LYS-LEU-LEU-GLY-SER-LEU-ALA-SER-VAL-PHE-VAL-ARG-LEU-PRO-CYS-GLY-GLY-VAL-GLY-VAL-ASP-SER-ASP-THR-ILE-TRP-ASN-GLU-VAL-HIS-SER-ALA-GLY-ALA-ALA-ARG-LEU-ALA-VAL-GLY-CYS-VAL-VAL-GLU-LEU-VAL-PHE-LYS-VAL-ALA-THR-GLY-GLU-LEU-LYS-ASN-GLY-PHE-ALA-VAL-VAL-ARG-PRO-PRO-GLY-HIS-HIS-ALA-GLU-GLU-SER-THR-PRO-MET-GLY-PHE-CYS-TYR-PHE-ASN-SER-VAL-ALA-VAL-ALA-ALA-LYS-LEU-LEU-GLN-GLN-ARG-LEU-SER-VAL-SER-LYS-ILE-LEU-ILE-VAL-ASP-TRP-ASP-VAL-HIS-HIS-GLY-ASN-GLY-THR-GLN-GLN-ALA-PHE-TYR-SER-ASP-PRO-SER-VAL-LEU-TYR-MET-SER-LEU-HIS-ARG-TYR-ASP-ASP-GLY-ASN-PHE-PHE-PRO-GLY-SER-GLY-ALA-PRO-ASP-GLU-VAL-GLY-THR-GLY-PRO-GLY-VAL-GLY-PHE-ASN-VAL-ASN-MET-ALA-PHE-THR-GLY-GLY-LEU-ASP-PRO-PRO-MET-GLY-ASP-ALA-GLU-TYR-LEU-ALA-ALA-PHE-ARG-THR-VAL-VAL-MET-PRO-ILE-ALA-SER-GLU-PHE-ALA-PRO-ASP-VAL-VAL-LEU-VAL-SER-SER-GLY-PHE-ASP-ALA-VAL-GLU-GLY-HIS-PRO-THR-PRO-LEU-GLY-GLY-TYR-ASN-LEU-SER-ALA-ARG-CYS-PHE-GLY-TYR-LEU-THR-LYS-GLN-LEU-MET-GLY-LEU-ALA-GLY-GLY-ARG-ILE-VAL-LEU-ALA-LEU-GLU-GLY-GLY-TYR-ASP-LEU-THR-ALA-ILE-CYS-ASP-ALA-SER-GLU-ALA-CYS-VAL-SER-ALA-LEU-LEU-GLY-ASN-GLU-LEU-ASP-PRO-LEU-PRO-GLU-LYS-VAL-LEU-GLN-GLN-ARG-PRO-ASN-ALA-ASN-ALA-VAL-ARG-SER-MET-GLU-LYS-VAL-MET-GLU-ILE-HIS-SER-LYS-TYR-TRP-ARG-CYS-LEU-GLN-ARG-THR-THR-SER-THR-ALA-GLY-ARG-SER-LEU-ILE-GLU-ALA-GLN-THR-CYS-GLU-ASN,GLU-GLY-SER-ILE-THR-GLN-GLY-THR-PRO-LEU-LYS-TYR,399,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)[NH3+])CO)CCC(=O)N)CC(C)C,Kd=18.8uM,4.725842,4.73,1,A,A,1,A,A,0,,A,G,,1,1,399,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.7236728072166443,0.633263885974884,84.12677001953125,81.79198455810547,0.5152561664581299,0.9903783798217772,0.9083662033081056,0.8481414318084717,0.6592512726783752,0.5795444846153259,EGSITQGTPLKY,Low,"(4.606, 4.745]",train
5ZML,protein-peptide,P06730,EVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,KKRYSRLQLLLFRRR,GLU-VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-GLU-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ACE-LYS-LYS-ARG-TYR-SER-ARG-MK8-GLN-LEU-LEU-MK8-PHE-ARG-ARG-ARG,191,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(C)C)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)Cc1ccccc1)CCC[NH+]=C(N)N)CO)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)C)CCCC[NH3+],Kd=7.8nM,8.107905,8.11,1,A,A,1,A,A,0,,B,A,,1,1,191,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9857351183891296,0.7095374464988708,94.0269775390625,90.78736877441406,0.3392333984375,0.9812580943107604,0.93015056848526,0.8213737607002258,0.941985547542572,0.6684893369674683,KKRYSRLQLLLFRRR,Moderate,"(7.921, 8.383]",train
5ZK9,protein-peptide,P06730,MVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,RIIYSRLQLLLLK,MET-VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-GLU-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ACE-ARG-ILE-ILE-TYR-SER-ARG-MK8-GLN-LEU-LEU-MK8-LEU-LYS-NH2,191,15,[NH3+]CCCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)C)CCC[NH+]=C(N)N)Cc2ccc(cc2)O)CO)CCC[NH+]=C(N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC(C)C)CCC(=O)N)CC(C)C,Kd=45.2nM,7.344862,7.34,1,A,A,1,A,A,0,,B,A,,1,1,191,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O,0.9277694821357728,0.6159844994544983,91.72425842285156,89.52103424072266,0.3514368534088135,1.0856603384017944,0.9236207008361816,0.7907781004905701,0.8644684553146362,0.5591970682144165,RIIYSRLQLLLLK,Moderate,"(7.268, 7.523]",train
5ZK5,protein-peptide,P06730,MVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,KKRYSREQLLLFQRL,MET-VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-GLU-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ACE-LYS-LYS-ARG-TYR-SER-ARG-GLU-GLN-LEU-LEU-MK8-PHE-GLN-ARG-MK8-NH2,191,17,CCCC[C@@](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC[NH+]=C(N)N)C=O)CCC(=O)N)Cc1ccccc1)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CO)CCC[NH+]=C(N)N)CCC(=O)O)CCC(=O)N)CC(C)C)CC(C)C)C,Kd=4.3nM,8.366532,8.37,1,A,A,1,A,A,0,,B,A,,1,1,191,17,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O,1.000394582748413,0.6158447861671448,92.54174041748048,89.02159881591797,0.3346351385116577,1.1553858518600464,0.9303359389305116,0.7810340523719788,0.9481277465820312,0.5712752342224121,KKRYSREQLLLFQRL,Moderate,"(7.921, 8.383]",train
5ZJZ,protein-peptide,P06730,MVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,KKRYSRLQLLLFW,MET-VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-GLU-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ACE-LYS-LYS-ARG-TYR-SER-ARG-MK8-GLN-LEU-LEU-MK8-PHE-TRP-NH2,191,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)N)CC(C)C)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)Cc1ccccc1)CCC[NH+]=C(N)N)CO)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)C)CCCC[NH3+],Kd=42.5nM,7.371611,7.37,1,A,A,1,A,A,0,,B,A,,1,1,191,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.9921648502349854,0.681307315826416,91.91722869873048,90.4224853515625,0.3344910740852356,0.9975547790527344,0.9303110241889954,0.8145558834075928,0.952481210231781,0.6349061131477356,KKRYSRLQLLLFW,Moderate,"(7.268, 7.523]",train
5YY9,protein-peptide,P18858 Q96T88,DEDMWDETELGLYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGE,IPKRRTARKQLPK,ASP-GLU-ASP-MET-TRP-ASP-GLU-THR-GLU-LEU-GLY-LEU-TYR-LYS-VAL-ASN-GLU-TYR-VAL-ASP-ALA-ARG-ASP-THR-ASN-MET-GLY-ALA-TRP-PHE-GLU-ALA-GLN-VAL-VAL-ARG-VAL-THR-ARG-LYS-ALA-PRO-SER-ARG-PRO-ALA-LEU-GLU-GLU-ASP-VAL-ILE-TYR-HIS-VAL-LYS-TYR-ASP-ASP-TYR-PRO-GLU-ASN-GLY-VAL-VAL-GLN-MET-ASN-SER-ARG-ASP-VAL-ARG-ALA-ARG-ALA-ARG-THR-ILE-ILE-LYS-TRP-GLN-ASP-LEU-GLU-VAL-GLY-GLN-VAL-VAL-MET-LEU-ASN-TYR-ASN-PRO-ASP-ASN-PRO-LYS-GLU-ARG-GLY-PHE-TRP-TYR-ASP-ALA-GLU-ILE-SER-ARG-LYS-ARG-GLU-THR-ARG-THR-ALA-ARG-GLU-LEU-TYR-ALA-ASN-VAL-VAL-LEU-GLY-ASP-ASP-SER-LEU-ASN-ASP-CYS-ARG-ILE-ILE-PHE-VAL-ASP-GLU-VAL-PHE-LYS-ILE-GLU-ARG-PRO-GLY-GLU,ILE-PRO-LYS-ARG-ARG-THR-ALA-ARG-M3L-GLN-LEU-PRO-LYS,154,13,CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CCC(=O)N)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C,Kd=9.1nM,8.040959,8.04,1,A,A,1,A,A,0,,C,A,,1,1,154,13,0,CC[C@H](C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9366971850395204,0.8437745571136475,87.7984619140625,84.88270568847656,0.342885822057724,0.6571763157844543,0.921637237071991,0.8868546485900879,0.8918094635009766,0.8330044746398926,IPKRRTARKQLPK,Moderate,"(7.921, 8.383]",val
5Y53,protein-peptide,Q9M9Y4 Q9SRM4,GSPRTVEEIFKDYSARRAALLRALTKDVDDFYSQCDPEKENLCLYGHPNESWEVNLPAEEVPPELPEPALGINFARDGMQRKDWLSLVAVHSDCWLLSVSFYFGARLNRNERKRLFSLINDLPTLFDVVTGRKAM,ETVTPKRMRTTQRKRSAT,GLY-SER-PRO-ARG-THR-VAL-GLU-GLU-ILE-PHE-LYS-ASP-TYR-SER-ALA-ARG-ARG-ALA-ALA-LEU-LEU-ARG-ALA-LEU-THR-LYS-ASP-VAL-ASP-ASP-PHE-TYR-SER-GLN-CYS-ASP-PRO-GLU-LYS-GLU-ASN-LEU-CYS-LEU-TYR-GLY-HIS-PRO-ASN-GLU-SER-TRP-GLU-VAL-ASN-LEU-PRO-ALA-GLU-GLU-VAL-PRO-PRO-GLU-LEU-PRO-GLU-PRO-ALA-LEU-GLY-ILE-ASN-PHE-ALA-ARG-ASP-GLY-MET-GLN-ARG-LYS-ASP-TRP-LEU-SER-LEU-VAL-ALA-VAL-HIS-SER-ASP-CYS-TRP-LEU-LEU-SER-VAL-SER-PHE-TYR-PHE-GLY-ALA-ARG-LEU-ASN-ARG-ASN-GLU-ARG-LYS-ARG-LEU-PHE-SER-LEU-ILE-ASN-ASP-LEU-PRO-THR-LEU-PHE-ASP-VAL-VAL-THR-GLY-ARG-LYS-ALA-MET,GLU-THR-VAL-THR-PRO-LYS-ARG-MET-ARG-THR-THR-GLN-ARG-LYS-ARG-SER-ALA-THR,135,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])CCC(=O)N)CCC[NH+]=C(N)N,Kd=0.43uM,6.366532,6.37,1,A,A,1,A,A,0,,D,A,dimer,1,1,135,18,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.7393496036529541,0.6199800968170166,90.06761169433594,86.31458282470703,0.4124763309955597,0.9888068437576294,0.8830881714820862,0.7495838403701782,0.6298855543136597,0.5875791907310486,ETVTPKRMRTTQRKRSAT,Low,"(6.26, 6.398]",val
5XVW,protein-peptide,Q9FKW0 Q9SRM4,GSPRTVEEIFKDYSARRAALLRALTKDVDDFYSQCDPEKENLCLYGHPNESWEVNLPAEEVPPELPEPALGINFARDGMQRKDWLSLVAVHSDCWLLSVSFYFGARLNRNERKRLFSLINDLPTLFDVVTGRKAM,ILAWGRGGTRSNTR,GLY-SER-PRO-ARG-THR-VAL-GLU-GLU-ILE-PHE-LYS-ASP-TYR-SER-ALA-ARG-ARG-ALA-ALA-LEU-LEU-ARG-ALA-LEU-THR-LYS-ASP-VAL-ASP-ASP-PHE-TYR-SER-GLN-CYS-ASP-PRO-GLU-LYS-GLU-ASN-LEU-CYS-LEU-TYR-GLY-HIS-PRO-ASN-GLU-SER-TRP-GLU-VAL-ASN-LEU-PRO-ALA-GLU-GLU-VAL-PRO-PRO-GLU-LEU-PRO-GLU-PRO-ALA-LEU-GLY-ILE-ASN-PHE-ALA-ARG-ASP-GLY-MET-GLN-ARG-LYS-ASP-TRP-LEU-SER-LEU-VAL-ALA-VAL-HIS-SER-ASP-CYS-TRP-LEU-LEU-SER-VAL-SER-PHE-TYR-PHE-GLY-ALA-ARG-LEU-ASN-ARG-ASN-GLU-ARG-LYS-ARG-LEU-PHE-SER-LEU-ILE-ASN-ASP-LEU-PRO-THR-LEU-PHE-ASP-VAL-VAL-THR-GLY-ARG-LYS-ALA-MET,ILE-LEU-ALA-TRP-GLY-ARG-GLY-GLY-THR-ARG-SER-ASN-THR-ARG,135,14,OC[C@@H](C(=O)N[C@H](C(=O)O)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CC(C)C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=3.29uM,5.482804,5.48,1,A,A,1,A,A,0,,D,A,dimer,1,1,135,14,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8826634287834167,0.6647316813468933,91.77679443359376,86.5365982055664,0.3580774962902069,0.9116777181625366,0.9101632237434388,0.7967910766601562,0.8170636296272278,0.6317168474197388,ILAWGRGGTRSNTR,Low,"(5.463, 5.6]",train
5VTB,protein-peptide,Q09028 Q9H165,GAMDPEFMADKEAAFDDAVEERVINEEYKIWKKNTPFLYDLVMTHALEWPSLTAQWLPDVTRPEGKDFSIHRLVLGTHTSDEQNHLVIASVQLPNDDAQFDASHYDSEKGEFGGFGSVSGKIEIEIKINHEGEVNRARYMPQNPCIIATKTPSSDVLVFDYTKHPSKPDPSGECNPDLRLRGHQKEGYGLSWNPNLSGHLLSASDDHTICLWDISAVPKEGKVVDAKTIFTGHTAVVEDVSWHLLHESLFGSVADDQKLMIWDTRSNNTSKPSHSVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHSFESHKDEIFQVQWSPHNETILASSGTDRRLNVWDLSKIGEEQSPEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQVWQMAENIYNDEDPEGSVDPEGQGS,SRRKQGKPQHLSKRE,GLY-ALA-MET-ASP-PRO-GLU-PHE-MET-ALA-ASP-LYS-GLU-ALA-ALA-PHE-ASP-ASP-ALA-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLU-TRP-PRO-SER-LEU-THR-ALA-GLN-TRP-LEU-PRO-ASP-VAL-THR-ARG-PRO-GLU-GLY-LYS-ASP-PHE-SER-ILE-HIS-ARG-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-ILE-ALA-SER-VAL-GLN-LEU-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-TYR-ASP-SER-GLU-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-SER-GLY-LYS-ILE-GLU-ILE-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-CYS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-SER-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-PRO-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-ILE-CYS-LEU-TRP-ASP-ILE-SER-ALA-VAL-PRO-LYS-GLU-GLY-LYS-VAL-VAL-ASP-ALA-LYS-THR-ILE-PHE-THR-GLY-HIS-THR-ALA-VAL-VAL-GLU-ASP-VAL-SER-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-ASN-THR-SER-LYS-PRO-SER-HIS-SER-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-SER-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-GLN-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-PRO-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-VAL-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU-ASP-PRO-GLU-GLY-SER-VAL-ASP-PRO-GLU-GLY-GLN-GLY-SER,SER-ARG-ARG-LYS-GLN-GLY-LYS-PRO-GLN-HIS-LEU-SER-LYS-ARG-GLU,432,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCC[NH+]=C(N)N)C)CO)CC(C)C)Cc1[nH]cnc1)CCC(=O)N)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Ki=110nM,6.958607,6.96,1,A,A,1,A,A,0,,B,A,,1,1,432,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.7857741117477417,0.6594685316085815,83.52429962158203,82.1181411743164,0.5177226066589355,1.120468258857727,0.871192216873169,0.8180424571037292,0.7070929408073425,0.5851028561592102,SRRKQGKPQHLSKRE,Low,"(6.824, 7.049]",train
5OY3,protein-peptide,O15054 P68431,DVVRASRNAKVKGKFRESYLSPAQSVKPKINTEEKLPREKLNPPTPSIYLESKRDAFSPVLLQFCTDPRNPITVIRGLAGSLRLNLGLFSTKTLVEASGEHTVEVRTQVQQPSDENWDLTGTRQIWPCESSRSHTTIAKYAQYQASSFQESLQEEKESEDEESEEPDSTTGTPPSSAPDPKNHHIIKFGTNIDLSDAKRWKPQLQELLKLPAFMRVTSTGNMLSHVGHTILGMNTVQLYMKVPGSRTPGHQENNNFCSVNINIGPGDCEWFAVHEHYWETISAFCDRHGVDYLTGSWWPILDDLYASNIPVYRFVQRPGDLVWINAGTVHWVQATGWCNNIAWNVGPLTAYQYQLALERYEWNEVKNVKSIVPMIHVSWNVARTVKISDPDLFKMIKFCLLQSMKHCQVQRESLVRAGKKIAYQGRVKDEPAYYCNECDVEVFNILFVTSENGSRNTYLVHCEGCARRRSAGLQGVVVLEQYRTEELAQAYDAFTLAPASTSRHHHHHH,RKQLMTKAARKSAPATG,ASP-VAL-VAL-ARG-ALA-SER-ARG-ASN-ALA-LYS-VAL-LYS-GLY-LYS-PHE-ARG-GLU-SER-TYR-LEU-SER-PRO-ALA-GLN-SER-VAL-LYS-PRO-LYS-ILE-ASN-THR-GLU-GLU-LYS-LEU-PRO-ARG-GLU-LYS-LEU-ASN-PRO-PRO-THR-PRO-SER-ILE-TYR-LEU-GLU-SER-LYS-ARG-ASP-ALA-PHE-SER-PRO-VAL-LEU-LEU-GLN-PHE-CYS-THR-ASP-PRO-ARG-ASN-PRO-ILE-THR-VAL-ILE-ARG-GLY-LEU-ALA-GLY-SER-LEU-ARG-LEU-ASN-LEU-GLY-LEU-PHE-SER-THR-LYS-THR-LEU-VAL-GLU-ALA-SER-GLY-GLU-HIS-THR-VAL-GLU-VAL-ARG-THR-GLN-VAL-GLN-GLN-PRO-SER-ASP-GLU-ASN-TRP-ASP-LEU-THR-GLY-THR-ARG-GLN-ILE-TRP-PRO-CYS-GLU-SER-SER-ARG-SER-HIS-THR-THR-ILE-ALA-LYS-TYR-ALA-GLN-TYR-GLN-ALA-SER-SER-PHE-GLN-GLU-SER-LEU-GLN-GLU-GLU-LYS-GLU-SER-GLU-ASP-GLU-GLU-SER-GLU-GLU-PRO-ASP-SER-THR-THR-GLY-THR-PRO-PRO-SER-SER-ALA-PRO-ASP-PRO-LYS-ASN-HIS-HIS-ILE-ILE-LYS-PHE-GLY-THR-ASN-ILE-ASP-LEU-SER-ASP-ALA-LYS-ARG-TRP-LYS-PRO-GLN-LEU-GLN-GLU-LEU-LEU-LYS-LEU-PRO-ALA-PHE-MET-ARG-VAL-THR-SER-THR-GLY-ASN-MET-LEU-SER-HIS-VAL-GLY-HIS-THR-ILE-LEU-GLY-MET-ASN-THR-VAL-GLN-LEU-TYR-MET-LYS-VAL-PRO-GLY-SER-ARG-THR-PRO-GLY-HIS-GLN-GLU-ASN-ASN-ASN-PHE-CYS-SER-VAL-ASN-ILE-ASN-ILE-GLY-PRO-GLY-ASP-CYS-GLU-TRP-PHE-ALA-VAL-HIS-GLU-HIS-TYR-TRP-GLU-THR-ILE-SER-ALA-PHE-CYS-ASP-ARG-HIS-GLY-VAL-ASP-TYR-LEU-THR-GLY-SER-TRP-TRP-PRO-ILE-LEU-ASP-ASP-LEU-TYR-ALA-SER-ASN-ILE-PRO-VAL-TYR-ARG-PHE-VAL-GLN-ARG-PRO-GLY-ASP-LEU-VAL-TRP-ILE-ASN-ALA-GLY-THR-VAL-HIS-TRP-VAL-GLN-ALA-THR-GLY-TRP-CYS-ASN-ASN-ILE-ALA-TRP-ASN-VAL-GLY-PRO-LEU-THR-ALA-TYR-GLN-TYR-GLN-LEU-ALA-LEU-GLU-ARG-TYR-GLU-TRP-ASN-GLU-VAL-LYS-ASN-VAL-LYS-SER-ILE-VAL-PRO-MET-ILE-HIS-VAL-SER-TRP-ASN-VAL-ALA-ARG-THR-VAL-LYS-ILE-SER-ASP-PRO-ASP-LEU-PHE-LYS-MET-ILE-LYS-PHE-CYS-LEU-LEU-GLN-SER-MET-LYS-HIS-CYS-GLN-VAL-GLN-ARG-GLU-SER-LEU-VAL-ARG-ALA-GLY-LYS-LYS-ILE-ALA-TYR-GLN-GLY-ARG-VAL-LYS-ASP-GLU-PRO-ALA-TYR-TYR-CYS-ASN-GLU-CYS-ASP-VAL-GLU-VAL-PHE-ASN-ILE-LEU-PHE-VAL-THR-SER-GLU-ASN-GLY-SER-ARG-ASN-THR-TYR-LEU-VAL-HIS-CYS-GLU-GLY-CYS-ALA-ARG-ARG-ARG-SER-ALA-GLY-LEU-GLN-GLY-VAL-VAL-VAL-LEU-GLU-GLN-TYR-ARG-THR-GLU-GLU-LEU-ALA-GLN-ALA-TYR-ASP-ALA-PHE-THR-LEU-ALA-PRO-ALA-SER-THR-SER-ARG-HIS-HIS-HIS-HIS-HIS-HIS,ARG-LYS-GLN-LEU-MET-THR-LYS-ALA-ALA-ARG-LYS-SER-ALA-PRO-ALA-THR-GLY,509,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)C)C)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCCC[NH3+])CCC(=O)N)CC(C)C)CCSC,IC50=71uM,4.148742,4.15,1,A,A,1,A,A,0,,B,A,,1,1,509,17,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.8896834850311279,0.7462220788002014,78.20944213867188,76.87205505371094,0.5898584127426147,1.04023540019989,0.8565857410430908,0.8247572183609009,0.8326061367988586,0.6836118102073669,RKQLMTKAARKSAPATG,Low,"(3.924, 4.155]",train
5OK6,protein-peptide,P51784,MDREPQHEELPGLDSQWRQIENGESGRERPLRAGESWFLVEKHWYKQWEAYVQGGDQDSSTFPGCINNATLFQDEINWRLKEGLVEGEDYVLLPAAAWHYLVSWYGLEHGQPPIERKVIELPNIQKVEVYPVELLLVRHNDLGKSHTVQFSHTDSIGLVLRTARERFLVEPQEDTRLWAKNSEGSLDRLYDTHITVLDAALETGQLIIMETRKKDGTWPSAQLEHHHHHH,AEGEFYKLKIRTPR,MET-ASP-ARG-GLU-PRO-GLN-HIS-GLU-GLU-LEU-PRO-GLY-LEU-ASP-SER-GLN-TRP-ARG-GLN-ILE-GLU-ASN-GLY-GLU-SER-GLY-ARG-GLU-ARG-PRO-LEU-ARG-ALA-GLY-GLU-SER-TRP-PHE-LEU-VAL-GLU-LYS-HIS-TRP-TYR-LYS-GLN-TRP-GLU-ALA-TYR-VAL-GLN-GLY-GLY-ASP-GLN-ASP-SER-SER-THR-PHE-PRO-GLY-CYS-ILE-ASN-ASN-ALA-THR-LEU-PHE-GLN-ASP-GLU-ILE-ASN-TRP-ARG-LEU-LYS-GLU-GLY-LEU-VAL-GLU-GLY-GLU-ASP-TYR-VAL-LEU-LEU-PRO-ALA-ALA-ALA-TRP-HIS-TYR-LEU-VAL-SER-TRP-TYR-GLY-LEU-GLU-HIS-GLY-GLN-PRO-PRO-ILE-GLU-ARG-LYS-VAL-ILE-GLU-LEU-PRO-ASN-ILE-GLN-LYS-VAL-GLU-VAL-TYR-PRO-VAL-GLU-LEU-LEU-LEU-VAL-ARG-HIS-ASN-ASP-LEU-GLY-LYS-SER-HIS-THR-VAL-GLN-PHE-SER-HIS-THR-ASP-SER-ILE-GLY-LEU-VAL-LEU-ARG-THR-ALA-ARG-GLU-ARG-PHE-LEU-VAL-GLU-PRO-GLN-GLU-ASP-THR-ARG-LEU-TRP-ALA-LYS-ASN-SER-GLU-GLY-SER-LEU-ASP-ARG-LEU-TYR-ASP-THR-HIS-ILE-THR-VAL-LEU-ASP-ALA-ALA-LEU-GLU-THR-GLY-GLN-LEU-ILE-ILE-MET-GLU-THR-ARG-LYS-LYS-ASP-GLY-THR-TRP-PRO-SER-ALA-GLN-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ALA-GLU-GLY-GLU-PHE-TYR-LYS-LEU-LYS-ILE-ARG-THR-PRO-AAR,230,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)[C@H](O)C)CCC[NH+]=C(N)N)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CCC(=O)O)Cc1ccccc1)Cc1ccc(cc1)O)CCCC[NH3+])CC(C)C,Kd=8.86uM,5.052566,5.05,1,A,A,1,A,A,0,,C,A,,0,1,230,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)NC(CCC[NH+]=C(N)N)C(N)=O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)NC(CCC[NH+]=C(N)N)C(N)=O,0.7252849340438843,0.7590649724006653,81.67656707763672,78.98577117919922,0.554048478603363,0.8834506869316101,0.778199315071106,0.7786381840705872,0.6377735137939453,0.7052586078643799,AEGEFYKLKIRTPR,Low,"(5.014, 5.105]",val
5NW8,protein-peptide,P25321 G3HK48,MGNAAAAKKGSEQESVKEFLAKAKEEFLKKWESPSQNTAQLDHFDRIKTLGTGSFGRVMLVKHKETGNHYAMKILDKQKVVKLKQIEHTLNEKRILQAVNFPFLVKLEFSFKDNSNLYMVMEYVPGGEMFSHLRRIGRFSEPHARFYAAQIVLTFEYLHSLDLIYRDLKPENLLIDQQGYIQVTDFGFAKRVKGRTWTLCGTPEYLAPEIILSKGYNKAVDWWALGVLIYEMAAGYPPFFADQPIQIYEKIVSGKVRFPSHFSSDLKDLLRNLLQVDLTKRFGNLKNGVNDIKNHKWFATTDWIAIYQRKVEAPFIPKFKGPGDTSNFDDYEEEEIRVSINEKCGKEFTEF,TTYADFIASGRTGSRNAI,MET-GLY-ASN-ALA-ALA-ALA-ALA-LYS-LYS-GLY-SEP-GLU-GLN-GLU-SER-VAL-LYS-GLU-PHE-LEU-ALA-LYS-ALA-LYS-GLU-GLU-PHE-LEU-LYS-LYS-TRP-GLU-SER-PRO-SER-GLN-ASN-THR-ALA-GLN-LEU-ASP-HIS-PHE-ASP-ARG-ILE-LYS-THR-LEU-GLY-THR-GLY-SER-PHE-GLY-ARG-VAL-MET-LEU-VAL-LYS-HIS-LYS-GLU-THR-GLY-ASN-HIS-TYR-ALA-MET-LYS-ILE-LEU-ASP-LYS-GLN-LYS-VAL-VAL-LYS-LEU-LYS-GLN-ILE-GLU-HIS-THR-LEU-ASN-GLU-LYS-ARG-ILE-LEU-GLN-ALA-VAL-ASN-PHE-PRO-PHE-LEU-VAL-LYS-LEU-GLU-PHE-SER-PHE-LYS-ASP-ASN-SER-ASN-LEU-TYR-MET-VAL-MET-GLU-TYR-VAL-PRO-GLY-GLY-GLU-MET-PHE-SER-HIS-LEU-ARG-ARG-ILE-GLY-ARG-PHE-SEP-GLU-PRO-HIS-ALA-ARG-PHE-TYR-ALA-ALA-GLN-ILE-VAL-LEU-THR-PHE-GLU-TYR-LEU-HIS-SER-LEU-ASP-LEU-ILE-TYR-ARG-ASP-LEU-LYS-PRO-GLU-ASN-LEU-LEU-ILE-ASP-GLN-GLN-GLY-TYR-ILE-GLN-VAL-THR-ASP-PHE-GLY-PHE-ALA-LYS-ARG-VAL-LYS-GLY-ARG-THR-TRP-TPO-LEU-CYS-GLY-THR-PRO-GLU-TYR-LEU-ALA-PRO-GLU-ILE-ILE-LEU-SER-LYS-GLY-TYR-ASN-LYS-ALA-VAL-ASP-TRP-TRP-ALA-LEU-GLY-VAL-LEU-ILE-TYR-GLU-MET-ALA-ALA-GLY-TYR-PRO-PRO-PHE-PHE-ALA-ASP-GLN-PRO-ILE-GLN-ILE-TYR-GLU-LYS-ILE-VAL-SER-GLY-LYS-VAL-ARG-PHE-PRO-SER-HIS-PHE-SER-SER-ASP-LEU-LYS-ASP-LEU-LEU-ARG-ASN-LEU-LEU-GLN-VAL-ASP-LEU-THR-LYS-ARG-PHE-GLY-ASN-LEU-LYS-ASN-GLY-VAL-ASN-ASP-ILE-LYS-ASN-HIS-LYS-TRP-PHE-ALA-THR-THR-ASP-TRP-ILE-ALA-ILE-TYR-GLN-ARG-LYS-VAL-GLU-ALA-PRO-PHE-ILE-PRO-LYS-PHE-LYS-GLY-PRO-GLY-ASP-THR-SER-ASN-PHE-ASP-ASP-TYR-GLU-GLU-GLU-GLU-ILE-ARG-VAL-SEP-ILE-ASN-GLU-LYS-CYS-GLY-LYS-GLU-PHE-THR-GLU-PHE,THR-THR-TYR-ALA-ASP-PHE-ILE-ALA-SER-GLY-ARG-THR-GLY-SER-ARG-ASN-ALA-ILE,351,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C)CC(=O)N)CCC[NH+]=C(N)N)CO)[C@H](O)C)CCC[NH+]=C(N)N)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O)C)CC(=O)O)Cc1ccccc1)C,Kd=100uM,4.0,4.0,1,A,A,1,A,A,0,,D,A,,1,1,351,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.8159503936767578,0.7432271242141724,84.1716537475586,83.21941375732422,0.4870774447917938,0.9447780847549438,0.9021503925323486,0.8742390275001526,0.7571374177932739,0.698009729385376,TTYADFIASGRTGSRNAI,Low,"(3.924, 4.155]",train
5N7B,protein-peptide,P01727 P01801,QVQLQESGGGLVQPGGSMKLSCVASGFTFSNYWMNWVRQSPEKGLEWVAEIRLKSNNYATHYAESVKGRFTISRDDSKSSVYLQMNNLRAEDTGIYYCTGVGQFAYWGQGTTVTVSSSSGGGGSGGGGGSSGSSDIVVTQESALTTSPGETVTLTCRSSTGAVTTSNYANWVQEKPDHLFTGLIGGTNNRAPGVPARFSGSLIGDKAALTITGAQTEDEAIYFCALWYSNHWVFGGGTKLTVLG,APDCRP,GLN-VAL-GLN-LEU-GLN-GLU-SER-GLY-GLY-GLY-LEU-VAL-GLN-PRO-GLY-GLY-SER-MET-LYS-LEU-SER-CYS-VAL-ALA-SER-GLY-PHE-THR-PHE-SER-ASN-TYR-TRP-MET-ASN-TRP-VAL-ARG-GLN-SER-PRO-GLU-LYS-GLY-LEU-GLU-TRP-VAL-ALA-GLU-ILE-ARG-LEU-LYS-SER-ASN-ASN-TYR-ALA-THR-HIS-TYR-ALA-GLU-SER-VAL-LYS-GLY-ARG-PHE-THR-ILE-SER-ARG-ASP-ASP-SER-LYS-SER-SER-VAL-TYR-LEU-GLN-MET-ASN-ASN-LEU-ARG-ALA-GLU-ASP-THR-GLY-ILE-TYR-TYR-CYS-THR-GLY-VAL-GLY-GLN-PHE-ALA-TYR-TRP-GLY-GLN-GLY-THR-THR-VAL-THR-VAL-SER-SER-SER-SER-GLY-GLY-GLY-GLY-SER-GLY-GLY-GLY-GLY-GLY-SER-SER-GLY-SER-SER-ASP-ILE-VAL-VAL-THR-GLN-GLU-SER-ALA-LEU-THR-THR-SER-PRO-GLY-GLU-THR-VAL-THR-LEU-THR-CYS-ARG-SER-SER-THR-GLY-ALA-VAL-THR-THR-SER-ASN-TYR-ALA-ASN-TRP-VAL-GLN-GLU-LYS-PRO-ASP-HIS-LEU-PHE-THR-GLY-LEU-ILE-GLY-GLY-THR-ASN-ASN-ARG-ALA-PRO-GLY-VAL-PRO-ALA-ARG-PHE-SER-GLY-SER-LEU-ILE-GLY-ASP-LYS-ALA-ALA-LEU-THR-ILE-THR-GLY-ALA-GLN-THR-GLU-ASP-GLU-ALA-ILE-TYR-PHE-CYS-ALA-LEU-TRP-TYR-SER-ASN-HIS-TRP-VAL-PHE-GLY-GLY-GLY-THR-LYS-LEU-THR-VAL-LEU-GLY,ALA-PRO-ASP-CG6-ARG-PRO-NH2,244,7,OC[C@H]1O[C@H](S[C@@H]([C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])C)CC(=O)O)C)[C@@H]([C@H]([C@H]1O)O)NC(=O)C,Kd=168uM,3.774691,3.77,1,A,A,1,A,A,0,,I,H,,1,1,244,7,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)O,CC(S)C(NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(S)C(NC(=O)[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9523953795433044,0.8640226125717163,94.57998657226562,92.82795715332033,0.3209005296230316,0.5247853398323059,0.943224310874939,0.9060079455375672,0.9221881031990052,0.8151041865348816,APDCRP,Low,"(3.548, 3.924]",train
5MTW,protein-peptide,P95257 P9WJA7,GSHMTDRTDADDLDLQRVGARLAARAQIRDIRLLRTQAAVHRAPKPAQGLTYDLEFEPAVDADPATISAFVVRISCHLRIQNQAADDDVKEGDTKDETQDVATADFEFAALFDYHLQEGEDDPTEEELTAYAATTGRFALYPYIREYVYDLTGRLALPPLTLEILSRPMPVSPGAQWPATRGTP,EVPTWHRLSSYRG,GLY-SER-HIS-MET-THR-ASP-ARG-THR-ASP-ALA-ASP-ASP-LEU-ASP-LEU-GLN-ARG-VAL-GLY-ALA-ARG-LEU-ALA-ALA-ARG-ALA-GLN-ILE-ARG-ASP-ILE-ARG-LEU-LEU-ARG-THR-GLN-ALA-ALA-VAL-HIS-ARG-ALA-PRO-LYS-PRO-ALA-GLN-GLY-LEU-THR-TYR-ASP-LEU-GLU-PHE-GLU-PRO-ALA-VAL-ASP-ALA-ASP-PRO-ALA-THR-ILE-SER-ALA-PHE-VAL-VAL-ARG-ILE-SER-CYS-HIS-LEU-ARG-ILE-GLN-ASN-GLN-ALA-ALA-ASP-ASP-ASP-VAL-LYS-GLU-GLY-ASP-THR-LYS-ASP-GLU-THR-GLN-ASP-VAL-ALA-THR-ALA-ASP-PHE-GLU-PHE-ALA-ALA-LEU-PHE-ASP-TYR-HIS-LEU-GLN-GLU-GLY-GLU-ASP-ASP-PRO-THR-GLU-GLU-GLU-LEU-THR-ALA-TYR-ALA-ALA-THR-THR-GLY-ARG-PHE-ALA-LEU-TYR-PRO-TYR-ILE-ARG-GLU-TYR-VAL-TYR-ASP-LEU-THR-GLY-ARG-LEU-ALA-LEU-PRO-PRO-LEU-THR-LEU-GLU-ILE-LEU-SER-ARG-PRO-MET-PRO-VAL-SER-PRO-GLY-ALA-GLN-TRP-PRO-ALA-THR-ARG-GLY-THR-PRO,GLU-VAL-PRO-THR-TRP-HIS-ARG-LEU-SER-SER-TYR-ARG-GLY,184,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1nc[nH]c1)CCC[NH+]=C(N)N)CC(C)C,Kd=1.9uM,5.721246,5.72,1,A,A,1,A,A,0,,E,A,3mer,1,1,184,13,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.7471109628677368,0.8241727352142334,73.74613952636719,71.14957427978516,0.7541408538818359,0.8222379684448242,0.7064896821975708,0.7568197250366211,0.6525708436965942,0.7594892382621765,EVPTWHRLSSYRG,Low,"(5.699, 5.821]",train
5J7J,protein-peptide,P78352 P0DP33,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,MDCLCIVTTKKYRYQDEDT,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,MET-ASP-CYS-LEU-CYS-ILE-VAL-THR-THR-LYS-LYS-TYR-ARG-TYR-GLN-ASP-GLU-ASP-TPO,148,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)N)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCCC[NH3+])NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)[NH3+])CC(=O)O)CS)CC(C)C)CS,Kd=8.6uM,5.065502,5.07,1,A,A,1,A,A,0,,B,A,,1,1,148,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C(N)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C(N)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,0.7428548336029053,0.701057493686676,69.87023162841797,57.94959259033203,0.5975087881088257,0.9482343196868896,0.7081813216209412,0.7454877495765686,0.6804153919219971,0.6899499297142029,MDCLCIVTTKKYRYQDEDT,Low,"(5.014, 5.105]",val
6BD1,protein-peptide,Q3SZI4 Q9UQB8,MEKTELIQKAKLAEQAERYDDMATCMKAVTEQGAELSNEERNLLSVAYKNVVGGRRSAWRVISSIEQKTDTSDKKLQLIKDYREKVESELRSICTTVLELLDKYLIANATNPESKVFYLKMKGDYFRYLAEVACGDDRKQTIDNSQGAYQEAFDISKKEMQPTHPIRLGLALNFSVFYYEILNNPELACTLAKTAFDEAIAELDTLNEDSYKDSTLIMQLLRDNLTLWTSDSAGEECDAAEGAEN,TLPRSSSMAAGLEK,MET-GLU-LYS-THR-GLU-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-THR-CYS-MET-LYS-ALA-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-ARG-ARG-SER-ALA-TRP-ARG-VAL-ILE-SER-SER-ILE-GLU-GLN-LYS-THR-ASP-THR-SER-ASP-LYS-LYS-LEU-GLN-LEU-ILE-LYS-ASP-TYR-ARG-GLU-LYS-VAL-GLU-SER-GLU-LEU-ARG-SER-ILE-CYS-THR-THR-VAL-LEU-GLU-LEU-LEU-ASP-LYS-TYR-LEU-ILE-ALA-ASN-ALA-THR-ASN-PRO-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-PHE-ARG-TYR-LEU-ALA-GLU-VAL-ALA-CYS-GLY-ASP-ASP-ARG-LYS-GLN-THR-ILE-ASP-ASN-SER-GLN-GLY-ALA-TYR-GLN-GLU-ALA-PHE-ASP-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-ASN-PRO-GLU-LEU-ALA-CYS-THR-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-ASN-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-SER-ALA-GLY-GLU-GLU-CYS-ASP-ALA-ALA-GLU-GLY-ALA-GLU-ASN,THR-LEU-PRO-ARG-SER-SER-SEP-MET-ALA-ALA-GLY-LEU-GLU-LYS,245,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO)CO)COP(O)(O)O,Kd=16.5uM,4.782516,4.78,1,A,A,1,A,A,0,,C,A,,1,1,245,14,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O,0.9242261052131652,0.8114628195762634,85.6817855834961,84.54256439208984,0.3718249499797821,0.7706902623176575,0.9076967835426332,0.8660184741020203,0.8728564977645874,0.774864673614502,TLPRSSSMAAGLEK,Low,"(4.745, 4.866]",train
6A9C,protein-peptide,C4LUC7 C4M4E9,MSKLPQVKALYPYTAANDEELSFKVGDIITILEKDEGWWKGELNGQEGWIPNNYVKEILEHHHHHH,KVAPPIPHR,MET-SER-LYS-LEU-PRO-GLN-VAL-LYS-ALA-LEU-TYR-PRO-TYR-THR-ALA-ALA-ASN-ASP-GLU-GLU-LEU-SER-PHE-LYS-VAL-GLY-ASP-ILE-ILE-THR-ILE-LEU-GLU-LYS-ASP-GLU-GLY-TRP-TRP-LYS-GLY-GLU-LEU-ASN-GLY-GLN-GLU-GLY-TRP-ILE-PRO-ASN-ASN-TYR-VAL-LYS-GLU-ILE-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,LYS-VAL-ALA-PRO-PRO-ILE-PRO-HIS-ARG,66,9,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCC[NH3+])[NH3+])C)C,Kd=1.8mM,2.744727,3.74,1,A,A,1,A,A,0,,E,A,,0,1,66,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8689722418785095,0.8002591133117676,91.91641235351562,92.86283111572266,0.3596105277538299,0.5928327441215515,0.847216784954071,0.8005180954933167,0.7494110465049744,0.7244367599487305,KVAPPIPHR,Low,"(2.044, 3.548]",train
6TYZ,protein-peptide,Q8IW19 A0A1L8EVE5,MHHHHHHMARAAKSAVVLCMDVGLAMSHSNQGKESPFEQAKKVMMLFLQRQVFAESKDEIAVVLYGTDTTDNALAREDQYENISVHRHLMLPDFDLLEQIENVVEPGSVQADFLDALIVSMDLLQKETLGKKYTRLHIAVFSDLSSPFSVDQLEVIIANLKKAEITLQFFLPFSVDEGSGPGKGLSDQQKEGIEMVRKIMFSLDGEEGLSEVFTFRDSLERLSIFKKIERR,LAERKRILPTWMLAEH,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-ALA-ARG-ALA-ALA-LYS-SER-ALA-VAL-VAL-LEU-CYS-MET-ASP-VAL-GLY-LEU-ALA-MET-SER-HIS-SER-ASN-GLN-GLY-LYS-GLU-SER-PRO-PHE-GLU-GLN-ALA-LYS-LYS-VAL-MET-MET-LEU-PHE-LEU-GLN-ARG-GLN-VAL-PHE-ALA-GLU-SER-LYS-ASP-GLU-ILE-ALA-VAL-VAL-LEU-TYR-GLY-THR-ASP-THR-THR-ASP-ASN-ALA-LEU-ALA-ARG-GLU-ASP-GLN-TYR-GLU-ASN-ILE-SER-VAL-HIS-ARG-HIS-LEU-MET-LEU-PRO-ASP-PHE-ASP-LEU-LEU-GLU-GLN-ILE-GLU-ASN-VAL-VAL-GLU-PRO-GLY-SER-VAL-GLN-ALA-ASP-PHE-LEU-ASP-ALA-LEU-ILE-VAL-SER-MET-ASP-LEU-LEU-GLN-LYS-GLU-THR-LEU-GLY-LYS-LYS-TYR-THR-ARG-LEU-HIS-ILE-ALA-VAL-PHE-SER-ASP-LEU-SER-SER-PRO-PHE-SER-VAL-ASP-GLN-LEU-GLU-VAL-ILE-ILE-ALA-ASN-LEU-LYS-LYS-ALA-GLU-ILE-THR-LEU-GLN-PHE-PHE-LEU-PRO-PHE-SER-VAL-ASP-GLU-GLY-SER-GLY-PRO-GLY-LYS-GLY-LEU-SER-ASP-GLN-GLN-LYS-GLU-GLY-ILE-GLU-MET-VAL-ARG-LYS-ILE-MET-PHE-SER-LEU-ASP-GLY-GLU-GLU-GLY-LEU-SER-GLU-VAL-PHE-THR-PHE-ARG-ASP-SER-LEU-GLU-ARG-LEU-SER-ILE-PHE-LYS-LYS-ILE-GLU-ARG-ARG,LEU-ALA-GLU-ARG-LYS-ARG-ILE-LEU-PRO-THR-TRP-MET-LEU-ALA-GLU-HIS,231,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CC(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC[NH+]=C(N)N)CCC)CCC[NH+]=C(N)N)CC(C)C,Kd=131nM,6.882729,6.88,1,A,A,1,A,A,0,,B,A,,1,1,231,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O,0.9277905821800232,0.8987252712249756,88.52229309082031,83.53458404541016,0.4460214674472809,0.5922861099243164,0.8917475938796997,0.8970955610275269,0.8760726451873779,0.8774876594543457,LAERKRILPTWMLAEH,Low,"(6.824, 7.049]",train
1T29,protein-peptide,Q9BX63 P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTREWVLDSVALYQCQELDTYLIPQIP,ISRSTSPTFNKQTK,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-GLU-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,ILE-SER-ARG-SER-THR-SEP-PRO-THR-PHE-ASN-LYS-GLN-THR-LYS,214,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCCC[NH3+])CC(=O)N)Cc1ccccc1)[C@H](O)C)COP(O)(O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CO)CCC[NH+]=C(N)N,Kd=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,B,A,,1,1,214,14,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8691836595535278,0.7980479001998901,92.8368682861328,91.84049224853516,0.3643642961978912,0.6863905191421509,0.9315000176429749,0.8908141851425171,0.8152273893356323,0.7748562693595886,ISRSTSPTFNKQTK,Low,"(5.959, 6.097]",val
1T79,protein-peptide,O97775,GSPGISGGGGGSHIEGYECQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,SSKFAALWDPPKLSRSGSGK,GLY-SER-PRO-GLY-ILE-SER-GLY-GLY-GLY-GLY-GLY-SER-HIS-ILE-GLU-GLY-TYR-GLU-CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,SER-SER-LYS-PHE-ALA-ALA-LEU-TRP-ASP-PRO-PRO-LYS-LEU-SER-ARG-SER-GLY-SER-GLY-LYS,269,20,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)CC(C)C)C)C)Cc1ccccc1)CCCC[NH3+])[NH3+],Kd=920nM,6.036212,6.04,1,A,A,1,A,A,0,,B,A,,1,1,269,20,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)O,0.8464194536209106,0.8005046248435974,88.96981811523438,88.04164123535156,0.3969230651855469,0.8257388472557068,0.8767446279525757,0.841637372970581,0.7523329257965088,0.7391062378883362,SSKFAALWDPPKLSRSGSGK,Low,"(5.959, 6.097]",train
1T7F,protein-peptide,O97775,GSPGISGGGGGSHIEGYECQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,SSRGLLWDLLTKDSRSGSGK,GLY-SER-PRO-GLY-ILE-SER-GLY-GLY-GLY-GLY-GLY-SER-HIS-ILE-GLU-GLY-TYR-GLU-CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,SER-SER-ARG-GLY-LEU-LEU-TRP-ASP-LEU-LEU-THR-LYS-ASP-SER-ARG-SER-GLY-SER-GLY-LYS,269,20,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(C)C)CC(C)C)CC(=O)O)Cc1c[nH]c2c1cccc2)CC(C)C)CC(C)C,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,B,A,,1,1,269,20,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,0.8476755023002625,0.7989416122436523,89.38089752197266,88.10453796386719,0.4123144745826721,0.8454751372337341,0.8767697215080261,0.8434410095214844,0.7495714426040649,0.741348385810852,SSRGLLWDLLTKDSRSGSGK,Low,"(5.699, 5.821]",train
1T7R,protein-peptide,O97775,GSPGISGGGGGSHIEGYECQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHTQ,SSRFESLFAGEKESR,GLY-SER-PRO-GLY-ILE-SER-GLY-GLY-GLY-GLY-GLY-SER-HIS-ILE-GLU-GLY-TYR-GLU-CYS-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR-GLN,SER-SER-ARG-PHE-GLU-SER-LEU-PHE-ALA-GLY-GLU-LYS-GLU-SER-ARG,269,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C)Cc1ccccc1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CO)CCC[NH+]=C(N)N)CCC(=O)O,Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,B,A,,1,1,269,15,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.9368672370910645,0.7462372183799744,89.9375991821289,89.60038757324219,0.3839239180088043,0.8046039938926697,0.8920620083808899,0.8570090532302856,0.866642415523529,0.7185442447662354,SSRFESLFAGEKESR,Low,"(5.821, 5.959]",train
1TZE,protein-peptide,P62993,MKPHPWFFGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVVKFNSLNELVDYHRSTSVSRNQQIFLRDIE,KPFYVNV,MET-LYS-PRO-HIS-PRO-TRP-PHE-PHE-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLU,LYS-PRO-PHE-PTR-VAL-ASN-VAL-NH2,98,8,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C(C)C)CC(=O)N)C(C)C)Cc1ccc(cc1)OP(O)(O)O)Cc1ccccc1)[NH3+],IC50=0.148uM,6.829738,6.83,1,A,A,1,A,A,0,,I,E,,1,1,98,8,0,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.86298006772995,0.8135560154914856,96.25409698486328,95.74839782714844,0.328955590724945,0.6192997694015503,0.9157819747924804,0.8777103424072266,0.8081129193305969,0.7975174188613892,KPFYVNV,Low,"(6.824, 7.049]",train
1U9L,protein-peptide,P0AFF6,AHAAIDTFTKYLDIDEDFATVLVEEGFSTLEELAYVPMKELLEIEGLDEPTVEALRERAKNALATIAQAQ,NRPILSL,ALA-HIS-ALA-ALA-ILE-ASP-THR-PHE-THR-LYS-TYR-LEU-ASP-ILE-ASP-GLU-ASP-PHE-ALA-THR-VAL-LEU-VAL-GLU-GLU-GLY-PHE-SER-THR-LEU-GLU-GLU-LEU-ALA-TYR-VAL-PRO-MET-LYS-GLU-LEU-LEU-GLU-ILE-GLU-GLY-LEU-ASP-GLU-PRO-THR-VAL-GLU-ALA-LEU-ARG-GLU-ARG-ALA-LYS-ASN-ALA-LEU-ALA-THR-ILE-ALA-GLN-ALA-GLN,ASN-ARG-PRO-ILE-LEU-SER-LEU,70,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N)C,Kd=9.6uM,5.017729,5.02,1,A,A,1,A,A,0,,C,A,dimer,1,1,70,7,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8302052617073059,0.8764070272445679,94.6152114868164,92.1934814453125,0.3310659825801849,0.4385693669319153,0.8832429051399231,0.8983526825904846,0.760127604007721,0.8709205389022827,NRPILSL,Low,"(5.014, 5.105]",val
1UEF,protein-peptide,P35546 P97465,GSHMGSQFWVTSQKTEASERCGLQGSYILRVEAEKLTLLTLGAQSQILEPLLFWPYTLLRRYGRDKVMFSFEAGRRCPSGPGTFTFQTSQGNDIFQAVEAAIQQQKAQGKVGQAQDILRLEHHHHHH,STWIENKLYGMSD,GLY-SER-HIS-MET-GLY-SER-GLN-PHE-TRP-VAL-THR-SER-GLN-LYS-THR-GLU-ALA-SER-GLU-ARG-CYS-GLY-LEU-GLN-GLY-SER-TYR-ILE-LEU-ARG-VAL-GLU-ALA-GLU-LYS-LEU-THR-LEU-LEU-THR-LEU-GLY-ALA-GLN-SER-GLN-ILE-LEU-GLU-PRO-LEU-LEU-PHE-TRP-PRO-TYR-THR-LEU-LEU-ARG-ARG-TYR-GLY-ARG-ASP-LYS-VAL-MET-PHE-SER-PHE-GLU-ALA-GLY-ARG-ARG-CYS-PRO-SER-GLY-PRO-GLY-THR-PHE-THR-PHE-GLN-THR-SER-GLN-GLY-ASN-ASP-ILE-PHE-GLN-ALA-VAL-GLU-ALA-ALA-ILE-GLN-GLN-GLN-LYS-ALA-GLN-GLY-LYS-VAL-GLY-GLN-ALA-GLN-ASP-ILE-LEU-ARG-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,SER-THR-TRP-ILE-GLU-ASN-LYS-LEU-PTR-GLY-MET-SER-ASP,127,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCSC)Cc1ccc(cc1)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1c[nH]c2c1cccc2)CCC(=O)O)CC(=O)N,Kd=3.2uM,5.49485,5.49,1,A,A,1,A,A,0,,C,A,,1,1,127,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9950790405273438,0.9543752670288086,86.71009826660156,83.7350082397461,0.3632680773735046,0.5281639695167542,0.8770042657852173,0.9014419317245485,0.9085263013839722,0.9036322832107544,STWIENKLYGMSD,Low,"(5.463, 5.6]",train
1UJ0,protein-peptide,O88811 Q80U87,AGHMARRVRALYDFEAVEDNELTFKHGELITVLDDSDANWWQGENHRGTGLFPSNFVTTDLS,TPMVNRENKPP,ALA-GLY-HIS-MET-ALA-ARG-ARG-VAL-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-VAL-GLU-ASP-ASN-GLU-LEU-THR-PHE-LYS-HIS-GLY-GLU-LEU-ILE-THR-VAL-LEU-ASP-ASP-SER-ASP-ALA-ASN-TRP-TRP-GLN-GLY-GLU-ASN-HIS-ARG-GLY-THR-GLY-LEU-PHE-PRO-SER-ASN-PHE-VAL-THR-THR-ASP-LEU-SER,THR-PRO-MET-VAL-ASN-ARG-GLU-ASN-LYS-PRO-PRO,62,11,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)[NH3+])CCSC)CC(=O)N)CCC[NH+]=C(N)N)CCC(=O)O)CC(=O)N,Kd=27uM,4.568636,4.57,1,A,A,1,A,A,0,,B,A,,1,1,62,11,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,0.9926699995994568,0.7729829549789429,96.60641479492188,89.21683502197266,0.2840625643730163,0.641319990158081,0.9217917919158936,0.8317123055458069,0.90764981508255,0.7583006024360657,TPMVNRENKPP,Low,"(4.456, 4.606]",train
1UMW,protein-peptide,P53350,GEVVDCHLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSRSASNRLKAS,PMQSTPL,GLY-GLU-VAL-VAL-ASP-CYS-HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG-SER-ALA-SER-ASN-ARG-LEU-LYS-ALA-SER,PRO-MET-GLN-SER-TPO-PRO-LEU,237,7,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](OP(O)(O)O)C)CO)CCC(=O)N)NC(=O)[C@H]1[NH2+]CCC1,Kd=280nM,6.552842,6.55,1,A,A,1,A,A,0,,E,A,,1,1,237,7,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NC(C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)OP(=O)(O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NC(C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)OP(=O)(O)O,0.8789634108543396,0.8314842581748962,85.91659545898438,89.22469329833984,0.42110675573349,0.6001361608505249,0.9067781567573548,0.8887571096420288,0.8540793657302856,0.8171660304069519,PMQSTPL,Low,"(6.523, 6.696]",train
1UPK,protein-peptide,Q7RTN6 Q9Y376,MPFPFGKSHKSPADIVKNLKESMAVLEKQDISDKKAEKATEEVSKNLVAMKEILYGTNEKEPQTEAVAQLAQELYNSGLLSTLVADLQLIDFEGKKDVAQIFNNILRRQIGTRTPTVEYICTQQNILFMLLKGYESPEIALNCGIMLRECIRHEPLAKIILWSEQFYDFFRYVEMSTFDIASDAFATFKDLLTRHKLLSAEFLEQHYDRFFSEYEKLLHSENYVTKRQSLKLLGELLLDRHNFTIMTKYISKPENLKLMMNLLRDKSRNIQFEAFHVFKVFVANPNKTQPILDILLKNQAKLIEFLSKFQNDRTEDEQFNDEKTYLVKQIRDLKRPAQQEA,NLEELEVDDWEF,MSE-PRO-PHE-PRO-PHE-GLY-LYS-SER-HIS-LYS-SER-PRO-ALA-ASP-ILE-VAL-LYS-ASN-LEU-LYS-GLU-SER-MSE-ALA-VAL-LEU-GLU-LYS-GLN-ASP-ILE-SER-ASP-LYS-LYS-ALA-GLU-LYS-ALA-THR-GLU-GLU-VAL-SER-LYS-ASN-LEU-VAL-ALA-MSE-LYS-GLU-ILE-LEU-TYR-GLY-THR-ASN-GLU-LYS-GLU-PRO-GLN-THR-GLU-ALA-VAL-ALA-GLN-LEU-ALA-GLN-GLU-LEU-TYR-ASN-SER-GLY-LEU-LEU-SER-THR-LEU-VAL-ALA-ASP-LEU-GLN-LEU-ILE-ASP-PHE-GLU-GLY-LYS-LYS-ASP-VAL-ALA-GLN-ILE-PHE-ASN-ASN-ILE-LEU-ARG-ARG-GLN-ILE-GLY-THR-ARG-THR-PRO-THR-VAL-GLU-TYR-ILE-CYS-THR-GLN-GLN-ASN-ILE-LEU-PHE-MSE-LEU-LEU-LYS-GLY-TYR-GLU-SER-PRO-GLU-ILE-ALA-LEU-ASN-CYS-GLY-ILE-MSE-LEU-ARG-GLU-CYS-ILE-ARG-HIS-GLU-PRO-LEU-ALA-LYS-ILE-ILE-LEU-TRP-SER-GLU-GLN-PHE-TYR-ASP-PHE-PHE-ARG-TYR-VAL-GLU-MSE-SER-THR-PHE-ASP-ILE-ALA-SER-ASP-ALA-PHE-ALA-THR-PHE-LYS-ASP-LEU-LEU-THR-ARG-HIS-LYS-LEU-LEU-SER-ALA-GLU-PHE-LEU-GLU-GLN-HIS-TYR-ASP-ARG-PHE-PHE-SER-GLU-TYR-GLU-LYS-LEU-LEU-HIS-SER-GLU-ASN-TYR-VAL-THR-LYS-ARG-GLN-SER-LEU-LYS-LEU-LEU-GLY-GLU-LEU-LEU-LEU-ASP-ARG-HIS-ASN-PHE-THR-ILE-MSE-THR-LYS-TYR-ILE-SER-LYS-PRO-GLU-ASN-LEU-LYS-LEU-MSE-MSE-ASN-LEU-LEU-ARG-ASP-LYS-SER-ARG-ASN-ILE-GLN-PHE-GLU-ALA-PHE-HIS-VAL-PHE-LYS-VAL-PHE-VAL-ALA-ASN-PRO-ASN-LYS-THR-GLN-PRO-ILE-LEU-ASP-ILE-LEU-LEU-LYS-ASN-GLN-ALA-LYS-LEU-ILE-GLU-PHE-LEU-SER-LYS-PHE-GLN-ASN-ASP-ARG-THR-GLU-ASP-GLU-GLN-PHE-ASN-ASP-GLU-LYS-THR-TYR-LEU-VAL-LYS-GLN-ILE-ARG-ASP-LEU-LYS-ARG-PRO-ALA-GLN-GLN-GLU-ALA,ASN-LEU-GLU-GLU-LEU-GLU-VAL-ASP-ASP-TRP-GLU-PHE,341,12,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1c[nH]c2c1cccc2,Kd=400nM,6.39794,6.4,1,A,A,1,A,A,0,,B,A,,1,1,341,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O)C(=O)O,0.7648194432258606,0.8143063187599182,84.46002197265625,83.27458190917969,0.4017414450645447,0.7481247186660767,0.8793787360191345,0.8518833518028259,0.6830634474754333,0.7755865454673767,NLEELEVDDWEF,Low,"(6.26, 6.398]",train
1UTC,protein-peptide,P49418 P49951,MAQILPIRFQEHLQLQNLGINPANIGFSTLTMESDKFICIREKVGEQAQVVIIDMNDPSNPIRRPISADSAIMNPASKVIALKAGKTLQIFNIEMKSKMKAHTMTDDVTFWKWISLNTVALVTDNAVYHWSMEGESQPVKMFDRHSSLAGCQIINYRTDAKQKWLLLTGISAQQNRVVGAMQLYSVDRKVSQPIEGHAASFAQFKMEGNAEESTLFCFAVRGQAGGKLHIIEVGTPPTGNQPFPKKAVDVFFPPEAQNDFPVAMQISEKHDVVFLITKYGYIHLYDLETGTCIYMNRISGETIFVTAPHEATAGIIGVNRKGQVLSVCVEEENIIPYITNVLQNPDLALRMAVRNNLAGAEEL,TLPWDLWTT,MET-ALA-GLN-ILE-LEU-PRO-ILE-ARG-PHE-GLN-GLU-HIS-LEU-GLN-LEU-GLN-ASN-LEU-GLY-ILE-ASN-PRO-ALA-ASN-ILE-GLY-PHE-SER-THR-LEU-THR-MET-GLU-SER-ASP-LYS-PHE-ILE-CYS-ILE-ARG-GLU-LYS-VAL-GLY-GLU-GLN-ALA-GLN-VAL-VAL-ILE-ILE-ASP-MET-ASN-ASP-PRO-SER-ASN-PRO-ILE-ARG-ARG-PRO-ILE-SER-ALA-ASP-SER-ALA-ILE-MET-ASN-PRO-ALA-SER-LYS-VAL-ILE-ALA-LEU-LYS-ALA-GLY-LYS-THR-LEU-GLN-ILE-PHE-ASN-ILE-GLU-MET-LYS-SER-LYS-MET-LYS-ALA-HIS-THR-MET-THR-ASP-ASP-VAL-THR-PHE-TRP-LYS-TRP-ILE-SER-LEU-ASN-THR-VAL-ALA-LEU-VAL-THR-ASP-ASN-ALA-VAL-TYR-HIS-TRP-SER-MET-GLU-GLY-GLU-SER-GLN-PRO-VAL-LYS-MET-PHE-ASP-ARG-HIS-SER-SER-LEU-ALA-GLY-CYS-GLN-ILE-ILE-ASN-TYR-ARG-THR-ASP-ALA-LYS-GLN-LYS-TRP-LEU-LEU-LEU-THR-GLY-ILE-SER-ALA-GLN-GLN-ASN-ARG-VAL-VAL-GLY-ALA-MET-GLN-LEU-TYR-SER-VAL-ASP-ARG-LYS-VAL-SER-GLN-PRO-ILE-GLU-GLY-HIS-ALA-ALA-SER-PHE-ALA-GLN-PHE-LYS-MET-GLU-GLY-ASN-ALA-GLU-GLU-SER-THR-LEU-PHE-CYS-PHE-ALA-VAL-ARG-GLY-GLN-ALA-GLY-GLY-LYS-LEU-HIS-ILE-ILE-GLU-VAL-GLY-THR-PRO-PRO-THR-GLY-ASN-GLN-PRO-PHE-PRO-LYS-LYS-ALA-VAL-ASP-VAL-PHE-PHE-PRO-PRO-GLU-ALA-GLN-ASN-ASP-PHE-PRO-VAL-ALA-MET-GLN-ILE-SER-GLU-LYS-HIS-ASP-VAL-VAL-PHE-LEU-ILE-THR-LYS-TYR-GLY-TYR-ILE-HIS-LEU-TYR-ASP-LEU-GLU-THR-GLY-THR-CYS-ILE-TYR-MET-ASN-ARG-ILE-SER-GLY-GLU-THR-ILE-PHE-VAL-THR-ALA-PRO-HIS-GLU-ALA-THR-ALA-GLY-ILE-ILE-GLY-VAL-ASN-ARG-LYS-GLY-GLN-VAL-LEU-SER-VAL-CYS-VAL-GLU-GLU-GLU-ASN-ILE-ILE-PRO-TYR-ILE-THR-ASN-VAL-LEU-GLN-ASN-PRO-ASP-LEU-ALA-LEU-ARG-MET-ALA-VAL-ARG-ASN-ASN-LEU-ALA-GLY-ALA-GLU-GLU-LEU,THR-LEU-PRO-TRP-ASP-LEU-TRP-THR-THR,363,9,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(C)C)CC(=O)O)C,Kd=28uM,4.552842,4.55,1,A,A,1,A,A,0,,P,A,dimer,1,1,363,9,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)[C@@H](C)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8357753753662109,0.7127783894538879,92.36023712158205,90.9437026977539,0.37447589635849,0.9388421177864076,0.9389178156852722,0.881141185760498,0.7948687672615051,0.6706876754760742,TLPWDLWTT,Low,"(4.456, 4.606]",val
1UTI,protein-peptide,P70218 O89100,VRWARALYDFEALEEDELGFRSGEVVEVLDSSNPSWWTGRLHNKLGLFPANYVAPMMR,GQPPLVPPRKEKMRGK,VAL-ARG-TRP-ALA-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-LEU-GLU-GLU-ASP-GLU-LEU-GLY-PHE-ARG-SER-GLY-GLU-VAL-VAL-GLU-VAL-LEU-ASP-SER-SER-ASN-PRO-SER-TRP-TRP-THR-GLY-ARG-LEU-HIS-ASN-LYS-LEU-GLY-LEU-PHE-PRO-ALA-ASN-TYR-VAL-ALA-PRO-MET-MET-ARG,GLY-GLN-PRO-PRO-LEU-VAL-PRO-PRO-ARG-LYS-GLU-LYS-MET-ARG-GLY-LYS,58,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)CCSC)CCCC[NH3+])CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)C[NH3+])CCC(=O)N)CC(C)C)CCC[NH+]=C(N)N,Kd=2.4uM,5.619789,5.62,1,A,A,1,A,A,0,,D,A,,1,1,58,16,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NCC(=O)O,0.9854817986488342,0.8293672800064087,96.90257263183594,89.28760528564453,0.3025481402873993,0.5681374669075012,0.9080706238746644,0.8635626435279846,0.8696994185447693,0.8208184838294983,GQPPLVPPRKEKMRGK,Low,"(5.6, 5.699]",train
1VJ6,protein-peptide,Q61315 Q64512,MHHHHHHMKPGDTFEVELAKTDGSLGISVTGGVNTSVRHGGIYVKAIIPKGAAESDGRIHKGDRVLAVNGVSLEGATHKQAVETLRNTGQVVHLLLEKGQVP,KRHSGSYLVTSV,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-LYS-PRO-GLY-ASP-THR-PHE-GLU-VAL-GLU-LEU-ALA-LYS-THR-ASP-GLY-SER-LEU-GLY-ILE-SER-VAL-THR-GLY-GLY-VAL-ASN-THR-SER-VAL-ARG-HIS-GLY-GLY-ILE-TYR-VAL-LYS-ALA-ILE-ILE-PRO-LYS-GLY-ALA-ALA-GLU-SER-ASP-GLY-ARG-ILE-HIS-LYS-GLY-ASP-ARG-VAL-LEU-ALA-VAL-ASN-GLY-VAL-SER-LEU-GLU-GLY-ALA-THR-HIS-LYS-GLN-ALA-VAL-GLU-THR-LEU-ARG-ASN-THR-GLY-GLN-VAL-VAL-HIS-LEU-LEU-LEU-GLU-LYS-GLY-GLN-VAL-PRO,LYS-ARG-HIS-SER-GLY-SER-TYR-LEU-VAL-THR-SER-VAL,102,12,OC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(C)C,Kd=8uM,5.09691,5.1,1,A,A,1,A,A,0,,B,A,,1,1,102,12,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9519034028053284,0.8466464877128601,90.88400268554688,89.97787475585938,0.3711013495922088,0.635212242603302,0.8728817105293274,0.8648831248283386,0.8400798439979553,0.7991951704025269,KRHSGSYLVTSV,Low,"(5.014, 5.105]",train
1VWF,protein-peptide,P22629,AEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKP,CHPQGPPC,ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO,ACE-CYS-HIS-PRO-GLN-GLY-PRO-PRO-CYS-NH2,123,10,SC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N)CS)CCC(=O)N)Cc1nc[nH]c1)NC(=O)C,Kd=310nM,6.508638,6.51,1,A,A,1,A,A,0,,P,B,,1,1,123,10,0,NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O,,NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CS)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O,0.787432849407196,0.8309932351112366,89.05022430419922,88.91100311279297,0.5471264719963074,0.5949318408966064,0.8569616079330444,0.8778671026229858,0.7318827509880066,0.8192747831344604,CHPQGPPC,Low,"(6.398, 6.523]",train
1X8S,protein-peptide,O97111,GSETHRRVRLLKHGSDKPLGFYIRDGTSVRVTASGLEKQPGIFISRLVPGGLAESTGLLAVNDEVIEVNGIEVAGKTLDQVTDMMVANSSNLIITVKPANQR,YPKHREMAVDCP,GLY-SER-GLU-THR-HIS-ARG-ARG-VAL-ARG-LEU-LEU-LYS-HIS-GLY-SER-ASP-LYS-PRO-LEU-GLY-PHE-TYR-ILE-ARG-ASP-GLY-THR-SER-VAL-ARG-VAL-THR-ALA-SER-GLY-LEU-GLU-LYS-GLN-PRO-GLY-ILE-PHE-ILE-SER-ARG-LEU-VAL-PRO-GLY-GLY-LEU-ALA-GLU-SER-THR-GLY-LEU-LEU-ALA-VAL-ASN-ASP-GLU-VAL-ILE-GLU-VAL-ASN-GLY-ILE-GLU-VAL-ALA-GLY-LYS-THR-LEU-ASP-GLN-VAL-THR-ASP-MET-MET-VAL-ALA-ASN-SER-SER-ASN-LEU-ILE-ILE-THR-VAL-LYS-PRO-ALA-ASN-GLN-ARG,TYR-PRO-LYS-HIS-ARG-GLU-MET-ALA-VAL-ASP-CYS-PRO,102,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CS)CC(=O)O)C(C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC[NH+]=C(N)N)CCC(=O)O,Kd=8uM,5.09691,5.1,1,A,A,1,A,A,0,,B,A,,1,1,102,12,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)O)C(C)C,0.973863422870636,0.8733339309692383,93.54215240478516,89.83465576171875,0.3097831904888153,0.5267584323883057,0.9277312755584716,0.9002028107643127,0.9196069836616516,0.8666166663169861,YPKHREMAVDCP,Low,"(5.014, 5.105]",val
1XB7,protein-peptide,P11474 Q9UBK2,GSSHHHHHHLEVLFQGPVNALVSHLLVVEPEKLYAMPDPAGPDGHLPAVATLCDLFDREIVVTISWAKSIPGFSSLSLSDQMSVLQSVWMEVLVLGVAQRSLPLQDELAFAEDLVLDEEGARAAGLGELGAALLQLVRRLQALRLEREEYVLLKALALANSDSVHIEDAEAVEQLREALHEALLEYEAGRAGPGGGAERRRAGRLLLTLPLLRQTAGKVLAHFYGVKLEGKVPMHKLFLEMLEAMMD,RPASELLKYLTT,GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-VAL-LEU-PHE-GLN-GLY-PRO-VAL-ASN-ALA-LEU-VAL-SER-HIS-LEU-LEU-VAL-VAL-GLU-PRO-GLU-LYS-LEU-TYR-ALA-MET-PRO-ASP-PRO-ALA-GLY-PRO-ASP-GLY-HIS-LEU-PRO-ALA-VAL-ALA-THR-LEU-CYS-ASP-LEU-PHE-ASP-ARG-GLU-ILE-VAL-VAL-THR-ILE-SER-TRP-ALA-LYS-SER-ILE-PRO-GLY-PHE-SER-SER-LEU-SER-LEU-SER-ASP-GLN-MET-SER-VAL-LEU-GLN-SER-VAL-TRP-MET-GLU-VAL-LEU-VAL-LEU-GLY-VAL-ALA-GLN-ARG-SER-LEU-PRO-LEU-GLN-ASP-GLU-LEU-ALA-PHE-ALA-GLU-ASP-LEU-VAL-LEU-ASP-GLU-GLU-GLY-ALA-ARG-ALA-ALA-GLY-LEU-GLY-GLU-LEU-GLY-ALA-ALA-LEU-LEU-GLN-LEU-VAL-ARG-ARG-LEU-GLN-ALA-LEU-ARG-LEU-GLU-ARG-GLU-GLU-TYR-VAL-LEU-LEU-LYS-ALA-LEU-ALA-LEU-ALA-ASN-SER-ASP-SER-VAL-HIS-ILE-GLU-ASP-ALA-GLU-ALA-VAL-GLU-GLN-LEU-ARG-GLU-ALA-LEU-HIS-GLU-ALA-LEU-LEU-GLU-TYR-GLU-ALA-GLY-ARG-ALA-GLY-PRO-GLY-GLY-GLY-ALA-GLU-ARG-ARG-ARG-ALA-GLY-ARG-LEU-LEU-LEU-THR-LEU-PRO-LEU-LEU-ARG-GLN-THR-ALA-GLY-LYS-VAL-LEU-ALA-HIS-PHE-TYR-GLY-VAL-LYS-LEU-GLU-GLY-LYS-VAL-PRO-MET-HIS-LYS-LEU-PHE-LEU-GLU-MET-LEU-GLU-ALA-MET-MET-ASP,ARG-PRO-ALA-SER-GLU-LEU-LEU-LYS-TYR-LEU-THR-THR,247,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](O)C)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)O)CC(C)C)CC(C)C,Kd=0.6uM,6.221849,6.22,1,A,A,1,A,A,0,,P,A,,1,1,247,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9516316056251526,0.8891486525535583,88.30075073242188,85.47937774658203,0.3943351507186889,0.6487073302268982,0.9074057340621948,0.9015113711357116,0.904772937297821,0.8556935787200928,RPASELLKYLTT,Low,"(6.097, 6.26]",val
1Y19,protein-peptide,O70161 P26039,PVQLNLLYVQARDDILNGSHPVSFDKACEFAGFQCQIQFGPHNEQKHKAGFLDLKDFLPKEYVKQKGERKIFQAHKNCGQMSEIEAKVRYVKLARSLKTYGVSFFLVKEKMKGKNKLVPRLLGITKECVMRVDEKTKEVIQEWSLTNIKRWAASPKSFTLDFGDYQDGYYSVQTTEGEQIAQLIAGYIDIILKKKKSKDHFG,DERSWVYSPLHYSA,PRO-VAL-GLN-LEU-ASN-LEU-LEU-TYR-VAL-GLN-ALA-ARG-ASP-ASP-ILE-LEU-ASN-GLY-SER-HIS-PRO-VAL-SER-PHE-ASP-LYS-ALA-CYS-GLU-PHE-ALA-GLY-PHE-GLN-CYS-GLN-ILE-GLN-PHE-GLY-PRO-HIS-ASN-GLU-GLN-LYS-HIS-LYS-ALA-GLY-PHE-LEU-ASP-LEU-LYS-ASP-PHE-LEU-PRO-LYS-GLU-TYR-VAL-LYS-GLN-LYS-GLY-GLU-ARG-LYS-ILE-PHE-GLN-ALA-HIS-LYS-ASN-CYS-GLY-GLN-MET-SER-GLU-ILE-GLU-ALA-LYS-VAL-ARG-TYR-VAL-LYS-LEU-ALA-ARG-SER-LEU-LYS-THR-TYR-GLY-VAL-SER-PHE-PHE-LEU-VAL-LYS-GLU-LYS-MET-LYS-GLY-LYS-ASN-LYS-LEU-VAL-PRO-ARG-LEU-LEU-GLY-ILE-THR-LYS-GLU-CYS-VAL-MET-ARG-VAL-ASP-GLU-LYS-THR-LYS-GLU-VAL-ILE-GLN-GLU-TRP-SER-LEU-THR-ASN-ILE-LYS-ARG-TRP-ALA-ALA-SER-PRO-LYS-SER-PHE-THR-LEU-ASP-PHE-GLY-ASP-TYR-GLN-ASP-GLY-TYR-TYR-SER-VAL-GLN-THR-THR-GLU-GLY-GLU-GLN-ILE-ALA-GLN-LEU-ILE-ALA-GLY-TYR-ILE-ASP-ILE-ILE-LEU-LYS-LYS-LYS-LYS-SER-LYS-ASP-HIS-PHE-GLY,ASP-GLU-ARG-SER-TRP-VAL-TYR-SER-PRO-LEU-HIS-TYR-SER-ALA,202,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)Cc1ccc(cc1)O)Cc1[nH]cnc1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O,Kd=170nM,6.769551,6.77,1,A,A,1,A,A,0,,A,B,dimer,1,1,202,14,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.9021272659301758,0.7642549276351929,87.8525619506836,79.29078674316406,0.3722214996814728,0.7492535710334778,0.8604544997215271,0.7923873066902161,0.8575685620307922,0.741751492023468,DERSWVYSPLHYSA,Low,"(6.696, 6.824]",train
1Y2A,protein-peptide,O15162 P52293,NQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFS,GKISKHWTGI,ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER,GLY-LYS-ILE-SER-LYS-HIS-TRP-THR-GLY-ILE,428,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H]([C@H](CC)C)C(=O)O)[C@H](O)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]cn1)CCCC[NH3+])NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)C[NH3+])CCCC[NH3+],Kd=45.8nM,7.339135,7.34,1,A,A,1,A,A,0,,P,C,,1,1,428,10,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CN)[C@@H](C)CC)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O,0.8051923513412476,0.8497787714004517,93.8102569580078,94.41360473632812,0.3562941253185272,0.5844073295593262,0.9267275929450988,0.9199366569519044,0.7605390548706055,0.8322393298149109,GKISKHWTGI,Moderate,"(7.268, 7.523]",val
1Y98,protein-peptide,P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTREWVLDSVALYQCQELDTYLIPQIP,PTRVSSPVFGAT,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-GLU-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,PRO-THR-ARG-VAL-SER-SEP-PRO-VAL-PHE-GLY-ALA-THR,214,12,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C)Cc1ccccc1)C(C)C)COP(O)(O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,B,A,,1,1,214,12,0,CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8966649174690247,0.8267428874969482,91.9261245727539,92.56989288330078,0.3489866852760315,0.5875949859619141,0.938988447189331,0.9037092328071594,0.8528981804847717,0.8075013160705566,PTRVSSPVFGAT,Low,"(5.31, 5.463]",val
1YBO,protein-peptide,O00560 P31431,GAMDPREVILCKDQDGKIGLRLKSIDNGIFVQLVQANSPASLVGLRFGDQVLQINGENCAGWSSDKAHKVLKQAFGEKITMTIRDRPFERTITMHKDSTGHVGFIFKNGKITSIVKDSSAARNGLLTEHNICEINGQNVIGLKDSQIADILSTSGTVVTITIMPAF,LGKKPIYKKAPTNEFYA,GLY-ALA-MET-ASP-PRO-ARG-GLU-VAL-ILE-LEU-CYS-LYS-ASP-GLN-ASP-GLY-LYS-ILE-GLY-LEU-ARG-LEU-LYS-SER-ILE-ASP-ASN-GLY-ILE-PHE-VAL-GLN-LEU-VAL-GLN-ALA-ASN-SER-PRO-ALA-SER-LEU-VAL-GLY-LEU-ARG-PHE-GLY-ASP-GLN-VAL-LEU-GLN-ILE-ASN-GLY-GLU-ASN-CYS-ALA-GLY-TRP-SER-SER-ASP-LYS-ALA-HIS-LYS-VAL-LEU-LYS-GLN-ALA-PHE-GLY-GLU-LYS-ILE-THR-MET-THR-ILE-ARG-ASP-ARG-PRO-PHE-GLU-ARG-THR-ILE-THR-MET-HIS-LYS-ASP-SER-THR-GLY-HIS-VAL-GLY-PHE-ILE-PHE-LYS-ASN-GLY-LYS-ILE-THR-SER-ILE-VAL-LYS-ASP-SER-SER-ALA-ALA-ARG-ASN-GLY-LEU-LEU-THR-GLU-HIS-ASN-ILE-CYS-GLU-ILE-ASN-GLY-GLN-ASN-VAL-ILE-GLY-LEU-LYS-ASP-SER-GLN-ILE-ALA-ASP-ILE-LEU-SER-THR-SER-GLY-THR-VAL-VAL-THR-ILE-THR-ILE-MET-PRO-ALA-PHE,LEU-GLY-LYS-LYS-PRO-ILE-TYR-LYS-LYS-ALA-PRO-THR-ASN-GLU-PHE-TYR-ALA,166,17,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(=O)N,Kd=0.16mM,3.79588,3.8,1,A,A,1,A,A,0,,C,A,,1,1,166,17,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.8124107718467712,0.7080194354057312,87.29235076904297,83.81610870361328,0.3773737549781799,1.0436294078826904,0.8730214238166809,0.7729013562202454,0.7391979098320007,0.6917989253997803,LGKKPIYKKAPTNEFYA,Low,"(3.548, 3.924]",train
1YVH,protein-peptide,Q9Z200 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,GRARAVENQYSFY,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,GLY-ARG-ALA-ARG-ALA-VAL-GLU-ASN-GLN-PTR-SER-PHE-TYR,329,13,OC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)CCC(=O)O)CC(=O)N)CCC(=O)N)Cc1ccc(cc1)OP(O)(O)O,Kd=43nM,7.366532,7.37,1,A,A,1,A,A,0,,B,A,,1,1,329,13,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.7795137166976929,0.8134810328483582,81.17984771728516,80.18008422851562,0.465118408203125,0.8159693479537964,0.8698359131813049,0.8337759375572205,0.6874886751174927,0.7609148621559143,GRARAVENQYSFY,Moderate,"(7.268, 7.523]",train
1YWH,protein-peptide,Q03405,LRCMQCKTNGDCRVEECALGQDLCRTTIVRLWEEGEELELVEKSCTHSEKTNRTLSYRTGLKITSLTEVVCGLDLCNQGNSGRAVTYSRSRYLECISCGSSDMSCERGRHQSLQCRSPEEQCLDVVTHWIQEGEEGRPKDDRHLRGCGYLPGCPGSNGFHNNDTFHFLKCCNTTKCNEGPILELENLPQNGRQCYSCKGQSTHGCSSEETFLIDCRGPMNQCLVATGTHEPKNQSYMVRGCATASMCQHAHLGDAFSMNHIDVSCCTKSGCNHPDLDVQYRSGAAPQPGPAHLSLTITLLMTARLWGGTLLWT,KSDAFSKYLWSSK,LEU-ARG-CYS-MET-GLN-CYS-LYS-THR-ASN-GLY-ASP-CYS-ARG-VAL-GLU-GLU-CYS-ALA-LEU-GLY-GLN-ASP-LEU-CYS-ARG-THR-THR-ILE-VAL-ARG-LEU-TRP-GLU-GLU-GLY-GLU-GLU-LEU-GLU-LEU-VAL-GLU-LYS-SER-CYS-THR-HIS-SER-GLU-LYS-THR-ASN-ARG-THR-LEU-SER-TYR-ARG-THR-GLY-LEU-LYS-ILE-THR-SER-LEU-THR-GLU-VAL-VAL-CYS-GLY-LEU-ASP-LEU-CYS-ASN-GLN-GLY-ASN-SER-GLY-ARG-ALA-VAL-THR-TYR-SER-ARG-SER-ARG-TYR-LEU-GLU-CYS-ILE-SER-CYS-GLY-SER-SER-ASP-MET-SER-CYS-GLU-ARG-GLY-ARG-HIS-GLN-SER-LEU-GLN-CYS-ARG-SER-PRO-GLU-GLU-GLN-CYS-LEU-ASP-VAL-VAL-THR-HIS-TRP-ILE-GLN-GLU-GLY-GLU-GLU-GLY-ARG-PRO-LYS-ASP-ASP-ARG-HIS-LEU-ARG-GLY-CYS-GLY-TYR-LEU-PRO-GLY-CYS-PRO-GLY-SER-ASN-GLY-PHE-HIS-ASN-ASN-ASP-THR-PHE-HIS-PHE-LEU-LYS-CYS-CYS-ASN-THR-THR-LYS-CYS-ASN-GLU-GLY-PRO-ILE-LEU-GLU-LEU-GLU-ASN-LEU-PRO-GLN-ASN-GLY-ARG-GLN-CYS-TYR-SER-CYS-LYS-GLY-GLN-SER-THR-HIS-GLY-CYS-SER-SER-GLU-GLU-THR-PHE-LEU-ILE-ASP-CYS-ARG-GLY-PRO-MET-ASN-GLN-CYS-LEU-VAL-ALA-THR-GLY-THR-HIS-GLU-PRO-LYS-ASN-GLN-SER-TYR-MET-VAL-ARG-GLY-CYS-ALA-THR-ALA-SER-MET-CYS-GLN-HIS-ALA-HIS-LEU-GLY-ASP-ALA-PHE-SER-MET-ASN-HIS-ILE-ASP-VAL-SER-CYS-CYS-THR-LYS-SER-GLY-CYS-ASN-HIS-PRO-ASP-LEU-ASP-VAL-GLN-TYR-ARG-SER-GLY-ALA-ALA-PRO-GLN-PRO-GLY-PRO-ALA-HIS-LEU-SER-LEU-THR-ILE-THR-LEU-LEU-MET-THR-ALA-ARG-LEU-TRP-GLY-GLY-THR-LEU-LEU-TRP-THR,LYS-SER-ASP-ALC-PHE-DSN-DLY-TYR-LEU-TRP-SER-SER-LYS,313,13,[NH3+]CCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CO)CO)Cc1c[nH]c2c1cccc2)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CO)CC(=O)O)CC1CCCCC1)Cc1ccccc1)CO,Kd=16.4nM,7.785156,7.79,1,A,A,1,A,A,0,,B,A,dimer,1,1,313,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O,0.8241856694221497,0.6076028347015381,72.83460235595703,61.180118560791016,0.6512201428413391,1.3652875423431396,0.7949912548065186,0.7151278853416443,0.7873892188072205,0.5807216167449951,KSDAFSKYLWSSK,Moderate,"(7.523, 7.921]",train
1YY6,protein-peptide,Q93009 P03211,GSHTAEEDMEDDTSWRSEATFQFTVERFSRLSESVLSPPCFVRNLPWKIMVMPRFYPDRPHQKSVGFFLQCNAESDSTSWSCHAQAVLKIINYRDDEKSFSRRISHLFFHKENDWGFSNFMAWSEVTDPEKGFIDDDKVTFEVFVQADAPHGVAW,DPGEGPSTGP,GLY-SER-HIS-THR-ALA-GLU-GLU-ASP-MET-GLU-ASP-ASP-THR-SER-TRP-ARG-SER-GLU-ALA-THR-PHE-GLN-PHE-THR-VAL-GLU-ARG-PHE-SER-ARG-LEU-SER-GLU-SER-VAL-LEU-SER-PRO-PRO-CYS-PHE-VAL-ARG-ASN-LEU-PRO-TRP-LYS-ILE-MET-VAL-MET-PRO-ARG-PHE-TYR-PRO-ASP-ARG-PRO-HIS-GLN-LYS-SER-VAL-GLY-PHE-PHE-LEU-GLN-CYS-ASN-ALA-GLU-SER-ASP-SER-THR-SER-TRP-SER-CYS-HIS-ALA-GLN-ALA-VAL-LEU-LYS-ILE-ILE-ASN-TYR-ARG-ASP-ASP-GLU-LYS-SER-PHE-SER-ARG-ARG-ILE-SER-HIS-LEU-PHE-PHE-HIS-LYS-GLU-ASN-ASP-TRP-GLY-PHE-SER-ASN-PHE-MET-ALA-TRP-SER-GLU-VAL-THR-ASP-PRO-GLU-LYS-GLY-PHE-ILE-ASP-ASP-ASP-LYS-VAL-THR-PHE-GLU-VAL-PHE-VAL-GLN-ALA-ASP-ALA-PRO-HIS-GLY-VAL-ALA-TRP,ASP-PRO-GLY-GLU-GLY-PRO-SER-THR-GLY-PRO,155,10,OC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O,Kd=0.86uM,6.065502,6.07,1,A,A,1,A,A,0,,B,A,,1,1,155,10,0,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O,C[C@@H](O)[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O,0.9454030394554138,0.8373778462409973,94.27818298339844,91.77112579345705,0.3499242961406708,0.5431705117225647,0.9186015725135804,0.891067385673523,0.8725579977035522,0.8078263998031616,DPGEGPSTGP,Low,"(5.959, 6.097]",train
1ZH7,protein-peptide,P97947 P45448,ASIPHLILELLKCEPDEPQVQAKIMAYLQQEQSNRNRQEKLSAFGLLCKMADQTLFSIVEWARSSIFFRELKVDDQMKLLQNCWSELLILDHIYRQVAHGKEGTIFLVTGEHVDYSTIISHTEVAFNNLLSLAQELVVRLRSLQFDQREFVCLKFLVLFSSDVKNLENLQLVEGVQEQVNAALLDYTVCNYPQQTEKFGQLLLRLPEIRAISKQAEDYLYYKHVNGDVPYNNLLIEMLHAKRA,SHPTILYTLLS,ALA-SER-ILE-PRO-HIS-LEU-ILE-LEU-GLU-LEU-LEU-LYS-CYS-GLU-PRO-ASP-GLU-PRO-GLN-VAL-GLN-ALA-LYS-ILE-MET-ALA-TYR-LEU-GLN-GLN-GLU-GLN-SER-ASN-ARG-ASN-ARG-GLN-GLU-LYS-LEU-SER-ALA-PHE-GLY-LEU-LEU-CYS-LYS-MET-ALA-ASP-GLN-THR-LEU-PHE-SER-ILE-VAL-GLU-TRP-ALA-ARG-SER-SER-ILE-PHE-PHE-ARG-GLU-LEU-LYS-VAL-ASP-ASP-GLN-MET-LYS-LEU-LEU-GLN-ASN-CYS-TRP-SER-GLU-LEU-LEU-ILE-LEU-ASP-HIS-ILE-TYR-ARG-GLN-VAL-ALA-HIS-GLY-LYS-GLU-GLY-THR-ILE-PHE-LEU-VAL-THR-GLY-GLU-HIS-VAL-ASP-TYR-SER-THR-ILE-ILE-SER-HIS-THR-GLU-VAL-ALA-PHE-ASN-ASN-LEU-LEU-SER-LEU-ALA-GLN-GLU-LEU-VAL-VAL-ARG-LEU-ARG-SER-LEU-GLN-PHE-ASP-GLN-ARG-GLU-PHE-VAL-CYS-LEU-LYS-PHE-LEU-VAL-LEU-PHE-SER-SER-ASP-VAL-LYS-ASN-LEU-GLU-ASN-LEU-GLN-LEU-VAL-GLU-GLY-VAL-GLN-GLU-GLN-VAL-ASN-ALA-ALA-LEU-LEU-ASP-TYR-THR-VAL-CYS-ASN-TYR-PRO-GLN-GLN-THR-GLU-LYS-PHE-GLY-GLN-LEU-LEU-LEU-ARG-LEU-PRO-GLU-ILE-ARG-ALA-ILE-SER-LYS-GLN-ALA-GLU-ASP-TYR-LEU-TYR-TYR-LYS-HIS-VAL-ASN-GLY-ASP-VAL-PRO-TYR-ASN-ASN-LEU-LEU-ILE-GLU-MET-LEU-HIS-ALA-LYS-ARG-ALA,SER-HIS-PRO-THR-ILE-LEU-TYR-THR-LEU-LEU-SER,243,11,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)CC(C)C)[C@H](O)C)Cc1ccc(cc1)O)CC(C)C)[C@H](CC)C)[C@H](O)C)Cc1c[nH]cn1)[NH3+],IC50=0.5uM,6.30103,6.3,1,A,A,1,A,A,0,,C,A,,1,1,243,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9627380967140198,0.8102537393569946,91.03616333007812,88.44624328613281,0.3237577676773071,0.6889150142669678,0.9487187266349792,0.8982500433921814,0.9391760230064392,0.7882546782493591,SHPTILYTLLS,Low,"(6.26, 6.398]",val
1ZUB,protein-peptide,Q811U3 Q9JIR4,GSPGSHPVTWQPSKEGDRLIGRVILNKRTTMPKESGALLGLKVVGGKMTDLGRLGAFITKVKKGSLADVVGHLRAGDEVLEWNGKPLPGATNEEVYNIILESKSEPQVEIIVSR,CDQDEEEGIWA,GLY-SER-PRO-GLY-SER-HIS-PRO-VAL-THR-TRP-GLN-PRO-SER-LYS-GLU-GLY-ASP-ARG-LEU-ILE-GLY-ARG-VAL-ILE-LEU-ASN-LYS-ARG-THR-THR-MET-PRO-LYS-GLU-SER-GLY-ALA-LEU-LEU-GLY-LEU-LYS-VAL-VAL-GLY-GLY-LYS-MET-THR-ASP-LEU-GLY-ARG-LEU-GLY-ALA-PHE-ILE-THR-LYS-VAL-LYS-LYS-GLY-SER-LEU-ALA-ASP-VAL-VAL-GLY-HIS-LEU-ARG-ALA-GLY-ASP-GLU-VAL-LEU-GLU-TRP-ASN-GLY-LYS-PRO-LEU-PRO-GLY-ALA-THR-ASN-GLU-GLU-VAL-TYR-ASN-ILE-ILE-LEU-GLU-SER-LYS-SER-GLU-PRO-GLN-VAL-GLU-ILE-ILE-VAL-SER-ARG,CYS-ASP-GLN-ASP-GLU-GLU-GLU-GLY-ILE-TRP-ALA,114,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)C,Kd=0.27uM,6.568636,6.57,1,A,A,1,A,A,0,,B,A,,1,1,114,11,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9471550583839417,0.8109422922134399,89.29881286621094,85.98316955566406,0.3739213943481445,0.7055418491363525,0.889996349811554,0.8628087639808655,0.856444776058197,0.7979756593704224,CDQDEEEGIWA,Low,"(6.523, 6.696]",train
2A0T,protein-peptide,P34217 P22216,ATQRFLIEKFSQEQIGENIVCRVICTTGQIPIRDLSADISQVLKEKRSIKKVWTFGRNPACDYHLGNISRLSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSNQLLSQGDEITVGVGVESDILSLVIFINDKFKQCLEQNKVDRIR,NDPDTLEIYS,ALA-THR-GLN-ARG-PHE-LEU-ILE-GLU-LYS-PHE-SER-GLN-GLU-GLN-ILE-GLY-GLU-ASN-ILE-VAL-CYS-ARG-VAL-ILE-CYS-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-LEU-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-SER-ARG-LEU-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-ASN-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-GLY-VAL-GLY-VAL-GLU-SER-ASP-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-CYS-LEU-GLU-GLN-ASN-LYS-VAL-ASP-ARG-ILE-ARG,ASN-ASP-PRO-ASP-TPO-LEU-GLU-ILE-TYR-SER,151,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(=O)O)CC(=O)O)CC(C)C)CCC(=O)O)C,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,B,A,,1,1,151,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8995404243469238,0.8657586574554443,77.755126953125,83.5583267211914,0.3942893743515014,0.599683403968811,0.9008809924125672,0.8768966794013977,0.8293294906616211,0.8050271272659302,NDPDTLEIYS,Low,"(4.745, 4.866]",train
2A25,protein-peptide,Q9HB71 Q8IUQ4,VANSVLFPCKYASSGCEITLPHTEKADHEELCEFRPYSCPCPGASCKWQGSLDAVMPHLMHQHKSITTLQGEDIVFLATDINLPGAVDWVMMQSCFGFHFMLVLEKQEKYDGHQQFFAIVQLIGTRKQAENFAYRLELNGHRRRLTWEATPRSIHEGIATAIMNSDCLVFDTSIAQLFAENGNLGINVTISMC,EKPAAVVAPITTG,VAL-ALA-ASN-SER-VAL-LEU-PHE-PRO-CYS-LYS-TYR-ALA-SER-SER-GLY-CYS-GLU-ILE-THR-LEU-PRO-HIS-THR-GLU-LYS-ALA-ASP-HIS-GLU-GLU-LEU-CYS-GLU-PHE-ARG-PRO-TYR-SER-CYS-PRO-CYS-PRO-GLY-ALA-SER-CYS-LYS-TRP-GLN-GLY-SER-LEU-ASP-ALA-VAL-MET-PRO-HIS-LEU-MET-HIS-GLN-HIS-LYS-SER-ILE-THR-THR-LEU-GLN-GLY-GLU-ASP-ILE-VAL-PHE-LEU-ALA-THR-ASP-ILE-ASN-LEU-PRO-GLY-ALA-VAL-ASP-TRP-VAL-MET-MET-GLN-SER-CYS-PHE-GLY-PHE-HIS-PHE-MET-LEU-VAL-LEU-GLU-LYS-GLN-GLU-LYS-TYR-ASP-GLY-HIS-GLN-GLN-PHE-PHE-ALA-ILE-VAL-GLN-LEU-ILE-GLY-THR-ARG-LYS-GLN-ALA-GLU-ASN-PHE-ALA-TYR-ARG-LEU-GLU-LEU-ASN-GLY-HIS-ARG-ARG-ARG-LEU-THR-TRP-GLU-ALA-THR-PRO-ARG-SER-ILE-HIS-GLU-GLY-ILE-ALA-THR-ALA-ILE-MET-ASN-SER-ASP-CYS-LEU-VAL-PHE-ASP-THR-SER-ILE-ALA-GLN-LEU-PHE-ALA-GLU-ASN-GLY-ASN-LEU-GLY-ILE-ASN-VAL-THR-ILE-SER-MET-CYS,GLU-LYS-PRO-ALA-ALA-VAL-VAL-ALA-PRO-ILE-THR-THR-GLY,193,13,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C)C(C)C)C(C)C)C)C)[NH3+],Kd=24uM,4.619789,4.62,1,A,A,1,A,A,0,,B,A,,1,1,193,13,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9347177147865297,0.9004821181297302,91.33361053466795,86.9681625366211,0.3837032914161682,0.4704276919364929,0.9049352407455444,0.9170319437980652,0.8966535925865173,0.8963446021080017,EKPAAVVAPITTG,Low,"(4.606, 4.745]",val
2A3I,protein-peptide,P08235 Q15788,RALTPSPVMVLENIEPEIVYAGYDSSKPDTAENLLSTLNRLAGKQMIQVVKWAKVLPGFKNLPLEDQITLIQYSWMSLSSFALSWRSYKHTNSQFLYFAPDLVFNEEKMHQSAMYELCQGMHQISLQFVRLQLTFEEYTIMKVLLLLSTIPKDGLKSQAAFEEMRTNYIKELRKMVTKCPNNSGQSWQRFYQLTKLLDSMHDLVSDLLEFCFYTFRESHALKVEFPAMLVEIISDQLPKVESGNAKPLYFHRK,QQKSLLQQLLTE,ARG-ALA-LEU-THR-PRO-SER-PRO-VAL-MET-VAL-LEU-GLU-ASN-ILE-GLU-PRO-GLU-ILE-VAL-TYR-ALA-GLY-TYR-ASP-SER-SER-LYS-PRO-ASP-THR-ALA-GLU-ASN-LEU-LEU-SER-THR-LEU-ASN-ARG-LEU-ALA-GLY-LYS-GLN-MET-ILE-GLN-VAL-VAL-LYS-TRP-ALA-LYS-VAL-LEU-PRO-GLY-PHE-LYS-ASN-LEU-PRO-LEU-GLU-ASP-GLN-ILE-THR-LEU-ILE-GLN-TYR-SER-TRP-MET-SER-LEU-SER-SER-PHE-ALA-LEU-SER-TRP-ARG-SER-TYR-LYS-HIS-THR-ASN-SER-GLN-PHE-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-GLU-LYS-MET-HIS-GLN-SER-ALA-MET-TYR-GLU-LEU-CYS-GLN-GLY-MET-HIS-GLN-ILE-SER-LEU-GLN-PHE-VAL-ARG-LEU-GLN-LEU-THR-PHE-GLU-GLU-TYR-THR-ILE-MET-LYS-VAL-LEU-LEU-LEU-LEU-SER-THR-ILE-PRO-LYS-ASP-GLY-LEU-LYS-SER-GLN-ALA-ALA-PHE-GLU-GLU-MET-ARG-THR-ASN-TYR-ILE-LYS-GLU-LEU-ARG-LYS-MET-VAL-THR-LYS-CYS-PRO-ASN-ASN-SER-GLY-GLN-SER-TRP-GLN-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-MET-HIS-ASP-LEU-VAL-SER-ASP-LEU-LEU-GLU-PHE-CYS-PHE-TYR-THR-PHE-ARG-GLU-SER-HIS-ALA-LEU-LYS-VAL-GLU-PHE-PRO-ALA-MET-LEU-VAL-GLU-ILE-ILE-SER-ASP-GLN-LEU-PRO-LYS-VAL-GLU-SER-GLY-ASN-ALA-LYS-PRO-LEU-TYR-PHE-HIS-ARG-LYS,GLN-GLN-LYS-SER-LEU-LEU-GLN-GLN-LEU-LEU-THR-GLU,253,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](O)C)CC(C)C)CC(C)C)CCC(=O)N)CCC(=O)N)CC(C)C)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC(=O)N,IC50=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,B,A,,1,1,253,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9437488317489624,0.7725436687469482,94.56065368652344,88.28105163574219,0.3476631045341491,0.7888627052307129,0.9325268864631652,0.8797491788864136,0.9182524681091307,0.7457422614097595,QQKSLLQQLLTE,Low,"(5.959, 6.097]",train
2AQ9,protein-peptide,P0A722,MIDKSAFVHPTAIVEEGASIGANAHIGPFCIVGPHVEIGEGTVLKSHVVVNGHTKIGRDNEIYQFASIGEVNQDLKYAGEPTRVEIGDRNRIRESVTIHRGTVQGGGLTKVGSDNLLMINAHIAHDCTVGNRCILANNATLAGHVSVDDFAIIGGMTAVHQFCIIGAHVMVGGCSGVAQDVPPYVIAQGNHATPFGVNIEGLKRRGFSREAITAIRNAYKLIYRSGKTLDEVKPEIAELAETYPEVKAFTDFFARSTRGLIR,SSGWMLDPIAGKWSR,MET-ILE-ASP-LYS-SER-ALA-PHE-VAL-HIS-PRO-THR-ALA-ILE-VAL-GLU-GLU-GLY-ALA-SER-ILE-GLY-ALA-ASN-ALA-HIS-ILE-GLY-PRO-PHE-CYS-ILE-VAL-GLY-PRO-HIS-VAL-GLU-ILE-GLY-GLU-GLY-THR-VAL-LEU-LYS-SER-HIS-VAL-VAL-VAL-ASN-GLY-HIS-THR-LYS-ILE-GLY-ARG-ASP-ASN-GLU-ILE-TYR-GLN-PHE-ALA-SER-ILE-GLY-GLU-VAL-ASN-GLN-ASP-LEU-LYS-TYR-ALA-GLY-GLU-PRO-THR-ARG-VAL-GLU-ILE-GLY-ASP-ARG-ASN-ARG-ILE-ARG-GLU-SER-VAL-THR-ILE-HIS-ARG-GLY-THR-VAL-GLN-GLY-GLY-GLY-LEU-THR-LYS-VAL-GLY-SER-ASP-ASN-LEU-LEU-MET-ILE-ASN-ALA-HIS-ILE-ALA-HIS-ASP-CYS-THR-VAL-GLY-ASN-ARG-CYS-ILE-LEU-ALA-ASN-ASN-ALA-THR-LEU-ALA-GLY-HIS-VAL-SER-VAL-ASP-ASP-PHE-ALA-ILE-ILE-GLY-GLY-MET-THR-ALA-VAL-HIS-GLN-PHE-CYS-ILE-ILE-GLY-ALA-HIS-VAL-MET-VAL-GLY-GLY-CYS-SER-GLY-VAL-ALA-GLN-ASP-VAL-PRO-PRO-TYR-VAL-ILE-ALA-GLN-GLY-ASN-HIS-ALA-THR-PRO-PHE-GLY-VAL-ASN-ILE-GLU-GLY-LEU-LYS-ARG-ARG-GLY-PHE-SER-ARG-GLU-ALA-ILE-THR-ALA-ILE-ARG-ASN-ALA-TYR-LYS-LEU-ILE-TYR-ARG-SER-GLY-LYS-THR-LEU-ASP-GLU-VAL-LYS-PRO-GLU-ILE-ALA-GLU-LEU-ALA-GLU-THR-TYR-PRO-GLU-VAL-LYS-ALA-PHE-THR-ASP-PHE-PHE-ALA-ARG-SER-THR-ARG-GLY-LEU-ILE-ARG,SER-SER-GLY-TRP-MET-LEU-ASP-PRO-ILE-ALA-GLY-LYS-TRP-SER-ARG,262,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CO)Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)[NH3+])C)CC(C)C)CC(=O)O)C,Ki=50nM,7.30103,7.3,1,A,A,1,A,A,0,,X,A,,1,1,262,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8322083353996277,0.6812779307365417,93.64022064208984,94.056884765625,0.3433486521244049,0.8472275733947754,0.9384613633155824,0.8520519137382507,0.7718002796173096,0.6385844349861145,SSGWMLDPIAGKWSR,Moderate,"(7.268, 7.523]",train
2ASU,protein-peptide,P26927,VVGGHPGNSPWTVSLRNRQGQHFCGGSLVKEQWILTARQCFSSCHMPLTGYEVWLGTLFQNPQHGEPSLQRVPVAKMVCGPSGSQLVLLKLERSVTLNQRVALICLPPEWYVVPPGTKCEIAGWGETKGTGNDTVLNVALLNVISNQECNIKHRGRVRESEMCTEGLLAPVGACEGDYGGPLACFTHNSWVLEGIIIPNRVCARSRWPAVFTRVSVFVDWIHKVMRLGHHHHHH,FEKCGKRVDRLDQRRSKLR,VAL-VAL-GLY-GLY-HIS-PRO-GLY-ASN-SER-PRO-TRP-THR-VAL-SER-LEU-ARG-ASN-ARG-GLN-GLY-GLN-HIS-PHE-CYS-GLY-GLY-SER-LEU-VAL-LYS-GLU-GLN-TRP-ILE-LEU-THR-ALA-ARG-GLN-CYS-PHE-SER-SER-CYS-HIS-MET-PRO-LEU-THR-GLY-TYR-GLU-VAL-TRP-LEU-GLY-THR-LEU-PHE-GLN-ASN-PRO-GLN-HIS-GLY-GLU-PRO-SER-LEU-GLN-ARG-VAL-PRO-VAL-ALA-LYS-MET-VAL-CYS-GLY-PRO-SER-GLY-SER-GLN-LEU-VAL-LEU-LEU-LYS-LEU-GLU-ARG-SER-VAL-THR-LEU-ASN-GLN-ARG-VAL-ALA-LEU-ILE-CYS-LEU-PRO-PRO-GLU-TRP-TYR-VAL-VAL-PRO-PRO-GLY-THR-LYS-CYS-GLU-ILE-ALA-GLY-TRP-GLY-GLU-THR-LYS-GLY-THR-GLY-ASN-ASP-THR-VAL-LEU-ASN-VAL-ALA-LEU-LEU-ASN-VAL-ILE-SER-ASN-GLN-GLU-CYS-ASN-ILE-LYS-HIS-ARG-GLY-ARG-VAL-ARG-GLU-SER-GLU-MET-CYS-THR-GLU-GLY-LEU-LEU-ALA-PRO-VAL-GLY-ALA-CYS-GLU-GLY-ASP-TYR-GLY-GLY-PRO-LEU-ALA-CYS-PHE-THR-HIS-ASN-SER-TRP-VAL-LEU-GLU-GLY-ILE-ILE-ILE-PRO-ASN-ARG-VAL-CYS-ALA-ARG-SER-ARG-TRP-PRO-ALA-VAL-PHE-THR-ARG-VAL-SER-VAL-PHE-VAL-ASP-TRP-ILE-HIS-LYS-VAL-MET-ARG-LEU-GLY-HIS-HIS-HIS-HIS-HIS-HIS,PHE-GLU-LYS-CYS-GLY-LYS-ARG-VAL-ASP-ARG-LEU-ASP-GLN-ARG-ARG-SER-LYS-LEU-ARG,234,19,SC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[NH3+],Kd=1.0nM,9.0,9.0,1,A,A,1,A,A,0,,A,B,,1,1,234,19,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.8148787021636963,0.6796872019767761,91.70256805419922,88.82723999023438,0.4235282838344574,1.0421684980392456,0.910635232925415,0.8152916431427002,0.7440028190612793,0.6457860469818115,FEKCGKRVDRLDQRRSKLR,High,"(8.824, 12.12]",train
2AUC,protein-peptide,Q7RQ71 D0VWV5,KDMFNTKSSNGKLRIEDASHNARKLGLAPSSTDEKKIRDLYGDSLTYEQYLEYLTMCVHDRDNMEELIKMFSHFDNNSSGFLTKNQMKNILTTWGDALTEQEANDALNAFSSEDRINYKLFCEDIL,SLMRVQAHIRKRMVA,LYS-ASP-MSE-PHE-ASN-THR-LYS-SER-SER-ASN-GLY-LYS-LEU-ARG-ILE-GLU-ASP-ALA-SER-HIS-ASN-ALA-ARG-LYS-LEU-GLY-LEU-ALA-PRO-SER-SER-THR-ASP-GLU-LYS-LYS-ILE-ARG-ASP-LEU-TYR-GLY-ASP-SER-LEU-THR-TYR-GLU-GLN-TYR-LEU-GLU-TYR-LEU-THR-MSE-CYS-VAL-HIS-ASP-ARG-ASP-ASN-MSE-GLU-GLU-LEU-ILE-LYS-MSE-PHE-SER-HIS-PHE-ASP-ASN-ASN-SER-SER-GLY-PHE-LEU-THR-LYS-ASN-GLN-MSE-LYS-ASN-ILE-LEU-THR-THR-TRP-GLY-ASP-ALA-LEU-THR-GLU-GLN-GLU-ALA-ASN-ASP-ALA-LEU-ASN-ALA-PHE-SER-SER-GLU-ASP-ARG-ILE-ASN-TYR-LYS-LEU-PHE-CYS-GLU-ASP-ILE-LEU,SAC-LEU-MET-ARG-VAL-GLN-ALA-HIS-ILE-ARG-LYS-ARG-MET-VAL-ALA,126,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCSC)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)CC(C)C)CCSC)CCC[NH+]=C(N)N)CCC(=O)N)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N,IC50=84uM,4.075721,4.08,1,A,A,1,A,A,0,,D,A,dimer,1,1,126,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C(CO)NC(C)=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C(CO)NC(C)=O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.889979362487793,0.7420099973678589,90.53572845458984,72.6778335571289,0.404707670211792,0.8399242162704468,0.7983771562576294,0.7782087326049805,0.8463905453681946,0.7329603433609009,SLMRVQAHIRKRMVA,Low,"(3.924, 4.155]",train
2AZM,protein-peptide,P16104 Q14676,RTKLNQESTAPKVLFTGVVDARGERAVLALGGSLAGSAAEASHLVTDRIRRTVKFLCALGRGIPILSLDWLHQSRKAGFFLPPDEYVVTDPEQEKNFGFSLQDALSRARERRLLEGYEIYVTPGVQPPPPQMGEIISCCGGTYLPSMPRSYKPQRVVITCPQDFPHCSIPLRVGLPLLSPEFLLTGVLKQEAKPEAFVLSPLEMSST,KKATQASQEY,ARG-THR-LYS-LEU-ASN-GLN-GLU-SER-THR-ALA-PRO-LYS-VAL-LEU-PHE-THR-GLY-VAL-VAL-ASP-ALA-ARG-GLY-GLU-ARG-ALA-VAL-LEU-ALA-LEU-GLY-GLY-SER-LEU-ALA-GLY-SER-ALA-ALA-GLU-ALA-SER-HIS-LEU-VAL-THR-ASP-ARG-ILE-ARG-ARG-THR-VAL-LYS-PHE-LEU-CYS-ALA-LEU-GLY-ARG-GLY-ILE-PRO-ILE-LEU-SER-LEU-ASP-TRP-LEU-HIS-GLN-SER-ARG-LYS-ALA-GLY-PHE-PHE-LEU-PRO-PRO-ASP-GLU-TYR-VAL-VAL-THR-ASP-PRO-GLU-GLN-GLU-LYS-ASN-PHE-GLY-PHE-SER-LEU-GLN-ASP-ALA-LEU-SER-ARG-ALA-ARG-GLU-ARG-ARG-LEU-LEU-GLU-GLY-TYR-GLU-ILE-TYR-VAL-THR-PRO-GLY-VAL-GLN-PRO-PRO-PRO-PRO-GLN-MSE-GLY-GLU-ILE-ILE-SER-CYS-CYS-GLY-GLY-THR-TYR-LEU-PRO-SER-MSE-PRO-ARG-SER-TYR-LYS-PRO-GLN-ARG-VAL-VAL-ILE-THR-CYS-PRO-GLN-ASP-PHE-PRO-HIS-CYS-SER-ILE-PRO-LEU-ARG-VAL-GLY-LEU-PRO-LEU-LEU-SER-PRO-GLU-PHE-LEU-LEU-THR-GLY-VAL-LEU-LYS-GLN-GLU-ALA-LYS-PRO-GLU-ALA-PHE-VAL-LEU-SER-PRO-LEU-GLU-MSE-SER-SER-THR,LYS-LYS-ALA-THR-GLN-ALA-SEP-GLN-GLU-TYR,207,10,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)COP(O)(O)O)CCC(=O)N,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,C,A,,1,1,207,10,0,C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9317671060562134,0.8919405937194824,90.70726776123048,90.62440490722656,0.360315203666687,0.5688912868499756,0.9127153754234314,0.9087361097335817,0.8789262771606445,0.8605678081512451,KKATQASQEY,Low,"(5.6, 5.699]",val
2BBA,protein-peptide,P54760,HHHHHEETLLNTKLETADLKWVTFPQVDGQWEELSGLDEEQHSVRTYEVCDVQRAPGQAHWLRTGWVPRRGAVHVYATLRFTMLECLSLPRAGRSCKETFTVFYYESDADTATALTPAWMENPYIKVDTVAAEHLTRKRPGAEATGKVNVKTLRLGPLSKAGFYLAFQDQGACMALLSLHLFYKK,TNYLFSPNGPIARAW,HIS-HIS-HIS-HIS-HIS-GLU-GLU-THR-LEU-LEU-ASN-THR-LYS-LEU-GLU-THR-ALA-ASP-LEU-LYS-TRP-VAL-THR-PHE-PRO-GLN-VAL-ASP-GLY-GLN-TRP-GLU-GLU-LEU-SER-GLY-LEU-ASP-GLU-GLU-GLN-HIS-SER-VAL-ARG-THR-TYR-GLU-VAL-CYS-ASP-VAL-GLN-ARG-ALA-PRO-GLY-GLN-ALA-HIS-TRP-LEU-ARG-THR-GLY-TRP-VAL-PRO-ARG-ARG-GLY-ALA-VAL-HIS-VAL-TYR-ALA-THR-LEU-ARG-PHE-THR-MET-LEU-GLU-CYS-LEU-SER-LEU-PRO-ARG-ALA-GLY-ARG-SER-CYS-LYS-GLU-THR-PHE-THR-VAL-PHE-TYR-TYR-GLU-SER-ASP-ALA-ASP-THR-ALA-THR-ALA-LEU-THR-PRO-ALA-TRP-MET-GLU-ASN-PRO-TYR-ILE-LYS-VAL-ASP-THR-VAL-ALA-ALA-GLU-HIS-LEU-THR-ARG-LYS-ARG-PRO-GLY-ALA-GLU-ALA-THR-GLY-LYS-VAL-ASN-VAL-LYS-THR-LEU-ARG-LEU-GLY-PRO-LEU-SER-LYS-ALA-GLY-PHE-TYR-LEU-ALA-PHE-GLN-ASP-GLN-GLY-ALA-CYS-MET-ALA-LEU-LEU-SER-LEU-HIS-LEU-PHE-TYR-LYS-LYS,THR-ASN-TYR-LEU-PHE-SER-PRO-ASN-GLY-PRO-ILE-ALA-ARG-ALA-TRP,185,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C)CCC[NH+]=C(N)N)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1ccc(cc1)O)CC(C)C)Cc1ccccc1)CO)CC(=O)N)C,Kd=70nM,7.154902,7.15,1,A,A,1,A,A,0,,P,A,,1,1,185,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.9066793322563172,0.726159930229187,90.47966766357422,86.94567108154297,0.422248363494873,0.8367016911506653,0.9152445197105408,0.8368645310401917,0.8576629757881165,0.6984838247299194,TNYLFSPNGPIARAW,Moderate,"(7.049, 7.268]",train
2BGR,protein-peptide,P12506 P27487,NKGTDDATADSRKTYTLTDYLKNTYRLKLYSLRWISDHEYLYKQENNILVFNAEYGNSSVFLENSTFDEFGHSINDYSISPDGQFILLEYNYVKQWRHSYTASYDIYDLNKRQLITEERIPNNTQWVTWSPVGHKLAYVWNNDIYVKIEPNLPSYRITWTGKEDIIYNGITDWVYEEEVFSAYSALWWSPNGTFLAYAQFNDTEVPLIEYSFYSDESLQYPKTVRVPYPKAGAVNPTVKFFVVNTDSLSSVTNATSIQITAPASMLIGDHYLCDVTWATQERISLQWLRRIQNYSVMDICDYDESSGRWNCLVARQHIEMSTTGWVGRFRPSEPHFTLDGNSFYKIISNEEGYRHICYFQIDKKDCTFITKGTWEVIGIEALTSDYLYYISNEYKGMPGGRNLYKIQLSDYTKVTCLSCELNPERCQYYSVSFSKEAKYYQLRCSGPGLPLYTLHSSVNDKGLRVLEDNSALDKMLQNVQMPSKKLDFIILNETKFWYQMILPPHFDKSKKYPLLLDVYAGPCSQKADTVFRLNWATYLASTENIIVASFDGRGSGYQGDKIMHAINRRLGTFEVEDQIEAARQFSKMGFVDNKRIAIWGWSYGGYVTSMVLGSGSGVFKCGIAVAPVSRWEYYDSVYTERYMGLPTPEDNLDHYRNSTVMSRAENFKQVEYLLIHGTADDNVHFQQSAQISKALVDVGVDFQAMWYTDEDHGIASSTAHQHIYTHMSHFIKQCFSLP,MDPVDPNIE,ASN-LYS-GLY-THR-ASP-ASP-ALA-THR-ALA-ASP-SER-ARG-LYS-THR-TYR-THR-LEU-THR-ASP-TYR-LEU-LYS-ASN-THR-TYR-ARG-LEU-LYS-LEU-TYR-SER-LEU-ARG-TRP-ILE-SER-ASP-HIS-GLU-TYR-LEU-TYR-LYS-GLN-GLU-ASN-ASN-ILE-LEU-VAL-PHE-ASN-ALA-GLU-TYR-GLY-ASN-SER-SER-VAL-PHE-LEU-GLU-ASN-SER-THR-PHE-ASP-GLU-PHE-GLY-HIS-SER-ILE-ASN-ASP-TYR-SER-ILE-SER-PRO-ASP-GLY-GLN-PHE-ILE-LEU-LEU-GLU-TYR-ASN-TYR-VAL-LYS-GLN-TRP-ARG-HIS-SER-TYR-THR-ALA-SER-TYR-ASP-ILE-TYR-ASP-LEU-ASN-LYS-ARG-GLN-LEU-ILE-THR-GLU-GLU-ARG-ILE-PRO-ASN-ASN-THR-GLN-TRP-VAL-THR-TRP-SER-PRO-VAL-GLY-HIS-LYS-LEU-ALA-TYR-VAL-TRP-ASN-ASN-ASP-ILE-TYR-VAL-LYS-ILE-GLU-PRO-ASN-LEU-PRO-SER-TYR-ARG-ILE-THR-TRP-THR-GLY-LYS-GLU-ASP-ILE-ILE-TYR-ASN-GLY-ILE-THR-ASP-TRP-VAL-TYR-GLU-GLU-GLU-VAL-PHE-SER-ALA-TYR-SER-ALA-LEU-TRP-TRP-SER-PRO-ASN-GLY-THR-PHE-LEU-ALA-TYR-ALA-GLN-PHE-ASN-ASP-THR-GLU-VAL-PRO-LEU-ILE-GLU-TYR-SER-PHE-TYR-SER-ASP-GLU-SER-LEU-GLN-TYR-PRO-LYS-THR-VAL-ARG-VAL-PRO-TYR-PRO-LYS-ALA-GLY-ALA-VAL-ASN-PRO-THR-VAL-LYS-PHE-PHE-VAL-VAL-ASN-THR-ASP-SER-LEU-SER-SER-VAL-THR-ASN-ALA-THR-SER-ILE-GLN-ILE-THR-ALA-PRO-ALA-SER-MET-LEU-ILE-GLY-ASP-HIS-TYR-LEU-CYS-ASP-VAL-THR-TRP-ALA-THR-GLN-GLU-ARG-ILE-SER-LEU-GLN-TRP-LEU-ARG-ARG-ILE-GLN-ASN-TYR-SER-VAL-MET-ASP-ILE-CYS-ASP-TYR-ASP-GLU-SER-SER-GLY-ARG-TRP-ASN-CYS-LEU-VAL-ALA-ARG-GLN-HIS-ILE-GLU-MET-SER-THR-THR-GLY-TRP-VAL-GLY-ARG-PHE-ARG-PRO-SER-GLU-PRO-HIS-PHE-THR-LEU-ASP-GLY-ASN-SER-PHE-TYR-LYS-ILE-ILE-SER-ASN-GLU-GLU-GLY-TYR-ARG-HIS-ILE-CYS-TYR-PHE-GLN-ILE-ASP-LYS-LYS-ASP-CYS-THR-PHE-ILE-THR-LYS-GLY-THR-TRP-GLU-VAL-ILE-GLY-ILE-GLU-ALA-LEU-THR-SER-ASP-TYR-LEU-TYR-TYR-ILE-SER-ASN-GLU-TYR-LYS-GLY-MET-PRO-GLY-GLY-ARG-ASN-LEU-TYR-LYS-ILE-GLN-LEU-SER-ASP-TYR-THR-LYS-VAL-THR-CYS-LEU-SER-CYS-GLU-LEU-ASN-PRO-GLU-ARG-CYS-GLN-TYR-TYR-SER-VAL-SER-PHE-SER-LYS-GLU-ALA-LYS-TYR-TYR-GLN-LEU-ARG-CYS-SER-GLY-PRO-GLY-LEU-PRO-LEU-TYR-THR-LEU-HIS-SER-SER-VAL-ASN-ASP-LYS-GLY-LEU-ARG-VAL-LEU-GLU-ASP-ASN-SER-ALA-LEU-ASP-LYS-MET-LEU-GLN-ASN-VAL-GLN-MET-PRO-SER-LYS-LYS-LEU-ASP-PHE-ILE-ILE-LEU-ASN-GLU-THR-LYS-PHE-TRP-TYR-GLN-MET-ILE-LEU-PRO-PRO-HIS-PHE-ASP-LYS-SER-LYS-LYS-TYR-PRO-LEU-LEU-LEU-ASP-VAL-TYR-ALA-GLY-PRO-CYS-SER-GLN-LYS-ALA-ASP-THR-VAL-PHE-ARG-LEU-ASN-TRP-ALA-THR-TYR-LEU-ALA-SER-THR-GLU-ASN-ILE-ILE-VAL-ALA-SER-PHE-ASP-GLY-ARG-GLY-SER-GLY-TYR-GLN-GLY-ASP-LYS-ILE-MET-HIS-ALA-ILE-ASN-ARG-ARG-LEU-GLY-THR-PHE-GLU-VAL-GLU-ASP-GLN-ILE-GLU-ALA-ALA-ARG-GLN-PHE-SER-LYS-MET-GLY-PHE-VAL-ASP-ASN-LYS-ARG-ILE-ALA-ILE-TRP-GLY-TRP-SER-TYR-GLY-GLY-TYR-VAL-THR-SER-MET-VAL-LEU-GLY-SER-GLY-SER-GLY-VAL-PHE-LYS-CYS-GLY-ILE-ALA-VAL-ALA-PRO-VAL-SER-ARG-TRP-GLU-TYR-TYR-ASP-SER-VAL-TYR-THR-GLU-ARG-TYR-MET-GLY-LEU-PRO-THR-PRO-GLU-ASP-ASN-LEU-ASP-HIS-TYR-ARG-ASN-SER-THR-VAL-MET-SER-ARG-ALA-GLU-ASN-PHE-LYS-GLN-VAL-GLU-TYR-LEU-LEU-ILE-HIS-GLY-THR-ALA-ASP-ASP-ASN-VAL-HIS-PHE-GLN-GLN-SER-ALA-GLN-ILE-SER-LYS-ALA-LEU-VAL-ASP-VAL-GLY-VAL-ASP-PHE-GLN-ALA-MET-TRP-TYR-THR-ASP-GLU-ASP-HIS-GLY-ILE-ALA-SER-SER-THR-ALA-HIS-GLN-HIS-ILE-TYR-THR-HIS-MET-SER-HIS-PHE-ILE-LYS-GLN-CYS-PHE-SER-LEU-PRO,MET-ASP-PRO-VAL-ASP-PRO-ASN-ILE-GLU,738,9,CSCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C=O)CC(=O)O)[NH3+],Ki=250uM,3.60206,3.6,1,A,A,1,A,A,0,,Y,A,,1,1,738,9,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCSC)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(=O)O,0.8870169520378113,0.8258675932884216,89.02259826660156,88.97444915771484,0.3719964027404785,0.5702847838401794,0.9313270449638368,0.9182816743850708,0.8592057824134827,0.7942951917648315,MDPVDPNIE,Low,"(3.548, 3.924]",train
2BR8,protein-peptide,P50984 Q8WSF8,QANLMRLKSDLFNRSPMYPGPTKDDPLTVTLGFTLQDIVKVDSSTNEVDLVYYEQQRWKLNSLMWDPNEYGNITDFRTSAADIWTPDITAYSSTRPVQVLSPQIAVVTHDGSVMFIPAQRLSFMCDPTGVDSEEGVTCAVKFGSWVYSGFEIDLKTDTDQVDLSSYYASSKYEILSATQTRQVQHYSCCPEPYIDVNLVVKFRERRAGNGFFRNLFD,GCCSLPPCALNNPKYC,GLN-ALA-ASN-LEU-MET-ARG-LEU-LYS-SER-ASP-LEU-PHE-ASN-ARG-SER-PRO-MET-TYR-PRO-GLY-PRO-THR-LYS-ASP-ASP-PRO-LEU-THR-VAL-THR-LEU-GLY-PHE-THR-LEU-GLN-ASP-ILE-VAL-LYS-VAL-ASP-SER-SER-THR-ASN-GLU-VAL-ASP-LEU-VAL-TYR-TYR-GLU-GLN-GLN-ARG-TRP-LYS-LEU-ASN-SER-LEU-MET-TRP-ASP-PRO-ASN-GLU-TYR-GLY-ASN-ILE-THR-ASP-PHE-ARG-THR-SER-ALA-ALA-ASP-ILE-TRP-THR-PRO-ASP-ILE-THR-ALA-TYR-SER-SER-THR-ARG-PRO-VAL-GLN-VAL-LEU-SER-PRO-GLN-ILE-ALA-VAL-VAL-THR-HIS-ASP-GLY-SER-VAL-MET-PHE-ILE-PRO-ALA-GLN-ARG-LEU-SER-PHE-MET-CYS-ASP-PRO-THR-GLY-VAL-ASP-SER-GLU-GLU-GLY-VAL-THR-CYS-ALA-VAL-LYS-PHE-GLY-SER-TRP-VAL-TYR-SER-GLY-PHE-GLU-ILE-ASP-LEU-LYS-THR-ASP-THR-ASP-GLN-VAL-ASP-LEU-SER-SER-TYR-TYR-ALA-SER-SER-LYS-TYR-GLU-ILE-LEU-SER-ALA-THR-GLN-THR-ARG-GLN-VAL-GLN-HIS-TYR-SER-CYS-CYS-PRO-GLU-PRO-TYR-ILE-ASP-VAL-ASN-LEU-VAL-VAL-LYS-PHE-ARG-GLU-ARG-ARG-ALA-GLY-ASN-GLY-PHE-PHE-ARG-ASN-LEU-PHE-ASP,GLY-CYS-CYS-SER-LEU-PRO-PRO-CYS-ALA-LEU-ASN-ASN-PRO-LYS-TYR-CYS-NH2,217,17,[NH3+]CCCC[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CSSC[C@@H](C(=O)N[C@@H](CSSC[C@H](NC(=O)[C@@H](NC1=O)Cc1ccc(cc1)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1[C@H](C(=O)N2)CCC1)NC(=O)C[NH3+],Kd=32.6nM,7.486782,7.49,1,A,A,1,A,A,0,,F,A,dimer,1,1,217,17,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)O,0.850682258605957,0.6782525181770325,84.72299194335938,84.8731918334961,0.4436670243740082,0.9475862979888916,0.8684644103050232,0.7889246344566345,0.779176652431488,0.6246628165245056,GCCSLPPCALNNPKYC,Moderate,"(7.268, 7.523]",train
2BYP,protein-peptide,P50983 Q8WSF8,DDDDKLHSQANLMRLKSDLFNRSPMYPGPTKDDPLTVTLGFTLQDIVKADSSTNEVDLVYYEQQRWKLNSLMWDPNEYGNITDFRTSAADIWTPDITAYSSTRPVQVLSPQIAVVTHDGSVMFIPAQRLSFMCDPTGVDSEEGATCAVKFGSWVYSGFEIDLKTDTDQVDLSSYYASSKYEILSATQTRQVQHYSCCPEPYIDVNLVVKFRERR,GCCSDPRCAWRC,ASP-ASP-ASP-ASP-LYS-LEU-HIS-SER-GLN-ALA-ASN-LEU-MET-ARG-LEU-LYS-SER-ASP-LEU-PHE-ASN-ARG-SER-PRO-MET-TYR-PRO-GLY-PRO-THR-LYS-ASP-ASP-PRO-LEU-THR-VAL-THR-LEU-GLY-PHE-THR-LEU-GLN-ASP-ILE-VAL-LYS-ALA-ASP-SER-SER-THR-ASN-GLU-VAL-ASP-LEU-VAL-TYR-TYR-GLU-GLN-GLN-ARG-TRP-LYS-LEU-ASN-SER-LEU-MET-TRP-ASP-PRO-ASN-GLU-TYR-GLY-ASN-ILE-THR-ASP-PHE-ARG-THR-SER-ALA-ALA-ASP-ILE-TRP-THR-PRO-ASP-ILE-THR-ALA-TYR-SER-SER-THR-ARG-PRO-VAL-GLN-VAL-LEU-SER-PRO-GLN-ILE-ALA-VAL-VAL-THR-HIS-ASP-GLY-SER-VAL-MET-PHE-ILE-PRO-ALA-GLN-ARG-LEU-SER-PHE-MET-CYS-ASP-PRO-THR-GLY-VAL-ASP-SER-GLU-GLU-GLY-ALA-THR-CYS-ALA-VAL-LYS-PHE-GLY-SER-TRP-VAL-TYR-SER-GLY-PHE-GLU-ILE-ASP-LEU-LYS-THR-ASP-THR-ASP-GLN-VAL-ASP-LEU-SER-SER-TYR-TYR-ALA-SER-SER-LYS-TYR-GLU-ILE-LEU-SER-ALA-THR-GLN-THR-ARG-GLN-VAL-GLN-HIS-TYR-SER-CYS-CYS-PRO-GLU-PRO-TYR-ILE-ASP-VAL-ASN-LEU-VAL-VAL-LYS-PHE-ARG-GLU-ARG-ARG,GLY-CYS-CYS-SER-ASP-PRO-ARG-CYS-ALA-TRP-ARG-CY3,214,12,[NH3+]CC(=O)N[C@H]1CSSC[C@@H]2NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H]3N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CSSC[C@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)C)Cc1c[nH]c2c1cccc2)C(=O)N)CO)CC(=O)O)CCC3,Kd=0.88nM,9.055517,9.06,1,A,A,1,A,A,0,,F,A,dimer,1,1,214,12,0,C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CS)C(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC(CS)C(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.874229371547699,0.714284360408783,89.32485961914062,89.12838745117188,0.3941450715065002,0.8014464974403381,0.896287739276886,0.8431898951530457,0.8355288505554199,0.6820579767227173,GCCSDPRCAWRC,High,"(8.824, 12.12]",train
2BZ8,protein-peptide,Q13191 Q96B97,MVEAIVEFDYQAQHDDELTISVGEIITNIRKEDGGWWEGQINGRRGLFPDNFVREIKK,PARPPKPRPRR,MET-VAL-GLU-ALA-ILE-VAL-GLU-PHE-ASP-TYR-GLN-ALA-GLN-HIS-ASP-ASP-GLU-LEU-THR-ILE-SER-VAL-GLY-GLU-ILE-ILE-THR-ASN-ILE-ARG-LYS-GLU-ASP-GLY-GLY-TRP-TRP-GLU-GLY-GLN-ILE-ASN-GLY-ARG-ARG-GLY-LEU-PHE-PRO-ASP-ASN-PHE-VAL-ARG-GLU-ILE-LYS-LYS,PRO-ALA-ARG-PRO-PRO-LYS-PRO-ARG-PRO-ARG-ARG,58,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CCC[NH+]=C(N)N,Kd=2.5uM,5.60206,5.6,1,A,A,1,A,A,0,,C,A,dimer,1,1,58,11,0,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8094625473022461,0.802408754825592,91.59810638427734,90.19829559326172,0.3482715189456939,0.574504554271698,0.8676062226295471,0.8464124798774719,0.6952890157699585,0.7914078235626221,PARPPKPRPRR,Low,"(5.6, 5.699]",train
2C1N,protein-peptide,P68431 P63104,MGSSHHHHHHSQDMDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,ARKSTGGK,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,ALA-ARG-LYS-SEP-THR-GLY-GLY-LYS,258,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)O)CCCC[NH3+])[C@H](O)C)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=78.1uM,4.107349,4.11,1,A,A,1,A,A,0,,C,A,,0,1,258,8,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)O,0.9175613522529602,0.9300248622894288,83.54310607910156,83.51707458496094,0.4035106003284454,0.5219193696975708,0.8768587112426758,0.8825350999832153,0.8548986315727234,0.8837577104568481,ARKSTGGK,Low,"(3.924, 4.155]",train
2C2L,protein-peptide,Q9WUD1 P07900,SPSAQELKEQGNRLFVGRKYPEAAACYGRAITRNPLVAVYYTNRALCYLKMQQPEQALADCRRALELDGQSVKAHFFLGQCQLEMESYDEAIANLQRAYSLAKEQRLNFGDDIPSALRIAKKKRWNSIEERRIHQESELHSYLTRLIAAERERELEECQRNHEGHEDDGHIRAQQACIEAKHDKYMADMDELFSQVDEKRKKRDIPDYLCGKISFELMREPCITPSGITYDRKDIEEHLQRVGHFNPVTRSPLTQEQLIPNLAMKEVIDAFISENGWVEDY,DTSRMEEVD,SER-PRO-SER-ALA-GLN-GLU-LEU-LYS-GLU-GLN-GLY-ASN-ARG-LEU-PHE-VAL-GLY-ARG-LYS-TYR-PRO-GLU-ALA-ALA-ALA-CYS-TYR-GLY-ARG-ALA-ILE-THR-ARG-ASN-PRO-LEU-VAL-ALA-VAL-TYR-TYR-THR-ASN-ARG-ALA-LEU-CYS-TYR-LEU-LYS-MET-GLN-GLN-PRO-GLU-GLN-ALA-LEU-ALA-ASP-CYS-ARG-ARG-ALA-LEU-GLU-LEU-ASP-GLY-GLN-SER-VAL-LYS-ALA-HIS-PHE-PHE-LEU-GLY-GLN-CYS-GLN-LEU-GLU-MET-GLU-SER-TYR-ASP-GLU-ALA-ILE-ALA-ASN-LEU-GLN-ARG-ALA-TYR-SER-LEU-ALA-LYS-GLU-GLN-ARG-LEU-ASN-PHE-GLY-ASP-ASP-ILE-PRO-SER-ALA-LEU-ARG-ILE-ALA-LYS-LYS-LYS-ARG-TRP-ASN-SER-ILE-GLU-GLU-ARG-ARG-ILE-HIS-GLN-GLU-SER-GLU-LEU-HIS-SER-TYR-LEU-THR-ARG-LEU-ILE-ALA-ALA-GLU-ARG-GLU-ARG-GLU-LEU-GLU-GLU-CYS-GLN-ARG-ASN-HIS-GLU-GLY-HIS-GLU-ASP-ASP-GLY-HIS-ILE-ARG-ALA-GLN-GLN-ALA-CYS-ILE-GLU-ALA-LYS-HIS-ASP-LYS-TYR-MET-ALA-ASP-MET-ASP-GLU-LEU-PHE-SER-GLN-VAL-ASP-GLU-LYS-ARG-LYS-LYS-ARG-ASP-ILE-PRO-ASP-TYR-LEU-CYS-GLY-LYS-ILE-SER-PHE-GLU-LEU-MET-ARG-GLU-PRO-CYS-ILE-THR-PRO-SER-GLY-ILE-THR-TYR-ASP-ARG-LYS-ASP-ILE-GLU-GLU-HIS-LEU-GLN-ARG-VAL-GLY-HIS-PHE-ASN-PRO-VAL-THR-ARG-SER-PRO-LEU-THR-GLN-GLU-GLN-LEU-ILE-PRO-ASN-LEU-ALA-MET-LYS-GLU-VAL-ILE-ASP-ALA-PHE-ILE-SER-GLU-ASN-GLY-TRP-VAL-GLU-ASP-TYR,ASP-THR-SER-ARG-MET-GLU-GLU-VAL-ASP,281,9,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(=O)O)[NH3+])CO)CCC[NH+]=C(N)N,Kd=2.8uM,5.552842,5.55,1,A,A,1,A,A,0,,E,A,,1,1,281,9,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,0.9280741214752196,0.894944965839386,73.86656188964844,75.67797088623047,0.3917028605937958,0.5372632741928101,0.8273205161094666,0.8731335401535034,0.9338659644126892,0.9003978371620178,DTSRMEEVD,Low,"(5.463, 5.6]",train
2CE9,protein-peptide,Q04724,DYFQGAMGSKPAYSFHVTADGQMQPVPFPPDALIGPGIPRHARQINTLNHGEVVCAVTISNPTRHVYTGGKGCVKVWDISHPGNKSPVSQLDCLNRDNYIRSCKLLPDGCTLIVGGEASTLSIWDLAAPTPRIKAELTSSAPACYALAISPDSKVCFSCCSDGNIAVWDLHNQTLVRQFQGHTDGASCIDISNDGTKLWTGGLDNTVRSWDLREGRQLQQHDFTSQIFSLGYCPTGEWLAVGMESSNVEVLHVNKPDKYQLHLHESCVLSLKFAYCGKWFVSTGKDNLLNAWRTPYGASIFQSKESSSVLSCDISVDDKYIVTGSGDKKATVYEVIY,MWRPW,ASP-TYR-PHE-GLN-GLY-ALA-MET-GLY-SER-LYS-PRO-ALA-TYR-SER-PHE-HIS-VAL-THR-ALA-ASP-GLY-GLN-MET-GLN-PRO-VAL-PRO-PHE-PRO-PRO-ASP-ALA-LEU-ILE-GLY-PRO-GLY-ILE-PRO-ARG-HIS-ALA-ARG-GLN-ILE-ASN-THR-LEU-ASN-HIS-GLY-GLU-VAL-VAL-CYS-ALA-VAL-THR-ILE-SER-ASN-PRO-THR-ARG-HIS-VAL-TYR-THR-GLY-GLY-LYS-GLY-CYS-VAL-LYS-VAL-TRP-ASP-ILE-SER-HIS-PRO-GLY-ASN-LYS-SER-PRO-VAL-SER-GLN-LEU-ASP-CYS-LEU-ASN-ARG-ASP-ASN-TYR-ILE-ARG-SER-CYS-LYS-LEU-LEU-PRO-ASP-GLY-CYS-THR-LEU-ILE-VAL-GLY-GLY-GLU-ALA-SER-THR-LEU-SER-ILE-TRP-ASP-LEU-ALA-ALA-PRO-THR-PRO-ARG-ILE-LYS-ALA-GLU-LEU-THR-SER-SER-ALA-PRO-ALA-CYS-TYR-ALA-LEU-ALA-ILE-SER-PRO-ASP-SER-LYS-VAL-CYS-PHE-SER-CYS-CYS-SER-ASP-GLY-ASN-ILE-ALA-VAL-TRP-ASP-LEU-HIS-ASN-GLN-THR-LEU-VAL-ARG-GLN-PHE-GLN-GLY-HIS-THR-ASP-GLY-ALA-SER-CYS-ILE-ASP-ILE-SER-ASN-ASP-GLY-THR-LYS-LEU-TRP-THR-GLY-GLY-LEU-ASP-ASN-THR-VAL-ARG-SER-TRP-ASP-LEU-ARG-GLU-GLY-ARG-GLN-LEU-GLN-GLN-HIS-ASP-PHE-THR-SER-GLN-ILE-PHE-SER-LEU-GLY-TYR-CYS-PRO-THR-GLY-GLU-TRP-LEU-ALA-VAL-GLY-MET-GLU-SER-SER-ASN-VAL-GLU-VAL-LEU-HIS-VAL-ASN-LYS-PRO-ASP-LYS-TYR-GLN-LEU-HIS-LEU-HIS-GLU-SER-CYS-VAL-LEU-SER-LEU-LYS-PHE-ALA-TYR-CYS-GLY-LYS-TRP-PHE-VAL-SER-THR-GLY-LYS-ASP-ASN-LEU-LEU-ASN-ALA-TRP-ARG-THR-PRO-TYR-GLY-ALA-SER-ILE-PHE-GLN-SER-LYS-GLU-SER-SER-SER-VAL-LEU-SER-CYS-ASP-ILE-SER-VAL-ASP-ASP-LYS-TYR-ILE-VAL-THR-GLY-SER-GLY-ASP-LYS-LYS-ALA-THR-VAL-TYR-GLU-VAL-ILE-TYR,MET-TRP-ARG-PRO-TRP,337,5,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2)[NH3+],Kd=0.93uM,6.031517,6.03,1,A,A,1,A,A,0,,X,A,,1,1,337,5,0,CSCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.9529510736465454,0.909626841545105,92.4186782836914,94.05611419677734,0.335206001996994,0.4601143002510071,0.944164514541626,0.9387102723121644,0.9460102319717408,0.902355968952179,MWRPW,Low,"(5.959, 6.097]",val
2CI9,protein-peptide,B7UM99 P16333,GPLGSPWYYGKVTRHQAEMALNERGHEGDFLIRDSESSPNDFSVSLKAQGKNKHFKVQLKETVYCIGQRKFSTMEELVEHYKKAPIFTSEQGEKLYLVKHLS,EEHIYDEVAADP,GLY-PRO-LEU-GLY-SER-PRO-TRP-TYR-TYR-GLY-LYS-VAL-THR-ARG-HIS-GLN-ALA-GLU-MET-ALA-LEU-ASN-GLU-ARG-GLY-HIS-GLU-GLY-ASP-PHE-LEU-ILE-ARG-ASP-SER-GLU-SER-SER-PRO-ASN-ASP-PHE-SER-VAL-SER-LEU-LYS-ALA-GLN-GLY-LYS-ASN-LYS-HIS-PHE-LYS-VAL-GLN-LEU-LYS-GLU-THR-VAL-TYR-CYS-ILE-GLY-GLN-ARG-LYS-PHE-SER-THR-MET-GLU-GLU-LEU-VAL-GLU-HIS-TYR-LYS-LYS-ALA-PRO-ILE-PHE-THR-SER-GLU-GLN-GLY-GLU-LYS-LEU-TYR-LEU-VAL-LYS-HIS-LEU-SER,GLU-GLU-HIS-ILE-PTR-ASP-GLU-VAL-ALA-ALA-ASP-PRO,102,12,CC[C@@H]([C@@H](/[C](=N/[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)C)C(C)C)CCC(=O)O)CC(=O)O)Cc1ccc(cc1)OP(O)(O)O)/O)NC(=O)[C@H](Cc1[nH]cnc1)[NH3+])C,Kd=60nM,7.221849,7.22,1,A,A,1,A,A,0,,L,A,,1,1,102,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.9606049060821532,0.7952231168746948,96.65648651123048,94.6222686767578,0.3195164799690246,0.6794751286506653,0.9249013662338256,0.8603752255439758,0.9037413597106934,0.7789350748062134,EEHIYDEVAADP,Moderate,"(7.049, 7.268]",val
2CIA,protein-peptide,B7UM99 O43639,GPLGSEWYYGNVTRHQAECALNERGVEGDFLIRDSESSPSDFSVSLKASGKNKHFKVQLVDNVYCIGQRRFHTMDELVEHYKKAPIFTSEHGEKLYLVRALQ,HIYDEVAADP,GLY-PRO-LEU-GLY-SER-GLU-TRP-TYR-TYR-GLY-ASN-VAL-THR-ARG-HIS-GLN-ALA-GLU-CYS-ALA-LEU-ASN-GLU-ARG-GLY-VAL-GLU-GLY-ASP-PHE-LEU-ILE-ARG-ASP-SER-GLU-SER-SER-PRO-SER-ASP-PHE-SER-VAL-SER-LEU-LYS-ALA-SER-GLY-LYS-ASN-LYS-HIS-PHE-LYS-VAL-GLN-LEU-VAL-ASP-ASN-VAL-TYR-CYS-ILE-GLY-GLN-ARG-ARG-PHE-HIS-THR-MET-ASP-GLU-LEU-VAL-GLU-HIS-TYR-LYS-LYS-ALA-PRO-ILE-PHE-THR-SER-GLU-HIS-GLY-GLU-LYS-LEU-TYR-LEU-VAL-ARG-ALA-LEU-GLN,ACE-HIS-ILE-PTR-ASP-GLU-VAL-ALA-ALA-ASP-PRO,102,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)C)C(C)C)CCC(=O)O)CC(=O)O)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@H](Cc1[nH]cnc1)NC(=O)C)C,Kd=370nM,6.431798,6.43,1,A,A,1,A,A,0,,L,A,,1,1,102,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)C(C)C,0.9153578281402588,0.788343608379364,97.25516510009766,94.35443878173828,0.3199655711650848,0.6517244577407837,0.931820034980774,0.866919219493866,0.8554387092590332,0.7686997056007385,HIYDEVAADP,Low,"(6.398, 6.523]",train
2CV3,protein-peptide,P00772,VVGGTEAQRNSWPSQISLQYRSGSSWAHTCGGTLIRQNWVMTAAHCVDRELTFRVVVGEHNLNQNDGTEQYVGVQKIVVHPYWNTDDVAAGYDIALLRLAQSVTLNSYVQLGVLPRAGTILANNSPCYITGWGLTRTNGQLAQTLQQAYLPTVDYAICSSSSYWGSTVKNSMVCAGGDGVRSGCQGDSGGPLHCLVNGQYAVHGVTSFVSRLGCNVTRKPTVFTRVSAYISWINNVIASN,TTLKFPSDWDD,VAL-VAL-GLY-GLY-THR-GLU-ALA-GLN-ARG-ASN-SER-TRP-PRO-SER-GLN-ILE-SER-LEU-GLN-TYR-ARG-SER-GLY-SER-SER-TRP-ALA-HIS-THR-CYS-GLY-GLY-THR-LEU-ILE-ARG-GLN-ASN-TRP-VAL-MET-THR-ALA-ALA-HIS-CYS-VAL-ASP-ARG-GLU-LEU-THR-PHE-ARG-VAL-VAL-VAL-GLY-GLU-HIS-ASN-LEU-ASN-GLN-ASN-ASP-GLY-THR-GLU-GLN-TYR-VAL-GLY-VAL-GLN-LYS-ILE-VAL-VAL-HIS-PRO-TYR-TRP-ASN-THR-ASP-ASP-VAL-ALA-ALA-GLY-TYR-ASP-ILE-ALA-LEU-LEU-ARG-LEU-ALA-GLN-SER-VAL-THR-LEU-ASN-SER-TYR-VAL-GLN-LEU-GLY-VAL-LEU-PRO-ARG-ALA-GLY-THR-ILE-LEU-ALA-ASN-ASN-SER-PRO-CYS-TYR-ILE-THR-GLY-TRP-GLY-LEU-THR-ARG-THR-ASN-GLY-GLN-LEU-ALA-GLN-THR-LEU-GLN-GLN-ALA-TYR-LEU-PRO-THR-VAL-ASP-TYR-ALA-ILE-CYS-SER-SER-SER-SER-TYR-TRP-GLY-SER-THR-VAL-LYS-ASN-SER-MET-VAL-CYS-ALA-GLY-GLY-ASP-GLY-VAL-ARG-SER-GLY-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-HIS-CYS-LEU-VAL-ASN-GLY-GLN-TYR-ALA-VAL-HIS-GLY-VAL-THR-SER-PHE-VAL-SER-ARG-LEU-GLY-CYS-ASN-VAL-THR-ARG-LYS-PRO-THR-VAL-PHE-THR-ARG-VAL-SER-ALA-TYR-ILE-SER-TRP-ILE-ASN-ASN-VAL-ILE-ALA-SER-ASN,THR-THR-LEU-LYS-PHE-PRO-SER-ASP-TRP-ASP-ASP,240,11,CC(C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])[C@@H](C)OC(=O)C[C@@H]2NC(=O)[C@H]3NC(=O)[C@H]4N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCCCNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)Cc1c[nH]c2c1cccc2)CC(=O)OC3)C(=O)O)Cc1ccccc1)CCC4)C,IC50=0.27uM,6.568636,6.57,1,A,A,1,A,A,0,,B,A,,1,1,240,11,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8358246088027954,0.8653095960617065,95.0414581298828,95.41883087158205,0.3509821891784668,0.5491247177124023,0.9488855004310608,0.9291920065879822,0.7801689505577087,0.849338948726654,TTLKFPSDWDD,Low,"(6.523, 6.696]",train
2D1X,protein-peptide,Q14247 Q9ULH1,GPLGSENDLGITAVALYDYQAAGDDEISFDPDDIITNIEMIDDGWWRGVCKGRYGLFPANYVELRQ,SKKRPPPPPPGHKRT,GLY-PRO-LEU-GLY-SER-GLU-ASN-ASP-LEU-GLY-ILE-THR-ALA-VAL-ALA-LEU-TYR-ASP-TYR-GLN-ALA-ALA-GLY-ASP-ASP-GLU-ILE-SER-PHE-ASP-PRO-ASP-ASP-ILE-ILE-THR-ASN-ILE-GLU-MET-ILE-ASP-ASP-GLY-TRP-TRP-ARG-GLY-VAL-CYS-LYS-GLY-ARG-TYR-GLY-LEU-PHE-PRO-ALA-ASN-TYR-VAL-GLU-LEU-ARG-GLN,SER-LYS-LYS-ARG-PRO-PRO-PRO-PRO-PRO-PRO-GLY-HIS-LYS-ARG-THR,66,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)CCC[NH+]=C(N)N)[NH3+],IC50=7.9uM,5.102373,5.1,1,A,A,1,A,A,0,,P,A,dimer,1,1,66,15,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8589286208152771,0.7961968183517456,86.54755401611328,89.3066635131836,0.3529588878154754,0.5685713291168213,0.8600782155990601,0.8353416919708252,0.7429004311561584,0.7864105701446533,SKKRPPPPPPGHKRT,Low,"(5.014, 5.105]",train
2DWX,protein-peptide,Q9UJY5,IKPSNILPVTVYDQHGFRILFHFARDPLPGRSDVLVVVVSMLSTAPQPIRNIVFQSAVPKVMKVKLQPPSGTELPAFNPIVHPSAITQVLLLANPQKEKVRLRYKLTFTMGDQTYNEMGDVDQFPPPETWGSL,SLDGTGWNSFQSS,ILE-LYS-PRO-SER-ASN-ILE-LEU-PRO-VAL-THR-VAL-TYR-ASP-GLN-HIS-GLY-PHE-ARG-ILE-LEU-PHE-HIS-PHE-ALA-ARG-ASP-PRO-LEU-PRO-GLY-ARG-SER-ASP-VAL-LEU-VAL-VAL-VAL-VAL-SER-MET-LEU-SER-THR-ALA-PRO-GLN-PRO-ILE-ARG-ASN-ILE-VAL-PHE-GLN-SER-ALA-VAL-PRO-LYS-VAL-MET-LYS-VAL-LYS-LEU-GLN-PRO-PRO-SER-GLY-THR-GLU-LEU-PRO-ALA-PHE-ASN-PRO-ILE-VAL-HIS-PRO-SER-ALA-ILE-THR-GLN-VAL-LEU-LEU-LEU-ALA-ASN-PRO-GLN-LYS-GLU-LYS-VAL-ARG-LEU-ARG-TYR-LYS-LEU-THR-PHE-THR-MET-GLY-ASP-GLN-THR-TYR-ASN-GLU-MET-GLY-ASP-VAL-ASP-GLN-PHE-PRO-PRO-PRO-GLU-THR-TRP-GLY-SER-LEU,SER-LEU-ASP-GLY-THR-GLY-TRP-ASN-SER-PHE-GLN-SER-SER,133,13,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CO)CCC(=O)N)Cc1ccccc1)CO)CC(=O)N)Cc1c[nH]c2c1cccc2,Kd=180uM,3.744727,3.74,1,A,A,1,A,A,0,,P,A,,1,1,133,13,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.917902946472168,0.8455137014389038,93.5523452758789,89.46297454833984,0.3802020847797394,0.6030077934265137,0.9128663539886476,0.88894122838974,0.8635113835334778,0.8346567749977112,SLDGTGWNSFQSS,Low,"(3.548, 3.924]",val
2FCI,protein-peptide,Q32PK0 P08487,GSPGIHESKEWYHASLTRAQAEHMLMRVPRDGAFLVRKRNEPNSYAISFRAEGKIKHCRVQQEGQTVMLGNSEFDSLVDLISYYEKHPLYRKMKLRYPINEENSS,DTEVYESPYADPE,GLY-SER-PRO-GLY-ILE-HIS-GLU-SER-LYS-GLU-TRP-TYR-HIS-ALA-SER-LEU-THR-ARG-ALA-GLN-ALA-GLU-HIS-MET-LEU-MET-ARG-VAL-PRO-ARG-ASP-GLY-ALA-PHE-LEU-VAL-ARG-LYS-ARG-ASN-GLU-PRO-ASN-SER-TYR-ALA-ILE-SER-PHE-ARG-ALA-GLU-GLY-LYS-ILE-LYS-HIS-CYS-ARG-VAL-GLN-GLN-GLU-GLY-GLN-THR-VAL-MET-LEU-GLY-ASN-SER-GLU-PHE-ASP-SER-LEU-VAL-ASP-LEU-ILE-SER-TYR-TYR-GLU-LYS-HIS-PRO-LEU-TYR-ARG-LYS-MET-LYS-LEU-ARG-TYR-PRO-ILE-ASN-GLU-GLU-ASN-SER-SER,ACE-ASP-THR-GLU-VAL-PTR-GLU-SER-PRO-PTR-ALA-ASP-PRO-GMA,105,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N)CCC(=O)O)CC(=O)O)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)C)CC(=O)O)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O)CCC(=O)O,Kd=70nM,7.154902,7.15,1,A,A,1,A,A,0,,B,A,,1,1,105,14,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O,,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8808275461196899,0.7866038680076599,86.8844985961914,86.85039520263672,0.3729229867458343,0.6707098484039307,0.9053943157196044,0.8509087562561035,0.8058298826217651,0.7705276608467102,DTEVYESPYADPE,Moderate,"(7.049, 7.268]",train
2FLU,protein-peptide,Q16236 Q14145,GSSHHHHHHSSGLVPRGSHAPKVGRLIYTAGGYFRQSLSYLEAYNPSDGTWLRLADLQVPRSGLAGCVVGGLLYAVGGRNNSPDGNTDSSALDCYNPMTNQWSPCAPMSVPRNRIGVGVIDGHIYAVGGSHGCIHHNSVERYEPERDEWHLVAPMLTRRIGVGVAVLNRLLYAVGGFDGTNRLNSAECYYPERNEWRMITAMNTIRSGAGVCVLHNCIYAAGGYDGQDQLNSVERYDVETETWTFVAPMKHRRSALGITVHQGRIYVLGGYDGHTFLDSVECYDPDTDTWSEVTRMTSGRSGVGVAVT,AFFAQLQLDEETGEFL,GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-ALA-PRO-LYS-VAL-GLY-ARG-LEU-ILE-TYR-THR-ALA-GLY-GLY-TYR-PHE-ARG-GLN-SER-LEU-SER-TYR-LEU-GLU-ALA-TYR-ASN-PRO-SER-ASP-GLY-THR-TRP-LEU-ARG-LEU-ALA-ASP-LEU-GLN-VAL-PRO-ARG-SER-GLY-LEU-ALA-GLY-CYS-VAL-VAL-GLY-GLY-LEU-LEU-TYR-ALA-VAL-GLY-GLY-ARG-ASN-ASN-SER-PRO-ASP-GLY-ASN-THR-ASP-SER-SER-ALA-LEU-ASP-CYS-TYR-ASN-PRO-MET-THR-ASN-GLN-TRP-SER-PRO-CYS-ALA-PRO-MET-SER-VAL-PRO-ARG-ASN-ARG-ILE-GLY-VAL-GLY-VAL-ILE-ASP-GLY-HIS-ILE-TYR-ALA-VAL-GLY-GLY-SER-HIS-GLY-CYS-ILE-HIS-HIS-ASN-SER-VAL-GLU-ARG-TYR-GLU-PRO-GLU-ARG-ASP-GLU-TRP-HIS-LEU-VAL-ALA-PRO-MET-LEU-THR-ARG-ARG-ILE-GLY-VAL-GLY-VAL-ALA-VAL-LEU-ASN-ARG-LEU-LEU-TYR-ALA-VAL-GLY-GLY-PHE-ASP-GLY-THR-ASN-ARG-LEU-ASN-SER-ALA-GLU-CYS-TYR-TYR-PRO-GLU-ARG-ASN-GLU-TRP-ARG-MET-ILE-THR-ALA-MET-ASN-THR-ILE-ARG-SER-GLY-ALA-GLY-VAL-CYS-VAL-LEU-HIS-ASN-CYS-ILE-TYR-ALA-ALA-GLY-GLY-TYR-ASP-GLY-GLN-ASP-GLN-LEU-ASN-SER-VAL-GLU-ARG-TYR-ASP-VAL-GLU-THR-GLU-THR-TRP-THR-PHE-VAL-ALA-PRO-MET-LYS-HIS-ARG-ARG-SER-ALA-LEU-GLY-ILE-THR-VAL-HIS-GLN-GLY-ARG-ILE-TYR-VAL-LEU-GLY-GLY-TYR-ASP-GLY-HIS-THR-PHE-LEU-ASP-SER-VAL-GLU-CYS-TYR-ASP-PRO-ASP-THR-ASP-THR-TRP-SER-GLU-VAL-THR-ARG-MET-THR-SER-GLY-ARG-SER-GLY-VAL-GLY-VAL-ALA-VAL-THR,ALA-PHE-PHE-ALA-GLN-LEU-GLN-LEU-ASP-GLU-GLU-THR-GLY-GLU-PHE-LEU,308,16,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccccc1)CCC(=O)O)[C@H](O)C)CCC(=O)O)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccccc1)Cc1ccccc1)C)CCC(=O)N)CC(C)C)CCC(=O)N)C,Kd=20nM,7.69897,7.7,1,A,A,1,A,A,0,,P,X,,1,1,308,16,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O,0.8903117179870605,0.6945824027061462,88.3748779296875,86.56057739257812,0.3626218140125274,1.0291842222213743,0.890235424041748,0.8102927207946777,0.8208863139152527,0.6250703930854797,AFFAQLQLDEETGEFL,Moderate,"(7.523, 7.921]",train
2FTS,protein-peptide,P20781 Q03555,MSPFPLTSMDKAFITVLEMTPVLGTEIINYRDGMGRVLAQDVYAKDNLPPFPASVKDGYAVRAADGPGDRFIIGESQAGEQPTQTVMPGQVMRVTTGAPIPCGADAVVQVEDTELIRESDDGTEELEVRILVQARPGQDIRPIGHDIKRGECVLAKGTHMGPSEIGLLATVGVTEVEVNKFPVVAVMSTGNELLNPEDDLLPGKIRDSNRSTLLATIQEHGYPTINLGIVGDNPDDLLNALNEGISRADVIITSGGVSMGEKDYLKQVLDIDLHAQIHFGRVFMKPGLPTTFATLDIDGVRKIIFALPGNPVSAVVTCNLFVVPALRKMQGILDPRPTIIKARLSCDVKLDPRPEYHRCILTWHHQEPLPWAQSTGNQMSSRLMSMRSANGLLMLPPKTEQYVELHKGEVVDVMVIGRL,FSIVGSLPRDFEL,MET-SER-PRO-PHE-PRO-LEU-THR-SER-MET-ASP-LYS-ALA-PHE-ILE-THR-VAL-LEU-GLU-MET-THR-PRO-VAL-LEU-GLY-THR-GLU-ILE-ILE-ASN-TYR-ARG-ASP-GLY-MET-GLY-ARG-VAL-LEU-ALA-GLN-ASP-VAL-TYR-ALA-LYS-ASP-ASN-LEU-PRO-PRO-PHE-PRO-ALA-SER-VAL-LYS-ASP-GLY-TYR-ALA-VAL-ARG-ALA-ALA-ASP-GLY-PRO-GLY-ASP-ARG-PHE-ILE-ILE-GLY-GLU-SER-GLN-ALA-GLY-GLU-GLN-PRO-THR-GLN-THR-VAL-MET-PRO-GLY-GLN-VAL-MET-ARG-VAL-THR-THR-GLY-ALA-PRO-ILE-PRO-CYS-GLY-ALA-ASP-ALA-VAL-VAL-GLN-VAL-GLU-ASP-THR-GLU-LEU-ILE-ARG-GLU-SER-ASP-ASP-GLY-THR-GLU-GLU-LEU-GLU-VAL-ARG-ILE-LEU-VAL-GLN-ALA-ARG-PRO-GLY-GLN-ASP-ILE-ARG-PRO-ILE-GLY-HIS-ASP-ILE-LYS-ARG-GLY-GLU-CYS-VAL-LEU-ALA-LYS-GLY-THR-HIS-MET-GLY-PRO-SER-GLU-ILE-GLY-LEU-LEU-ALA-THR-VAL-GLY-VAL-THR-GLU-VAL-GLU-VAL-ASN-LYS-PHE-PRO-VAL-VAL-ALA-VAL-MET-SER-THR-GLY-ASN-GLU-LEU-LEU-ASN-PRO-GLU-ASP-ASP-LEU-LEU-PRO-GLY-LYS-ILE-ARG-ASP-SER-ASN-ARG-SER-THR-LEU-LEU-ALA-THR-ILE-GLN-GLU-HIS-GLY-TYR-PRO-THR-ILE-ASN-LEU-GLY-ILE-VAL-GLY-ASP-ASN-PRO-ASP-ASP-LEU-LEU-ASN-ALA-LEU-ASN-GLU-GLY-ILE-SER-ARG-ALA-ASP-VAL-ILE-ILE-THR-SER-GLY-GLY-VAL-SER-MET-GLY-GLU-LYS-ASP-TYR-LEU-LYS-GLN-VAL-LEU-ASP-ILE-ASP-LEU-HIS-ALA-GLN-ILE-HIS-PHE-GLY-ARG-VAL-PHE-MET-LYS-PRO-GLY-LEU-PRO-THR-THR-PHE-ALA-THR-LEU-ASP-ILE-ASP-GLY-VAL-ARG-LYS-ILE-ILE-PHE-ALA-LEU-PRO-GLY-ASN-PRO-VAL-SER-ALA-VAL-VAL-THR-CYS-ASN-LEU-PHE-VAL-VAL-PRO-ALA-LEU-ARG-LYS-MET-GLN-GLY-ILE-LEU-ASP-PRO-ARG-PRO-THR-ILE-ILE-LYS-ALA-ARG-LEU-SER-CYS-ASP-VAL-LYS-LEU-ASP-PRO-ARG-PRO-GLU-TYR-HIS-ARG-CYS-ILE-LEU-THR-TRP-HIS-HIS-GLN-GLU-PRO-LEU-PRO-TRP-ALA-GLN-SER-THR-GLY-ASN-GLN-MET-SER-SER-ARG-LEU-MET-SER-MET-ARG-SER-ALA-ASN-GLY-LEU-LEU-MET-LEU-PRO-PRO-LYS-THR-GLU-GLN-TYR-VAL-GLU-LEU-HIS-LYS-GLY-GLU-VAL-VAL-ASP-VAL-MET-VAL-ILE-GLY-ARG-LEU,PHE-SER-ILE-VAL-GLY-SER-LEU-PRO-ARG-ASP-PHE-GLU-LEU,419,13,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC(=O)O)Cc1ccccc1)CC(=O)O)CCC[NH+]=C(N)N)CC(C)C)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CO,Kd=90nM,7.045757,7.05,1,A,A,1,A,A,0,,P,A,,1,1,419,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O,0.639754593372345,0.5490803718566895,79.23273468017578,83.08233642578125,0.5618025064468384,1.624292254447937,0.8212710022926331,0.7800679206848145,0.5755676031112671,0.4913334846496582,FSIVGSLPRDFEL,Moderate,"(6.824, 7.049]",train
2FUU,protein-peptide,Q7M3Z9 Q12830,GPLGSDTKLYCICKTPYDESKFYIGCDRCQNWYHGRCVGILQSEAELIDEYVCPQCQSTEDA,ARTKQTARKSTGGKA,GLY-PRO-LEU-GLY-SER-ASP-THR-LYS-LEU-TYR-CYS-ILE-CYS-LYS-THR-PRO-TYR-ASP-GLU-SER-LYS-PHE-TYR-ILE-GLY-CYS-ASP-ARG-CYS-GLN-ASN-TRP-TYR-HIS-GLY-ARG-CYS-VAL-GLY-ILE-LEU-GLN-SER-GLU-ALA-GLU-LEU-ILE-ASP-GLU-TYR-VAL-CYS-PRO-GLN-CYS-GLN-SER-THR-GLU-ASP-ALA,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,62,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=2.7uM,5.568636,5.57,1,A,A,1,A,A,0,,B,A,,1,1,62,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.8726404905319214,0.5625394582748413,84.82185363769531,83.43439483642578,0.4316883981227875,1.1233259439468384,0.777971625328064,0.594643235206604,0.6690348982810974,0.4335457682609558,ARTKQTARKSTGGKA,Low,"(5.463, 5.6]",train
2G6Q,protein-peptide,Q9ESK4,GSEFAIDPNEPTYCLCNQVSYGEMIGCDNEQCPIEWFHFSCVSLTYKPKGKWYCPKCRGDNE,ARTKQTARKSTG,GLY-SER-GLU-PHE-ALA-ILE-ASP-PRO-ASN-GLU-PRO-THR-TYR-CYS-LEU-CYS-ASN-GLN-VAL-SER-TYR-GLY-GLU-MET-ILE-GLY-CYS-ASP-ASN-GLU-GLN-CYS-PRO-ILE-GLU-TRP-PHE-HIS-PHE-SER-CYS-VAL-SER-LEU-THR-TYR-LYS-PRO-LYS-GLY-LYS-TRP-TYR-CYS-PRO-LYS-CYS-ARG-GLY-ASP-ASN-GLU,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,62,12,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,B,A,,1,1,62,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9246860146522522,0.8660688400268555,81.30068969726562,82.70918273925781,0.4136219024658203,0.6755092740058899,0.8043090105056763,0.8139930963516235,0.7605234980583191,0.7782812714576721,ARTKQTARKSTG,Low,"(5.821, 5.959]",train
2GPH,protein-peptide,P35236 P63086,HHHHHHMAAAAAAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNLNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKCQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,RLQERRGSNVALMLDC,HIS-HIS-HIS-HIS-HIS-HIS-MET-ALA-ALA-ALA-ALA-ALA-ALA-GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-LEU-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ARG-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-CYS-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-CYS-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-THR-GLU-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-ILE-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-GLU-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,ARG-LEU-GLN-GLU-ARG-ARG-GLY-SER-ASN-VAL-ALA-LEU-MET-LEU-ASP-CYS,364,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)CC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(C)C)CCC(=O)N)CCC(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CO)CC(=O)N)C)CC(C)C,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,364,16,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)C(C)C,0.8925632834434509,0.7685330510139465,76.76630401611328,81.72067260742188,0.5199751853942871,0.9613352417945862,0.871634304523468,0.8486537933349609,0.8451640009880066,0.7193132042884827,RLQERRGSNVALMLDC,Low,"(5.222, 5.31]",val
2H13,protein-peptide,P61964,GAMGSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,ARTKQTARKS,GLY-ALA-MET-GLY-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ALA-ARG-THR-MLY-GLN-THR-ALA-ARG-LYS-SER,317,10,CC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=4.5uM,5.346787,5.35,1,A,A,1,A,A,0,,B,A,,1,1,317,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.881443977355957,0.7984256744384766,94.63423919677734,92.18840789794922,0.3547039926052093,0.704082727432251,0.9197167158126832,0.8865482807159424,0.8260042071342468,0.7448492646217346,ARTKQTARKS,Low,"(5.31, 5.463]",train
2H2G,protein-peptide,Q9WYW0 P61830,MKMKEFLDLLNESRLTVTLTGAGISTPSGIPDFRGPNGIYKKYSQNVFDIDFFYSHPEEFYRFAKEGIFPMLQAKPNLAHVLLAKLEEKGLIEAVITQNIDRLHQRAGSKKVIELHGNVEEYYCVRCEKKYTVEDVIKKLESSDVPLCDDCNSLIRPNIVFFGENLPQDALREAIGLSSRASLMIVLGSSLVVYPAAELPLITVRSGGKLVIVNLGETPFDDIATLKYNMDVVEFARRVMEEGGIS,HAKRVTIQKKD,MET-LYS-MET-LYS-GLU-PHE-LEU-ASP-LEU-LEU-ASN-GLU-SER-ARG-LEU-THR-VAL-THR-LEU-THR-GLY-ALA-GLY-ILE-SER-THR-PRO-SER-GLY-ILE-PRO-ASP-PHE-ARG-GLY-PRO-ASN-GLY-ILE-TYR-LYS-LYS-TYR-SER-GLN-ASN-VAL-PHE-ASP-ILE-ASP-PHE-PHE-TYR-SER-HIS-PRO-GLU-GLU-PHE-TYR-ARG-PHE-ALA-LYS-GLU-GLY-ILE-PHE-PRO-MET-LEU-GLN-ALA-LYS-PRO-ASN-LEU-ALA-HIS-VAL-LEU-LEU-ALA-LYS-LEU-GLU-GLU-LYS-GLY-LEU-ILE-GLU-ALA-VAL-ILE-THR-GLN-ASN-ILE-ASP-ARG-LEU-HIS-GLN-ARG-ALA-GLY-SER-LYS-LYS-VAL-ILE-GLU-LEU-HIS-GLY-ASN-VAL-GLU-GLU-TYR-TYR-CYS-VAL-ARG-CYS-GLU-LYS-LYS-TYR-THR-VAL-GLU-ASP-VAL-ILE-LYS-LYS-LEU-GLU-SER-SER-ASP-VAL-PRO-LEU-CYS-ASP-ASP-CYS-ASN-SER-LEU-ILE-ARG-PRO-ASN-ILE-VAL-PHE-PHE-GLY-GLU-ASN-LEU-PRO-GLN-ASP-ALA-LEU-ARG-GLU-ALA-ILE-GLY-LEU-SER-SER-ARG-ALA-SER-LEU-MET-ILE-VAL-LEU-GLY-SER-SER-LEU-VAL-VAL-TYR-PRO-ALA-ALA-GLU-LEU-PRO-LEU-ILE-THR-VAL-ARG-SER-GLY-GLY-LYS-LEU-VAL-ILE-VAL-ASN-LEU-GLY-GLU-THR-PRO-PHE-ASP-ASP-ILE-ALA-THR-LEU-LYS-TYR-ASN-MET-ASP-VAL-VAL-GLU-PHE-ALA-ARG-ARG-VAL-MET-GLU-GLU-GLY-GLY-ILE-SER,HIS-ALA-ALY-ARG-VAL-THR-ILE-GLN-LYS-LYS-ASP,246,11,CC(=O)NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1[nH]cnc1)[NH3+])C,Kd=9.2uM,5.036212,5.04,1,A,A,1,A,A,0,,B,A,,1,1,246,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(C)C)[C@@H](C)O,0.7885942459106445,0.825722873210907,89.61565399169922,89.8587875366211,0.4205772280693054,0.6800025105476379,0.9138405323028564,0.9013744592666626,0.7305316925048828,0.8068099617958069,HAKRVTIQKKD,Low,"(5.014, 5.105]",train
2H2H,protein-peptide,Q9WYW0 P02309,MKMKEFLDLLNESRLTVTLTGAGISTPSGIPDFRGPNGIYKKYSQNVFDIDFFYSHPEEFYRFAKEGIFPMLQAKPNLAHVLLAKLEEKGLIEAVITQNIDRLHQRAGSKKVIELHGNVEEYYCVRCEKKYTVEDVIKKLESSDVPLCDDCNSLIRPNIVFFGENLPQDALREAIGLSSRASLMIVLGSSLVVYPAAELPLITVRSGGKLVIVNLGETPFDDIATLKYNMDVVEFARRVMEEGGIS,HAKRKTVTSLD,MET-LYS-MET-LYS-GLU-PHE-LEU-ASP-LEU-LEU-ASN-GLU-SER-ARG-LEU-THR-VAL-THR-LEU-THR-GLY-ALA-GLY-ILE-SER-THR-PRO-SER-GLY-ILE-PRO-ASP-PHE-ARG-GLY-PRO-ASN-GLY-ILE-TYR-LYS-LYS-TYR-SER-GLN-ASN-VAL-PHE-ASP-ILE-ASP-PHE-PHE-TYR-SER-HIS-PRO-GLU-GLU-PHE-TYR-ARG-PHE-ALA-LYS-GLU-GLY-ILE-PHE-PRO-MET-LEU-GLN-ALA-LYS-PRO-ASN-LEU-ALA-HIS-VAL-LEU-LEU-ALA-LYS-LEU-GLU-GLU-LYS-GLY-LEU-ILE-GLU-ALA-VAL-ILE-THR-GLN-ASN-ILE-ASP-ARG-LEU-HIS-GLN-ARG-ALA-GLY-SER-LYS-LYS-VAL-ILE-GLU-LEU-HIS-GLY-ASN-VAL-GLU-GLU-TYR-TYR-CYS-VAL-ARG-CYS-GLU-LYS-LYS-TYR-THR-VAL-GLU-ASP-VAL-ILE-LYS-LYS-LEU-GLU-SER-SER-ASP-VAL-PRO-LEU-CYS-ASP-ASP-CYS-ASN-SER-LEU-ILE-ARG-PRO-ASN-ILE-VAL-PHE-PHE-GLY-GLU-ASN-LEU-PRO-GLN-ASP-ALA-LEU-ARG-GLU-ALA-ILE-GLY-LEU-SER-SER-ARG-ALA-SER-LEU-MET-ILE-VAL-LEU-GLY-SER-SER-LEU-VAL-VAL-TYR-PRO-ALA-ALA-GLU-LEU-PRO-LEU-ILE-THR-VAL-ARG-SER-GLY-GLY-LYS-LEU-VAL-ILE-VAL-ASN-LEU-GLY-GLU-THR-PRO-PHE-ASP-ASP-ILE-ALA-THR-LEU-LYS-TYR-ASN-MET-ASP-VAL-VAL-GLU-PHE-ALA-ARG-ARG-VAL-MET-GLU-GLU-GLY-GLY-ILE-SER,HIS-ALA-LYS-ARG-ALY-THR-VAL-THR-SER-LEU-ASP,246,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C(C)C)[C@H](O)C)CCCCNC(=O)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]([NH3+])C,Kd=10.5uM,4.978811,4.98,1,A,A,1,A,A,0,,B,A,,1,1,246,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.8491842150688171,0.7980580925941467,92.56805419921876,89.70454406738281,0.3734928965568542,0.7097687721252441,0.9291831851005554,0.8896251320838928,0.8024335503578186,0.7751662731170654,HAKRKTVTSLD,Low,"(4.866, 5.014]",train
2H9P,protein-peptide,Q6P823 P61964,MHHHHHHSSGRENLYFQGTQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,ARTKQTARKST,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR,329,11,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)NC(=O)[C@@H]([NH3+])C)N,Kd=192uM,3.716699,3.72,1,A,A,1,A,A,0,,B,A,,1,1,329,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8550369143486023,0.740669310092926,89.66676330566406,89.69027709960938,0.3898476362228393,0.7974417209625244,0.8922961354255676,0.851546049118042,0.7850603461265564,0.6787556409835815,ARTKQTARKST,Low,"(3.548, 3.924]",train
2HDX,protein-peptide,Q62120 Q91ZM2,GSDQPLSGYPWFHGMLSRLKAAQLVLEGGTGSHGVFLVRQSETRRGECVLTFNFQGKAKHLRLSLNAAGQCRVQHLHFQSIFDMLEHFRVHPIPLESGGSSDVVLVSYVPS,TPDYELLTEND,GLY-SER-ASP-GLN-PRO-LEU-SER-GLY-TYR-PRO-TRP-PHE-HIS-GLY-MET-LEU-SER-ARG-LEU-LYS-ALA-ALA-GLN-LEU-VAL-LEU-GLU-GLY-GLY-THR-GLY-SER-HIS-GLY-VAL-PHE-LEU-VAL-ARG-GLN-SER-GLU-THR-ARG-ARG-GLY-GLU-CYS-VAL-LEU-THR-PHE-ASN-PHE-GLN-GLY-LYS-ALA-LYS-HIS-LEU-ARG-LEU-SER-LEU-ASN-ALA-ALA-GLY-GLN-CYS-ARG-VAL-GLN-HIS-LEU-HIS-PHE-GLN-SER-ILE-PHE-ASP-MET-LEU-GLU-HIS-PHE-ARG-VAL-HIS-PRO-ILE-PRO-LEU-GLU-SER-GLY-GLY-SER-SER-ASP-VAL-VAL-LEU-VAL-SER-TYR-VAL-PRO-SER,THR-PRO-ASP-PTR-GLU-LEU-LEU-THR-GLU-ASN-ASP,111,11,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)[NH3+])CC(=O)O)Cc1ccc(cc1)OP(O)(O)O)CCC(=O)O)C,Kd=0.55uM,6.259637,6.26,1,A,A,1,A,A,0,,G,A,,1,1,111,11,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9079034328460692,0.8323955535888672,93.2718734741211,90.7191925048828,0.3519579470157623,0.616163969039917,0.9189631938934326,0.8822783827781677,0.8487859964370728,0.8199248313903809,TPDYELLTEND,Low,"(6.097, 6.26]",train
2HMH,protein-peptide,O35718 Q00560,GSEFPLDTSLRLKTFSSKSEYQLVVNAVRKLQESGFYWSAVTGGEANLLLSAEPAGTFLIRDSSDQRHFFTLSVKTQSGTKNLRIQCEGGSFSLQSDPRSTQPVPRFDCVLKLVHHYMPPQALPGSTPKRAYYIYSGGEKIPLVLSRPLSSN,STVEYSTVVHS,GLY-SER-GLU-PHE-PRO-LEU-ASP-THR-SER-LEU-ARG-LEU-LYS-THR-PHE-SER-SER-LYS-SER-GLU-TYR-GLN-LEU-VAL-VAL-ASN-ALA-VAL-ARG-LYS-LEU-GLN-GLU-SER-GLY-PHE-TYR-TRP-SER-ALA-VAL-THR-GLY-GLY-GLU-ALA-ASN-LEU-LEU-LEU-SER-ALA-GLU-PRO-ALA-GLY-THR-PHE-LEU-ILE-ARG-ASP-SER-SER-ASP-GLN-ARG-HIS-PHE-PHE-THR-LEU-SER-VAL-LYS-THR-GLN-SER-GLY-THR-LYS-ASN-LEU-ARG-ILE-GLN-CAS-GLU-GLY-GLY-SER-PHE-SER-LEU-GLN-SER-ASP-PRO-ARG-SER-THR-GLN-PRO-VAL-PRO-ARG-PHE-ASP-CAS-VAL-LEU-LYS-LEU-VAL-HIS-HIS-TYR-MET-PRO-PRO-GLN-ALA-LEU-PRO-GLY-SER-THR-PRO-LYS-ARG-ALA-TYR-TYR-ILE-TYR-SER-GLY-GLY-GLU-LYS-ILE-PRO-LEU-VAL-LEU-SER-ARG-PRO-LEU-SER-SER-ASN,SER-THR-VAL-GLU-PTR-SER-THR-VAL-VAL-HIS-SER,152,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1c[nH]cn1)C(C)C)C(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CO)[NH3+])CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O,Kd=70nM,7.154902,7.15,1,A,A,1,A,A,0,,B,A,,1,1,152,11,0,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(C)C)C(C)C)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(C)C)C(C)C)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9493893384933472,0.8506234288215637,90.1112823486328,89.79417419433594,0.3633687198162079,0.6140541434288025,0.9200626015663148,0.8873822689056396,0.914543092250824,0.8414337038993835,STVEYSTVVHS,Moderate,"(7.049, 7.268]",train
2HUG,protein-peptide,P37107 O22265,GSQVFEYAEVDEIVEKRGKGKDVEYLVRWKDGGDCEWVKGVHVAEDVAKDYEDGLEY,APPGTARRKRKADS,GLY-SER-GLN-VAL-PHE-GLU-TYR-ALA-GLU-VAL-ASP-GLU-ILE-VAL-GLU-LYS-ARG-GLY-LYS-GLY-LYS-ASP-VAL-GLU-TYR-LEU-VAL-ARG-TRP-LYS-ASP-GLY-GLY-ASP-CYS-GLU-TRP-VAL-LYS-GLY-VAL-HIS-VAL-ALA-GLU-ASP-VAL-ALA-LYS-ASP-TYR-GLU-ASP-GLY-LEU-GLU-TYR,ALA-PRO-PRO-GLY-THR-ALA-ARG-ARG-LYS-ARG-LYS-ALA-ASP-SER,57,14,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCCC[NH3+])CCC[NH+]=C(N)N)CCCC[NH3+])C)CC(=O)O,Kd=1.06uM,5.974694,5.97,1,A,A,1,A,A,0,,B,A,,1,1,57,14,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.7969163656234741,0.8804599046707153,86.37781524658203,82.03483581542969,0.5152199864387512,0.6713935732841492,0.7272748351097107,0.8084276914596558,0.6910872459411621,0.7668889760971069,APPGTARRKRKADS,Low,"(5.959, 6.097]",train
2IV9,protein-peptide,P63010 P42566,IGMAPGGYVAPKAVWLPAVKAKGLEISGTFTHRQGHIYMEMNFTNKALQHMTDFAIQFNKNSFGVIPSTPLAIHTPLMPNQSIDVSLPLNTLGPVMKMEPLNNLQVAVKNNIDVFYFSCLIPLNVLFVEDGKMERQVFLATWKDIPNENELQFQIKECHLNADTVSSKLQNNNVYTIAKRNVEGQDMLYQSLKLTNGIWILAELRIQPGNPNYTLSLKCRAPEVSQYIYQVYDSILKN,SFGDGFADFSTL,ILE-GLY-MET-ALA-PRO-GLY-GLY-TYR-VAL-ALA-PRO-LYS-ALA-VAL-TRP-LEU-PRO-ALA-VAL-LYS-ALA-LYS-GLY-LEU-GLU-ILE-SER-GLY-THR-PHE-THR-HIS-ARG-GLN-GLY-HIS-ILE-TYR-MET-GLU-MET-ASN-PHE-THR-ASN-LYS-ALA-LEU-GLN-HIS-MET-THR-ASP-PHE-ALA-ILE-GLN-PHE-ASN-LYS-ASN-SER-PHE-GLY-VAL-ILE-PRO-SER-THR-PRO-LEU-ALA-ILE-HIS-THR-PRO-LEU-MET-PRO-ASN-GLN-SER-ILE-ASP-VAL-SER-LEU-PRO-LEU-ASN-THR-LEU-GLY-PRO-VAL-MET-LYS-MET-GLU-PRO-LEU-ASN-ASN-LEU-GLN-VAL-ALA-VAL-LYS-ASN-ASN-ILE-ASP-VAL-PHE-TYR-PHE-SER-CYS-LEU-ILE-PRO-LEU-ASN-VAL-LEU-PHE-VAL-GLU-ASP-GLY-LYS-MET-GLU-ARG-GLN-VAL-PHE-LEU-ALA-THR-TRP-LYS-ASP-ILE-PRO-ASN-GLU-ASN-GLU-LEU-GLN-PHE-GLN-ILE-LYS-GLU-CYS-HIS-LEU-ASN-ALA-ASP-THR-VAL-SER-SER-LYS-LEU-GLN-ASN-ASN-ASN-VAL-TYR-THR-ILE-ALA-LYS-ARG-ASN-VAL-GLU-GLY-GLN-ASP-MET-LEU-TYR-GLN-SER-LEU-LYS-LEU-THR-ASN-GLY-ILE-TRP-ILE-LEU-ALA-GLU-LEU-ARG-ILE-GLN-PRO-GLY-ASN-PRO-ASN-TYR-THR-LEU-SER-LEU-LYS-CYS-ARG-ALA-PRO-GLU-VAL-SER-GLN-TYR-ILE-TYR-GLN-VAL-TYR-ASP-SER-ILE-LEU-LYS-ASN,SER-PHE-GLY-ASP-GLY-PHE-ALA-ASP-PHE-SER-THR-LEU,238,12,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(=O)O)C)Cc1ccccc1)CC(=O)O)Cc1ccccc1)[NH3+],Kd=46uM,4.337242,4.34,1,A,A,1,A,A,0,,P,A,dimer,1,1,238,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,0.9188464283943176,0.6471665501594543,94.3925552368164,90.56856536865234,0.348555713891983,1.133013129234314,0.9199674129486084,0.8339948654174805,0.8785660862922668,0.58995521068573,SFGDGFADFSTL,Low,"(4.319, 4.456]",train
2IVZ,protein-peptide,P0A855 P09883,MMKQALRVAFGFLILWASVLHAEVRIVIDSGVDSGRPIGVVPFQWAGPGAAPEDIGGIVAADLRNSGKFNPLDRARLPQQPGSAQEVQPAAWSALGIDAVVVGQVTPNPDGSYNVAYQLVDTGGAPGTVLAQNSYKVNKQWLRYAGHTASDEVFEKLTGIKGAFRTRIAYVVQTNGGQFPYELRVSDYDGYNQFVVHRSPQPLMSPAWSPDGSKLAYVTFESGRSALVIQTLANGAVRQVASFPRHNGAPAFSPDGSKLAFALSKTGSLNLYVMDLASGQIRQVTDGRSNNTEPTWFPDSQNLAFTSDQAGRPQVYKVNINGGAPQRITWEGSQNQDADVSSDGKFMVMVSSNGGQQHIAKQDLATGGVQVLSSTFLDETPSLAPNGTMVIYSSSQGMGSVLNLVSTDGRFKARLPATDGQVKFPAWSPYLLEHHHHHH,GASDGSGWSSENNPWG,MET-MET-LYS-GLN-ALA-LEU-ARG-VAL-ALA-PHE-GLY-PHE-LEU-ILE-LEU-TRP-ALA-SER-VAL-LEU-HIS-ALA-GLU-VAL-ARG-ILE-VAL-ILE-ASP-SER-GLY-VAL-ASP-SER-GLY-ARG-PRO-ILE-GLY-VAL-VAL-PRO-PHE-GLN-TRP-ALA-GLY-PRO-GLY-ALA-ALA-PRO-GLU-ASP-ILE-GLY-GLY-ILE-VAL-ALA-ALA-ASP-LEU-ARG-ASN-SER-GLY-LYS-PHE-ASN-PRO-LEU-ASP-ARG-ALA-ARG-LEU-PRO-GLN-GLN-PRO-GLY-SER-ALA-GLN-GLU-VAL-GLN-PRO-ALA-ALA-TRP-SER-ALA-LEU-GLY-ILE-ASP-ALA-VAL-VAL-VAL-GLY-GLN-VAL-THR-PRO-ASN-PRO-ASP-GLY-SER-TYR-ASN-VAL-ALA-TYR-GLN-LEU-VAL-ASP-THR-GLY-GLY-ALA-PRO-GLY-THR-VAL-LEU-ALA-GLN-ASN-SER-TYR-LYS-VAL-ASN-LYS-GLN-TRP-LEU-ARG-TYR-ALA-GLY-HIS-THR-ALA-SER-ASP-GLU-VAL-PHE-GLU-LYS-LEU-THR-GLY-ILE-LYS-GLY-ALA-PHE-ARG-THR-ARG-ILE-ALA-TYR-VAL-VAL-GLN-THR-ASN-GLY-GLY-GLN-PHE-PRO-TYR-GLU-LEU-ARG-VAL-SER-ASP-TYR-ASP-GLY-TYR-ASN-GLN-PHE-VAL-VAL-HIS-ARG-SER-PRO-GLN-PRO-LEU-MET-SER-PRO-ALA-TRP-SER-PRO-ASP-GLY-SER-LYS-LEU-ALA-TYR-VAL-THR-PHE-GLU-SER-GLY-ARG-SER-ALA-LEU-VAL-ILE-GLN-THR-LEU-ALA-ASN-GLY-ALA-VAL-ARG-GLN-VAL-ALA-SER-PHE-PRO-ARG-HIS-ASN-GLY-ALA-PRO-ALA-PHE-SER-PRO-ASP-GLY-SER-LYS-LEU-ALA-PHE-ALA-LEU-SER-LYS-THR-GLY-SER-LEU-ASN-LEU-TYR-VAL-MET-ASP-LEU-ALA-SER-GLY-GLN-ILE-ARG-GLN-VAL-THR-ASP-GLY-ARG-SER-ASN-ASN-THR-GLU-PRO-THR-TRP-PHE-PRO-ASP-SER-GLN-ASN-LEU-ALA-PHE-THR-SER-ASP-GLN-ALA-GLY-ARG-PRO-GLN-VAL-TYR-LYS-VAL-ASN-ILE-ASN-GLY-GLY-ALA-PRO-GLN-ARG-ILE-THR-TRP-GLU-GLY-SER-GLN-ASN-GLN-ASP-ALA-ASP-VAL-SER-SER-ASP-GLY-LYS-PHE-MET-VAL-MET-VAL-SER-SER-ASN-GLY-GLY-GLN-GLN-HIS-ILE-ALA-LYS-GLN-ASP-LEU-ALA-THR-GLY-GLY-VAL-GLN-VAL-LEU-SER-SER-THR-PHE-LEU-ASP-GLU-THR-PRO-SER-LEU-ALA-PRO-ASN-GLY-THR-MET-VAL-ILE-TYR-SER-SER-SER-GLN-GLY-MET-GLY-SER-VAL-LEU-ASN-LEU-VAL-SER-THR-ASP-GLY-ARG-PHE-LYS-ALA-ARG-LEU-PRO-ALA-THR-ASP-GLY-GLN-VAL-LYS-PHE-PRO-ALA-TRP-SER-PRO-TYR-LEU-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-ALA-SER-ASP-GLY-SER-GLY-TRP-SER-SER-GLU-ASN-ASN-PRO-TRP-GLY,439,16,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CC(=O)N)CC(=O)N)CCC(=O)O)CO)CO)Cc1c[nH]c2c1cccc2)CO)CC(=O)O)CO)C,Kd=0.92uM,6.036212,6.04,1,A,A,1,A,A,0,,E,A,,1,1,439,16,0,C[C@H](NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O,C[C@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O,0.8431134223937988,0.7670924663543701,81.52629852294922,82.06096649169922,0.5137072205543518,0.9251527786254884,0.8580144047737122,0.8386508822441101,0.7789485454559326,0.7107632160186768,GASDGSGWSSENNPWG,Low,"(5.959, 6.097]",train
2JDL,protein-peptide,P09989 P05387,MVSFRLSGATSSSYGVFISNLRKALPNERKLYDIPLLRSSLPGSQRYALIHLTNYADETISVAIDVTNVYIMGYRAGDTSYFFNEASATEAAKYVFKDAMRKVTLPYSGNYERLQTAAGKIRENIPLGLPALDSAITTLFYYNANSAASALMVLIQSTSEAARYKFIEQQIGKRVDKTFLPSLAIISLENSWSALSKQIQIASTNNGQFESPVVLINAQNQRVTITNVDAGVVTSNIALLLNRNNMA,SDDDMGFGLFD,MET-VAL-SER-PHE-ARG-LEU-SER-GLY-ALA-THR-SER-SER-SER-TYR-GLY-VAL-PHE-ILE-SER-ASN-LEU-ARG-LYS-ALA-LEU-PRO-ASN-GLU-ARG-LYS-LEU-TYR-ASP-ILE-PRO-LEU-LEU-ARG-SER-SER-LEU-PRO-GLY-SER-GLN-ARG-TYR-ALA-LEU-ILE-HIS-LEU-THR-ASN-TYR-ALA-ASP-GLU-THR-ILE-SER-VAL-ALA-ILE-ASP-VAL-THR-ASN-VAL-TYR-ILE-MET-GLY-TYR-ARG-ALA-GLY-ASP-THR-SER-TYR-PHE-PHE-ASN-GLU-ALA-SER-ALA-THR-GLU-ALA-ALA-LYS-TYR-VAL-PHE-LYS-ASP-ALA-MET-ARG-LYS-VAL-THR-LEU-PRO-TYR-SER-GLY-ASN-TYR-GLU-ARG-LEU-GLN-THR-ALA-ALA-GLY-LYS-ILE-ARG-GLU-ASN-ILE-PRO-LEU-GLY-LEU-PRO-ALA-LEU-ASP-SER-ALA-ILE-THR-THR-LEU-PHE-TYR-TYR-ASN-ALA-ASN-SER-ALA-ALA-SER-ALA-LEU-MET-VAL-LEU-ILE-GLN-SER-THR-SER-GLU-ALA-ALA-ARG-TYR-LYS-PHE-ILE-GLU-GLN-GLN-ILE-GLY-LYS-ARG-VAL-ASP-LYS-THR-PHE-LEU-PRO-SER-LEU-ALA-ILE-ILE-SER-LEU-GLU-ASN-SER-TRP-SER-ALA-LEU-SER-LYS-GLN-ILE-GLN-ILE-ALA-SER-THR-ASN-ASN-GLY-GLN-PHE-GLU-SER-PRO-VAL-VAL-LEU-ILE-ASN-ALA-GLN-ASN-GLN-ARG-VAL-THR-ILE-THR-ASN-VAL-ASP-ALA-GLY-VAL-VAL-THR-SER-ASN-ILE-ALA-LEU-LEU-LEU-ASN-ARG-ASN-ASN-MET-ALA,SER-ASP-ASP-ASP-MET-GLY-PHE-GLY-LEU-PHE-ASP,247,11,CSCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccccc1)CC(C)C)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)CC(=O)O,IC50=0.37nM,9.431798,9.43,1,A,A,1,A,A,0,,C,A,,1,1,247,11,0,CSCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9276334643363952,0.7012096643447876,94.15630340576172,92.6822738647461,0.3257757723331451,0.8922186493873596,0.9551200270652772,0.8769702911376953,0.8941144943237305,0.6572694778442383,SDDDMGFGLFD,High,"(8.824, 12.12]",train
2JK9,protein-peptide,Q96BD6 Q96IZ0,SMQELQGLDYCKPTRLDLLLDMPPVSYDVQLLHSWNNNDRSLNVFVKEDDKLIFHRHPVAQSTDAIRGKVGYTRGLHVWQITWAMRQRGTHAVVGVATADAPLHSVGYTTLVGNNHESWGWDLGRNRLYHDGKNQPSKTYPAFLEPDETFIVPDSFLVALDMDDGTLSFIVDGQYMGVAFRGLKGKKLYPVVSAVWGHCEIRMRYLNGLDPE,NELNNNLPGGAPAAP,SER-MET-GLN-GLU-LEU-GLN-GLY-LEU-ASP-TYR-CYS-LYS-PRO-THR-ARG-LEU-ASP-LEU-LEU-LEU-ASP-MET-PRO-PRO-VAL-SER-TYR-ASP-VAL-GLN-LEU-LEU-HIS-SER-TRP-ASN-ASN-ASN-ASP-ARG-SER-LEU-ASN-VAL-PHE-VAL-LYS-GLU-ASP-ASP-LYS-LEU-ILE-PHE-HIS-ARG-HIS-PRO-VAL-ALA-GLN-SER-THR-ASP-ALA-ILE-ARG-GLY-LYS-VAL-GLY-TYR-THR-ARG-GLY-LEU-HIS-VAL-TRP-GLN-ILE-THR-TRP-ALA-MET-ARG-GLN-ARG-GLY-THR-HIS-ALA-VAL-VAL-GLY-VAL-ALA-THR-ALA-ASP-ALA-PRO-LEU-HIS-SER-VAL-GLY-TYR-THR-THR-LEU-VAL-GLY-ASN-ASN-HIS-GLU-SER-TRP-GLY-TRP-ASP-LEU-GLY-ARG-ASN-ARG-LEU-TYR-HIS-ASP-GLY-LYS-ASN-GLN-PRO-SER-LYS-THR-TYR-PRO-ALA-PHE-LEU-GLU-PRO-ASP-GLU-THR-PHE-ILE-VAL-PRO-ASP-SER-PHE-LEU-VAL-ALA-LEU-ASP-MET-ASP-ASP-GLY-THR-LEU-SER-PHE-ILE-VAL-ASP-GLY-GLN-TYR-MET-GLY-VAL-ALA-PHE-ARG-GLY-LEU-LYS-GLY-LYS-LYS-LEU-TYR-PRO-VAL-VAL-SER-ALA-VAL-TRP-GLY-HIS-CYS-GLU-ILE-ARG-MET-ARG-TYR-LEU-ASN-GLY-LEU-ASP-PRO-GLU,ASN-GLU-LEU-ASN-ASN-ASN-LEU-PRO-GLY-GLY-ALA-PRO-ALA-ALA-PRO,212,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)CC(=O)N)CC(=O)N)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC(=O)O)C,Kd=150nM,6.823909,6.82,1,A,A,1,A,A,0,,B,A,,1,1,212,15,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,0.9229563474655152,0.7775574922561646,91.87677764892578,90.16963958740234,0.3807182013988495,0.6436892747879028,0.9200323224067688,0.8590400815010071,0.8548548221588135,0.7100170850753784,NELNNNLPGGAPAAP,Low,"(6.696, 6.824]",train
2JMJ,protein-peptide,Q08465 P61830,GPLGSHMASEFINQGDVTEGNNNQEEVYCFCRNVSYGPMVACDNPACPFEWFHYGCVGLKQAPKGKWYCSKDCKEIANQRSKSKRQKRRK,ARTKQTARK,GLY-PRO-LEU-GLY-SER-HIS-MET-ALA-SER-GLU-PHE-ILE-ASN-GLN-GLY-ASP-VAL-THR-GLU-GLY-ASN-ASN-ASN-GLN-GLU-GLU-VAL-TYR-CYS-PHE-CYS-ARG-ASN-VAL-SER-TYR-GLY-PRO-MET-VAL-ALA-CYS-ASP-ASN-PRO-ALA-CYS-PRO-PHE-GLU-TRP-PHE-HIS-TYR-GLY-CYS-VAL-GLY-LEU-LYS-GLN-ALA-PRO-LYS-GLY-LYS-TRP-TYR-CYS-SER-LYS-ASP-CYS-LYS-GLU-ILE-ALA-ASN-GLN-ARG-SER-LYS-SER-LYS-ARG-GLN-LYS-ARG-ARG-LYS,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS,90,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=9.1uM,5.040959,5.04,1,A,A,1,A,A,0,,P,A,,1,1,90,9,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.002147912979126,0.9374947547912598,65.3967056274414,72.50614166259766,0.5267215371131897,0.7696057558059692,0.6471600532531738,0.7160996198654175,0.8068039417266846,0.742843508720398,ARTKQTARK,Low,"(5.014, 5.105]",train
2JNW,protein-peptide,P07992 P23025,MGSSHHHHHHSQDPAKSNSIIVSPRQRGNPVLKFVRNVPWEFGDVIPDYVLGQSTCALFLSLRYHNLHPDYIHGRLQSLGKNFALRVLLVQVDVKDPQQALKELAKMCILADCTLILAWSPEEAGRYLETYKA,KIIDTGGGFILEEE,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLN-ASP-PRO-ALA-LYS-SER-ASN-SER-ILE-ILE-VAL-SER-PRO-ARG-GLN-ARG-GLY-ASN-PRO-VAL-LEU-LYS-PHE-VAL-ARG-ASN-VAL-PRO-TRP-GLU-PHE-GLY-ASP-VAL-ILE-PRO-ASP-TYR-VAL-LEU-GLY-GLN-SER-THR-CYS-ALA-LEU-PHE-LEU-SER-LEU-ARG-TYR-HIS-ASN-LEU-HIS-PRO-ASP-TYR-ILE-HIS-GLY-ARG-LEU-GLN-SER-LEU-GLY-LYS-ASN-PHE-ALA-LEU-ARG-VAL-LEU-LEU-VAL-GLN-VAL-ASP-VAL-LYS-ASP-PRO-GLN-GLN-ALA-LEU-LYS-GLU-LEU-ALA-LYS-MET-CYS-ILE-LEU-ALA-ASP-CYS-THR-LEU-ILE-LEU-ALA-TRP-SER-PRO-GLU-GLU-ALA-GLY-ARG-TYR-LEU-GLU-THR-TYR-LYS-ALA,LYS-ILE-ILE-ASP-THR-GLY-GLY-GLY-PHE-ILE-LEU-GLU-GLU-GLU,133,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](CC)C)Cc1ccccc1)[C@H](O)C)CC(=O)O)[C@H](CC)C)[C@H](CC)C)[NH3+],Kd=0.78uM,6.107905,6.11,1,A,A,1,A,A,0,,B,A,,1,1,133,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,0.9575673937797546,0.7924456000328064,88.43547058105469,84.23578643798828,0.3685325086116791,0.7730826735496521,0.8858444094657898,0.8008036017417908,0.8692055940628052,0.7104688882827759,KIIDTGGGFILEEE,Low,"(6.097, 6.26]",train
2JOA,protein-peptide,Q92743,GSHMKKYIGIRMMSLTSSKAKELKDRHRDFPDVISGAYIIEVIPDTPAEAGGLKENDVIISINGQSVVSANDVSDVIKRESTLNMVVRRGNEDIMITVIPEEIDP,DSRIWWV,GLY-SER-HIS-MET-LYS-LYS-TYR-ILE-GLY-ILE-ARG-MET-MET-SER-LEU-THR-SER-SER-LYS-ALA-LYS-GLU-LEU-LYS-ASP-ARG-HIS-ARG-ASP-PHE-PRO-ASP-VAL-ILE-SER-GLY-ALA-TYR-ILE-ILE-GLU-VAL-ILE-PRO-ASP-THR-PRO-ALA-GLU-ALA-GLY-GLY-LEU-LYS-GLU-ASN-ASP-VAL-ILE-ILE-SER-ILE-ASN-GLY-GLN-SER-VAL-VAL-SER-ALA-ASN-ASP-VAL-SER-ASP-VAL-ILE-LYS-ARG-GLU-SER-THR-LEU-ASN-MET-VAL-VAL-ARG-ARG-GLY-ASN-GLU-ASP-ILE-MET-ILE-THR-VAL-ILE-PRO-GLU-GLU-ILE-ASP-PRO,ASP-SER-ARG-ILE-TRP-TRP-VAL,105,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CO)CCC[NH+]=C(N)N)C,Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,B,A,,1,1,105,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8995189070701599,0.8698363900184631,95.5541534423828,91.64154052734376,0.401303619146347,0.5217061042785645,0.8611181974411011,0.8958989381790161,0.8700565695762634,0.8633207082748413,DSRIWWV,Low,"(5.821, 5.959]",val
2JQ9,protein-peptide,Q9HD42 Q9UN37,MTTSTLQKAIDLVTKATEEDKAKNYEEALRLYQHAVEYFLHAIKYEAHSDKAKESIRAKCVQYLDRAEKLKDYLRSKEKHGKKP,VRSQEDQLSRRLAALRN,MET-THR-THR-SER-THR-LEU-GLN-LYS-ALA-ILE-ASP-LEU-VAL-THR-LYS-ALA-THR-GLU-GLU-ASP-LYS-ALA-LYS-ASN-TYR-GLU-GLU-ALA-LEU-ARG-LEU-TYR-GLN-HIS-ALA-VAL-GLU-TYR-PHE-LEU-HIS-ALA-ILE-LYS-TYR-GLU-ALA-HIS-SER-ASP-LYS-ALA-LYS-GLU-SER-ILE-ARG-ALA-LYS-CYS-VAL-GLN-TYR-LEU-ASP-ARG-ALA-GLU-LYS-LEU-LYS-ASP-TYR-LEU-ARG-SER-LYS-GLU-LYS-HIS-GLY-LYS-LYS-PRO,VAL-ARG-SER-GLN-GLU-ASP-GLN-LEU-SER-ARG-ARG-LEU-ALA-ALA-LEU-ARG-ASN,84,17,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC[NH+]=C(N)N)CC(C)C)C)C)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CCC(=O)N)CC(C)C,Kd=33.4uM,4.476254,4.48,1,A,A,1,A,A,0,,B,A,,1,1,84,17,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)C(=O)O,1.0300103425979614,0.845022439956665,94.00434112548828,90.29129791259766,0.3187608122825622,0.6332753300666809,0.8999776840209961,0.874108076095581,0.8954393267631531,0.837751030921936,VRSQEDQLSRRLAALRN,Low,"(4.456, 4.606]",train
2JQI,protein-peptide,P22216,ATQRFLIEKFSQEQIGENIVCRVICTTGQIPIRDLSADISQVLKEKRSIKKVWTFGRNPACDYHLGNISRLSNKHFQILLGEDGNLLLNDISTNGTWLNGQKVEKNSNQLLSQGDEITVGVGVESDILSLVIFINDKFKQCLEQNKVDRIR,NITQPTQQST,ALA-THR-GLN-ARG-PHE-LEU-ILE-GLU-LYS-PHE-SER-GLN-GLU-GLN-ILE-GLY-GLU-ASN-ILE-VAL-CYS-ARG-VAL-ILE-CYS-THR-THR-GLY-GLN-ILE-PRO-ILE-ARG-ASP-LEU-SER-ALA-ASP-ILE-SER-GLN-VAL-LEU-LYS-GLU-LYS-ARG-SER-ILE-LYS-LYS-VAL-TRP-THR-PHE-GLY-ARG-ASN-PRO-ALA-CYS-ASP-TYR-HIS-LEU-GLY-ASN-ILE-SER-ARG-LEU-SER-ASN-LYS-HIS-PHE-GLN-ILE-LEU-LEU-GLY-GLU-ASP-GLY-ASN-LEU-LEU-LEU-ASN-ASP-ILE-SER-THR-ASN-GLY-THR-TRP-LEU-ASN-GLY-GLN-LYS-VAL-GLU-LYS-ASN-SER-ASN-GLN-LEU-LEU-SER-GLN-GLY-ASP-GLU-ILE-THR-VAL-GLY-VAL-GLY-VAL-GLU-SER-ASP-ILE-LEU-SER-LEU-VAL-ILE-PHE-ILE-ASN-ASP-LYS-PHE-LYS-GLN-CYS-LEU-GLU-GLN-ASN-LYS-VAL-ASP-ARG-ILE-ARG,ASN-ILE-TPO-GLN-PRO-THR-GLN-GLN-SER-THR,151,10,CC[C@@H]([C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCC(=O)N)CCC(=O)N)[C@H](O)C)CCC(=O)N)NC(=O)[C@H](CC(=O)N)[NH3+])C,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,B,A,,1,1,151,10,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9303735494613647,0.8989423513412476,74.9283218383789,83.1805648803711,0.4044616818428039,0.5555224418640137,0.8933435082435608,0.8856683373451233,0.8386993408203125,0.8318965435028076,NITQPTQQST,Low,"(4.866, 5.014]",train
2JQK,protein-peptide,O75351 Q9UQN3,GHMMSSTSPNLQKAIDLASKAAQEDKAGNYEEALQLYQHAVQYFLHVVKYEAQGDKAKQSIRAKCTEYLDRAEKLKEYLKNKEKKAQKP,KATISDEEIERQLKALGVD,GLY-HIS-MET-MET-SER-SER-THR-SER-PRO-ASN-LEU-GLN-LYS-ALA-ILE-ASP-LEU-ALA-SER-LYS-ALA-ALA-GLN-GLU-ASP-LYS-ALA-GLY-ASN-TYR-GLU-GLU-ALA-LEU-GLN-LEU-TYR-GLN-HIS-ALA-VAL-GLN-TYR-PHE-LEU-HIS-VAL-VAL-LYS-TYR-GLU-ALA-GLN-GLY-ASP-LYS-ALA-LYS-GLN-SER-ILE-ARG-ALA-LYS-CYS-THR-GLU-TYR-LEU-ASP-ARG-ALA-GLU-LYS-LEU-LYS-GLU-TYR-LEU-LYS-ASN-LYS-GLU-LYS-LYS-ALA-GLN-LYS-PRO,LYS-ALA-THR-ILE-SER-ASP-GLU-GLU-ILE-GLU-ARG-GLN-LEU-LYS-ALA-LEU-GLY-VAL-ASP,89,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CC(C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC[NH+]=C(N)N)CCC(=O)N)CC(C)C,Kd=402uM,3.395774,3.4,1,A,A,1,A,A,0,,B,A,,1,1,89,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)O,1.0020462274551392,0.9121800661087036,91.60942840576172,88.116943359375,0.3505977988243103,0.6395077705383301,0.8747796416282654,0.8797685503959656,0.8486775755882263,0.8500582575798035,KATISDEEIERQLKALGVD,Low,"(2.044, 3.548]",train
2JQL,protein-peptide,P39009 P22216,MAKRQQRSNKPSSEYTCLGHLVNLIPGKEQKVEITNRNVTTIGRSRSCDVILSEPDISTFHAEFHLLQMDVDNFQRNLINVIDKSRNGTFINGNRLVKKDYILKNGDRIVFGKSCSFLFKYASSSSTDIENDDEKVSSESRSYRSHHHHHH,NITQPTQQST,MET-ALA-LYS-ARG-GLN-GLN-ARG-SER-ASN-LYS-PRO-SER-SER-GLU-TYR-THR-CYS-LEU-GLY-HIS-LEU-VAL-ASN-LEU-ILE-PRO-GLY-LYS-GLU-GLN-LYS-VAL-GLU-ILE-THR-ASN-ARG-ASN-VAL-THR-THR-ILE-GLY-ARG-SER-ARG-SER-CYS-ASP-VAL-ILE-LEU-SER-GLU-PRO-ASP-ILE-SER-THR-PHE-HIS-ALA-GLU-PHE-HIS-LEU-LEU-GLN-MET-ASP-VAL-ASP-ASN-PHE-GLN-ARG-ASN-LEU-ILE-ASN-VAL-ILE-ASP-LYS-SER-ARG-ASN-GLY-THR-PHE-ILE-ASN-GLY-ASN-ARG-LEU-VAL-LYS-LYS-ASP-TYR-ILE-LEU-LYS-ASN-GLY-ASP-ARG-ILE-VAL-PHE-GLY-LYS-SER-CYS-SER-PHE-LEU-PHE-LYS-TYR-ALA-SER-SER-SER-SER-THR-ASP-ILE-GLU-ASN-ASP-ASP-GLU-LYS-VAL-SER-SER-GLU-SER-ARG-SER-TYR-ARG-SER-HIS-HIS-HIS-HIS-HIS-HIS,ASN-ILE-TPO-GLN-PRO-TPO-GLN-GLN-SER-THR,151,10,CC[C@@H]([C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCC(=O)N)CCC(=O)N)CCC(=O)N)NC(=O)[C@H](CC(=O)N)[NH3+])C,Kd=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,B,A,,1,1,151,10,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O,CC[C@H](C)[C@H](NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CC(N)=O)C(=O)NC(C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O,0.6622517704963684,0.7817065715789795,60.02175521850586,66.9435043334961,0.7393856048583984,0.9119237661361694,0.687913715839386,0.6786611676216125,0.4617368578910827,0.6501831412315369,NITQPTQQST,Low,"(6.398, 6.523]",train
2K00,protein-peptide,Q8C351 P54939,GVSFFLVKEKMKGKNKLVPRLLGITKECVMRVDEKTKEVIQEWSLTNIKRWAASPKSFTLDFGDYQDGYYSVQTTEGEQIAQLIAGYIDIIL,GRSKESGWVENEIYY,GLY-VAL-SER-PHE-PHE-LEU-VAL-LYS-GLU-LYS-MET-LYS-GLY-LYS-ASN-LYS-LEU-VAL-PRO-ARG-LEU-LEU-GLY-ILE-THR-LYS-GLU-CYS-VAL-MET-ARG-VAL-ASP-GLU-LYS-THR-LYS-GLU-VAL-ILE-GLN-GLU-TRP-SER-LEU-THR-ASN-ILE-LYS-ARG-TRP-ALA-ALA-SER-PRO-LYS-SER-PHE-THR-LEU-ASP-PHE-GLY-ASP-TYR-GLN-ASP-GLY-TYR-TYR-SER-VAL-GLN-THR-THR-GLU-GLY-GLU-GLN-ILE-ALA-GLN-LEU-ILE-ALA-GLY-TYR-ILE-ASP-ILE-ILE-LEU,GLY-ARG-SER-LYS-GLU-SER-GLY-TRP-VAL-GLU-ASN-GLU-ILE-TYR-TYR,92,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)[C@H](CC)C)CCC(=O)O)CC(=O)N)CCC(=O)O)C(C)C)Cc1c[nH]c2c1cccc2)CO)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CCC[NH+]=C(N)N)CO,Kd=24uM,4.619789,4.62,1,A,A,1,A,A,0,,B,A,,1,1,92,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O,0.8884548544883728,0.7389242053031921,91.80072784423828,83.88089752197266,0.370011955499649,0.7800058722496033,0.8796319961547852,0.8068920969963074,0.8030437231063843,0.7219321727752686,GRSKESGWVENEIYY,Low,"(4.606, 4.745]",train
2K2R,protein-peptide,Q9NVD7 P49023,RHERDAFDTLFDHAPDKLNVVKKTLITFVNKHLNKLNLEVTELETQFADGVYLVLLMGLLEGYFVPLHSFFLTPDSFEQKVLNVSFAFELMQDGGLEKPKPRPEDIVNCDLKSTLRVLYNLFTKYRNVE,DLDALLADLE,ARG-HIS-GLU-ARG-ASP-ALA-PHE-ASP-THR-LEU-PHE-ASP-HIS-ALA-PRO-ASP-LYS-LEU-ASN-VAL-VAL-LYS-LYS-THR-LEU-ILE-THR-PHE-VAL-ASN-LYS-HIS-LEU-ASN-LYS-LEU-ASN-LEU-GLU-VAL-THR-GLU-LEU-GLU-THR-GLN-PHE-ALA-ASP-GLY-VAL-TYR-LEU-VAL-LEU-LEU-MET-GLY-LEU-LEU-GLU-GLY-TYR-PHE-VAL-PRO-LEU-HIS-SER-PHE-PHE-LEU-THR-PRO-ASP-SER-PHE-GLU-GLN-LYS-VAL-LEU-ASN-VAL-SER-PHE-ALA-PHE-GLU-LEU-MET-GLN-ASP-GLY-GLY-LEU-GLU-LYS-PRO-LYS-PRO-ARG-PRO-GLU-ASP-ILE-VAL-ASN-CYS-ASP-LEU-LYS-SER-THR-LEU-ARG-VAL-LEU-TYR-ASN-LEU-PHE-THR-LYS-TYR-ARG-ASN-VAL-GLU,ASP-LEU-ASP-ALA-LEU-LEU-ALA-ASP-LEU-GLU,129,10,OC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(C)C)CC(=O)O)C)CC(C)C)CC(C)C)C)CC(=O)O)CC(C)C,Kd=1.3mM,2.886057,2.89,1,A,A,1,A,A,0,,B,A,,1,1,129,10,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7973686456680298,0.8108876347541809,89.23513793945312,74.59610748291016,0.4276213347911834,0.639717161655426,0.8313094973564148,0.846531093120575,0.7439193725585938,0.80197674036026,DLDALLADLE,Low,"(2.044, 3.548]",train
2K3W,protein-peptide,Q9UN37 Q96FZ7,MTTSTLQKAIDLVTKATEEDKAKNYEEALRLYQHAVEYFLHAIKYEAHSDKAKESIRAKCVQYLDRAEKLKDYLRSKEKHGKKP,EQIELPEVPSEPLPEK,MET-THR-THR-SER-THR-LEU-GLN-LYS-ALA-ILE-ASP-LEU-VAL-THR-LYS-ALA-THR-GLU-GLU-ASP-LYS-ALA-LYS-ASN-TYR-GLU-GLU-ALA-LEU-ARG-LEU-TYR-GLN-HIS-ALA-VAL-GLU-TYR-PHE-LEU-HIS-ALA-ILE-LYS-TYR-GLU-ALA-HIS-SER-ASP-LYS-ALA-LYS-GLU-SER-ILE-ARG-ALA-LYS-CYS-VAL-GLN-TYR-LEU-ASP-ARG-ALA-GLU-LYS-LEU-LYS-ASP-TYR-LEU-ARG-SER-LYS-GLU-LYS-HIS-GLY-LYS-LYS-PRO,GLU-GLN-ILE-GLU-LEU-PRO-GLU-VAL-PRO-SER-GLU-PRO-LEU-PRO-GLU-LYS,84,16,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CCC(=O)O)CO)C(C)C)CCC(=O)O)CC(C)C)CCC(=O)O)[NH3+])C,Kd=5.8uM,5.236572,5.24,1,A,A,1,A,A,0,,B,A,,1,1,84,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,0.9992446899414062,0.938467025756836,92.8357925415039,90.9197998046875,0.3317506015300751,0.5174592733383179,0.8943203687667847,0.894658625125885,0.856725811958313,0.8675739169120789,EQIELPEVPSEPLPEK,Low,"(5.222, 5.31]",train
2K7L,protein-peptide,P35269 Q9Y5B0,DVQVTEDAVRRYLTRKPMTTKDLLKKFQTKKTGLSSEQTVNVLAQILKRLNPERKMINDKMHFSLKE,EDTDEDDHLIYLEEILVRV,ASP-VAL-GLN-VAL-THR-GLU-ASP-ALA-VAL-ARG-ARG-TYR-LEU-THR-ARG-LYS-PRO-MET-THR-THR-LYS-ASP-LEU-LEU-LYS-LYS-PHE-GLN-THR-LYS-LYS-THR-GLY-LEU-SER-SER-GLU-GLN-THR-VAL-ASN-VAL-LEU-ALA-GLN-ILE-LEU-LYS-ARG-LEU-ASN-PRO-GLU-ARG-LYS-MET-ILE-ASN-ASP-LYS-MET-HIS-PHE-SER-LEU-LYS-GLU,GLU-ASP-TPO-ASP-GLU-ASP-ASP-HIS-LEU-ILE-TYR-LEU-GLU-GLU-ILE-LEU-VAL-ARG-VAL,67,19,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC[NH+]=C(N)N)C(C)C)CC(C)C)[C@H](CC)C)CCC(=O)O)CCC(=O)O)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CC(=O)O)Cc1nc[nH]c1)CC(C)C)C,Kd=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,B,A,,1,1,67,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)NC(C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)NC(C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,0.9408445954322816,0.6709885001182556,96.26742553710938,82.72834777832031,0.3494011461734772,0.8306941986083984,0.8706069588661194,0.7334612607955933,0.8421249389648438,0.65537029504776,EDTDEDDHLIYLEEILVRV,Low,"(6.097, 6.26]",train
2KBR,protein-peptide,Q9H251 Q9Y6N9,MDRKVAREFRHKVDFLIENDAEKDYLYDVLRMYHQTMDVAVLVGDLKLVINEPSRLPLFDAIRPLIPLKHQVEYDQLTPR,DDDRYLREAIQEYDNIAK,MET-ASP-ARG-LYS-VAL-ALA-ARG-GLU-PHE-ARG-HIS-LYS-VAL-ASP-PHE-LEU-ILE-GLU-ASN-ASP-ALA-GLU-LYS-ASP-TYR-LEU-TYR-ASP-VAL-LEU-ARG-MET-TYR-HIS-GLN-THR-MET-ASP-VAL-ALA-VAL-LEU-VAL-GLY-ASP-LEU-LYS-LEU-VAL-ILE-ASN-GLU-PRO-SER-ARG-LEU-PRO-LEU-PHE-ASP-ALA-ILE-ARG-PRO-LEU-ILE-PRO-LEU-LYS-HIS-GLN-VAL-GLU-TYR-ASP-GLN-LEU-THR-PRO-ARG,ASP-ASP-ASP-ARG-TYR-LEU-ARG-GLU-ALA-ILE-GLN-GLU-TYR-ASP-ASN-ILE-ALA-LYS,80,18,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)O)C)CCC(=O)N)CCC(=O)O)Cc1ccc(cc1)O)CC(=O)O)CC(=O)N)C,Kd=25.4uM,4.595166,4.6,1,A,A,1,A,A,0,,B,A,,1,1,80,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O,0.9857468008995056,0.7658266425132751,96.25706481933594,83.21136474609375,0.3303070664405823,0.8094664812088013,0.9064925909042358,0.811283528804779,0.8907643556594849,0.7466498613357544,DDDRYLREAIQEYDNIAK,Low,"(4.456, 4.606]",train
2KBS,protein-peptide,Q9H251 Q9Y6N9,KEKKVFISLVGSRGLGCSISSGPIQKPGIFISHVKPGSLSAEVGLEIGDQIVEVNGVDFSNLDHKEAVNVLKSSRSLTISIVAAAGRELFMT,TPLEITEL,LYS-GLU-LYS-LYS-VAL-PHE-ILE-SER-LEU-VAL-GLY-SER-ARG-GLY-LEU-GLY-CYS-SER-ILE-SER-SER-GLY-PRO-ILE-GLN-LYS-PRO-GLY-ILE-PHE-ILE-SER-HIS-VAL-LYS-PRO-GLY-SER-LEU-SER-ALA-GLU-VAL-GLY-LEU-GLU-ILE-GLY-ASP-GLN-ILE-VAL-GLU-VAL-ASN-GLY-VAL-ASP-PHE-SER-ASN-LEU-ASP-HIS-LYS-GLU-ALA-VAL-ASN-VAL-LEU-LYS-SER-SER-ARG-SER-LEU-THR-ILE-SER-ILE-VAL-ALA-ALA-ALA-GLY-ARG-GLU-LEU-PHE-MET-THR,THR-PRO-LEU-GLU-ILE-THR-GLU-LEU,92,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)[NH3+])CC(C)C)CCC(=O)O)C,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,B,A,,1,1,92,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9479653239250184,0.838031530380249,97.63963317871094,87.94463348388672,0.3258477747440338,0.538822591304779,0.9075914025306702,0.8859411478042603,0.9080588221549988,0.8260540962219238,TPLEITEL,Low,"(4.866, 5.014]",train
2KE1,protein-peptide,O43918,GAMAQKNEDECAVCRDGGELICCDGCPRAFHLACLSPPLREIPSGTWRCSSCLQATVQEVQPRAEE,ARTKQTARKS,GLY-ALA-MET-ALA-GLN-LYS-ASN-GLU-ASP-GLU-CYS-ALA-VAL-CYS-ARG-ASP-GLY-GLY-GLU-LEU-ILE-CYS-CYS-ASP-GLY-CYS-PRO-ARG-ALA-PHE-HIS-LEU-ALA-CYS-LEU-SER-PRO-PRO-LEU-ARG-GLU-ILE-PRO-SER-GLY-THR-TRP-ARG-CYS-SER-SER-CYS-LEU-GLN-ALA-THR-VAL-GLN-GLU-VAL-GLN-PRO-ARG-ALA-GLU-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER,66,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,66,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.038172721862793,1.0570814609527588,85.625244140625,84.33084869384766,0.4019711315631866,0.5261853933334351,0.791761577129364,0.8612362742424011,0.8448413014411926,0.8598304986953735,ARTKQTARKS,Low,"(5.222, 5.31]",train
2KFF,protein-peptide,Q9H4M9,GPLGSDDVEWVVGKDKPTYDEIFYTLSPVNGKITGANAKKEMVKSKLPNTVLGKIWKLADVDKDGLLDDEEFALANHLIKVKLEGHELPADLPPHLVPPSKRRHE,FNYESTNPFTAK,GLY-PRO-LEU-GLY-SER-ASP-ASP-VAL-GLU-TRP-VAL-VAL-GLY-LYS-ASP-LYS-PRO-THR-TYR-ASP-GLU-ILE-PHE-TYR-THR-LEU-SER-PRO-VAL-ASN-GLY-LYS-ILE-THR-GLY-ALA-ASN-ALA-LYS-LYS-GLU-MET-VAL-LYS-SER-LYS-LEU-PRO-ASN-THR-VAL-LEU-GLY-LYS-ILE-TRP-LYS-LEU-ALA-ASP-VAL-ASP-LYS-ASP-GLY-LEU-LEU-ASP-ASP-GLU-GLU-PHE-ALA-LEU-ALA-ASN-HIS-LEU-ILE-LYS-VAL-LYS-LEU-GLU-GLY-HIS-GLU-LEU-PRO-ALA-ASP-LEU-PRO-PRO-HIS-LEU-VAL-PRO-PRO-SER-LYS-ARG-ARG-HIS-GLU,PHE-ASN-TYR-GLU-SER-THR-ASN-PRO-PHE-THR-ALA-LYS,105,12,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(=O)N)Cc1ccc(cc1)O)CCC(=O)O)CO)CC(=O)N)Cc1ccccc1)C,Kd=245uM,3.610834,3.61,1,A,A,1,A,A,0,,B,A,,1,1,105,12,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9190248250961304,0.7616599798202515,86.53208923339844,87.68994140625,0.3504988551139831,0.7038158774375916,0.8996497392654419,0.8267766237258911,0.8277146816253662,0.7453808188438416,FNYESTNPFTAK,Low,"(3.548, 3.924]",train
2KFG,protein-peptide,Q9H4M9,GPLGSDDVEWVVGKDKPTYDEIFYTLSPVNGKITGANAKKEMVKSKLPNTVLGKIWKLADVDKDGLLDDEEFALANHLIKVKLEGHELPADLPPHLVPPSKRRHE,FNYESTDPFTAK,GLY-PRO-LEU-GLY-SER-ASP-ASP-VAL-GLU-TRP-VAL-VAL-GLY-LYS-ASP-LYS-PRO-THR-TYR-ASP-GLU-ILE-PHE-TYR-THR-LEU-SER-PRO-VAL-ASN-GLY-LYS-ILE-THR-GLY-ALA-ASN-ALA-LYS-LYS-GLU-MET-VAL-LYS-SER-LYS-LEU-PRO-ASN-THR-VAL-LEU-GLY-LYS-ILE-TRP-LYS-LEU-ALA-ASP-VAL-ASP-LYS-ASP-GLY-LEU-LEU-ASP-ASP-GLU-GLU-PHE-ALA-LEU-ALA-ASN-HIS-LEU-ILE-LYS-VAL-LYS-LEU-GLU-GLY-HIS-GLU-LEU-PRO-ALA-ASP-LEU-PRO-PRO-HIS-LEU-VAL-PRO-PRO-SER-LYS-ARG-ARG-HIS-GLU,PHE-ASN-TYR-GLU-SER-THR-ASP-PRO-PHE-THR-ALA-LYS,105,12,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(=O)N)Cc1ccc(cc1)O)CCC(=O)O)CO)CC(=O)O)Cc1ccccc1)C,Kd=1.2mM,2.920819,2.92,1,A,A,1,A,A,0,,B,A,,1,1,105,12,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O,0.9225466251373292,0.7572914361953735,85.62945556640625,87.97994232177734,0.350165992975235,0.7283571362495422,0.9020284414291382,0.8256635665893555,0.8261803984642029,0.7401984333992004,FNYESTDPFTAK,Low,"(2.044, 3.548]",train
2KFH,protein-peptide,Q9H4M9,GPLGSDDVEWVVGKDKPTYDEIFYTLSPVNGKITGANAKKEMVKSKLPNTVLGKIWKLADVDKDGLLDDEEFALANHLIKVKLEGHELPADLPPHLVPPSKRRHE,FNYESTGPFTAK,GLY-PRO-LEU-GLY-SER-ASP-ASP-VAL-GLU-TRP-VAL-VAL-GLY-LYS-ASP-LYS-PRO-THR-TYR-ASP-GLU-ILE-PHE-TYR-THR-LEU-SER-PRO-VAL-ASN-GLY-LYS-ILE-THR-GLY-ALA-ASN-ALA-LYS-LYS-GLU-MET-VAL-LYS-SER-LYS-LEU-PRO-ASN-THR-VAL-LEU-GLY-LYS-ILE-TRP-LYS-LEU-ALA-ASP-VAL-ASP-LYS-ASP-GLY-LEU-LEU-ASP-ASP-GLU-GLU-PHE-ALA-LEU-ALA-ASN-HIS-LEU-ILE-LYS-VAL-LYS-LEU-GLU-GLY-HIS-GLU-LEU-PRO-ALA-ASP-LEU-PRO-PRO-HIS-LEU-VAL-PRO-PRO-SER-LYS-ARG-ARG-HIS-GLU,PHE-ASN-TYR-GLU-SER-THR-GLY-PRO-PHE-THR-ALA-LYS,105,12,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(=O)N)Cc1ccc(cc1)O)CCC(=O)O)CO)Cc1ccccc1)C,Kd=2.4mM,2.619789,2.62,1,A,A,1,A,A,0,,B,A,,1,1,105,12,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.902726948261261,0.7250509262084961,87.05060577392578,88.29119110107422,0.3704832792282104,0.7570194005966187,0.8873347043991089,0.8119374513626099,0.8104211688041687,0.7033292651176453,FNYESTGPFTAK,Low,"(2.044, 3.548]",train
2KHH,protein-peptide,Q99257,GSRLNPVQLELLNKLHLETKLNAEYTFMLAEQSNWNYEVAIKGFQSSMNGIPREAFVQF,DSGFSFGSK,GLY-SER-ARG-LEU-ASN-PRO-VAL-GLN-LEU-GLU-LEU-LEU-ASN-LYS-LEU-HIS-LEU-GLU-THR-LYS-LEU-ASN-ALA-GLU-TYR-THR-PHE-MET-LEU-ALA-GLU-GLN-SER-ASN-TRP-ASN-TYR-GLU-VAL-ALA-ILE-LYS-GLY-PHE-GLN-SER-SER-MET-ASN-GLY-ILE-PRO-ARG-GLU-ALA-PHE-VAL-GLN-PHE,ASP-SER-GLY-PHE-SER-PHE-GLY-SER-LYS,59,9,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CO)CO)Cc1ccccc1)CO,Kd=276nM,6.559091,6.56,1,A,A,1,A,A,0,,B,A,,1,1,59,9,0,NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8713554739952087,0.7905681133270264,94.98550415039062,91.12261199951172,0.3369718194007873,0.5960703492164612,0.8689343333244324,0.842754065990448,0.7892401218414307,0.7775216698646545,DSGFSFGSK,Low,"(6.523, 6.696]",train
2KNH,protein-peptide,Q99081 Q06455,GAMGSGARQLSKLKRFLTTLQQFGNDISPEIGERVRTLVLGLVNSTLTIEEFHSKLQEATNFPLRPFVIPFLKANLPLLQRELLHCARLAKQNPAQYLAQHEQ,IGTDKELSDLLDFSAMFS,GLY-ALA-MET-GLY-SER-GLY-ALA-ARG-GLN-LEU-SER-LYS-LEU-LYS-ARG-PHE-LEU-THR-THR-LEU-GLN-GLN-PHE-GLY-ASN-ASP-ILE-SER-PRO-GLU-ILE-GLY-GLU-ARG-VAL-ARG-THR-LEU-VAL-LEU-GLY-LEU-VAL-ASN-SER-THR-LEU-THR-ILE-GLU-GLU-PHE-HIS-SER-LYS-LEU-GLN-GLU-ALA-THR-ASN-PHE-PRO-LEU-ARG-PRO-PHE-VAL-ILE-PRO-PHE-LEU-LYS-ALA-ASN-LEU-PRO-LEU-LEU-GLN-ARG-GLU-LEU-LEU-HIS-CYS-ALA-ARG-LEU-ALA-LYS-GLN-ASN-PRO-ALA-GLN-TYR-LEU-ALA-GLN-HIS-GLU-GLN,ILE-GLY-THR-ASP-LYS-GLU-LEU-SER-ASP-LEU-LEU-ASP-PHE-SER-ALA-MET-PHE-SER,103,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1ccccc1)CCSC)C)CO)Cc1ccccc1)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CO)CC(C)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@H]([C@H](CC)C)[NH3+])CC(=O)O,Kd=7uM,5.154902,5.15,1,A,A,1,A,A,0,,B,A,,1,1,103,18,0,CC[C@H](C)[C@H](N)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)O)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9518896341323853,0.718242347240448,91.8033447265625,85.47257232666016,0.397288054227829,0.876348614692688,0.8687103390693665,0.7957552671432495,0.8125605583190918,0.6988640427589417,IGTDKELSDLLDFSAMFS,Low,"(5.105, 5.222]",train
2KOH,protein-peptide,P55284 Q99NH2,GSDGTREFLTFEVPLNDSGSAGLGVSVKGNRSKENHADLGIFVKSIINGGAASKDGRLRVNDQLIAVNGESLLGKANQEAMETLRRSMSTEGNKRGMIQLIVARRISRCNE,MLAELYGSDPQEELII,GLY-SER-ASP-GLY-THR-ARG-GLU-PHE-LEU-THR-PHE-GLU-VAL-PRO-LEU-ASN-ASP-SER-GLY-SER-ALA-GLY-LEU-GLY-VAL-SER-VAL-LYS-GLY-ASN-ARG-SER-LYS-GLU-ASN-HIS-ALA-ASP-LEU-GLY-ILE-PHE-VAL-LYS-SER-ILE-ILE-ASN-GLY-GLY-ALA-ALA-SER-LYS-ASP-GLY-ARG-LEU-ARG-VAL-ASN-ASP-GLN-LEU-ILE-ALA-VAL-ASN-GLY-GLU-SER-LEU-LEU-GLY-LYS-ALA-ASN-GLN-GLU-ALA-MET-GLU-THR-LEU-ARG-ARG-SER-MET-SER-THR-GLU-GLY-ASN-LYS-ARG-GLY-MET-ILE-GLN-LEU-ILE-VAL-ALA-ARG-ARG-ILE-SER-ARG-CYS-ASN-GLU,MET-LEU-ALA-GLU-LEU-TYR-GLY-SER-ASP-PRO-GLN-GLU-GLU-LEU-ILE-ILE,111,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)[C@H](CC)C)CC(C)C)CCC(=O)O)CCC(=O)O)CCC(=O)N)CC(=O)O)CO)Cc1ccc(cc1)O)CC(C)C)CCC(=O)O)C)CC(C)C)[NH3+],Kd=6uM,5.221849,5.22,1,A,A,1,A,A,0,,B,A,,1,1,111,16,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCSC)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)O,0.8894573450088501,0.7836362719535828,87.22135925292969,81.78523254394531,0.4141514897346496,0.7446995377540588,0.8696564435958862,0.8359641432762146,0.8156673908233643,0.7705543041229248,MLAELYGSDPQEELII,Low,"(5.105, 5.222]",train
2KPL,protein-peptide,Q96QZ7 P03126,GAMGKPFFTRNPSELKGKFIHTKLRKSSRGFGFTVVGGDEPDEFLQIKSLVLDGPAALDGKMETGDVIVSVNDTCVLGHTHAQVVKIFQSIPIGASVDLELCRGYPLPFDPDDPNTSLVTSVAILDKEP,RSSRTRRETQV,GLY-ALA-MET-GLY-LYS-PRO-PHE-PHE-THR-ARG-ASN-PRO-SER-GLU-LEU-LYS-GLY-LYS-PHE-ILE-HIS-THR-LYS-LEU-ARG-LYS-SER-SER-ARG-GLY-PHE-GLY-PHE-THR-VAL-VAL-GLY-GLY-ASP-GLU-PRO-ASP-GLU-PHE-LEU-GLN-ILE-LYS-SER-LEU-VAL-LEU-ASP-GLY-PRO-ALA-ALA-LEU-ASP-GLY-LYS-MET-GLU-THR-GLY-ASP-VAL-ILE-VAL-SER-VAL-ASN-ASP-THR-CYS-VAL-LEU-GLY-HIS-THR-HIS-ALA-GLN-VAL-VAL-LYS-ILE-PHE-GLN-SER-ILE-PRO-ILE-GLY-ALA-SER-VAL-ASP-LEU-GLU-LEU-CYS-ARG-GLY-TYR-PRO-LEU-PRO-PHE-ASP-PRO-ASP-ASP-PRO-ASN-THR-SER-LEU-VAL-THR-SER-VAL-ALA-ILE-LEU-ASP-LYS-GLU-PRO,ARG-SER-SER-ARG-THR-ARG-ARG-GLU-THR-GLN-VAL,129,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)N)[C@H](O)C)CCC(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](O)C)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CO,Kd=0.23uM,6.638272,6.64,1,A,A,1,A,A,0,,B,A,,1,1,129,11,0,CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.8899137377738953,0.8278691172599792,91.94770050048828,88.43382263183594,0.4450911283493042,0.6923351883888245,0.8443369269371033,0.8653110265731812,0.8522007465362549,0.8039737343788147,RSSRTRRETQV,Low,"(6.523, 6.696]",train
2KSP,protein-peptide,Q8N3F8 Q9H4M9,GPLGSDDVEWVVGKDKPTYDEIFYTLSPVNGKITGANAKKEMVKSKLPNTVLGKIWKLADVDKDGLLDDEEFALANHLIKVKLEGHELPADLPPHLVPPSKRRHE,LESKPYNPFEEEEED,GLY-PRO-LEU-GLY-SER-ASP-ASP-VAL-GLU-TRP-VAL-VAL-GLY-LYS-ASP-LYS-PRO-THR-TYR-ASP-GLU-ILE-PHE-TYR-THR-LEU-SER-PRO-VAL-ASN-GLY-LYS-ILE-THR-GLY-ALA-ASN-ALA-LYS-LYS-GLU-MET-VAL-LYS-SER-LYS-LEU-PRO-ASN-THR-VAL-LEU-GLY-LYS-ILE-TRP-LYS-LEU-ALA-ASP-VAL-ASP-LYS-ASP-GLY-LEU-LEU-ASP-ASP-GLU-GLU-PHE-ALA-LEU-ALA-ASN-HIS-LEU-ILE-LYS-VAL-LYS-LEU-GLU-GLY-HIS-GLU-LEU-PRO-ALA-ASP-LEU-PRO-PRO-HIS-LEU-VAL-PRO-PRO-SER-LYS-ARG-ARG-HIS-GLU,LEU-GLU-SER-LYS-PRO-TYR-ASN-PRO-PHE-GLU-GLU-GLU-GLU-GLU-ASP,105,15,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)Cc1ccccc1)CC(=O)N)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CCC(=O)O)CO,Kd=57uM,4.244125,4.24,1,A,A,1,A,A,0,,B,A,,1,1,105,15,0,CC(C)C[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9351468086242676,0.8275942802429199,88.03665924072266,88.07108306884766,0.373666912317276,0.7032479643821716,0.8776224851608276,0.8451706171035767,0.8245278596878052,0.7874858975410461,LESKPYNPFEEEEED,Low,"(4.155, 4.319]",val
2KUP,protein-peptide,O43559 Q9UM73,GSSGSSGLNRDSVPDNHPTKFKVTNVDDEGVELGSGVMELTQSELVLHLHRREAVRWPYLCLRRYGYDSNLFSFESGRRCQTGQGIFAFKCSRAEEIFNLLQDLMQCNSINVMEEPVIITRNSHPAELDLPRAPQPPNALGYTVSS,LFRLRHFPCGNVNYGYQQQ,GLY-SER-SER-GLY-SER-SER-GLY-LEU-ASN-ARG-ASP-SER-VAL-PRO-ASP-ASN-HIS-PRO-THR-LYS-PHE-LYS-VAL-THR-ASN-VAL-ASP-ASP-GLU-GLY-VAL-GLU-LEU-GLY-SER-GLY-VAL-MET-GLU-LEU-THR-GLN-SER-GLU-LEU-VAL-LEU-HIS-LEU-HIS-ARG-ARG-GLU-ALA-VAL-ARG-TRP-PRO-TYR-LEU-CYS-LEU-ARG-ARG-TYR-GLY-TYR-ASP-SER-ASN-LEU-PHE-SER-PHE-GLU-SER-GLY-ARG-ARG-CYS-GLN-THR-GLY-GLN-GLY-ILE-PHE-ALA-PHE-LYS-CYS-SER-ARG-ALA-GLU-GLU-ILE-PHE-ASN-LEU-LEU-GLN-ASP-LEU-MET-GLN-CYS-ASN-SER-ILE-ASN-VAL-MET-GLU-GLU-PRO-VAL-ILE-ILE-THR-ARG-ASN-SER-HIS-PRO-ALA-GLU-LEU-ASP-LEU-PRO-ARG-ALA-PRO-GLN-PRO-PRO-ASN-ALA-LEU-GLY-TYR-THR-VAL-SER-SER,LEU-PHE-ARG-LEU-ARG-HIS-PHE-PRO-CYS-GLY-ASN-VAL-ASN-TYR-GLY-TYR-GLN-GLN-GLN,146,19,SC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)N)CCC(=O)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(=O)N)C(C)C)CC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCC[NH+]=C(N)N)CC(C)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)Cc1ccccc1,Kd=0.2uM,6.69897,6.7,1,A,A,1,A,A,0,,B,A,,1,1,146,19,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C,1.0175447463989258,0.9260869026184082,75.45838928222656,69.6609115600586,0.4994411170482635,0.8150579333305359,0.7748892307281494,0.7789561152458191,0.8282085061073303,0.7830750942230225,LFRLRHFPCGNVNYGYQQQ,Low,"(6.696, 6.824]",train
2KVM,protein-peptide,Q8VDS3,GSHMELSAIGEQVFAVESIRKKRVRKGKVEYLVKWKGWPPKYSTWEPEEHILDPRLVMAYEEKEERDRASGYRK,APRKQLATKAARKSAP,GLY-SER-HIS-MET-GLU-LEU-SER-ALA-ILE-GLY-GLU-GLN-VAL-PHE-ALA-VAL-GLU-SER-ILE-ARG-LYS-LYS-ARG-VAL-ARG-LYS-GLY-LYS-VAL-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-PRO-PRO-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-HIS-ILE-LEU-ASP-PRO-ARG-LEU-VAL-MET-ALA-TYR-GLU-GLU-LYS-GLU-GLU-ARG-ASP-ARG-ALA-SER-GLY-TYR-ARG-LYS,ALA-PRO-ARG-LYS-GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-MLY-SER-ALA-PRO,74,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)CO)CCCC[NH+](C)C)CCC[NH+]=C(N)N)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH3+])CCC(=O)N)CC(C)C)C,Kd=108.4uM,3.964971,3.96,1,A,A,1,A,A,0,,B,A,,1,1,74,16,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,1.0531132221221924,0.9225896596908568,88.4739761352539,84.7531509399414,0.3686642944812774,0.8068479299545288,0.8427368402481079,0.7787899971008301,0.7932072877883911,0.722053050994873,APRKQLATKAARKSAP,Low,"(3.924, 4.155]",train
2KWN,protein-peptide,Q92784 P62805,GSYCDFCLGGSNMNKKSGRPEELVSCADCGRSGHPTCLQFTLNMTEAVKTYKWQCIECKSCILCGTSENDDQLLFCDDCDRGYHMYCLNPPVAEPPEGSWSCHLCWELLKEKAS,GLGKGGAKRHRKVLR,GLY-SER-TYR-CYS-ASP-PHE-CYS-LEU-GLY-GLY-SER-ASN-MET-ASN-LYS-LYS-SER-GLY-ARG-PRO-GLU-GLU-LEU-VAL-SER-CYS-ALA-ASP-CYS-GLY-ARG-SER-GLY-HIS-PRO-THR-CYS-LEU-GLN-PHE-THR-LEU-ASN-MET-THR-GLU-ALA-VAL-LYS-THR-TYR-LYS-TRP-GLN-CYS-ILE-GLU-CYS-LYS-SER-CYS-ILE-LEU-CYS-GLY-THR-SER-GLU-ASN-ASP-ASP-GLN-LEU-LEU-PHE-CYS-ASP-ASP-CYS-ASP-ARG-GLY-TYR-HIS-MET-TYR-CYS-LEU-ASN-PRO-PRO-VAL-ALA-GLU-PRO-PRO-GLU-GLY-SER-TRP-SER-CYS-HIS-LEU-CYS-TRP-GLU-LEU-LEU-LYS-GLU-LYS-ALA-SER,GLY-LEU-GLY-LYS-GLY-GLY-ALA-ALY-ARG-HIS-ARG-LYS-VAL-LEU-ARG,114,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)C[NH3+])CC(C)C)CCCC[NH3+])C)CCCCNC(=O)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N,Kd=7.4uM,5.130768,5.13,1,A,A,1,A,A,0,,B,A,,1,1,114,15,0,CC(C)C[C@H](NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,0.8221760988235474,0.7998858094215393,82.41573333740234,90.20657348632812,0.4487819075584411,0.7058554291725159,0.8522747159004211,0.8584099411964417,0.7419769167900085,0.785254716873169,GLGKGGAKRHRKVLR,Low,"(5.105, 5.222]",train
2KZU,protein-peptide,Q9NS23 Q9UER7,GSHMGKKCYKLENEKLFEEFLELCKMQTADHPEVVPFLYNRQQRAHSLFLASAEFCNILSRVLSRARSRPAKLYVYINELCTVLKAHSAKKKLN,GSQEDSDSELEQYFTARW,GLY-SER-HIS-MET-GLY-LYS-LYS-CYS-TYR-LYS-LEU-GLU-ASN-GLU-LYS-LEU-PHE-GLU-GLU-PHE-LEU-GLU-LEU-CYS-LYS-MET-GLN-THR-ALA-ASP-HIS-PRO-GLU-VAL-VAL-PRO-PHE-LEU-TYR-ASN-ARG-GLN-GLN-ARG-ALA-HIS-SER-LEU-PHE-LEU-ALA-SER-ALA-GLU-PHE-CYS-ASN-ILE-LEU-SER-ARG-VAL-LEU-SER-ARG-ALA-ARG-SER-ARG-PRO-ALA-LYS-LEU-TYR-VAL-TYR-ILE-ASN-GLU-LEU-CYS-THR-VAL-LEU-LYS-ALA-HIS-SER-ALA-LYS-LYS-LYS-LEU-ASN,GLY-SER-GLN-GLU-ASP-SER-ASP-SER-GLU-LEU-GLU-GLN-TYR-PHE-THR-ALA-ARG-TRP,94,18,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)C)[C@H](O)C)Cc1ccccc1)Cc1ccc(cc1)O)CCC(=O)N)CCC(=O)O)CC(C)C)CCC(=O)O)CO)CC(=O)O)CO)CC(=O)O)CCC(=O)O)CCC(=O)N)CO,Kd=60uM,4.221849,4.22,1,A,A,1,A,A,0,,B,A,,1,1,94,18,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8809848427772522,0.7030839323997498,91.47116088867188,86.91265106201172,0.3703592717647552,0.8585457801818848,0.8794944882392883,0.7743757367134094,0.8311341404914856,0.6852609515190125,GSQEDSDSELEQYFTARW,Low,"(4.155, 4.319]",train
2L0I,protein-peptide,Q05543 P04050,MAFSSEQFTTKLNTLEDSQESISSASKWLLLQYRDAPKVAEMWKEYMLRPSVNTRRKLLGLYLMNHVVQQAKGQKIIQFQDSFGKVAAEVLGRINQEFPRDLKKKLSRVVNILKERNIFSKQVVNDIERSLAAALEHHHHHH,YSPTSPSYSPTSPS,MET-ALA-PHE-SER-SER-GLU-GLN-PHE-THR-THR-LYS-LEU-ASN-THR-LEU-GLU-ASP-SER-GLN-GLU-SER-ILE-SER-SER-ALA-SER-LYS-TRP-LEU-LEU-LEU-GLN-TYR-ARG-ASP-ALA-PRO-LYS-VAL-ALA-GLU-MET-TRP-LYS-GLU-TYR-MET-LEU-ARG-PRO-SER-VAL-ASN-THR-ARG-ARG-LYS-LEU-LEU-GLY-LEU-TYR-LEU-MET-ASN-HIS-VAL-VAL-GLN-GLN-ALA-LYS-GLY-GLN-LYS-ILE-ILE-GLN-PHE-GLN-ASP-SER-PHE-GLY-LYS-VAL-ALA-ALA-GLU-VAL-LEU-GLY-ARG-ILE-ASN-GLN-GLU-PHE-PRO-ARG-ASP-LEU-LYS-LYS-LYS-LEU-SER-ARG-VAL-VAL-ASN-ILE-LEU-LYS-GLU-ARG-ASN-ILE-PHE-SER-LYS-GLN-VAL-VAL-ASN-ASP-ILE-GLU-ARG-SER-LEU-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,TYR-SER-PRO-THR-SER-PRO-SER-TYR-SEP-PRO-THR-SER-PRO-SER,142,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CO)COP(O)(O)O,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,B,A,,1,1,142,14,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,0.9053948521614076,0.783937394618988,86.88690948486328,88.66551971435547,0.3508276641368866,0.64573734998703,0.917841374874115,0.8646090626716614,0.8461934328079224,0.7637694478034973,YSPTSPSYSPTSPS,Low,"(4.745, 4.866]",val
2L11,protein-peptide,Q13185 P84233,GEFVVEKVLDRRVVNGKVEYFLKWKGFTDADNTWEPEENLDCPELIEAFLNSQK,ARTKQTARKSTGGKA,GLY-GLU-PHE-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-VAL-VAL-ASN-GLY-LYS-VAL-GLU-TYR-PHE-LEU-LYS-TRP-LYS-GLY-PHE-THR-ASP-ALA-ASP-ASN-THR-TRP-GLU-PRO-GLU-GLU-ASN-LEU-ASP-CYS-PRO-GLU-LEU-ILE-GLU-ALA-PHE-LEU-ASN-SER-GLN-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,54,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,B,A,,1,1,54,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9489812850952148,0.8119250535964966,94.78662872314452,92.3703155517578,0.3205859065055847,0.6105521321296692,0.8855880498886108,0.8497393131256104,0.8289600014686584,0.8024714589118958,ARTKQTARKSTGGKA,Low,"(4.745, 4.866]",train
2L12,protein-peptide,O95931 P84233,GEQVFAVESIRKKRVRKGKVEYLVKWKGWPPKYSTWEPEEHILDPRLVMAYEEKEE,ARTKQTARKSTGGKA,GLY-GLU-GLN-VAL-PHE-ALA-VAL-GLU-SER-ILE-ARG-LYS-LYS-ARG-VAL-ARG-LYS-GLY-LYS-VAL-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-PRO-PRO-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-HIS-ILE-LEU-ASP-PRO-ARG-LEU-VAL-MET-ALA-TYR-GLU-GLU-LYS-GLU-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,56,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=55uM,4.259637,4.26,1,A,A,1,A,A,0,,B,A,,1,1,56,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9274048209190368,0.7912532687187195,90.65725708007812,91.93531036376952,0.3525537252426147,0.6693857312202454,0.8642398715019226,0.8336936235427856,0.811153769493103,0.7806431651115417,ARTKQTARKSTGGKA,Low,"(4.155, 4.319]",train
2L1B,protein-peptide,Q92133 O95931,GEQVFAVESIRKKRVRKGKVEYLVKWKGWPPKYSTWEPEEHILDPRLVMAYEEKEE,QLATKAARKSAPATG,GLY-GLU-GLN-VAL-PHE-ALA-VAL-GLU-SER-ILE-ARG-LYS-LYS-ARG-VAL-ARG-LYS-GLY-LYS-VAL-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-PRO-PRO-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-HIS-ILE-LEU-ASP-PRO-ARG-LEU-VAL-MET-ALA-TYR-GLU-GLU-LYS-GLU-GLU,GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-M3L-SER-ALA-PRO-ALA-THR-GLY,56,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)C)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CC(C)C)C,Kd=110uM,3.958607,3.96,1,A,A,1,A,A,0,,B,A,,1,1,56,15,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.9193186163902284,0.8637573719024658,90.49481201171876,94.13408660888672,0.3536047041416168,0.5036468505859375,0.861316978931427,0.8888450264930725,0.8017767667770386,0.8574854135513306,QLATKAARKSAPATG,Low,"(3.924, 4.155]",val
2L3R,protein-peptide,Q3BDD9 Q96T88,GGMWDETELGLYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRDEPCSSTSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGE,ARTKQTARKST,GLY-GLY-MET-TRP-ASP-GLU-THR-GLU-LEU-GLY-LEU-TYR-LYS-VAL-ASN-GLU-TYR-VAL-ASP-ALA-ARG-ASP-THR-ASN-MET-GLY-ALA-TRP-PHE-GLU-ALA-GLN-VAL-VAL-ARG-VAL-THR-ARG-LYS-ALA-PRO-SER-ARG-ASP-GLU-PRO-CYS-SER-SER-THR-SER-ARG-PRO-ALA-LEU-GLU-GLU-ASP-VAL-ILE-TYR-HIS-VAL-LYS-TYR-ASP-ASP-TYR-PRO-GLU-ASN-GLY-VAL-VAL-GLN-MET-ASN-SER-ARG-ASP-VAL-ARG-ALA-ARG-ALA-ARG-THR-ILE-ILE-LYS-TRP-GLN-ASP-LEU-GLU-VAL-GLY-GLN-VAL-VAL-MET-LEU-ASN-TYR-ASN-PRO-ASP-ASN-PRO-LYS-GLU-ARG-GLY-PHE-TRP-TYR-ASP-ALA-GLU-ILE-SER-ARG-LYS-ARG-GLU-THR-ARG-THR-ALA-ARG-GLU-LEU-TYR-ALA-ASN-VAL-VAL-LEU-GLY-ASP-ASP-SER-LEU-ASN-ASP-CYS-ARG-ILE-ILE-PHE-VAL-ASP-GLU-VAL-PHE-LYS-ILE-GLU-ARG-PRO-GLY-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR,162,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=22uM,4.657577,4.66,1,A,A,1,A,A,0,,B,A,,1,1,162,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8868920803070068,0.8829891681671143,74.0662841796875,84.94801330566406,0.3905656635761261,0.5720791220664978,0.8900652527809143,0.8929444551467896,0.8463588953018188,0.8805003762245178,ARTKQTARKST,Low,"(4.606, 4.745]",val
2L6E,protein-peptide,P35963,MGSSHHHHHHSSGLVPRGSHMTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKNAATETLLVQNANPDCKTILKALGPAATLEEMMTACQGVGGPGHKARVL,ITFLDLLLYYGKKK,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-ALA-ALA-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-ALA-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,ILE-THR-PHE-MK8-ASP-LEU-LEU-MK8-TYR-TYR-GLY-LYS-LYS-LYS,105,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCCC[NH3+])NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)[NH3+])Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC(C)C)CC(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O,Kd=1uM,6.0,6.0,1,A,A,1,A,A,0,,B,A,,1,1,105,14,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CCCCC(C)(N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CCCCC(C)(N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)[C@@H](C)O,0.9314846992492676,0.9026153087615968,75.91520690917969,73.56243133544922,0.5055953860282898,0.7604199647903442,0.7229535579681396,0.7837998270988464,0.7735334038734436,0.7894620299339294,ITFLDLLLYYGKKK,Low,"(5.959, 6.097]",train
2L6J,protein-peptide,P25638 P08238,MSQFEKQKEQGNSLFKQGLYREAVHCYDQLITAQPQNPVGYSNKAMALIKLGEYTQAIQMCQQGLRYTSTAEHVAIRSKLQYRLELAQGAVGSVQIPVVEVDELPEGYDRS,MEEVD,MET-SER-GLN-PHE-GLU-LYS-GLN-LYS-GLU-GLN-GLY-ASN-SER-LEU-PHE-LYS-GLN-GLY-LEU-TYR-ARG-GLU-ALA-VAL-HIS-CYS-TYR-ASP-GLN-LEU-ILE-THR-ALA-GLN-PRO-GLN-ASN-PRO-VAL-GLY-TYR-SER-ASN-LYS-ALA-MET-ALA-LEU-ILE-LYS-LEU-GLY-GLU-TYR-THR-GLN-ALA-ILE-GLN-MET-CYS-GLN-GLN-GLY-LEU-ARG-TYR-THR-SER-THR-ALA-GLU-HIS-VAL-ALA-ILE-ARG-SER-LYS-LEU-GLN-TYR-ARG-LEU-GLU-LEU-ALA-GLN-GLY-ALA-VAL-GLY-SER-VAL-GLN-ILE-PRO-VAL-VAL-GLU-VAL-ASP-GLU-LEU-PRO-GLU-GLY-TYR-ASP-ARG-SER,MET-GLU-GLU-VAL-ASP,111,5,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)[NH3+],Kd=0.55uM,6.259637,6.26,1,A,A,1,A,A,0,,B,A,,1,1,111,5,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,0.8024533987045288,0.9773082733154296,71.45952606201172,80.53974151611328,0.4348932802677154,0.4435604214668274,0.7601318359375,0.8824580311775208,0.7753182649612427,0.9221919775009156,MEEVD,Low,"(6.097, 6.26]",train
2L75,protein-peptide,Q14839 P68431,GPLGSDHHMEFCRVCKDGGELLCCDTCPSSYHIHCLNPPLPEIPNGEWLCPRCTCPALKGK,ARTKQTARKSTGGY,GLY-PRO-LEU-GLY-SER-ASP-HIS-HIS-MET-GLU-PHE-CYS-ARG-VAL-CYS-LYS-ASP-GLY-GLY-GLU-LEU-LEU-CYS-CYS-ASP-THR-CYS-PRO-SER-SER-TYR-HIS-ILE-HIS-CYS-LEU-ASN-PRO-PRO-LEU-PRO-GLU-ILE-PRO-ASN-GLY-GLU-TRP-LEU-CYS-PRO-ARG-CYS-THR-CYS-PRO-ALA-LEU-LYS-GLY-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-TYR,61,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,B,A,,1,1,61,14,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.0221449136734009,0.9177420139312744,86.59265899658203,83.6379623413086,0.4215219616889953,0.7277699112892151,0.7892496585845947,0.787016749382019,0.7470353245735168,0.7250134944915771,ARTKQTARKSTGGY,Low,"(5.959, 6.097]",train
2L7U,protein-peptide,P02769 Q15109,GSAQNITARIGEPLVLKCKGAPKKPPQRLEWKLNTGRTEAWKVLSPQGGGPWDSVARVLPNGSLFLPAVGIQDEGIFRCQAMNRNGKETKSNYRVRVYQIPGKPE,DEFKADE,GLY-SER-ALA-GLN-ASN-ILE-THR-ALA-ARG-ILE-GLY-GLU-PRO-LEU-VAL-LEU-LYS-CYS-LYS-GLY-ALA-PRO-LYS-LYS-PRO-PRO-GLN-ARG-LEU-GLU-TRP-LYS-LEU-ASN-THR-GLY-ARG-THR-GLU-ALA-TRP-LYS-VAL-LEU-SER-PRO-GLN-GLY-GLY-GLY-PRO-TRP-ASP-SER-VAL-ALA-ARG-VAL-LEU-PRO-ASN-GLY-SER-LEU-PHE-LEU-PRO-ALA-VAL-GLY-ILE-GLN-ASP-GLU-GLY-ILE-PHE-ARG-CYS-GLN-ALA-MET-ASN-ARG-ASN-GLY-LYS-GLU-THR-LYS-SER-ASN-TYR-ARG-VAL-ARG-VAL-TYR-GLN-ILE-PRO-GLY-LYS-PRO-GLU,ASP-GLU-PHE-KPI-ALA-ASP-GLU,105,7,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(=O)O)C)CCCC[NH2+][C@@H](C(=O)O)C)Cc1ccccc1)NC(=O)[C@H](CC(=O)O)[NH3+],Kd=104uM,3.982967,3.98,1,A,A,1,A,A,0,,B,A,,1,1,105,7,0,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(=NCCCCC(NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(=NCCCCC(NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8665586709976196,0.8061692714691162,81.91024017333984,88.9464340209961,0.3737216293811798,0.6368198990821838,0.8946183323860168,0.8482873439788818,0.8204812407493591,0.7956397533416748,DEFKADE,Low,"(3.924, 4.155]",val
2L8J,protein-peptide,Q9H0R8 Q14596,GSPEFKFQYKEDHPFEYRKKEGEKIRKKYPDRVPVIVEKAPKARVPDLDKRKYLVPSDLTVGQFYFLIRKRIHLRPEDALFFFVNNTIPPTSATMGQLYEDNHEEDYFLYVAYSDESVY,GAMGSASSEDYIIILPES,GLY-SER-PRO-GLU-PHE-LYS-PHE-GLN-TYR-LYS-GLU-ASP-HIS-PRO-PHE-GLU-TYR-ARG-LYS-LYS-GLU-GLY-GLU-LYS-ILE-ARG-LYS-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-ALA-ARG-VAL-PRO-ASP-LEU-ASP-LYS-ARG-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-HIS-LEU-ARG-PRO-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-THR-ILE-PRO-PRO-THR-SER-ALA-THR-MET-GLY-GLN-LEU-TYR-GLU-ASP-ASN-HIS-GLU-GLU-ASP-TYR-PHE-LEU-TYR-VAL-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR,GLY-ALA-MET-GLY-SER-ALA-SER-SER-GLU-ASP-TYR-ILE-ILE-ILE-LEU-PRO-GLU-SER,119,18,CSCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCC(=O)O)CC(C)C)[C@H](CC)C)[C@H](CC)C)[C@H](CC)C)Cc1ccc(cc1)O)CC(=O)O)CCC(=O)O)CO)CO)C)CO)NC(=O)[C@@H](NC(=O)C[NH3+])C,Kd=3uM,5.522879,5.52,1,A,A,1,A,A,0,,B,A,,1,1,119,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,0.8543837666511536,0.852491557598114,82.4711685180664,90.90496063232422,0.4570090174674988,0.5775541067123413,0.8386425375938416,0.8918145895004272,0.7625161409378052,0.8426607847213745,GAMGSASSEDYIIILPES,Low,"(5.463, 5.6]",train
2LAS,protein-peptide,P49792 P63165,MSDQEAKPSTEDLGDKKEGEYIKLKVIGQDSSEIHFKVKMTTHLKKLKESYCQRQGVPMNSLRFLFEGQRIADNHTPKELGMEEEDVIEVYQEQTGGHSTV,DNEIEVIIVWEKK,MET-SER-ASP-GLN-GLU-ALA-LYS-PRO-SER-THR-GLU-ASP-LEU-GLY-ASP-LYS-LYS-GLU-GLY-GLU-TYR-ILE-LYS-LEU-LYS-VAL-ILE-GLY-GLN-ASP-SER-SER-GLU-ILE-HIS-PHE-LYS-VAL-LYS-MET-THR-THR-HIS-LEU-LYS-LYS-LEU-LYS-GLU-SER-TYR-CYS-GLN-ARG-GLN-GLY-VAL-PRO-MET-ASN-SER-LEU-ARG-PHE-LEU-PHE-GLU-GLY-GLN-ARG-ILE-ALA-ASP-ASN-HIS-THR-PRO-LYS-GLU-LEU-GLY-MET-GLU-GLU-GLU-ASP-VAL-ILE-GLU-VAL-TYR-GLN-GLU-GLN-THR-GLY-GLY-HIS-SER-THR-VAL,ASP-ASN-GLU-ILE-GLU-VAL-ILE-ILE-VAL-TRP-GLU-LYS-LYS,101,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)N)CCC(=O)O)CCC(=O)O)CCC(=O)O,Kd~1.8uM,5.74,5.74,1,A,A,1,A,A,0,,B,A,,1,1,101,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,1.0290186405181885,0.9101503491401672,87.68141174316406,76.07536315917969,0.3804195821285248,0.5994858145713806,0.8431305289268494,0.8421947956085205,0.850709855556488,0.8466936349868774,DNEIEVIIVWEKK,Low,"(5.699, 5.821]",train
2LBM,protein-peptide,P46100 P68431,GAMADKRGDGLHGIVSCTACGQQVNHFQKDSIYRHPSLQVLICKNCFKYYMSDDISRDSDGMDEQCRWCAEGGNLICCDFCHNAFCKKCILRNLGRKELSTIMDENNQWYCYICHPEPLLDLVTACNSVFENLEQLLQQNKK,ARTKQTARKSTGGKA,GLY-ALA-MET-ALA-ASP-LYS-ARG-GLY-ASP-GLY-LEU-HIS-GLY-ILE-VAL-SER-CYS-THR-ALA-CYS-GLY-GLN-GLN-VAL-ASN-HIS-PHE-GLN-LYS-ASP-SER-ILE-TYR-ARG-HIS-PRO-SER-LEU-GLN-VAL-LEU-ILE-CYS-LYS-ASN-CYS-PHE-LYS-TYR-TYR-MET-SER-ASP-ASP-ILE-SER-ARG-ASP-SER-ASP-GLY-MET-ASP-GLU-GLN-CYS-ARG-TRP-CYS-ALA-GLU-GLY-GLY-ASN-LEU-ILE-CYS-CYS-ASP-PHE-CYS-HIS-ASN-ALA-PHE-CYS-LYS-LYS-CYS-ILE-LEU-ARG-ASN-LEU-GLY-ARG-LYS-GLU-LEU-SER-THR-ILE-MET-ASP-GLU-ASN-ASN-GLN-TRP-TYR-CYS-TYR-ILE-CYS-HIS-PRO-GLU-PRO-LEU-LEU-ASP-LEU-VAL-THR-ALA-CYS-ASN-SER-VAL-PHE-GLU-ASN-LEU-GLU-GLN-LEU-LEU-GLN-GLN-ASN-LYS-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,142,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.27uM,6.568636,6.57,1,A,A,1,A,A,0,,C,A,,1,1,142,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.8886008858680725,0.9013274908065796,82.35327911376953,83.971923828125,0.4170014262199402,0.5979001522064209,0.8735198974609375,0.8869428038597107,0.7848869562149048,0.8477053642272949,ARTKQTARKSTGGKA,Low,"(6.523, 6.696]",val
2LCS,protein-peptide,Q03497 Q12163,MAIVNQRAVALYDFEPENDNELRLAEGDIVFISYKHGQGWLVAENESGSKTGLVPEEFVSYIQPELEHHHHHH,GKFIPSRPAPKPPSSA,MET-ALA-ILE-VAL-ASN-GLN-ARG-ALA-VAL-ALA-LEU-TYR-ASP-PHE-GLU-PRO-GLU-ASN-ASP-ASN-GLU-LEU-ARG-LEU-ALA-GLU-GLY-ASP-ILE-VAL-PHE-ILE-SER-TYR-LYS-HIS-GLY-GLN-GLY-TRP-LEU-VAL-ALA-GLU-ASN-GLU-SER-GLY-SER-LYS-THR-GLY-LEU-VAL-PRO-GLU-GLU-PHE-VAL-SER-TYR-ILE-GLN-PRO-GLU-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLY-LYS-PHE-ILE-PRO-SER-ARG-PRO-ALA-PRO-LYS-PRO-PRO-SER-SER-ALA,73,16,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)CO)CCCC[NH3+])C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)C[NH3+])CCCC[NH3+],Kd=0.2uM,6.69897,6.7,1,A,A,1,A,A,0,,B,A,,1,1,73,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,1.0050336122512815,0.8634378910064697,93.47763061523438,89.5425033569336,0.3329730033874511,0.5914489030838013,0.8778359889984131,0.8309381008148193,0.8612711429595947,0.7773846983909607,GKFIPSRPAPKPPSSA,Low,"(6.696, 6.824]",val
2LGF,protein-peptide,P14151 P0DP23,DQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,AFIIWLARRLKKGKK,ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ALA-PHE-ILE-ILE-TRP-LEU-ALA-ARG-ARG-LEU-LYS-LYS-GLY-LYS-LYS,147,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCCC[NH3+])CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccccc1)CC(C)C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CC(C)C,Kd=2.7uM,5.568636,5.57,1,A,A,1,A,A,0,,B,A,,1,1,147,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,0.7187910676002502,0.7039445042610168,60.5749626159668,60.13163757324219,0.5819941163063049,0.9946935772895812,0.7125018835067749,0.7478854060173035,0.6624929308891296,0.6929592490196228,AFIIWLARRLKKGKK,Low,"(5.463, 5.6]",train
2LL6,protein-peptide,P35228 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,LKVLVKAVLFACMLMRK,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,LEU-LYS-VAL-LEU-VAL-LYS-ALA-VAL-LEU-PHE-ALA-CYS-MET-LEU-MET-ARG-LYS,148,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)CCSC)CC(C)C)CCSC)CS)C)Cc1ccccc1)CC(C)C)C(C)C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CCCC[NH3+])CC(C)C,Kd<0.1nM,10.0,10.0,1,A,A,1,A,A,0,,B,A,,1,1,148,17,0,CSCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C)C(C)C)C(C)C,0.8853299021720886,0.6085432767868042,79.97552490234375,57.45425033569336,0.4423966705799103,1.255632400512695,0.8226708769798279,0.6647104024887085,0.8366007208824158,0.5945014953613281,LKVLVKAVLFACMLMRK,High,"(8.824, 12.12]",train
2LL7,protein-peptide,P29474 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,KKTFKEVANAVKISASL,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,LYS-LYS-THR-PHE-LYS-GLU-VAL-ALA-ASN-ALA-VAL-LYS-ILE-SER-ALA-SER-LEU,148,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)C)CO)[C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+])Cc1ccccc1)CCCC[NH3+])CCC(=O)O)C)CC(=O)N)C,Kd=1.6nM,8.79588,8.8,1,A,A,1,A,A,0,,B,A,,1,1,148,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)C(=O)O)C(C)C)C(C)C,0.8784212470054626,0.6950777173042297,58.843048095703125,50.47710418701172,0.4599759578704834,0.9850369095802308,0.8011781573295593,0.725355327129364,0.8333380222320557,0.6748393774032593,KKTFKEVANAVKISASL,Moderate,"(8.383, 8.824]",train
2LLO,protein-peptide,P03372 P0DP33,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTD,RAANLWPSPLMIKRSKKNS,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP,ARG-ALA-ALA-ASN-LEU-TRP-PRO-SER-PRO-LEU-MET-ILE-LYS-ARG-SER-LYS-LYS-ASN-SER,80,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)N)CCCC[NH3+])CCCC[NH3+])CO)CCC[NH+]=C(N)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)C)CC(=O)N)CC(C)C)CO)CC(C)C)CCSC,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,B,A,,1,1,80,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,0.8648754954338074,0.6372362375259399,77.47425079345703,59.90318298339844,0.4387473165988922,0.8414600491523743,0.8135821223258972,0.7193707823753357,0.7577492594718933,0.6167026162147522,RAANLWPSPLMIKRSKKNS,Low,"(5.821, 5.959]",train
2LLQ,protein-peptide,P03372 P0DP33,EEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,RAANLWPSPLMIKRSKKNS,GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,ARG-ALA-ALA-ASN-LEU-TRP-PRO-SER-PRO-LEU-MET-ILE-LYS-ARG-SER-LYS-LYS-ASN-SER,67,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)N)CCCC[NH3+])CCCC[NH3+])CO)CCC[NH+]=C(N)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)C)CC(=O)N)CC(C)C)CO)CC(C)C)CCSC,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,B,A,,1,1,67,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O,0.8266545534133911,0.6103591322898865,82.66573333740234,75.78945922851562,0.4606634080410003,0.926224946975708,0.7880896925926208,0.6780998110771179,0.6982143521308899,0.5934239625930786,RAANLWPSPLMIKRSKKNS,Low,"(5.821, 5.959]",train
2LNW,protein-peptide,P52735 Q8WWN8,MGHHHHHHMSRPPSREIDYTAYPWFAGNMERQQTDNLLKSHASGTYLIRERPAEAERFAISIKFNDEVKHIKVVEKDNWIHITEAKKFDSLLELVEYYQCHSLKESFKQLDTTLKYPYKSRE,EEPVYEEVG,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-SER-ARG-PRO-PRO-SER-ARG-GLU-ILE-ASP-TYR-THR-ALA-TYR-PRO-TRP-PHE-ALA-GLY-ASN-MET-GLU-ARG-GLN-GLN-THR-ASP-ASN-LEU-LEU-LYS-SER-HIS-ALA-SER-GLY-THR-TYR-LEU-ILE-ARG-GLU-ARG-PRO-ALA-GLU-ALA-GLU-ARG-PHE-ALA-ILE-SER-ILE-LYS-PHE-ASN-ASP-GLU-VAL-LYS-HIS-ILE-LYS-VAL-VAL-GLU-LYS-ASP-ASN-TRP-ILE-HIS-ILE-THR-GLU-ALA-LYS-LYS-PHE-ASP-SER-LEU-LEU-GLU-LEU-VAL-GLU-TYR-TYR-GLN-CYS-HIS-SER-LEU-LYS-GLU-SER-PHE-LYS-GLN-LEU-ASP-THR-THR-LEU-LYS-TYR-PRO-TYR-LYS-SER-ARG-GLU,GLU-GLU-PRO-VAL-PTR-GLU-GLU-VAL-GLY,122,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C(C)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O,Kd=1.40uM,5.853872,5.85,1,A,A,1,A,A,0,,B,A,,1,1,122,9,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.9315683245658876,0.9205832481384276,86.59806823730469,85.31712341308594,0.3716684281826019,0.5740528106689453,0.8707783222198486,0.8685302734375,0.827491044998169,0.8465063571929932,EEPVYEEVG,Low,"(5.821, 5.959]",train
2LO6,protein-peptide,P53617 P04050,MQQDDDFQNFVATLESFKDLKSGISGSRIKKLTTYALDHIDIESKIISLIIDYSRLCPDSHKLGSLYIIDSIGRAYLDETRSNSNSSSNKPGTCAHAINTLGEVIQELLSDAIAKSNQDHKEKIRMLLDIWDRSGLFQKSYLNAIRSKCFAMDLEHHHHHH,YSPTSPSYSPTSPS,MET-GLN-GLN-ASP-ASP-ASP-PHE-GLN-ASN-PHE-VAL-ALA-THR-LEU-GLU-SER-PHE-LYS-ASP-LEU-LYS-SER-GLY-ILE-SER-GLY-SER-ARG-ILE-LYS-LYS-LEU-THR-THR-TYR-ALA-LEU-ASP-HIS-ILE-ASP-ILE-GLU-SER-LYS-ILE-ILE-SER-LEU-ILE-ILE-ASP-TYR-SER-ARG-LEU-CYS-PRO-ASP-SER-HIS-LYS-LEU-GLY-SER-LEU-TYR-ILE-ILE-ASP-SER-ILE-GLY-ARG-ALA-TYR-LEU-ASP-GLU-THR-ARG-SER-ASN-SER-ASN-SER-SER-SER-ASN-LYS-PRO-GLY-THR-CYS-ALA-HIS-ALA-ILE-ASN-THR-LEU-GLY-GLU-VAL-ILE-GLN-GLU-LEU-LEU-SER-ASP-ALA-ILE-ALA-LYS-SER-ASN-GLN-ASP-HIS-LYS-GLU-LYS-ILE-ARG-MET-LEU-LEU-ASP-ILE-TRP-ASP-ARG-SER-GLY-LEU-PHE-GLN-LYS-SER-TYR-LEU-ASN-ALA-ILE-ARG-SER-LYS-CYS-PHE-ALA-MET-ASP-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,TYR-SER-PRO-THR-SEP-PRO-SER-TYR-SER-PRO-THR-SEP-PRO-SER,161,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CO)COP(O)(O)O)[C@H](O)C)CO)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CO)COP(O)(O)O,Kd=113uM,3.946922,3.95,1,A,A,1,A,A,0,,B,A,,1,1,161,14,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.8971785306930542,0.7557028532028198,75.90143585205078,81.47166442871094,0.4297852516174316,0.7110817432403564,0.8755437135696411,0.8484224081039429,0.8275872468948364,0.7325229644775391,YSPTSPSYSPTSPS,Low,"(3.924, 4.155]",train
2LOZ,protein-peptide,Q63HR2 Q96QB1,MSTAADLLRQGAACSVLYLTSVETESLTGPQAVARASSAALSCSPRPTPAVVHFKVSAQGITLTDNQRKLFFRRHYPVNSITFSSTDPQDRRWTNPDGTTSKIFGFVAKKPGSPWENVCHLFAELDPDQPAGAIVTFITKVLLGQRK,EDHKPGTFPKALTN,MET-SER-THR-ALA-ALA-ASP-LEU-LEU-ARG-GLN-GLY-ALA-ALA-CYS-SER-VAL-LEU-TYR-LEU-THR-SER-VAL-GLU-THR-GLU-SER-LEU-THR-GLY-PRO-GLN-ALA-VAL-ALA-ARG-ALA-SER-SER-ALA-ALA-LEU-SER-CYS-SER-PRO-ARG-PRO-THR-PRO-ALA-VAL-VAL-HIS-PHE-LYS-VAL-SER-ALA-GLN-GLY-ILE-THR-LEU-THR-ASP-ASN-GLN-ARG-LYS-LEU-PHE-PHE-ARG-ARG-HIS-TYR-PRO-VAL-ASN-SER-ILE-THR-PHE-SER-SER-THR-ASP-PRO-GLN-ASP-ARG-ARG-TRP-THR-ASN-PRO-ASP-GLY-THR-THR-SER-LYS-ILE-PHE-GLY-PHE-VAL-ALA-LYS-LYS-PRO-GLY-SER-PRO-TRP-GLU-ASN-VAL-CYS-HIS-LEU-PHE-ALA-GLU-LEU-ASP-PRO-ASP-GLN-PRO-ALA-GLY-ALA-ILE-VAL-THR-PHE-ILE-THR-LYS-VAL-LEU-LEU-GLY-GLN-ARG-LYS,GLU-ASP-HIS-LYS-PRO-GLY-THR-PHE-PRO-LYS-ALA-LEU-THR-ASN,147,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)[C@H](O)C)CC(C)C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)Cc1[nH]cnc1)CCCC[NH3+])Cc1ccccc1,Kd=86.5uM,4.062984,4.06,1,A,A,1,A,A,0,,B,A,,1,1,147,14,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O)NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7767086625099182,0.7912487387657166,82.92928314208984,77.16386413574219,0.5158241391181946,0.6574217677116394,0.8222976326942444,0.8562549352645874,0.7109636068344116,0.7749971747398376,EDHKPGTFPKALTN,Low,"(3.924, 4.155]",val
2LP8,protein-peptide,Q16611 Q07817,MSQSNRELVVDFLSYKLSQKGYSWSQFSDVEENRTEAPEGTESEAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQERLEHHHHHHLEHHHHHH,GCVGRALAAFGDCINR,MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-PHE-SER-ASP-VAL-GLU-GLU-ASN-ARG-THR-GLU-ALA-PRO-GLU-GLY-THR-GLU-SER-GLU-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ACE-GLY-CYS-VAL-GLY-ARG-ALA-LEU-ALA-ALA-PHE-GLY-ASP-CYS-ILE-ASN-ARG-NH2,185,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)CC(=O)N)NC(=O)[C@@H]1CSCC(=O)Nc2ccc(cc2S(O)(O)O)/N=N/c2ccc(c(c2)S(O)(O)O)NC(=O)CSC[C@H](NC(=O)CNC(=O)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CC(=O)O)Cc1ccccc1)C)C)CC(C)C)C)CCC[NH+]=C(N)N)C,Kd=30.5nM,7.5157,7.52,1,A,A,1,A,A,0,,B,A,,1,1,185,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CN)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CN)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,1.0021233558654783,0.9316268563270568,70.29389190673828,73.97112274169922,0.4672788083553314,0.684238612651825,0.8413072228431702,0.8580605983734131,0.9397153854370116,0.8351535201072693,GCVGRALAAFGDCINR,Moderate,"(7.268, 7.523]",train
2LSK,protein-peptide,Q9Y253 Q9UBZ9,GNLAGAVEFNDVKTLLREWITTISDPMEEDILQVVKYCTDLIEEKDLEKLDLVIKYMKRLMQQSVESVWNMAFDFILDNVQVVLQQTYGSTLKVT,QSTGTEPFFKQKSLLL,GLY-ASN-LEU-ALA-GLY-ALA-VAL-GLU-PHE-ASN-ASP-VAL-LYS-THR-LEU-LEU-ARG-GLU-TRP-ILE-THR-THR-ILE-SER-ASP-PRO-MET-GLU-GLU-ASP-ILE-LEU-GLN-VAL-VAL-LYS-TYR-CYS-THR-ASP-LEU-ILE-GLU-GLU-LYS-ASP-LEU-GLU-LYS-LEU-ASP-LEU-VAL-ILE-LYS-TYR-MET-LYS-ARG-LEU-MET-GLN-GLN-SER-VAL-GLU-SER-VAL-TRP-ASN-MET-ALA-PHE-ASP-PHE-ILE-LEU-ASP-ASN-VAL-GLN-VAL-VAL-LEU-GLN-GLN-THR-TYR-GLY-SER-THR-LEU-LYS-VAL-THR,GLN-SER-THR-GLY-THR-GLU-PRO-PHE-PHE-LYS-GLN-LYS-SER-LEU-LEU-LEU,95,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)CC(C)C)CO)CCCC[NH3+])CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CO)CCC(=O)O)Cc1ccccc1)Cc1ccccc1,Kd=13uM,4.886057,4.89,1,A,A,1,A,A,0,,B,A,,1,1,95,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9190463423728944,0.632773220539093,93.79570770263672,85.04736328125,0.3440159857273102,0.9429545402526855,0.9041744470596312,0.7407886385917664,0.8326742053031921,0.6057693362236023,QSTGTEPFFKQKSLLL,Low,"(4.866, 5.014]",val
2LSP,protein-peptide,O60885 Q04206,KDVPDSQQHPAPEKSSKVSEQLKCCSGILKEMFAKKHAAYAWPFYKPVDVEALGLHDYCDIIKHPMDMSTIKSKLEAREYRDAQEFGADVRLMFSNCYKYNPPDHEVVAMARKLQDVFEMRFAKMPDE,RTYETFKSIMKKS,LYS-ASP-VAL-PRO-ASP-SER-GLN-GLN-HIS-PRO-ALA-PRO-GLU-LYS-SER-SER-LYS-VAL-SER-GLU-GLN-LEU-LYS-CYS-CYS-SER-GLY-ILE-LEU-LYS-GLU-MET-PHE-ALA-LYS-LYS-HIS-ALA-ALA-TYR-ALA-TRP-PRO-PHE-TYR-LYS-PRO-VAL-ASP-VAL-GLU-ALA-LEU-GLY-LEU-HIS-ASP-TYR-CYS-ASP-ILE-ILE-LYS-HIS-PRO-MET-ASP-MET-SER-THR-ILE-LYS-SER-LYS-LEU-GLU-ALA-ARG-GLU-TYR-ARG-ASP-ALA-GLN-GLU-PHE-GLY-ALA-ASP-VAL-ARG-LEU-MET-PHE-SER-ASN-CYS-TYR-LYS-TYR-ASN-PRO-PRO-ASP-HIS-GLU-VAL-VAL-ALA-MET-ALA-ARG-LYS-LEU-GLN-ASP-VAL-PHE-GLU-MET-ARG-PHE-ALA-LYS-MET-PRO-ASP-GLU,ARG-THR-TYR-GLU-THR-PHE-ALY-SER-ILE-MET-LYS-LYS-SER,128,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1ccc(cc1)O)CCC(=O)O)Cc1ccccc1)CCCCNC(=O)C)CO)CCSC,Ki=274uM,3.562249,3.56,1,A,A,1,A,A,0,,A,B,,1,1,128,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)O,0.9259348511695862,0.827288806438446,86.12406158447266,86.07111358642578,0.3884932696819305,0.7104371786117554,0.8567692041397095,0.8238074779510498,0.8235454559326172,0.7549169659614563,RTYETFKSIMKKS,Low,"(3.548, 3.924]",train
2LSR,protein-peptide,Q9H251 Q9Y6N9,MDRKVAREFRHKVDFLIENDAEKDYLYDVLRMYHQTMDVAVLVGDLKLVINEPSRLPLFDAIRPLIPLKHQVEYDQLTPR,GSLLKEVLEDYLRLKK,MET-ASP-ARG-LYS-VAL-ALA-ARG-GLU-PHE-ARG-HIS-LYS-VAL-ASP-PHE-LEU-ILE-GLU-ASN-ASP-ALA-GLU-LYS-ASP-TYR-LEU-TYR-ASP-VAL-LEU-ARG-MET-TYR-HIS-GLN-THR-MET-ASP-VAL-ALA-VAL-LEU-VAL-GLY-ASP-LEU-LYS-LEU-VAL-ILE-ASN-GLU-PRO-SER-ARG-LEU-PRO-LEU-PHE-ASP-ALA-ILE-ARG-PRO-LEU-ILE-PRO-LEU-LYS-HIS-GLN-VAL-GLU-TYR-ASP-GLN-LEU-THR-PRO-ARG,GLY-SER-LEU-LEU-LYS-GLU-VAL-LEU-GLU-ASP-TYR-LEU-ARG-LEU-LYS-LYS,80,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCCC[NH3+])CC(C)C)CCC[NH+]=C(N)N)CC(C)C)Cc1ccc(cc1)O)CC(=O)O)CCC(=O)O)CC(C)C)C(C)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CO)CC(C)C)CC(C)C,Kd=5.7uM,5.244125,5.24,1,A,A,1,A,A,0,,B,A,,1,1,80,16,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(=O)O)C(C)C,0.9954433441162108,0.7130534052848816,96.05770874023438,84.22083282470703,0.3116790652275085,0.8817716240882874,0.9178172945976256,0.7862251400947571,0.9106832146644592,0.6947604417800903,GSLLKEVLEDYLRLKK,Low,"(5.222, 5.31]",train
2LSV,protein-peptide,P25638 P02829,SQFEKQKEQGNSLFKQGLYREAVHCYDQLITAQPQNPVGYSNKAMALIKLGEYTQAIQMCQQGLRYTSTAEHVAIRSKLQYRLELAQGAVGSVQIPVVEVDELPEGYDRS,ADTEMEEVD,SER-GLN-PHE-GLU-LYS-GLN-LYS-GLU-GLN-GLY-ASN-SER-LEU-PHE-LYS-GLN-GLY-LEU-TYR-ARG-GLU-ALA-VAL-HIS-CYS-TYR-ASP-GLN-LEU-ILE-THR-ALA-GLN-PRO-GLN-ASN-PRO-VAL-GLY-TYR-SER-ASN-LYS-ALA-MET-ALA-LEU-ILE-LYS-LEU-GLY-GLU-TYR-THR-GLN-ALA-ILE-GLN-MET-CYS-GLN-GLN-GLY-LEU-ARG-TYR-THR-SER-THR-ALA-GLU-HIS-VAL-ALA-ILE-ARG-SER-LYS-LEU-GLN-TYR-ARG-LEU-GLU-LEU-ALA-GLN-GLY-ALA-VAL-GLY-SER-VAL-GLN-ILE-PRO-VAL-VAL-GLU-VAL-ASP-GLU-LEU-PRO-GLU-GLY-TYR-ASP-ARG-SER,ALA-ASP-THR-GLU-MET-GLU-GLU-VAL-ASP,110,9,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)O)CCC(=O)O,Kd=5.41uM,5.266803,5.27,1,A,A,1,A,A,0,,B,A,,1,1,110,9,0,CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,1.0221564769744873,0.97938472032547,80.69873809814453,82.3135986328125,0.3120843470096588,0.5242388844490051,0.8963806629180908,0.8798440098762512,0.91179358959198,0.896315336227417,ADTEMEEVD,Low,"(5.222, 5.31]",train
2M0O,protein-peptide,P68431 O43189,SRLSRSGASSLWDPASPAPTSGPRPRLWEGQDVLARWTDGLLYLGTIKKVDSAREVCLVQFEDDSQFLVLWKDISPAAL,ATGGVKKPHRY,SER-ARG-LEU-SER-ARG-SER-GLY-ALA-SER-SER-LEU-TRP-ASP-PRO-ALA-SER-PRO-ALA-PRO-THR-SER-GLY-PRO-ARG-PRO-ARG-LEU-TRP-GLU-GLY-GLN-ASP-VAL-LEU-ALA-ARG-TRP-THR-ASP-GLY-LEU-LEU-TYR-LEU-GLY-THR-ILE-LYS-LYS-VAL-ASP-SER-ALA-ARG-GLU-VAL-CYS-LEU-VAL-GLN-PHE-GLU-ASP-ASP-SER-GLN-PHE-LEU-VAL-LEU-TRP-LYS-ASP-ILE-SER-PRO-ALA-ALA-LEU,ALA-THR-GLY-GLY-VAL-M3L-LYS-PRO-HIS-ARG-TYR,79,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCCC[N+](C)(C)C,Kd=4.2uM,5.376751,5.38,1,A,A,1,A,A,0,,B,A,,1,1,79,11,0,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,0.8947606086730957,0.9030223488807678,75.67455291748047,75.66178894042969,0.4482999145984649,0.6997418403625488,0.717739462852478,0.7575365900993347,0.6820714473724365,0.7416089773178101,ATGGVKKPHRY,Low,"(5.31, 5.463]",val
2M0U,protein-peptide,O14745,GIDPFTMLPRLCCLEKGPNGYGFHLHGEKGKLGQYIRLVEPGSPAEKAGLLAGDRLVEVNGENVEKETHQQVVSRIRAALNAVRLLVVDPETDEQLQKLGVQVREELLRAQEAPGQA,QDTRL,GLY-ILE-ASP-PRO-PHE-THR-MET-LEU-PRO-ARG-LEU-CYS-CYS-LEU-GLU-LYS-GLY-PRO-ASN-GLY-TYR-GLY-PHE-HIS-LEU-HIS-GLY-GLU-LYS-GLY-LYS-LEU-GLY-GLN-TYR-ILE-ARG-LEU-VAL-GLU-PRO-GLY-SER-PRO-ALA-GLU-LYS-ALA-GLY-LEU-LEU-ALA-GLY-ASP-ARG-LEU-VAL-GLU-VAL-ASN-GLY-GLU-ASN-VAL-GLU-LYS-GLU-THR-HIS-GLN-GLN-VAL-VAL-SER-ARG-ILE-ARG-ALA-ALA-LEU-ASN-ALA-VAL-ARG-LEU-LEU-VAL-VAL-ASP-PRO-GLU-THR-ASP-GLU-GLN-LEU-GLN-LYS-LEU-GLY-VAL-GLN-VAL-ARG-GLU-GLU-LEU-LEU-ARG-ALA-GLN-GLU-ALA-PRO-GLY-GLN-ALA,GLN-ASP-THR-ARG-LEU,117,5,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CC(=O)O)CCC[NH+]=C(N)N)C,Kd=365nM,6.437707,6.44,1,A,A,1,A,A,0,,B,A,,1,1,117,5,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)[C@@H](C)O,0.955035924911499,0.9710983633995056,94.84362030029295,87.82919311523438,0.4009456038475036,0.40833181142807,0.8692576885223389,0.9134500622749328,0.8842673301696777,0.9214078783988952,QDTRL,Low,"(6.398, 6.523]",train
2M0V,protein-peptide,O14745,GIDPFTMLRPRLCTMKKGPSGYGFNLHSDKSKPGQFIRSVDPDSPAEASGLRAQDRIVEVNGVCMEGKQHGDVVSAIRAGGDETKLLVVDRETDEFFKKCRVIPSQEHLNGPLPVPFTNGEIQKENSR,QDTRL,GLY-ILE-ASP-PRO-PHE-THR-MET-LEU-ARG-PRO-ARG-LEU-CYS-THR-MET-LYS-LYS-GLY-PRO-SER-GLY-TYR-GLY-PHE-ASN-LEU-HIS-SER-ASP-LYS-SER-LYS-PRO-GLY-GLN-PHE-ILE-ARG-SER-VAL-ASP-PRO-ASP-SER-PRO-ALA-GLU-ALA-SER-GLY-LEU-ARG-ALA-GLN-ASP-ARG-ILE-VAL-GLU-VAL-ASN-GLY-VAL-CYS-MET-GLU-GLY-LYS-GLN-HIS-GLY-ASP-VAL-VAL-SER-ALA-ILE-ARG-ALA-GLY-GLY-ASP-GLU-THR-LYS-LEU-LEU-VAL-VAL-ASP-ARG-GLU-THR-ASP-GLU-PHE-PHE-LYS-LYS-CYS-ARG-VAL-ILE-PRO-SER-GLN-GLU-HIS-LEU-ASN-GLY-PRO-LEU-PRO-VAL-PRO-PHE-THR-ASN-GLY-GLU-ILE-GLN-LYS-GLU-ASN-SER-ARG,GLN-ASP-THR-ARG-LEU,128,5,CC(C[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CC(=O)O)CCC[NH+]=C(N)N)C,Kd=1079nM,5.966979,5.97,1,A,A,1,A,A,0,,B,A,,1,1,128,5,0,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O)[C@@H](C)O,0.9087406992912292,0.9634318351745604,84.82371520996094,86.89520263671875,0.4344683885574341,0.4224106073379516,0.8340839743614197,0.8996632695198059,0.8616153597831726,0.9207801818847656,QDTRL,Low,"(5.959, 6.097]",train
2M3M,protein-peptide,P26554 Q12959,MEIKLIKGPKGLGFSIAGGVGNQHIPGDNSIYVTKIIEGGAAHKDGKLQIGDKLLAVNNVCLEEVTHEEAVTALKNTSDFVYLKVAKPTGSHHHHHH,QRTRQRNETQV,MET-GLU-ILE-LYS-LEU-ILE-LYS-GLY-PRO-LYS-GLY-LEU-GLY-PHE-SER-ILE-ALA-GLY-GLY-VAL-GLY-ASN-GLN-HIS-ILE-PRO-GLY-ASP-ASN-SER-ILE-TYR-VAL-THR-LYS-ILE-ILE-GLU-GLY-GLY-ALA-ALA-HIS-LYS-ASP-GLY-LYS-LEU-GLN-ILE-GLY-ASP-LYS-LEU-LEU-ALA-VAL-ASN-ASN-VAL-CYS-LEU-GLU-GLU-VAL-THR-HIS-GLU-GLU-ALA-VAL-THR-ALA-LEU-LYS-ASN-THR-SER-ASP-PHE-VAL-TYR-LEU-LYS-VAL-ALA-LYS-PRO-THR-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS,PCA-ARG-THR-ARG-GLN-ARG-ASN-GLU-THR-GLN-VAL,97,11,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)N)[C@H](O)C)CCC(=O)O)CC(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CC[C@@H]([NH2+]1)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=9.63uM,5.016374,5.02,1,A,A,1,A,A,0,,B,A,,1,1,97,11,0,CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1CCC(=O)N1)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C1CCC(=O)N1)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9452353715896606,0.7989193797111511,91.91487121582033,88.67131042480469,0.3580967485904693,0.6256788969039917,0.8839008212089539,0.8552324175834656,0.8506152629852295,0.7848411202430725,QRTRQRNETQV,Low,"(5.014, 5.105]",train
2M41,protein-peptide,P54253 Q96RK0,GAMAPPTLPPYFMKGSIIQLANGELKKVEDLKTEDFIQSAEISNDLKIDSSTVERIEDSHSPGVAVIQFAVGEHRAQVSVEVLVEYPFFVFGQGWSSCCPERTSQLFDLPCSKLSVGDVCISLTLK,VFPWHSLVPFLAPSQ,GLY-ALA-MET-ALA-PRO-PRO-THR-LEU-PRO-PRO-TYR-PHE-MET-LYS-GLY-SER-ILE-ILE-GLN-LEU-ALA-ASN-GLY-GLU-LEU-LYS-LYS-VAL-GLU-ASP-LEU-LYS-THR-GLU-ASP-PHE-ILE-GLN-SER-ALA-GLU-ILE-SER-ASN-ASP-LEU-LYS-ILE-ASP-SER-SER-THR-VAL-GLU-ARG-ILE-GLU-ASP-SER-HIS-SER-PRO-GLY-VAL-ALA-VAL-ILE-GLN-PHE-ALA-VAL-GLY-GLU-HIS-ARG-ALA-GLN-VAL-SER-VAL-GLU-VAL-LEU-VAL-GLU-TYR-PRO-PHE-PHE-VAL-PHE-GLY-GLN-GLY-TRP-SER-SER-CYS-CYS-PRO-GLU-ARG-THR-SER-GLN-LEU-PHE-ASP-LEU-PRO-CYS-SER-LYS-LEU-SER-VAL-GLY-ASP-VAL-CYS-ILE-SER-LEU-THR-LEU-LYS,VAL-PHE-PRO-TRP-HIS-SER-LEU-VAL-PRO-PHE-LEU-ALA-PRO-SER-GLN,126,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CO)C)CC(C)C)Cc1ccccc1)C(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])Cc1ccccc1)Cc1nc[nH]c1,Kd=8uM,5.09691,5.1,1,A,A,1,A,A,0,,A,B,,1,1,126,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9518529772758484,0.8082318305969238,86.92796325683594,89.8239517211914,0.4367212355136871,0.6885607242584229,0.8535561561584473,0.8463954925537109,0.8523136973381042,0.7738893628120422,VFPWHSLVPFLAPSQ,Low,"(5.014, 5.105]",train
2MG5,protein-peptide,P29474 P0DP23,ADQLTEEQIAEFKEAFSLFDKDGDGTITTKELGTVMRSLGQNPTEAELQDMINEVDADGNGTIDFPEFLTMMARKMKDTDSEEEIREAFRVFDKDGNGYISAAELRHVMTNLGEKLTDEEVDEMIREADIDGDGQVNYEEFVQMMTAK,TFKEVANAVKISASLM,ALA-ASP-GLN-LEU-THR-GLU-GLU-GLN-ILE-ALA-GLU-PHE-LYS-GLU-ALA-PHE-SER-LEU-PHE-ASP-LYS-ASP-GLY-ASP-GLY-THR-ILE-THR-THR-LYS-GLU-LEU-GLY-THR-VAL-MET-ARG-SER-LEU-GLY-GLN-ASN-PRO-THR-GLU-ALA-GLU-LEU-GLN-ASP-MET-ILE-ASN-GLU-VAL-ASP-ALA-ASP-GLY-ASN-GLY-THR-ILE-ASP-PHE-PRO-GLU-PHE-LEU-THR-MET-MET-ALA-ARG-LYS-MET-LYS-ASP-THR-ASP-SER-GLU-GLU-GLU-ILE-ARG-GLU-ALA-PHE-ARG-VAL-PHE-ASP-LYS-ASP-GLY-ASN-GLY-TYR-ILE-SER-ALA-ALA-GLU-LEU-ARG-HIS-VAL-MET-THR-ASN-LEU-GLY-GLU-LYS-LEU-THR-ASP-GLU-GLU-VAL-ASP-GLU-MET-ILE-ARG-GLU-ALA-ASP-ILE-ASP-GLY-ASP-GLY-GLN-VAL-ASN-TYR-GLU-GLU-PHE-VAL-GLN-MET-MET-THR-ALA-LYS,TPO-PHE-LYS-GLU-VAL-ALA-ASN-ALA-VAL-LYS-ILE-SER-ALA-SER-LEU-MET,148,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCSC)CC(C)C)CO)C)CO)[C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccccc1)CCCC[NH3+])CCC(=O)O)C)CC(=O)N)C,Kd=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,B,A,,1,1,148,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(C)C)C(C)C,0.8718511462211609,0.7131404280662537,64.23825073242188,58.28398132324219,0.4576670229434967,0.9697198867797852,0.7957229614257812,0.7465901374816895,0.8299075365066528,0.6836631298065186,TFKEVANAVKISASLM,Low,"(6.097, 6.26]",train
2MIP,protein-peptide,P04584,PQFSLWKRPVVTAYIEGQPVEVLLDTGADDSIVAGIELGNNYSPKIVGGIGGFINTKEYKNVEIEVLNKKVRATIMTGDTPINIFGRNILTALGMSLNL,FVFLEI,PRO-GLN-PHE-SER-LEU-TRP-LYS-ARG-PRO-VAL-VAL-THR-ALA-TYR-ILE-GLU-GLY-GLN-PRO-VAL-GLU-VAL-LEU-LEU-ASP-THR-GLY-ALA-ASP-ASP-SER-ILE-VAL-ALA-GLY-ILE-GLU-LEU-GLY-ASN-ASN-TYR-SER-PRO-LYS-ILE-VAL-GLY-GLY-ILE-GLY-GLY-PHE-ILE-ASN-THR-LYS-GLU-TYR-LYS-ASN-VAL-GLU-ILE-GLU-VAL-LEU-ASN-LYS-LYS-VAL-ARG-ALA-THR-ILE-MET-THR-GLY-ASP-THR-PRO-ILE-ASN-ILE-PHE-GLY-ARG-ASN-ILE-LEU-THR-ALA-LEU-GLY-MET-SER-LEU-ASN-LEU,PHE-VAL-PHE-LEU-GLU-ILE-NH2,99,7,CC[C@@H]([C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH2+]C[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccccc1)[NH3+])Cc1ccccc1)CCC(=O)O)C,IC50<=3.5nM,8.46,8.46,1,A,A,1,A,A,0,,E,A,3mer,1,1,99,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)C(=O)O,0.8797193765640259,0.8108404874801636,89.1366958618164,79.67890167236328,0.4103519320487976,0.612114667892456,0.8676965832710266,0.840178370475769,0.8053440451622009,0.8035059571266174,FVFLEI,Moderate,"(8.383, 8.824]",val
2MKR,protein-peptide,P12978 P32776,PSHSGAAIFEKVSGIIAINEDVSPAELTWRSTDGDKVHTVVLSTIDKLQATPASSEKMMLRLIGKVDESKKRKDNEGNEVVPKPQRHMFSFNNRTVMDNIKMTLQQIISRYKDAD,DLDESWDYIFETT,PRO-SER-HIS-SER-GLY-ALA-ALA-ILE-PHE-GLU-LYS-VAL-SER-GLY-ILE-ILE-ALA-ILE-ASN-GLU-ASP-VAL-SER-PRO-ALA-GLU-LEU-THR-TRP-ARG-SER-THR-ASP-GLY-ASP-LYS-VAL-HIS-THR-VAL-VAL-LEU-SER-THR-ILE-ASP-LYS-LEU-GLN-ALA-THR-PRO-ALA-SER-SER-GLU-LYS-MET-MET-LEU-ARG-LEU-ILE-GLY-LYS-VAL-ASP-GLU-SER-LYS-LYS-ARG-LYS-ASP-ASN-GLU-GLY-ASN-GLU-VAL-VAL-PRO-LYS-PRO-GLN-ARG-HIS-MET-PHE-SER-PHE-ASN-ASN-ARG-THR-VAL-MET-ASP-ASN-ILE-LYS-MET-THR-LEU-GLN-GLN-ILE-ILE-SER-ARG-TYR-LYS-ASP-ALA-ASP,ASP-LEU-ASP-GLU-SER-TRP-ASP-TYR-ILE-PHE-GLU-THR-THR,115,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](O)C)CCC(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(C)C)CC(=O)O)CCC(=O)O)CO)CC(=O)O)Cc1ccc(cc1)O)C,Kd=0.54uM,6.267606,6.27,1,A,A,1,A,A,0,,B,A,,1,1,115,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8522443175315857,0.8198971152305603,87.46720123291016,80.90911102294922,0.3780090510845184,0.6576467156410217,0.8728488683700562,0.8644733428955078,0.7836166024208069,0.8087530732154846,DLDESWDYIFETT,Low,"(6.26, 6.398]",train
2MNZ,protein-peptide,Q9UGL1,AVDLYVCLLCGSGNDEDRLLLCDGCDDSYHTFCLIPPLHDVPKGDWRCPKCLAQE,ARTKQTARKS,ALA-VAL-ASP-LEU-TYR-VAL-CYS-LEU-LEU-CYS-GLY-SER-GLY-ASN-ASP-GLU-ASP-ARG-LEU-LEU-LEU-CYS-ASP-GLY-CYS-ASP-ASP-SER-TYR-HIS-THR-PHE-CYS-LEU-ILE-PRO-PRO-LEU-HIS-ASP-VAL-PRO-LYS-GLY-ASP-TRP-ARG-CYS-PRO-LYS-CYS-LEU-ALA-GLN-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER,55,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=6.4uM,5.19382,5.19,1,A,A,1,A,A,0,,B,A,,1,1,55,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7859622836112976,0.7121486663818359,94.63419342041016,79.09223175048828,0.4133368134498596,0.7664403319358826,0.7986941337585449,0.7780720591545105,0.6866254210472107,0.6956677436828613,ARTKQTARKS,Low,"(5.105, 5.222]",train
2MOW,protein-peptide,P53617 P53632,MQQDDDFQNFVATLESFKDLKSGISGSRIKKLTTYALDHIDIESKIISLIIDYSRLCPDSHKLGSLYIIDSIGRAYLDETRSNSNSSSNKPGTCAHAINTLGEVIQELLSDAIAKSNQDHKEKIRMLLDIWDRSGLFQKSYLNAIRSKCFAMDLEHHHHHH,DDDEDGYNPYTL,MET-GLN-GLN-ASP-ASP-ASP-PHE-GLN-ASN-PHE-VAL-ALA-THR-LEU-GLU-SER-PHE-LYS-ASP-LEU-LYS-SER-GLY-ILE-SER-GLY-SER-ARG-ILE-LYS-LYS-LEU-THR-THR-TYR-ALA-LEU-ASP-HIS-ILE-ASP-ILE-GLU-SER-LYS-ILE-ILE-SER-LEU-ILE-ILE-ASP-TYR-SER-ARG-LEU-CYS-PRO-ASP-SER-HIS-LYS-LEU-GLY-SER-LEU-TYR-ILE-ILE-ASP-SER-ILE-GLY-ARG-ALA-TYR-LEU-ASP-GLU-THR-ARG-SER-ASN-SER-ASN-SER-SER-SER-ASN-LYS-PRO-GLY-THR-CYS-ALA-HIS-ALA-ILE-ASN-THR-LEU-GLY-GLU-VAL-ILE-GLN-GLU-LEU-LEU-SER-ASP-ALA-ILE-ALA-LYS-SER-ASN-GLN-ASP-HIS-LYS-GLU-LYS-ILE-ARG-MET-LEU-LEU-ASP-ILE-TRP-ASP-ARG-SER-GLY-LEU-PHE-GLN-LYS-SER-TYR-LEU-ASN-ALA-ILE-ARG-SER-LYS-CYS-PHE-ALA-MET-ASP-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ASP-ASP-ASP-GLU-ASP-GLY-TYR-ASN-PRO-TYR-THR-LEU,161,12,CC(C[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CCC(=O)O)CC(=O)O)CC(=O)N)Cc1ccc(cc1)O)C,Kd=1.09uM,5.962574,5.96,1,A,A,1,A,A,0,,B,A,,1,1,161,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.9136130213737488,0.8397327065467834,84.92784881591797,83.38966369628906,0.4165453314781189,0.639029860496521,0.8841699361801147,0.8878307342529297,0.863170325756073,0.8277081251144409,DDDEDGYNPYTL,Low,"(5.959, 6.097]",val
2MPM,protein-peptide,P51671,GPASVPTTCCFNLANRKIPLQRLESYRRITSGKCPQKAVIFKTKLAKDICADPKKKWVQDSMKYLDQKSPTPKP,VETFGTTSYYDDVGLL,GLY-PRO-ALA-SER-VAL-PRO-THR-THR-CYS-CYS-PHE-ASN-LEU-ALA-ASN-ARG-LYS-ILE-PRO-LEU-GLN-ARG-LEU-GLU-SER-TYR-ARG-ARG-ILE-THR-SER-GLY-LYS-CYS-PRO-GLN-LYS-ALA-VAL-ILE-PHE-LYS-THR-LYS-LEU-ALA-LYS-ASP-ILE-CYS-ALA-ASP-PRO-LYS-LYS-LYS-TRP-VAL-GLN-ASP-SER-MET-LYS-TYR-LEU-ASP-GLN-LYS-SER-PRO-THR-PRO-LYS-PRO,VAL-GLU-THR-PHE-GLY-THR-THR-SER-TYS-TYS-ASP-ASP-VAL-GLY-LEU-LEU,74,16,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)C(C)C)CC(=O)O)CC(=O)O)Cc1ccc(cc1)OS(O)(O)O)Cc1ccc(cc1)OS(O)(O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CCC(=O)O)Cc1ccccc1,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,B,A,,1,1,74,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)NC(Cc1ccc(OS(=O)(=O)O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)C(C)C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C,0.9191657304763794,0.9230703711509703,80.51321411132812,86.47899627685547,0.4200411438941955,0.5881742238998413,0.8214307427406311,0.8615608215332031,0.7630438804626465,0.8370963931083679,VETFGTTSYYDDVGLL,Low,"(5.821, 5.959]",train
2MPS,protein-peptide,Q00987 O15350,NTNMSVPTDGAVTTSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVV,DGGTTFEHLWSSLEPD,ASN-THR-ASN-MET-SER-VAL-PRO-THR-ASP-GLY-ALA-VAL-THR-THR-SER-GLN-ILE-PRO-ALA-SER-GLU-GLN-GLU-THR-LEU-VAL-ARG-PRO-LYS-PRO-LEU-LEU-LEU-LYS-LEU-LEU-LYS-SER-VAL-GLY-ALA-GLN-LYS-ASP-THR-TYR-THR-MET-LYS-GLU-VAL-LEU-PHE-TYR-LEU-GLY-GLN-TYR-ILE-MET-THR-LYS-ARG-LEU-TYR-ASP-GLU-LYS-GLN-GLN-HIS-ILE-VAL-TYR-CYS-SER-ASN-ASP-LEU-LEU-GLY-ASP-LEU-PHE-GLY-VAL-PRO-SER-PHE-SER-VAL-LYS-GLU-HIS-ARG-LYS-ILE-TYR-THR-MET-ILE-TYR-ARG-ASN-LEU-VAL-VAL,ASP-GLY-GLY-THR-THR-PHE-GLU-HIS-LEU-TRP-SER-SER-LEU-GLU-PRO-ASP,107,16,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)O)CC(C)C)CO)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)CNC(=O)[C@H](CC(=O)O)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1[nH]cnc1)CC(C)C,Kd=3.9uM,5.408935,5.41,1,A,A,1,A,A,0,,B,A,,1,1,107,16,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.0350338220596311,0.8389528393745422,78.97735595703125,84.92762756347656,0.4302112758159637,0.8060962557792664,0.8262894153594971,0.8248485922813416,0.8890491724014282,0.7548620104789734,DGGTTFEHLWSSLEPD,Low,"(5.31, 5.463]",train
2MS4,protein-peptide,P46108 P62937,MVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE,PEPGPYAQP,MET-VAL-ASN-PRO-THR-VAL-PHE-PHE-ASP-ILE-ALA-VAL-ASP-GLY-GLU-PRO-LEU-GLY-ARG-VAL-SER-PHE-GLU-LEU-PHE-ALA-ASP-LYS-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-ALA-LEU-SER-THR-GLY-GLU-LYS-GLY-PHE-GLY-TYR-LYS-GLY-SER-CYS-PHE-HIS-ARG-ILE-ILE-PRO-GLY-PHE-MET-CYS-GLN-GLY-GLY-ASP-PHE-THR-ARG-HIS-ASN-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-GLU-LYS-PHE-GLU-ASP-GLU-ASN-PHE-ILE-LEU-LYS-HIS-THR-GLY-PRO-GLY-ILE-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-CYS-THR-ALA-LYS-THR-GLU-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-LYS-GLU-GLY-MET-ASN-ILE-VAL-GLU-ALA-MET-GLU-ARG-PHE-GLY-SER-ARG-ASN-GLY-LYS-THR-SER-LYS-LYS-ILE-THR-ILE-ALA-ASP-CYS-GLY-GLN-LEU-GLU,PRO-GLU-PRO-GLY-PRO-TYR-ALA-GLN-PRO,165,9,NC(=O)CC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC(=O)O)Cc1ccc(cc1)O)C,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,B,A,,1,1,165,9,0,C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)O,C[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@H](NC(=O)CNC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8558478355407715,0.892621636390686,81.23375701904297,95.12537384033205,0.4600609540939331,0.4797611236572265,0.877098023891449,0.9345821738243104,0.8182076215744019,0.8821315169334412,PEPGPYAQP,Low,"(4.745, 4.866]",train
2MWO,protein-peptide,Q12888 P04637,GHMNSFVGLRVVAKWSSNGYFYSGKITRDVGAGKYKLLFDDGYECDVLGKDILLCDPIPLDTEVTALSEDEYFSAGVVKGHRKESGELYYSIEKEGQRKWYKRMAVILSLEQGNRLREQYGLG,RAHSSHLKSKKGQST,GLY-HIS-MET-ASN-SER-PHE-VAL-GLY-LEU-ARG-VAL-VAL-ALA-LYS-TRP-SER-SER-ASN-GLY-TYR-PHE-TYR-SER-GLY-LYS-ILE-THR-ARG-ASP-VAL-GLY-ALA-GLY-LYS-TYR-LYS-LEU-LEU-PHE-ASP-ASP-GLY-TYR-GLU-CYS-ASP-VAL-LEU-GLY-LYS-ASP-ILE-LEU-LEU-CYS-ASP-PRO-ILE-PRO-LEU-ASP-THR-GLU-VAL-THR-ALA-LEU-SER-GLU-ASP-GLU-TYR-PHE-SER-ALA-GLY-VAL-VAL-LYS-GLY-HIS-ARG-LYS-GLU-SER-GLY-GLU-LEU-TYR-TYR-SER-ILE-GLU-LYS-GLU-GLY-GLN-ARG-LYS-TRP-TYR-LYS-ARG-MET-ALA-VAL-ILE-LEU-SER-LEU-GLU-GLN-GLY-ASN-ARG-LEU-ARG-GLU-GLN-TYR-GLY-LEU-GLY,ARG-ALA-HIS-SER-SER-HIS-LEU-MLY-SER-LYS-LYS-GLY-GLN-SER-THR,123,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CO)CCC(=O)N)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)Cc1nc[nH]c1)CO)CO)Cc1nc[nH]c1)CC(C)C)CCCC[NH+](C)C)CO,Kd=20uM,4.69897,4.7,1,A,A,1,A,A,0,,B,A,,1,1,123,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)C(CCCCN(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8699244856834412,0.6961585879325867,82.0333023071289,86.9760971069336,0.3735423386096954,0.8845327496528625,0.8901664018630981,0.7994306087493896,0.7969291806221008,0.6703405976295471,RAHSSHLKSKKGQST,Low,"(4.606, 4.745]",train
2MWP,protein-peptide,Q12888 P04637,GHMNSFVGLRVVAKWSSNGYFYSGKITRDVGAGKYKLLFDDGYECDVLGKDILLCDPIPLDTEVTALSEDEYFSAGVVKGHRKESGELYYSIEKEGQRKWYKRMAVILSLEQGNRLREQYGLG,STSRHKKLMFKT,GLY-HIS-MET-ASN-SER-PHE-VAL-GLY-LEU-ARG-VAL-VAL-ALA-LYS-TRP-SER-SER-ASN-GLY-TYR-PHE-TYR-SER-GLY-LYS-ILE-THR-ARG-ASP-VAL-GLY-ALA-GLY-LYS-TYR-LYS-LEU-LEU-PHE-ASP-ASP-GLY-TYR-GLU-CYS-ASP-VAL-LEU-GLY-LYS-ASP-ILE-LEU-LEU-CYS-ASP-PRO-ILE-PRO-LEU-ASP-THR-GLU-VAL-THR-ALA-LEU-SER-GLU-ASP-GLU-TYR-PHE-SER-ALA-GLY-VAL-VAL-LYS-GLY-HIS-ARG-LYS-GLU-SER-GLY-GLU-LEU-TYR-TYR-SER-ILE-GLU-LYS-GLU-GLY-GLN-ARG-LYS-TRP-TYR-LYS-ARG-MET-ALA-VAL-ILE-LEU-SER-LEU-GLU-GLN-GLY-ASN-ARG-LEU-ARG-GLU-GLN-TYR-GLY-LEU-GLY,SER-THR-SER-ARG-HIS-LYS-MLY-LEU-MET-PHE-LYS-THR,123,12,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCC[NH3+])Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CO)[NH3+])CO)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CCCC[NH3+])CCCC[NH+](C)C)CC(C)C,Kd=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,B,A,,1,1,123,12,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.8761410713195801,0.8465930223464966,88.91839599609375,89.49899291992188,0.3595715463161468,0.603215754032135,0.8978280425071716,0.8915342688560486,0.815163791179657,0.835357666015625,STSRHKKLMFKT,Low,"(5.959, 6.097]",val
2MWY,protein-peptide,O15151 P04637,QINQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDQQEQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVTLAT,SQETFSDLWKLLPEN,GLN-ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-GLN-GLN-GLU-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-TYR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR-LEU-ALA-THR,SER-GLN-GLU-THR-PHE-SER-ASP-LEU-TRP-LYS-LEU-LEU-PRO-GLU-ASN,89,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC(=O)O)CC(C)C)CC(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)N)CCC(=O)O)Cc1ccccc1)CO)CC(=O)O)CC(C)C,Kd=0.15uM,6.823909,6.82,1,A,A,1,A,A,0,,B,A,,1,1,89,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9862331748008728,0.7990970611572266,91.73689270019533,65.37815856933594,0.3050865232944488,0.6765121817588806,0.931756854057312,0.8458115458488464,0.9097080230712892,0.7874183654785156,SQETFSDLWKLLPEN,Low,"(6.696, 6.824]",val
2N1G,protein-peptide,Q15054 Q9UBZ9,NLAGAVEFNDVKTLLREWITTISDPMEEDILQVVKYCTDLIEEKDLEKLDLVIKYMKRLMQQSVESVWNMAFDFILDNVQVVLQQTYGSTLKVT,KGNMMSNFFGKAAMNK,ASN-LEU-ALA-GLY-ALA-VAL-GLU-PHE-ASN-ASP-VAL-LYS-THR-LEU-LEU-ARG-GLU-TRP-ILE-THR-THR-ILE-SER-ASP-PRO-MET-GLU-GLU-ASP-ILE-LEU-GLN-VAL-VAL-LYS-TYR-CYS-THR-ASP-LEU-ILE-GLU-GLU-LYS-ASP-LEU-GLU-LYS-LEU-ASP-LEU-VAL-ILE-LYS-TYR-MET-LYS-ARG-LEU-MET-GLN-GLN-SER-VAL-GLU-SER-VAL-TRP-ASN-MET-ALA-PHE-ASP-PHE-ILE-LEU-ASP-ASN-VAL-GLN-VAL-VAL-LEU-GLN-GLN-THR-TYR-GLY-SER-THR-LEU-LYS-VAL-THR,LYS-GLY-ASN-MET-MET-SER-ASN-PHE-PHE-GLY-LYS-ALA-ALA-MET-ASN-LYS,94,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CC(=O)N)CCSC)C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCCC[NH3+])[NH3+])CC(=O)N)CCSC)CCSC)CO)CC(=O)N)Cc1ccccc1)Cc1ccccc1,Kd=2.3uM,5.638272,5.64,1,A,A,1,A,A,0,,B,A,,1,1,94,16,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,0.9570650458335876,0.7135368585586548,96.01136016845705,79.56538391113281,0.3247110247611999,0.8605790734291077,0.916247010231018,0.801543653011322,0.8763604164123535,0.6915351748466492,KGNMMSNFFGKAAMNK,Low,"(5.6, 5.699]",train
2N3K,protein-peptide,Q8UN00 O60885,GAIAMESEEEDKCKPMSYEEKRQLSLDINKLPGEKLGRVVHIIQSREPSLKNSNPDEIEIDFETLKPSTLRELERYVTSCLRKKTR,TWRVQRSQNPLKIRLTR,GLY-ALA-ILE-ALA-MET-GLU-SER-GLU-GLU-GLU-ASP-LYS-CYS-LYS-PRO-MET-SER-TYR-GLU-GLU-LYS-ARG-GLN-LEU-SER-LEU-ASP-ILE-ASN-LYS-LEU-PRO-GLY-GLU-LYS-LEU-GLY-ARG-VAL-VAL-HIS-ILE-ILE-GLN-SER-ARG-GLU-PRO-SER-LEU-LYS-ASN-SER-ASN-PRO-ASP-GLU-ILE-GLU-ILE-ASP-PHE-GLU-THR-LEU-LYS-PRO-SER-THR-LEU-ARG-GLU-LEU-GLU-ARG-TYR-VAL-THR-SER-CYS-LEU-ARG-LYS-LYS-THR-ARG,THR-TRP-ARG-VAL-GLN-ARG-SER-GLN-ASN-PRO-LEU-LYS-ILE-ARG-LEU-THR-ARG,86,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)[C@H](O)C)CC(C)C)CCC[NH+]=C(N)N)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)CCC(=O)N)CCC[NH+]=C(N)N)CO)CCC(=O)N)CC(=O)N)CC(C)C,Kd=159nM,6.798603,6.8,1,A,A,1,A,A,0,,B,A,,1,1,86,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,1.0298889875411987,0.8342781066894531,94.0151824951172,77.62987518310547,0.3628158867359161,0.740642786026001,0.8718516230583191,0.7979384064674377,0.8812914490699768,0.7561536431312561,TWRVQRSQNPLKIRLTR,Low,"(6.696, 6.824]",val
2N9E,protein-peptide,Q96RL1 P61956,MADEKPKEGVKTENNDHINLKVAGQDGSVVQFKIKRHTPLSKLMKAYCERQGLSMRQIRFRFDGQPINETDTPAQLEMEDEDTIDVFQQQTGGVY,EDAFIVISDSDGE,MET-ALA-ASP-GLU-LYS-PRO-LYS-GLU-GLY-VAL-LYS-THR-GLU-ASN-ASN-ASP-HIS-ILE-ASN-LEU-LYS-VAL-ALA-GLY-GLN-ASP-GLY-SER-VAL-VAL-GLN-PHE-LYS-ILE-LYS-ARG-HIS-THR-PRO-LEU-SER-LYS-LEU-MET-LYS-ALA-TYR-CYS-GLU-ARG-GLN-GLY-LEU-SER-MET-ARG-GLN-ILE-ARG-PHE-ARG-PHE-ASP-GLY-GLN-PRO-ILE-ASN-GLU-THR-ASP-THR-PRO-ALA-GLN-LEU-GLU-MET-GLU-ASP-GLU-ASP-THR-ILE-ASP-VAL-PHE-GLN-GLN-GLN-THR-GLY-GLY-VAL-TYR,ACE-GLU-ASP-ALA-PHE-ILE-VAL-ILE-SEP-ASP-SEP-ASP-GLY-GLU-NH2,95,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N)CCC(=O)O)CC(=O)O)COP(O)(O)O)CC(=O)O)COP(O)(O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)O)CC(=O)O)C)Cc1ccccc1)C,Kd=9uM,5.045757,5.05,1,A,A,1,A,A,0,,A,B,,1,1,95,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C,,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)CC)C(C)C,0.932526469230652,0.9221699237823486,87.6023178100586,74.8758773803711,0.3818182647228241,0.5833829045295715,0.8381542563438416,0.8491882681846619,0.8230176568031311,0.8483100533485413,EDAFIVISDSDGE,Low,"(5.014, 5.105]",train
2N9X,protein-peptide,Q8IVP5 Q9GZQ8,MPSEKTFKQRRTFEQRVEDVRLIREQHPTKIPVIIERYKGEKQLPVLDKTKFLVPDHVNMSELIKIIRRRLQLNANQAFFLLVNGHSMVSVSTPISEVYESEKDEDGFLYMVYASQETFG,DYESDDDSYEVLDLTEY,MET-PRO-SER-GLU-LYS-THR-PHE-LYS-GLN-ARG-ARG-THR-PHE-GLU-GLN-ARG-VAL-GLU-ASP-VAL-ARG-LEU-ILE-ARG-GLU-GLN-HIS-PRO-THR-LYS-ILE-PRO-VAL-ILE-ILE-GLU-ARG-TYR-LYS-GLY-GLU-LYS-GLN-LEU-PRO-VAL-LEU-ASP-LYS-THR-LYS-PHE-LEU-VAL-PRO-ASP-HIS-VAL-ASN-MET-SER-GLU-LEU-ILE-LYS-ILE-ILE-ARG-ARG-ARG-LEU-GLN-LEU-ASN-ALA-ASN-GLN-ALA-PHE-PHE-LEU-LEU-VAL-ASN-GLY-HIS-SER-MET-VAL-SER-VAL-SER-THR-PRO-ILE-SER-GLU-VAL-TYR-GLU-SER-GLU-LYS-ASP-GLU-ASP-GLY-PHE-LEU-TYR-MET-VAL-TYR-ALA-SER-GLN-GLU-THR-PHE-GLY,ASP-TYR-GLU-SER-ASP-ASP-ASP-SER-TYR-GLU-VAL-LEU-ASP-LEU-THR-GLU-TYR,120,17,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O)[C@H](O)C)CC(C)C)CC(=O)O)CC(C)C)C(C)C)CCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1ccc(cc1)O)CCC(=O)O)CO)CC(=O)O)CC(=O)O)CC(=O)O,Kd=0.4uM,6.39794,6.4,1,A,A,1,A,A,0,,B,A,,1,1,120,17,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C,0.8456369042396545,0.7619710564613342,84.16039276123047,86.0051040649414,0.4898866713047027,0.7529166340827942,0.8186787962913513,0.830681562423706,0.7748216986656189,0.7447934150695801,DYESDDDSYEVLDLTEY,Low,"(6.26, 6.398]",val
2NCZ,protein-peptide,Q9BZ95 O60885,SEEEDKCKPMSYEEKRQLSLDINKLPGEKLGRVVHIIQSREPSLKNSNPDEIEIDFETLKPSTLRELERYVTSCLRKKRKPQA,EIKLKITKTIQN,SER-GLU-GLU-GLU-ASP-LYS-CYS-LYS-PRO-MET-SER-TYR-GLU-GLU-LYS-ARG-GLN-LEU-SER-LEU-ASP-ILE-ASN-LYS-LEU-PRO-GLY-GLU-LYS-LEU-GLY-ARG-VAL-VAL-HIS-ILE-ILE-GLN-SER-ARG-GLU-PRO-SER-LEU-LYS-ASN-SER-ASN-PRO-ASP-GLU-ILE-GLU-ILE-ASP-PHE-GLU-THR-LEU-LYS-PRO-SER-THR-LEU-ARG-GLU-LEU-GLU-ARG-TYR-VAL-THR-SER-CYS-LEU-ARG-LYS-LYS-ARG-LYS-PRO-GLN-ALA,GLU-ILE-LYS-LEU-LYS-ILE-THR-LYS-THR-ILE-GLN-ASN,83,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC(=O)N)[C@H](CC)C)[C@H](O)C)CCCC[NH3+])[C@H](O)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CCC(=O)O)[NH3+])CCCC[NH3+])CC(C)C,Kd=140.5uM,3.852324,3.85,1,A,A,1,A,A,0,,B,A,,1,1,83,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8980507254600525,0.8974564671516418,93.90351104736328,86.4921646118164,0.3652932643890381,0.5374817252159119,0.8756193518638611,0.8828932046890259,0.8247111439704895,0.8634466528892517,EIKLKITKTIQN,Low,"(3.548, 3.924]",train
2ND0,protein-peptide,O60885 Q9QR71,SEEEDKCKPMSYEEKRQLSLDINKLPGEKLGRVVHIIQSREPSLKNSNPDEIEIDFETLKPSTLRELERYVTSCLRKKRKPQA,NLQSSIVKFKKPLPLTQPG,SER-GLU-GLU-GLU-ASP-LYS-CYS-LYS-PRO-MET-SER-TYR-GLU-GLU-LYS-ARG-GLN-LEU-SER-LEU-ASP-ILE-ASN-LYS-LEU-PRO-GLY-GLU-LYS-LEU-GLY-ARG-VAL-VAL-HIS-ILE-ILE-GLN-SER-ARG-GLU-PRO-SER-LEU-LYS-ASN-SER-ASN-PRO-ASP-GLU-ILE-GLU-ILE-ASP-PHE-GLU-THR-LEU-LYS-PRO-SER-THR-LEU-ARG-GLU-LEU-GLU-ARG-TYR-VAL-THR-SER-CYS-LEU-ARG-LYS-LYS-ARG-LYS-PRO-GLN-ALA,ASN-LEU-GLN-SER-SER-ILE-VAL-LYS-PHE-LYS-LYS-PRO-LEU-PRO-LEU-THR-GLN-PRO-GLY,83,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)CCC(=O)N)[C@H](O)C)CC(C)C)CC(C)C)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(C)C)CCC(=O)N)CO)CO)CCCC[NH3+])Cc1ccccc1,Kd=635uM,3.197226,3.2,1,A,A,1,A,A,0,,B,A,,1,1,83,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)O)[C@@H](C)O,0.8500858545303345,0.8155044913291931,91.88249969482422,79.8523941040039,0.4144043028354645,0.7409237027168274,0.8428544998168945,0.7901954650878906,0.7354720234870911,0.7390004396438599,NLQSSIVKFKKPLPLTQPG,Low,"(2.044, 3.548]",train
2NDF,protein-peptide,P42568 P68431,GSHMASSCAVQVKLELGHRAQVRKKPTVEGFTHDWMVFVRGPEHSNIQHFVEKVVFHLHESFPRPKRVCKDPPYKVEESGYAGFILPIEVYFKNKEEPRKVRFDYDLFLHLEGHPPVNHLRCEKLTFNNPTEDFRRKLLKA,GGKAPRKQLATKA,GLY-SER-HIS-MET-ALA-SER-SER-CYS-ALA-VAL-GLN-VAL-LYS-LEU-GLU-LEU-GLY-HIS-ARG-ALA-GLN-VAL-ARG-LYS-LYS-PRO-THR-VAL-GLU-GLY-PHE-THR-HIS-ASP-TRP-MET-VAL-PHE-VAL-ARG-GLY-PRO-GLU-HIS-SER-ASN-ILE-GLN-HIS-PHE-VAL-GLU-LYS-VAL-VAL-PHE-HIS-LEU-HIS-GLU-SER-PHE-PRO-ARG-PRO-LYS-ARG-VAL-CYS-LYS-ASP-PRO-PRO-TYR-LYS-VAL-GLU-GLU-SER-GLY-TYR-ALA-GLY-PHE-ILE-LEU-PRO-ILE-GLU-VAL-TYR-PHE-LYS-ASN-LYS-GLU-GLU-PRO-ARG-LYS-VAL-ARG-PHE-ASP-TYR-ASP-LEU-PHE-LEU-HIS-LEU-GLU-GLY-HIS-PRO-PRO-VAL-ASN-HIS-LEU-ARG-CYS-GLU-LYS-LEU-THR-PHE-ASN-ASN-PRO-THR-GLU-ASP-PHE-ARG-ARG-LYS-LEU-LEU-LYS-ALA,GLY-GLY-LYS-ALA-PRO-ARG-ALY-GLN-LEU-ALA-THR-LYS-ALA,141,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)C)CC(C)C)CCC(=O)N)CCCCNC(=O)C)CCC[NH+]=C(N)N)C)NC(=O)CNC(=O)C[NH3+],Kd=59.5uM,4.225483,4.23,1,A,A,1,A,A,0,,B,A,,1,1,141,13,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.911770224571228,0.7620918154716492,84.15218353271484,91.44976806640624,0.3482281267642975,0.7750279307365417,0.9156006574630736,0.8382977843284607,0.8458775281906128,0.7297424077987671,GGKAPRKQLATKA,Low,"(4.155, 4.319]",train
2NM1,protein-peptide,P29101 P10844,SEILNNIILNLRYKDNNLIDLSGYGAKVEVYDGVELNDKNQFKLTSSANSKIRVTQNQNIIFNSVFLDFSVSFWIRIPKYKNDGIQNYIHNEYTIINCMKNNSGWKISIRGNRIIWTLIDINGKTKSVFFEYNIREDISEYINRWFFVTITNNLNNAKIYINGKLESNTDIKDIREVIANGEIIFKLDGDIDRTQFIWMKYFSIFNTELSQSNIEERYKIQSYSEYLKDFWGNPLMYNKEYYMFNAGNKNSYIKLKKDSPVGEILTRSKYNQNSKYINYRDLYIGEKFIIRRKSNSQSINDDIVRKEDYIYLDFFNLNQEWRVYTYKYFKKEEEKLFLAPISDSDEFYNTIQIKEYDEQPTYSCQLLFKKDEESTDEIGLIGIHRFYESGIVFEEYKDYFCISKWYLKEVKRKPYNLKLGCNWQFIPKDEGWTEPP,EDMFAKLKDKFFNEINK,SER-GLU-ILE-LEU-ASN-ASN-ILE-ILE-LEU-ASN-LEU-ARG-TYR-LYS-ASP-ASN-ASN-LEU-ILE-ASP-LEU-SER-GLY-TYR-GLY-ALA-LYS-VAL-GLU-VAL-TYR-ASP-GLY-VAL-GLU-LEU-ASN-ASP-LYS-ASN-GLN-PHE-LYS-LEU-THR-SER-SER-ALA-ASN-SER-LYS-ILE-ARG-VAL-THR-GLN-ASN-GLN-ASN-ILE-ILE-PHE-ASN-SER-VAL-PHE-LEU-ASP-PHE-SER-VAL-SER-PHE-TRP-ILE-ARG-ILE-PRO-LYS-TYR-LYS-ASN-ASP-GLY-ILE-GLN-ASN-TYR-ILE-HIS-ASN-GLU-TYR-THR-ILE-ILE-ASN-CYS-MET-LYS-ASN-ASN-SER-GLY-TRP-LYS-ILE-SER-ILE-ARG-GLY-ASN-ARG-ILE-ILE-TRP-THR-LEU-ILE-ASP-ILE-ASN-GLY-LYS-THR-LYS-SER-VAL-PHE-PHE-GLU-TYR-ASN-ILE-ARG-GLU-ASP-ILE-SER-GLU-TYR-ILE-ASN-ARG-TRP-PHE-PHE-VAL-THR-ILE-THR-ASN-ASN-LEU-ASN-ASN-ALA-LYS-ILE-TYR-ILE-ASN-GLY-LYS-LEU-GLU-SER-ASN-THR-ASP-ILE-LYS-ASP-ILE-ARG-GLU-VAL-ILE-ALA-ASN-GLY-GLU-ILE-ILE-PHE-LYS-LEU-ASP-GLY-ASP-ILE-ASP-ARG-THR-GLN-PHE-ILE-TRP-MET-LYS-TYR-PHE-SER-ILE-PHE-ASN-THR-GLU-LEU-SER-GLN-SER-ASN-ILE-GLU-GLU-ARG-TYR-LYS-ILE-GLN-SER-TYR-SER-GLU-TYR-LEU-LYS-ASP-PHE-TRP-GLY-ASN-PRO-LEU-MET-TYR-ASN-LYS-GLU-TYR-TYR-MET-PHE-ASN-ALA-GLY-ASN-LYS-ASN-SER-TYR-ILE-LYS-LEU-LYS-LYS-ASP-SER-PRO-VAL-GLY-GLU-ILE-LEU-THR-ARG-SER-LYS-TYR-ASN-GLN-ASN-SER-LYS-TYR-ILE-ASN-TYR-ARG-ASP-LEU-TYR-ILE-GLY-GLU-LYS-PHE-ILE-ILE-ARG-ARG-LYS-SER-ASN-SER-GLN-SER-ILE-ASN-ASP-ASP-ILE-VAL-ARG-LYS-GLU-ASP-TYR-ILE-TYR-LEU-ASP-PHE-PHE-ASN-LEU-ASN-GLN-GLU-TRP-ARG-VAL-TYR-THR-TYR-LYS-TYR-PHE-LYS-LYS-GLU-GLU-GLU-LYS-LEU-PHE-LEU-ALA-PRO-ILE-SER-ASP-SER-ASP-GLU-PHE-TYR-ASN-THR-ILE-GLN-ILE-LYS-GLU-TYR-ASP-GLU-GLN-PRO-THR-TYR-SER-CYS-GLN-LEU-LEU-PHE-LYS-LYS-ASP-GLU-GLU-SER-THR-ASP-GLU-ILE-GLY-LEU-ILE-GLY-ILE-HIS-ARG-PHE-TYR-GLU-SER-GLY-ILE-VAL-PHE-GLU-GLU-TYR-LYS-ASP-TYR-PHE-CYS-ILE-SER-LYS-TRP-TYR-LEU-LYS-GLU-VAL-LYS-ARG-LYS-PRO-TYR-ASN-LEU-LYS-LEU-GLY-CYS-ASN-TRP-GLN-PHE-ILE-PRO-LYS-ASP-GLU-GLY-TRP-THR-GLU-PRO-PRO,GLU-ASP-MET-PHE-ALA-LYS-LEU-LYS-ASP-LYS-PHE-PHE-ASN-GLU-ILE-ASN-LYS,436,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CC(=O)N)[C@H](CC)C)CCC(=O)O)CC(=O)N)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CCSC)Cc1ccccc1)C)CCCC[NH3+])CC(C)C)CCCC[NH3+])CC(=O)O,Kd=34nM,7.468521,7.47,1,A,A,1,A,A,0,,B,A,,1,1,436,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.7806298732757568,0.6507444977760315,68.60546875,69.0155029296875,0.7341325879096985,1.085080623626709,0.8032412528991699,0.7605388164520264,0.7515222430229187,0.6232959032058716,EDMFAKLKDKFFNEINK,Moderate,"(7.268, 7.523]",train
2NMB,protein-peptide,P16554,GSPGIPDRVPESSKPHQWQADEEAVRSATCSFSVKYLGCVEVFESRGMQVCEEALKVLRQSRRRPVRGLLHVSGDGLRVVDDETKGLIVDQTIEKVSFCAPDRNHERGFSYICRDGTTRRWMCHGFLACKDSGERLSHAVGCAFAVCLERKQRRTRAAAS,AYIGPYL,GLY-SER-PRO-GLY-ILE-PRO-ASP-ARG-VAL-PRO-GLU-SER-SER-LYS-PRO-HIS-GLN-TRP-GLN-ALA-ASP-GLU-GLU-ALA-VAL-ARG-SER-ALA-THR-CYS-SER-PHE-SER-VAL-LYS-TYR-LEU-GLY-CYS-VAL-GLU-VAL-PHE-GLU-SER-ARG-GLY-MET-GLN-VAL-CYS-GLU-GLU-ALA-LEU-LYS-VAL-LEU-ARG-GLN-SER-ARG-ARG-ARG-PRO-VAL-ARG-GLY-LEU-LEU-HIS-VAL-SER-GLY-ASP-GLY-LEU-ARG-VAL-VAL-ASP-ASP-GLU-THR-LYS-GLY-LEU-ILE-VAL-ASP-GLN-THR-ILE-GLU-LYS-VAL-SER-PHE-CYS-ALA-PRO-ASP-ARG-ASN-HIS-GLU-ARG-GLY-PHE-SER-TYR-ILE-CYS-ARG-ASP-GLY-THR-THR-ARG-ARG-TRP-MET-CYS-HIS-GLY-PHE-LEU-ALA-CYS-LYS-ASP-SER-GLY-GLU-ARG-LEU-SER-HIS-ALA-VAL-GLY-CYS-ALA-PHE-ALA-VAL-CYS-LEU-GLU-ARG-LYS-GLN-ARG-ARG-THR-ARG-ALA-ALA-ALA-SER,ALA-TYR-ILE-GLY-PRO-PTR-LEU,160,7,CC[C@@H]([C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccc(cc1)O)C,Kd=0.53uM,6.275724,6.28,1,A,A,1,A,A,0,,B,A,,1,1,160,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)O,0.956443190574646,0.954097867012024,78.51022338867188,83.25971221923828,0.4279433786869049,0.4778170585632324,0.8414039611816406,0.8970828652381897,0.8766700625419617,0.9019452929496764,AYIGPYL,Low,"(6.26, 6.398]",val
2NWN,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKEENGLAL,CSWRGLENHRMC,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU-GLU-ASN-GLY-LEU-ALA-LEU,CYS-SER-TRP-ARG-GLY-LEU-GLU-ASN-HIS-ARG-MET-CYS,253,12,CSCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)O)[NH3+])CO)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N,Ki=500nM,6.30103,6.3,1,A,A,1,A,A,0,,B,A,,1,1,253,12,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CS)C(=O)O,CSCC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O)C(=O)O,0.9183229207992554,0.8517934083938599,95.45946502685548,93.19686889648438,0.3300793468952179,0.6188825964927673,0.9554474949836732,0.9229801893234252,0.8807398676872253,0.8339966535568237,CSWRGLENHRMC,Low,"(6.26, 6.398]",train
2NXD,protein-peptide,P03369,PQITLWKRPLVTIRIGGQLKEALLNTGADDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF,GADIFYLDGA,PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-ALA-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-ILE-GLU-ILE-CYS-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-CYS-THR-LEU-ASN-PHE,GLY-ALA-ASP-ILE-PHE-TYR-LEU-ASP-GLY-ALA,99,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C)CC(C)C)Cc1ccc(cc1)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)C,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,P,A,dimer,1,1,99,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O,0.7740783095359802,0.8039190769195557,90.31623840332033,92.17725372314452,0.4856531620025635,0.62978595495224,0.8572624325752258,0.8589882254600525,0.6959428787231445,0.7901517748832703,GADIFYLDGA,Low,"(5.6, 5.699]",val
2NXL,protein-peptide,P03369,PQITLWKRPLVTIRIGGQLKEALLNTGADDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF,GAEVFYVDGA,PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-ALA-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-ILE-GLU-ILE-CYS-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-CYS-THR-LEU-ASN-PHE,GLY-ALA-GLU-VAL-PHE-TYR-VAL-ASP-GLY-ALA,99,10,OC(=O)C[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC(=O)O)Cc1ccccc1)Cc1ccc(cc1)O,Kd=0.54uM,6.267606,6.27,1,A,A,1,A,A,0,,P,A,dimer,1,1,99,10,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CN)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)C(C)C,0.7897691130638123,0.7892482280731201,90.78282928466795,91.74962615966795,0.4702220261096954,0.6545047163963318,0.8604530692100525,0.8452927470207214,0.7147586941719055,0.7752370834350586,GAEVFYVDGA,Low,"(6.26, 6.398]",train
2NXM,protein-peptide,P03369,PQITLWKRPLVTIRIGGQLKEALLNTGADDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF,GAQTFYVDGA,PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-ALA-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-ILE-GLU-ILE-CYS-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-CYS-THR-LEU-ASN-PHE,GLY-ALA-GLN-THR-PHE-TYR-VAL-ASP-GLY-ALA,99,10,OC(=O)C[C@@H](C(=O)NCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC(=O)N)Cc1ccccc1)Cc1ccc(cc1)O,Kd=6.4uM,5.19382,5.19,1,A,A,1,A,A,0,,P,A,dimer,1,1,99,10,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@H](C)N)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)O)[C@@H](C)O,0.8319656848907471,0.8029435873031616,92.10385131835938,92.74051666259766,0.4439276158809662,0.6220513582229614,0.863739550113678,0.8570391535758972,0.7666827440261841,0.7894197106361389,GAQTFYVDGA,Low,"(5.105, 5.222]",val
2O9V,protein-peptide,Q9BX66 P49023,GIDPFTGEAIAKFNFNGDTQVEMSFRKGERITLLRQVDENWYEGRIPGTSRQGIFPITYVDVIKRPL,VPPPVPPPPS,GLY-ILE-ASP-PRO-PHE-THR-GLY-GLU-ALA-ILE-ALA-LYS-PHE-ASN-PHE-ASN-GLY-ASP-THR-GLN-VAL-GLU-MET-SER-PHE-ARG-LYS-GLY-GLU-ARG-ILE-THR-LEU-LEU-ARG-GLN-VAL-ASP-GLU-ASN-TRP-TYR-GLU-GLY-ARG-ILE-PRO-GLY-THR-SER-ARG-GLN-GLY-ILE-PHE-PRO-ILE-THR-TYR-VAL-ASP-VAL-ILE-LYS-ARG-PRO-LEU,VAL-PRO-PRO-PRO-VAL-PRO-PRO-PRO-PRO-SER,67,10,OC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)[NH3+],Kd=288uM,3.540608,3.54,1,A,A,1,A,A,0,,B,A,,1,1,67,10,0,CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,0.9632961750030518,0.7834630608558655,98.36343383789062,96.15626525878906,0.2937813103199005,0.4732532799243927,0.9213111400604248,0.8408162593841553,0.8926235437393188,0.7691247463226318,VPPPVPPPPS,Low,"(2.044, 3.548]",val
2ODD,protein-peptide,Q9Y618 Q06455,ENLYFQGENLYFQGDSSESCWNCGRKASETCSGCNTARYCGSFCQHKDWEKHHHICGQTLQAQQ,GSGSTISNPPPLISSAK,GLU-ASN-LEU-TYR-PHE-GLN-GLY-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ASP-SER-SER-GLU-SER-CYS-TRP-ASN-CYS-GLY-ARG-LYS-ALA-SER-GLU-THR-CYS-SER-GLY-CYS-ASN-THR-ALA-ARG-TYR-CYS-GLY-SER-PHE-CYS-GLN-HIS-LYS-ASP-TRP-GLU-LYS-HIS-HIS-HIS-ILE-CYS-GLY-GLN-THR-LEU-GLN-ALA-GLN-GLN,GLY-SER-GLY-SER-THR-ILE-SER-ASN-PRO-PRO-PRO-LEU-ILE-SER-SER-ALA-LYS,64,17,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](O)C)[NH3+])CO)CC(=O)N)CC(C)C)CO)CO)C,Kd=109.4uM,3.960983,3.96,1,A,A,1,A,A,0,,B,A,,1,1,64,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O,1.0554087162017822,0.907727062702179,75.04100036621094,67.13552856445312,0.4218660295009613,0.746198296546936,0.7570662498474121,0.7248351573944092,0.7673398852348328,0.6897781491279602,GSGSTISNPPPLISSAK,Low,"(3.924, 4.155]",train
2OI3,protein-peptide,P08631,GPLGSPGPNSHNSNTPGIREAGSEDIIVVALYDYEAIHHEDLSFQKGDQMVVLEESGEWWKARSLATRKEGYIPSNYVARVDSLET,HSKYPLPPLPSL,GLY-PRO-LEU-GLY-SER-PRO-GLY-PRO-ASN-SER-HIS-ASN-SER-ASN-THR-PRO-GLY-ILE-ARG-GLU-ALA-GLY-SER-GLU-ASP-ILE-ILE-VAL-VAL-ALA-LEU-TYR-ASP-TYR-GLU-ALA-ILE-HIS-HIS-GLU-ASP-LEU-SER-PHE-GLN-LYS-GLY-ASP-GLN-MET-VAL-VAL-LEU-GLU-GLU-SER-GLY-GLU-TRP-TRP-LYS-ALA-ARG-SER-LEU-ALA-THR-ARG-LYS-GLU-GLY-TYR-ILE-PRO-SER-ASN-TYR-VAL-ALA-ARG-VAL-ASP-SER-LEU-GLU-THR,ACE-HIS-SER-LYS-TYR-PRO-LEU-PRO-PRO-LEU-PRO-SER-LEU-NH2,86,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)CO)CC(C)C)CC(C)C)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1[nH]cnc1)NC(=O)C)CO,Kd=0.23uM,6.638272,6.64,1,A,A,1,A,A,0,,B,A,,1,1,86,14,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O,1.0013175010681152,0.9489352107048036,81.6933364868164,79.90267944335938,0.3882109820842743,0.5728545784950256,0.7830371260643005,0.7765300273895264,0.8454282879829407,0.7958154678344727,HSKYPLPPLPSL,Low,"(6.523, 6.696]",val
2OQS,protein-peptide,Q12959,MEIKLIKGPKGLGFSIAGGVGNQHIPGDNSIYVTKIIEGGAAHKDGKLQIGDKLLAVNNVCLEEVTHEEAVTALKNTSDFVYLKVAKPTGSHHHHHH,RRETQV,MET-GLU-ILE-LYS-LEU-ILE-LYS-GLY-PRO-LYS-GLY-LEU-GLY-PHE-SER-ILE-ALA-GLY-GLY-VAL-GLY-ASN-GLN-HIS-ILE-PRO-GLY-ASP-ASN-SER-ILE-TYR-VAL-THR-LYS-ILE-ILE-GLU-GLY-GLY-ALA-ALA-HIS-LYS-ASP-GLY-LYS-LEU-GLN-ILE-GLY-ASP-LYS-LEU-LEU-ALA-VAL-ASN-ASN-VAL-CYS-LEU-GLU-GLU-VAL-THR-HIS-GLU-GLU-ALA-VAL-THR-ALA-LEU-LYS-ASN-THR-SER-ASP-PHE-VAL-TYR-LEU-LYS-VAL-ALA-LYS-PRO-THR-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS,ARG-ARG-GLU-THR-GLN-VAL,97,6,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,B,A,,1,1,97,6,0,CC(C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O)[C@@H](C)O,0.9826610088348388,0.963705599308014,93.54084014892578,91.38928985595705,0.382339596748352,0.448940098285675,0.8524765968322754,0.9109017252922058,0.9120516777038574,0.906030297279358,RRETQV,Low,"(5.821, 5.959]",train
2PCU,protein-peptide,Q9UI42,NNFNYGAYHSLEAIYHEMDNIAADFPDLARRVKIGHSFENRPMYVLKFSTGKGVRRPAVWLNAGIHSREWISQATAIWTARKIVSDYQRDPAITSILEKMDIFLLPVANPDGYVYTQTQNRLWRKTRSRNPGSSCIGADPNRNWNASFAGKGASDNPCSEVYHGPHANSEVEVKSVVDFIQKHGNFKGFIDLHSYSQLLMYPYGYSVKKAPDAEELDKVARLAAKALASVSGTEYQVGPTCTTVYPASGSSIDWAYDNGIKFAFTFELRDTGTYGFLLPANQIIPTAEETWLGLKTIMEHVRDNL,FNRPV,ASN-ASN-PHE-ASN-TYR-GLY-ALA-TYR-HIS-SER-LEU-GLU-ALA-ILE-TYR-HIS-GLU-MET-ASP-ASN-ILE-ALA-ALA-ASP-PHE-PRO-ASP-LEU-ALA-ARG-ARG-VAL-LYS-ILE-GLY-HIS-SER-PHE-GLU-ASN-ARG-PRO-MET-TYR-VAL-LEU-LYS-PHE-SER-THR-GLY-LYS-GLY-VAL-ARG-ARG-PRO-ALA-VAL-TRP-LEU-ASN-ALA-GLY-ILE-HIS-SER-ARG-GLU-TRP-ILE-SER-GLN-ALA-THR-ALA-ILE-TRP-THR-ALA-ARG-LYS-ILE-VAL-SER-ASP-TYR-GLN-ARG-ASP-PRO-ALA-ILE-THR-SER-ILE-LEU-GLU-LYS-MET-ASP-ILE-PHE-LEU-LEU-PRO-VAL-ALA-ASN-PRO-ASP-GLY-TYR-VAL-TYR-THR-GLN-THR-GLN-ASN-ARG-LEU-TRP-ARG-LYS-THR-ARG-SER-ARG-ASN-PRO-GLY-SER-SER-CYS-ILE-GLY-ALA-ASP-PRO-ASN-ARG-ASN-TRP-ASN-ALA-SER-PHE-ALA-GLY-LYS-GLY-ALA-SER-ASP-ASN-PRO-CYS-SER-GLU-VAL-TYR-HIS-GLY-PRO-HIS-ALA-ASN-SER-GLU-VAL-GLU-VAL-LYS-SER-VAL-VAL-ASP-PHE-ILE-GLN-LYS-HIS-GLY-ASN-PHE-LYS-GLY-PHE-ILE-ASP-LEU-HIS-SER-TYR-SER-GLN-LEU-LEU-MET-TYR-PRO-TYR-GLY-TYR-SER-VAL-LYS-LYS-ALA-PRO-ASP-ALA-GLU-GLU-LEU-ASP-LYS-VAL-ALA-ARG-LEU-ALA-ALA-LYS-ALA-LEU-ALA-SER-VAL-SER-GLY-THR-GLU-TYR-GLN-VAL-GLY-PRO-THR-CYS-THR-THR-VAL-TYR-PRO-ALA-SER-GLY-SER-SER-ILE-ASP-TRP-ALA-TYR-ASP-ASN-GLY-ILE-LYS-PHE-ALA-PHE-THR-PHE-GLU-LEU-ARG-ASP-THR-GLY-THR-TYR-GLY-PHE-LEU-LEU-PRO-ALA-ASN-GLN-ILE-ILE-PRO-THR-ALA-GLU-GLU-THR-TRP-LEU-GLY-LEU-LYS-THR-ILE-MET-GLU-HIS-VAL-ARG-ASP-ASN-LEU,PHE-ASN-ARG-PRO-VAL,305,5,NC(=O)C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)CCC[NH+]=C(N)N)NC(=O)[C@H](Cc1ccccc1)[NH3+],IC50=910uM,3.040959,3.04,1,A,A,1,A,A,0,,B,A,,1,1,305,5,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9048228859901428,0.8416191339492798,96.972900390625,96.27306365966795,0.2876929342746734,0.4968413710594177,0.967094361782074,0.945573627948761,0.8791744112968445,0.8156304359436035,FNRPV,Low,"(2.044, 3.548]",train
2PEH,protein-peptide,Q96I25 O75533,GAMGKCPTKVVLLRNMVGAGEVDEDLEVETKEECEKYGKVGKCVIFEIPGAPDDEAVRIFLEFERVESAIKAVVDLNGRYFGGRVVKACFYNLDKFRVLDLAEQV,KRKSRWDETP,GLY-ALA-MET-GLY-LYS-CYS-PRO-THR-LYS-VAL-VAL-LEU-LEU-ARG-ASN-MET-VAL-GLY-ALA-GLY-GLU-VAL-ASP-GLU-ASP-LEU-GLU-VAL-GLU-THR-LYS-GLU-GLU-CYS-GLU-LYS-TYR-GLY-LYS-VAL-GLY-LYS-CYS-VAL-ILE-PHE-GLU-ILE-PRO-GLY-ALA-PRO-ASP-ASP-GLU-ALA-VAL-ARG-ILE-PHE-LEU-GLU-PHE-GLU-ARG-VAL-GLU-SER-ALA-ILE-LYS-ALA-VAL-VAL-ASP-LEU-ASN-GLY-ARG-TYR-PHE-GLY-GLY-ARG-VAL-VAL-LYS-ALA-CYS-PHE-TYR-ASN-LEU-ASP-LYS-PHE-ARG-VAL-LEU-ASP-LEU-ALA-GLU-GLN-VAL,LYS-ARG-LYS-SER-ARG-TRP-ASP-GLU-THR-PRO,105,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)CCC(=O)O)CC(=O)O)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)CO)C)CCC[NH+]=C(N)N)[NH3+],Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,C,A,,1,1,105,10,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N1CCC[C@H]1C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O,0.966922640800476,0.8547264933586121,96.6769027709961,93.78751373291016,0.2923253178596496,0.5883798599243164,0.945678174495697,0.8987045884132385,0.917885959148407,0.8437319993972778,KRKSRWDETP,Low,"(5.821, 5.959]",train
2PEM,protein-peptide,Q44176 Q44177,MEFKKVAKETAITLQSYLTYQAVRLISQQLSETNPGQAIWLGEFSKRHPIQESDLYLEAMMLENKELVLRILTVRENLAEGVLEFLPEMVLSQIKQSNGNHRRSLLERLTQVDSSSTDQTEPNPGESDTSEDSE,EIKFEFD,MET-GLU-PHE-LYS-LYS-VAL-ALA-LYS-GLU-THR-ALA-ILE-THR-LEU-GLN-SER-TYR-LEU-THR-TYR-GLN-ALA-VAL-ARG-LEU-ILE-SER-GLN-GLN-LEU-SER-GLU-THR-ASN-PRO-GLY-GLN-ALA-ILE-TRP-LEU-GLY-GLU-PHE-SER-LYS-ARG-HIS-PRO-ILE-GLN-GLU-SER-ASP-LEU-TYR-LEU-GLU-ALA-MET-MET-LEU-GLU-ASN-LYS-GLU-LEU-VAL-LEU-ARG-ILE-LEU-THR-VAL-ARG-GLU-ASN-LEU-ALA-GLU-GLY-VAL-LEU-GLU-PHE-LEU-PRO-GLU-MET-VAL-LEU-SER-GLN-ILE-LYS-GLN-SER-ASN-GLY-ASN-HIS-ARG-ARG-SER-LEU-LEU-GLU-ARG-LEU-THR-GLN-VAL-ASP-SER-SER-SER-THR-ASP-GLN-THR-GLU-PRO-ASN-PRO-GLY-GLU-SER-ASP-THR-SER-GLU-ASP-SER-GLU,GLU-ILE-LYS-PHE-GLU-PHE-ASP,134,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)CCC(=O)O)Cc1ccccc1)C)NC(=O)[C@@H]([NH3+])C)C,Kd=230uM,3.638272,3.64,1,A,A,1,A,A,0,,R,A,dimer,1,1,134,7,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8902814388275146,0.9282944798469543,75.49436950683594,76.22398376464844,0.4403265416622162,0.6064015030860901,0.712438702583313,0.7830455899238586,0.7751676440238953,0.8293454647064209,EIKFEFD,Low,"(3.548, 3.924]",train
2PL9,protein-peptide,P07800 P0A2D5,ADKELKFLVVDDFSTMRRIVRNLLKELGFNNVEEAEDGVDALNKLQAGGFGFIISDWNMPNMDGLELLKTIRADSAMSALPVLMVTAEAKKENIIAAAQAGASGYVVKPFTAATLEEKLNKIFEKLGM,AGVVASQDQVDDLLDSLGF,ALA-ASP-LYS-GLU-LEU-LYS-PHE-LEU-VAL-VAL-ASP-ASP-PHE-SER-THR-MET-ARG-ARG-ILE-VAL-ARG-ASN-LEU-LEU-LYS-GLU-LEU-GLY-PHE-ASN-ASN-VAL-GLU-GLU-ALA-GLU-ASP-GLY-VAL-ASP-ALA-LEU-ASN-LYS-LEU-GLN-ALA-GLY-GLY-PHE-GLY-PHE-ILE-ILE-SER-ASP-TRP-ASN-MET-PRO-ASN-MET-ASP-GLY-LEU-GLU-LEU-LEU-LYS-THR-ILE-ARG-ALA-ASP-SER-ALA-MET-SER-ALA-LEU-PRO-VAL-LEU-MET-VAL-THR-ALA-GLU-ALA-LYS-LYS-GLU-ASN-ILE-ILE-ALA-ALA-ALA-GLN-ALA-GLY-ALA-SER-GLY-TYR-VAL-VAL-LYS-PRO-PHE-THR-ALA-ALA-THR-LEU-GLU-GLU-LYS-LEU-ASN-LYS-ILE-PHE-GLU-LYS-LEU-GLY-MET,ALA-GLY-VAL-VAL-ALA-SER-GLN-ASP-GLN-VAL-ASP-ASP-LEU-LEU-ASP-SER-LEU-GLY-PHE,128,19,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(C)C)CO)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CC(=O)O)C(C)C)CCC(=O)N)CC(=O)O)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@@H]([NH3+])C)C,Kd=67.4uM,4.17134,4.17,1,A,A,1,A,A,0,,D,A,,1,1,128,19,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)N)C(C)C)C(C)C)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(C)C)C(C)C)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,0.99419105052948,0.6489862203598022,93.29571533203124,87.79590606689453,0.2982816100120544,0.961876630783081,0.9496989250183104,0.7704119086265564,0.9287834167480468,0.6186298131942749,AGVVASQDQVDDLLDSLGF,Low,"(4.155, 4.319]",train
2PMC,protein-peptide,P07800 P0A2D5,ADKELKFLVVDDFSTMRRIVRNLLKELGFNNVEEAEDGVDALNKLQAGGFGFIISDWNMPNMDGLELLKTIRADSAMSALPVLMVTAEAKKENIIAAAQAGASGYVVKPFTAATLEEKLNKIFEKLGM,ASQDQVDDLLDSLGF,ALA-ASP-LYS-GLU-LEU-LYS-PHE-LEU-VAL-VAL-ASP-ASP-PHE-SER-THR-MET-ARG-ARG-ILE-VAL-ARG-ASN-LEU-LEU-LYS-GLU-LEU-GLY-PHE-ASN-ASN-VAL-GLU-GLU-ALA-GLU-ASP-GLY-VAL-ASP-ALA-LEU-ASN-LYS-LEU-GLN-ALA-GLY-GLY-PHE-GLY-PHE-ILE-ILE-SER-ASP-TRP-ASN-MET-PRO-ASN-MET-ASP-GLY-LEU-GLU-LEU-LEU-LYS-THR-ILE-ARG-ALA-ASP-SER-ALA-MET-SER-ALA-LEU-PRO-VAL-LEU-MET-VAL-THR-ALA-GLU-ALA-LYS-LYS-GLU-ASN-ILE-ILE-ALA-ALA-ALA-GLN-ALA-GLY-ALA-SER-GLY-TYR-VAL-VAL-LYS-PRO-PHE-THR-ALA-ALA-THR-LEU-GLU-GLU-LYS-LEU-ASN-LYS-ILE-PHE-GLU-LYS-LEU-GLY-MET,ALA-SER-GLN-ASP-GLN-VAL-ASP-ASP-LEU-LEU-ASP-SER-LEU-GLY-PHE,128,15,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(C)C)CC(C)C)CC(=O)O,Kd=64.7uM,4.189096,4.19,1,A,A,1,A,A,0,,E,A,,1,1,128,15,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(C)C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,0.9289379119873048,0.5996503829956055,93.3895492553711,89.14075469970703,0.3137410879135132,1.0164817571640017,0.941962957382202,0.7652780413627625,0.8644928336143494,0.558243453502655,ASQDQVDDLLDSLGF,Low,"(4.155, 4.319]",train
2PR9,protein-peptide,P18508 P84092,MGSSHHHHHHSSGLVPRGSHMQIGWRREGIKYRRNELFLDVLESVNLLMSPQGQVLSAHVSGRVVMKSYLSGMPECKFGMNDKIVIEKQGKGTADETSKSGKQSIAIDDCTFHQCVRLSKFDSERSISFIPPDGEFELMRYRTTKDIILPFRVIPLVREVGRTKLEVKVVIKSNFKPSLLAQKIEVRIPTPLNTSGVQVICMKGKAKYKASENAIVWKIKRMAGMKESQISAEIELLPTNDKKKWARPPISMNFEVPFAPSGLKVRYLKVFEPKLNYSDHDVIKWVRYIGRSGIYETRC,DEEYGYECLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-GLN-ILE-GLY-TRP-ARG-ARG-GLU-GLY-ILE-LYS-TYR-ARG-ARG-ASN-GLU-LEU-PHE-LEU-ASP-VAL-LEU-GLU-SER-VAL-ASN-LEU-LEU-MET-SER-PRO-GLN-GLY-GLN-VAL-LEU-SER-ALA-HIS-VAL-SER-GLY-ARG-VAL-VAL-MET-LYS-SER-TYR-LEU-SER-GLY-MET-PRO-GLU-CYS-LYS-PHE-GLY-MET-ASN-ASP-LYS-ILE-VAL-ILE-GLU-LYS-GLN-GLY-LYS-GLY-THR-ALA-ASP-GLU-THR-SER-LYS-SER-GLY-LYS-GLN-SER-ILE-ALA-ILE-ASP-ASP-CYS-THR-PHE-HIS-GLN-CYS-VAL-ARG-LEU-SER-LYS-PHE-ASP-SER-GLU-ARG-SER-ILE-SER-PHE-ILE-PRO-PRO-ASP-GLY-GLU-PHE-GLU-LEU-MET-ARG-TYR-ARG-THR-THR-LYS-ASP-ILE-ILE-LEU-PRO-PHE-ARG-VAL-ILE-PRO-LEU-VAL-ARG-GLU-VAL-GLY-ARG-THR-LYS-LEU-GLU-VAL-LYS-VAL-VAL-ILE-LYS-SER-ASN-PHE-LYS-PRO-SER-LEU-LEU-ALA-GLN-LYS-ILE-GLU-VAL-ARG-ILE-PRO-THR-PRO-LEU-ASN-THR-SER-GLY-VAL-GLN-VAL-ILE-CYS-MET-LYS-GLY-LYS-ALA-LYS-TYR-LYS-ALA-SER-GLU-ASN-ALA-ILE-VAL-TRP-LYS-ILE-LYS-ARG-MET-ALA-GLY-MET-LYS-GLU-SER-GLN-ILE-SER-ALA-GLU-ILE-GLU-LEU-LEU-PRO-THR-ASN-ASP-LYS-LYS-LYS-TRP-ALA-ARG-PRO-PRO-ILE-SER-MET-ASN-PHE-GLU-VAL-PRO-PHE-ALA-PRO-SER-GLY-LEU-LYS-VAL-ARG-TYR-LEU-LYS-VAL-PHE-GLU-PRO-LYS-LEU-ASN-TYR-SER-ASP-HIS-ASP-VAL-ILE-LYS-TRP-VAL-ARG-TYR-ILE-GLY-ARG-SER-GLY-ILE-TYR-GLU-THR-ARG-CYS,ASP-GLU-GLU-TYR-GLY-TYR-GLU-CYS-LEU-ASP,299,10,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)CCC(=O)O)Cc1ccc(cc1)O)CCC(=O)O,Kd=42.2nM,7.374688,7.37,1,A,A,1,A,A,0,,P,A,,1,1,299,10,0,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9104431867599488,0.7605133056640625,82.70048522949219,76.55026245117188,0.5488938689231873,0.912445604801178,0.8067177534103394,0.786450207233429,0.8534457087516785,0.6955006718635559,DEEYGYECLD,Moderate,"(7.268, 7.523]",train
2PUY,protein-peptide,Q96BD5 Q6NXT2,HMIHEDFCSVCRKSGQLLMCDTCSRVYHLDCLDPPLKTIPKGMWICPRCQDQMLKKEEAI,ARTKQTARKS,HIS-MET-ILE-HIS-GLU-ASP-PHE-CYS-SER-VAL-CYS-ARG-LYS-SER-GLY-GLN-LEU-LEU-MET-CYS-ASP-THR-CYS-SER-ARG-VAL-TYR-HIS-LEU-ASP-CYS-LEU-ASP-PRO-PRO-LEU-LYS-THR-ILE-PRO-LYS-GLY-MET-TRP-ILE-CYS-PRO-ARG-CYS-GLN-ASP-GLN-MET-LEU-LYS-LYS-GLU-GLU-ALA-ILE,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER,60,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=30uM,4.522879,4.52,1,A,A,1,A,A,0,,E,A,,0,1,60,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8673027157783508,0.858933687210083,93.5269775390625,92.56694793701172,0.3743831813335418,0.4990301430225372,0.8296369314193726,0.8852025270462036,0.787433385848999,0.8523664474487305,ARTKQTARKS,Low,"(4.456, 4.606]",train
2PV1,protein-peptide,P0ABZ6 Q2RHX9,TELNLSHILIPLPENPTSDQVNEAESQARAIVDQARNGADFGKLAIAHSADQQALNGGQMGWGRIQELPGIFAQALSTAKKGDIVGPIRSGVGFHILKVNDLR,WEYIPNV,THR-GLU-LEU-ASN-LEU-SER-HIS-ILE-LEU-ILE-PRO-LEU-PRO-GLU-ASN-PRO-THR-SER-ASP-GLN-VAL-ASN-GLU-ALA-GLU-SER-GLN-ALA-ARG-ALA-ILE-VAL-ASP-GLN-ALA-ARG-ASN-GLY-ALA-ASP-PHE-GLY-LYS-LEU-ALA-ILE-ALA-HIS-SER-ALA-ASP-GLN-GLN-ALA-LEU-ASN-GLY-GLY-GLN-MET-GLY-TRP-GLY-ARG-ILE-GLN-GLU-LEU-PRO-GLY-ILE-PHE-ALA-GLN-ALA-LEU-SER-THR-ALA-LYS-LYS-GLY-ASP-ILE-VAL-GLY-PRO-ILE-ARG-SER-GLY-VAL-GLY-PHE-HIS-ILE-LEU-LYS-VAL-ASN-ASP-LEU-ARG,TRP-GLU-TYR-ILE-PRO-ASN-VAL,103,7,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)[NH3+])CCC(=O)O)Cc1ccc(cc1)O)C,Kd=73nM,7.136677,7.14,1,A,A,1,A,A,0,,B,A,,1,1,103,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.962909698486328,0.8584115505218506,98.3404541015625,93.31493377685548,0.2868716716766357,0.5282593965530396,0.948414385318756,0.9094752073287964,0.9267607927322388,0.845645546913147,WEYIPNV,Moderate,"(7.049, 7.268]",train
2PV2,protein-peptide,P0ABZ6,TELNLSHILIPLPENPTSDQVNEAESQARAIVDQARNGADFGKLAIAHSADQQALNGGQMGWGRIQELPGIFAQALSTAKKGDIVGPIRSGVGFHILKVNDLR,NFTLKFWDIFRK,THR-GLU-LEU-ASN-LEU-SER-HIS-ILE-LEU-ILE-PRO-LEU-PRO-GLU-ASN-PRO-THR-SER-ASP-GLN-VAL-ASN-GLU-ALA-GLU-SER-GLN-ALA-ARG-ALA-ILE-VAL-ASP-GLN-ALA-ARG-ASN-GLY-ALA-ASP-PHE-GLY-LYS-LEU-ALA-ILE-ALA-HIS-SER-ALA-ASP-GLN-GLN-ALA-LEU-ASN-GLY-GLY-GLN-MET-GLY-TRP-GLY-ARG-ILE-GLN-GLU-LEU-PRO-GLY-ILE-PHE-ALA-GLN-ALA-LEU-SER-THR-ALA-LYS-LYS-GLY-ASP-ILE-VAL-GLY-PRO-ILE-ARG-SER-GLY-VAL-GLY-PHE-HIS-ILE-LEU-LYS-VAL-ASN-ASP-LEU-ARG,ASN-PHE-THR-LEU-LYS-PHE-TRP-ASP-ILE-PHE-ARG-LYS,103,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)Cc1ccccc1)[C@H](CC)C)CC(=O)O)Cc1c[nH]c2c1cccc2)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1ccccc1)CC(C)C,Kd=1.23uM,5.910095,5.91,1,A,A,1,A,A,0,,E,A,dimer,1,1,103,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O,0.9429449439048768,0.7543457746505737,97.6417999267578,90.28015899658205,0.3221195042133331,0.7641167044639587,0.9317989349365234,0.8354265093803406,0.8805139660835266,0.7340756058692932,NFTLKFWDIFRK,Low,"(5.821, 5.959]",train
2PV3,protein-peptide,P0ABZ6,APQVVDKVAAVVNNGVVLESDVDGLMQSVKLNAAQARQQLPDDATLRHQIMERLIMDQIILQMGQKMGVKISDEQLDQAIANIAKQNNMTLDQMRSRLAYDGLNYNTYRNQIRKEMIISEVRNNEVRRRITILPQEVESLAQQVGNQNDASTELNLSHILIPLPENPTSDQVNEAESQARAIVDQARNGADFGKLAIAHSADQQALNGGQMGWGRIQELPGIFAQALSTAKKGDIVGPIRSGVGFHILKVNDLRGESKNISAAQKDRAYRMLMNRKFSEEAASWMQEQRASAYVKILSN,NFTLKFWDIFRK,ALA-PRO-GLN-VAL-VAL-ASP-LYS-VAL-ALA-ALA-VAL-VAL-ASN-ASN-GLY-VAL-VAL-LEU-GLU-SER-ASP-VAL-ASP-GLY-LEU-MET-GLN-SER-VAL-LYS-LEU-ASN-ALA-ALA-GLN-ALA-ARG-GLN-GLN-LEU-PRO-ASP-ASP-ALA-THR-LEU-ARG-HIS-GLN-ILE-MET-GLU-ARG-LEU-ILE-MET-ASP-GLN-ILE-ILE-LEU-GLN-MET-GLY-GLN-LYS-MET-GLY-VAL-LYS-ILE-SER-ASP-GLU-GLN-LEU-ASP-GLN-ALA-ILE-ALA-ASN-ILE-ALA-LYS-GLN-ASN-ASN-MET-THR-LEU-ASP-GLN-MET-ARG-SER-ARG-LEU-ALA-TYR-ASP-GLY-LEU-ASN-TYR-ASN-THR-TYR-ARG-ASN-GLN-ILE-ARG-LYS-GLU-MET-ILE-ILE-SER-GLU-VAL-ARG-ASN-ASN-GLU-VAL-ARG-ARG-ARG-ILE-THR-ILE-LEU-PRO-GLN-GLU-VAL-GLU-SER-LEU-ALA-GLN-GLN-VAL-GLY-ASN-GLN-ASN-ASP-ALA-SER-THR-GLU-LEU-ASN-LEU-SER-HIS-ILE-LEU-ILE-PRO-LEU-PRO-GLU-ASN-PRO-THR-SER-ASP-GLN-VAL-ASN-GLU-ALA-GLU-SER-GLN-ALA-ARG-ALA-ILE-VAL-ASP-GLN-ALA-ARG-ASN-GLY-ALA-ASP-PHE-GLY-LYS-LEU-ALA-ILE-ALA-HIS-SER-ALA-ASP-GLN-GLN-ALA-LEU-ASN-GLY-GLY-GLN-MET-GLY-TRP-GLY-ARG-ILE-GLN-GLU-LEU-PRO-GLY-ILE-PHE-ALA-GLN-ALA-LEU-SER-THR-ALA-LYS-LYS-GLY-ASP-ILE-VAL-GLY-PRO-ILE-ARG-SER-GLY-VAL-GLY-PHE-HIS-ILE-LEU-LYS-VAL-ASN-ASP-LEU-ARG-GLY-GLU-SER-LYS-ASN-ILE-SER-ALA-ALA-GLN-LYS-ASP-ARG-ALA-TYR-ARG-MET-LEU-MET-ASN-ARG-LYS-PHE-SER-GLU-GLU-ALA-ALA-SER-TRP-MET-GLN-GLU-GLN-ARG-ALA-SER-ALA-TYR-VAL-LYS-ILE-LEU-SER-ASN,ASN-PHE-THR-LEU-LYS-PHE-TRP-ASP-ILE-PHE-ARG-LYS,299,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)[C@H](CC)C)CC(=O)O)Cc1c[nH]c2c1cccc2)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1ccccc1)CC(C)C,Kd=5.57uM,5.254145,5.25,1,A,A,1,A,A,0,,C,A,dimer,1,1,299,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O,0.7872248291969299,0.8006812334060669,56.49685287475586,55.39698791503906,0.5933276414871216,0.8808494210243225,0.574806809425354,0.7261226773262024,0.8162135481834412,0.8193208575248718,NFTLKFWDIFRK,Low,"(5.222, 5.31]",train
2Q8Y,protein-peptide,P0A2M9 Q13164,MPINRPNLNLNIPPLNIVAAYDGAEIPSTNKHLKNNFNSLHNQMRKMPVSHFKEALDVPDYSGMRQSGFFAMSQGFQLNNHGYDVFIHARRESPQSQGKFAGDKFHISVLRDMVPQAFQALSGLLFSEDSPVDKWAVTDMEKVVQQARVSLGAQFTLYIKPDQENSQYSASFLHKTRQFIECLESRLSENGVISGQCPESDVHPENWKYLSYRNELRSGRDGGEMQRQALREEPFYRLMTE,QYFMTEYVA,MET-PRO-ILE-ASN-ARG-PRO-ASN-LEU-ASN-LEU-ASN-ILE-PRO-PRO-LEU-ASN-ILE-VAL-ALA-ALA-TYR-ASP-GLY-ALA-GLU-ILE-PRO-SER-THR-ASN-LYS-HIS-LEU-LYS-ASN-ASN-PHE-ASN-SER-LEU-HIS-ASN-GLN-MET-ARG-LYS-MET-PRO-VAL-SER-HIS-PHE-LYS-GLU-ALA-LEU-ASP-VAL-PRO-ASP-TYR-SER-GLY-MET-ARG-GLN-SER-GLY-PHE-PHE-ALA-MET-SER-GLN-GLY-PHE-GLN-LEU-ASN-ASN-HIS-GLY-TYR-ASP-VAL-PHE-ILE-HIS-ALA-ARG-ARG-GLU-SER-PRO-GLN-SER-GLN-GLY-LYS-PHE-ALA-GLY-ASP-LYS-PHE-HIS-ILE-SER-VAL-LEU-ARG-ASP-MET-VAL-PRO-GLN-ALA-PHE-GLN-ALA-LEU-SER-GLY-LEU-LEU-PHE-SER-GLU-ASP-SER-PRO-VAL-ASP-LYS-TRP-ALA-VAL-THR-ASP-MET-GLU-LYS-VAL-VAL-GLN-GLN-ALA-ARG-VAL-SER-LEU-GLY-ALA-GLN-PHE-THR-LEU-TYR-ILE-LYS-PRO-ASP-GLN-GLU-ASN-SER-GLN-TYR-SER-ALA-SER-PHE-LEU-HIS-LYS-THR-ARG-GLN-PHE-ILE-GLU-CYS-LEU-GLU-SER-ARG-LEU-SER-GLU-ASN-GLY-VAL-ILE-SER-GLY-GLN-CYS-PRO-GLU-SER-ASP-VAL-HIS-PRO-GLU-ASN-TRP-LYS-TYR-LEU-SER-TYR-ARG-ASN-GLU-LEU-ARG-SER-GLY-ARG-ASP-GLY-GLY-GLU-MET-GLN-ARG-GLN-ALA-LEU-ARG-GLU-GLU-PRO-PHE-TYR-ARG-LEU-MET-THR-GLU,GLN-TYR-PHE-MET-TPO-GLU-PTR-VAL-ALA,241,9,CSCC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C=O)C)Cc1ccc(cc1)OP(O)(O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])Cc1ccc(cc1)O)Cc1ccccc1,Kd=102uM,3.9914,3.99,1,A,A,1,A,A,0,,B,A,,1,1,241,9,0,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C)[C@@H](C)O,CSCC[C@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CSCC[C@H](NC(=O)C(NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8307957053184509,0.8902602791786194,80.68614196777344,82.34893035888672,0.4684046506881714,0.764454185962677,0.8603447079658508,0.8767614960670471,0.7359084486961365,0.8339875936508179,QYFMTEYVA,Low,"(3.924, 4.155]",val
2QBW,protein-peptide,Q96RT1,SPELGFSISGGVGGRGNPFRPDDDGIFVTRVQPEGPASKLLQPGDKIIQANGYSFINIEHGQAVSLLKTFQNTVELIIVREVGNGAKQEIRVRVEKDGGSGGVSSVPTNLEVVAATPTSLLISWDASYYGVSYYRITYGETGGNSPVQEFTVPYSSSTATISGLKPGVDYTITVYAYSDYYGSHHYSPISINYRT,PQPVDSWV,SER-PRO-GLU-LEU-GLY-PHE-SER-ILE-SER-GLY-GLY-VAL-GLY-GLY-ARG-GLY-ASN-PRO-PHE-ARG-PRO-ASP-ASP-ASP-GLY-ILE-PHE-VAL-THR-ARG-VAL-GLN-PRO-GLU-GLY-PRO-ALA-SER-LYS-LEU-LEU-GLN-PRO-GLY-ASP-LYS-ILE-ILE-GLN-ALA-ASN-GLY-TYR-SER-PHE-ILE-ASN-ILE-GLU-HIS-GLY-GLN-ALA-VAL-SER-LEU-LEU-LYS-THR-PHE-GLN-ASN-THR-VAL-GLU-LEU-ILE-ILE-VAL-ARG-GLU-VAL-GLY-ASN-GLY-ALA-LYS-GLN-GLU-ILE-ARG-VAL-ARG-VAL-GLU-LYS-ASP-GLY-GLY-SER-GLY-GLY-VAL-SER-SER-VAL-PRO-THR-ASN-LEU-GLU-VAL-VAL-ALA-ALA-THR-PRO-THR-SER-LEU-LEU-ILE-SER-TRP-ASP-ALA-SER-TYR-TYR-GLY-VAL-SER-TYR-TYR-ARG-ILE-THR-TYR-GLY-GLU-THR-GLY-GLY-ASN-SER-PRO-VAL-GLN-GLU-PHE-THR-VAL-PRO-TYR-SER-SER-SER-THR-ALA-THR-ILE-SER-GLY-LEU-LYS-PRO-GLY-VAL-ASP-TYR-THR-ILE-THR-VAL-TYR-ALA-TYR-SER-ASP-TYR-TYR-GLY-SER-HIS-HIS-TYR-SER-PRO-ILE-SER-ILE-ASN-TYR-ARG-THR,PRO-GLN-PRO-VAL-ASP-SER-TRP-VAL,195,8,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)/C=C/C(=O)N)CC(=O)O,Kd=56nM,7.251812,7.25,1,A,A,1,A,A,0,,B,A,,1,1,195,8,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.8753448724746704,0.8998924493789673,78.83000183105469,75.51573944091797,0.4548347294330597,0.4756346642971039,0.8031825423240662,0.8607969284057617,0.8687548041343689,0.9096663594245912,PQPVDSWV,Moderate,"(7.049, 7.268]",train
2QBX,protein-peptide,P29323,MVSAIVLYVLLAAAAHSAFAAMVHHHHHHSAEETLMDSTTATAELGWMVHPPSGWEEVSGYDENMNTIRTYQVCNVFESSQNNWLRTKFIRRRGAHRIHVEMKFSVRDCSSIPSVPGSCKETFNLYYYEADFDSATKTFPNWMENPWVKVDTIAADESFSQVDLGGRVMKINTEVRSFGPVSRSGFYLAFQDYGGCMSLIAVRVFYRK,SNEWIQPRLPQH,MET-VAL-SER-ALA-ILE-VAL-LEU-TYR-VAL-LEU-LEU-ALA-ALA-ALA-ALA-HIS-SER-ALA-PHE-ALA-ALA-MET-VAL-HIS-HIS-HIS-HIS-HIS-HIS-SER-ALA-GLU-GLU-THR-LEU-MET-ASP-SER-THR-THR-ALA-THR-ALA-GLU-LEU-GLY-TRP-MET-VAL-HIS-PRO-PRO-SER-GLY-TRP-GLU-GLU-VAL-SER-GLY-TYR-ASP-GLU-ASN-MET-ASN-THR-ILE-ARG-THR-TYR-GLN-VAL-CYS-ASN-VAL-PHE-GLU-SER-SER-GLN-ASN-ASN-TRP-LEU-ARG-THR-LYS-PHE-ILE-ARG-ARG-ARG-GLY-ALA-HIS-ARG-ILE-HIS-VAL-GLU-MET-LYS-PHE-SER-VAL-ARG-ASP-CYS-SER-SER-ILE-PRO-SER-VAL-PRO-GLY-SER-CYS-LYS-GLU-THR-PHE-ASN-LEU-TYR-TYR-TYR-GLU-ALA-ASP-PHE-ASP-SER-ALA-THR-LYS-THR-PHE-PRO-ASN-TRP-MET-GLU-ASN-PRO-TRP-VAL-LYS-VAL-ASP-THR-ILE-ALA-ALA-ASP-GLU-SER-PHE-SER-GLN-VAL-ASP-LEU-GLY-GLY-ARG-VAL-MET-LYS-ILE-ASN-THR-GLU-VAL-ARG-SER-PHE-GLY-PRO-VAL-SER-ARG-SER-GLY-PHE-TYR-LEU-ALA-PHE-GLN-ASP-TYR-GLY-GLY-CYS-MET-SER-LEU-ILE-ALA-VAL-ARG-VAL-PHE-TYR-ARG-LYS,SER-ASN-GLU-TRP-ILE-GLN-PRO-ARG-LEU-PRO-GLN-HIS,208,12,O=C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(=O)N)CCC(=O)O)CCC(=O)N)CCC[NH+]=C(N)N)CC(C)C)CCC(=O)N,Kd=6uM,5.221849,5.22,1,A,A,1,A,A,0,,D,A,,0,1,208,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9236515164375304,0.8996888399124146,82.49234008789062,76.19692993164062,0.5223231911659241,0.6960105299949646,0.8267800807952881,0.8306844830513,0.8228693008422852,0.8237908482551575,SNEWIQPRLPQH,Low,"(5.105, 5.222]",train
2QIC,protein-peptide,Q9UK53,GSDLPIDPNEPTYCLCNQVSYGEMIGCDNDECPIEWFHFSCVGLNHKPKGKWYCPKCRGENE,ARTKQTARKSTG,GLY-SER-ASP-LEU-PRO-ILE-ASP-PRO-ASN-GLU-PRO-THR-TYR-CYS-LEU-CYS-ASN-GLN-VAL-SER-TYR-GLY-GLU-MET-ILE-GLY-CYS-ASP-ASN-ASP-GLU-CYS-PRO-ILE-GLU-TRP-PHE-HIS-PHE-SER-CYS-VAL-GLY-LEU-ASN-HIS-LYS-PRO-LYS-GLY-LYS-TRP-TYR-CYS-PRO-LYS-CYS-ARG-GLY-GLU-ASN-GLU,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,62,12,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=3.3uM,5.481486,5.48,1,A,A,1,A,A,0,,B,A,,1,1,62,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.937247633934021,0.8889892101287842,80.73265075683594,79.54800415039062,0.4472244679927826,0.7197598218917847,0.7784487009048462,0.7852240204811096,0.7404608130455017,0.7334789037704468,ARTKQTARKSTG,Low,"(5.463, 5.6]",train
2QQS,protein-peptide,O75164 P62805,GHMQSITAGQKVISKHKNGRFYQCEVVRLTTETFYEVNFDDGSFSDNLYPEDIVSQDCLQFGPPAEGEVVQVRWTDGQVYGAKFVASHPIQMYQVEFEDGSQLVVKRDDVYTLDEELP,KRHRKVLRDN,GLY-HIS-MET-GLN-SER-ILE-THR-ALA-GLY-GLN-LYS-VAL-ILE-SER-LYS-HIS-LYS-ASN-GLY-ARG-PHE-TYR-GLN-CYS-GLU-VAL-VAL-ARG-LEU-THR-THR-GLU-THR-PHE-TYR-GLU-VAL-ASN-PHE-ASP-ASP-GLY-SER-PHE-SER-ASP-ASN-LEU-TYR-PRO-GLU-ASP-ILE-VAL-SER-GLN-ASP-CYS-LEU-GLN-PHE-GLY-PRO-PRO-ALA-GLU-GLY-GLU-VAL-VAL-GLN-VAL-ARG-TRP-THR-ASP-GLY-GLN-VAL-TYR-GLY-ALA-LYS-PHE-VAL-ALA-SER-HIS-PRO-ILE-GLN-MET-TYR-GLN-VAL-GLU-PHE-GLU-ASP-GLY-SER-GLN-LEU-VAL-VAL-LYS-ARG-ASP-ASP-VAL-TYR-THR-LEU-ASP-GLU-GLU-LEU-PRO,LYS-ARG-HIS-ARG-M3L-VAL-LEU-ARG-ASP-ASN,118,10,NC(=[NH+]CCC[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)CCCC[N+](C)(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1c[nH]cn1)N,Kd=0.40uM,6.39794,6.4,1,A,A,1,A,A,0,,C,A,dimer,1,1,118,10,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,0.8504656553268433,0.7849527597427368,80.35468292236328,80.75167846679688,0.3617582619190216,0.7616215944290161,0.8399412631988525,0.8228291273117065,0.8042686581611633,0.7754836678504944,KRHRKVLRDN,Low,"(6.26, 6.398]",train
2QT5,protein-peptide,P97879,GPGSFKGSTVVELMKKEGTTLGLTVSGGIDKDGKPRVSNLRQGGIAARSDQLDVGDYIKAVNGINLAKFRHDEIISLLKNVGERVVLEVEYELPPVSIQGSSVMFRTVEVTLHKEGNTFGFVIRGGAHDDRNKSRPVVITCVRPGGPADREGTIKPGDRLLSVDGIRLLGTTHAEAMSILKQCGQEATLLIEYDVSVMDS,NNLQDGTEV,GLY-PRO-GLY-SER-PHE-LYS-GLY-SER-THR-VAL-VAL-GLU-LEU-MET-LYS-LYS-GLU-GLY-THR-THR-LEU-GLY-LEU-THR-VAL-SER-GLY-GLY-ILE-ASP-LYS-ASP-GLY-LYS-PRO-ARG-VAL-SER-ASN-LEU-ARG-GLN-GLY-GLY-ILE-ALA-ALA-ARG-SER-ASP-GLN-LEU-ASP-VAL-GLY-ASP-TYR-ILE-LYS-ALA-VAL-ASN-GLY-ILE-ASN-LEU-ALA-LYS-PHE-ARG-HIS-ASP-GLU-ILE-ILE-SER-LEU-LEU-LYS-ASN-VAL-GLY-GLU-ARG-VAL-VAL-LEU-GLU-VAL-GLU-TYR-GLU-LEU-PRO-PRO-VAL-SER-ILE-GLN-GLY-SER-SER-VAL-MET-PHE-ARG-THR-VAL-GLU-VAL-THR-LEU-HIS-LYS-GLU-GLY-ASN-THR-PHE-GLY-PHE-VAL-ILE-ARG-GLY-GLY-ALA-HIS-ASP-ASP-ARG-ASN-LYS-SER-ARG-PRO-VAL-VAL-ILE-THR-CYS-VAL-ARG-PRO-GLY-GLY-PRO-ALA-ASP-ARG-GLU-GLY-THR-ILE-LYS-PRO-GLY-ASP-ARG-LEU-LEU-SER-VAL-ASP-GLY-ILE-ARG-LEU-LEU-GLY-THR-THR-HIS-ALA-GLU-ALA-MET-SER-ILE-LEU-LYS-GLN-CYS-GLY-GLN-GLU-ALA-THR-LEU-LEU-ILE-GLU-TYR-ASP-VAL-SER-VAL-MET-ASP-SER,ASN-ASN-LEU-GLN-ASP-GLY-THR-GLU-VAL,200,9,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)O)[C@H](O)C,Kd=9.4uM,5.026872,5.03,1,A,A,1,A,A,0,,X,A,,1,1,200,9,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8628442883491516,0.7940701842308044,89.637451171875,90.04803466796875,0.3863052129745483,0.6608494520187378,0.9025222659111024,0.8717700242996216,0.8260109424591064,0.774645209312439,NNLQDGTEV,Low,"(5.014, 5.105]",val
2R02,protein-peptide,Q9WC62 Q8WUM4,ATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQYYFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMVPVSVQQSLAAYNQRKADLVNRSIAQMREATTLANGVLASLNLPAAIEDVSGDTVPQSILTKSRSVIEQGGIQTVDQLIKELPELLQRNREILDESLRLLDEEEATDNDLRAKFKERWQRTPSNELYKPLRAEGTNFRTVLDKAVQADGQVKECYQSHRDTIVLLCKPEPELNAAIPSANPAKTMQGSEVVNVLKSLLSNLDEVKKEREGLENDLKSVNFDMTSKFLTALAQDGVINEEALSVTELDRVYGGLTTKVQESLKKQEGLLKNIQVSHQEFSKMKQSNNEANLREEVLKNLATAYDNFVELVANLKEGTKFYNELTEILVRFQNKCSDIVFAR,ELYPLTSLRSL,ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-TYR-TYR-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL-PRO-VAL-SER-VAL-GLN-GLN-SER-LEU-ALA-ALA-TYR-ASN-GLN-ARG-LYS-ALA-ASP-LEU-VAL-ASN-ARG-SER-ILE-ALA-GLN-MET-ARG-GLU-ALA-THR-THR-LEU-ALA-ASN-GLY-VAL-LEU-ALA-SER-LEU-ASN-LEU-PRO-ALA-ALA-ILE-GLU-ASP-VAL-SER-GLY-ASP-THR-VAL-PRO-GLN-SER-ILE-LEU-THR-LYS-SER-ARG-SER-VAL-ILE-GLU-GLN-GLY-GLY-ILE-GLN-THR-VAL-ASP-GLN-LEU-ILE-LYS-GLU-LEU-PRO-GLU-LEU-LEU-GLN-ARG-ASN-ARG-GLU-ILE-LEU-ASP-GLU-SER-LEU-ARG-LEU-LEU-ASP-GLU-GLU-GLU-ALA-THR-ASP-ASN-ASP-LEU-ARG-ALA-LYS-PHE-LYS-GLU-ARG-TRP-GLN-ARG-THR-PRO-SER-ASN-GLU-LEU-TYR-LYS-PRO-LEU-ARG-ALA-GLU-GLY-THR-ASN-PHE-ARG-THR-VAL-LEU-ASP-LYS-ALA-VAL-GLN-ALA-ASP-GLY-GLN-VAL-LYS-GLU-CYS-TYR-GLN-SER-HIS-ARG-ASP-THR-ILE-VAL-LEU-LEU-CYS-LYS-PRO-GLU-PRO-GLU-LEU-ASN-ALA-ALA-ILE-PRO-SER-ALA-ASN-PRO-ALA-LYS-THR-MET-GLN-GLY-SER-GLU-VAL-VAL-ASN-VAL-LEU-LYS-SER-LEU-LEU-SER-ASN-LEU-ASP-GLU-VAL-LYS-LYS-GLU-ARG-GLU-GLY-LEU-GLU-ASN-ASP-LEU-LYS-SER-VAL-ASN-PHE-ASP-MET-THR-SER-LYS-PHE-LEU-THR-ALA-LEU-ALA-GLN-ASP-GLY-VAL-ILE-ASN-GLU-GLU-ALA-LEU-SER-VAL-THR-GLU-LEU-ASP-ARG-VAL-TYR-GLY-GLY-LEU-THR-THR-LYS-VAL-GLN-GLU-SER-LEU-LYS-LYS-GLN-GLU-GLY-LEU-LEU-LYS-ASN-ILE-GLN-VAL-SER-HIS-GLN-GLU-PHE-SER-LYS-MET-LYS-GLN-SER-ASN-ASN-GLU-ALA-ASN-LEU-ARG-GLU-GLU-VAL-LEU-LYS-ASN-LEU-ALA-THR-ALA-TYR-ASP-ASN-PHE-VAL-GLU-LEU-VAL-ALA-ASN-LEU-LYS-GLU-GLY-THR-LYS-PHE-TYR-ASN-GLU-LEU-THR-GLU-ILE-LEU-VAL-ARG-PHE-GLN-ASN-LYS-CYS-SER-ASP-ILE-VAL-PHE-ALA-ARG,GLU-LEU-TYR-PRO-LEU-THR-SER-LEU-ARG-SER-LEU,697,11,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)CCC[NH+]=C(N)N)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(C)C)Cc1ccc(cc1)O)CC(C)C,Kd=8uM,5.09691,5.1,1,A,A,1,A,A,0,,B,A,,1,1,697,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8021318316459656,0.6184415221214294,59.73971939086914,58.30461883544922,0.5734613537788391,1.1695098876953125,0.6233182549476624,0.6563311219215393,0.837124764919281,0.6089691519737244,ELYPLTSLRSL,Low,"(5.014, 5.105]",train
2R03,protein-peptide,P69732 Q8WUM4,ATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQYYFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMVPVSVQQSLAAYNQRKADLVNRSIAQMREATTLANGVLASLNLPAAIEDVSGDTVPQSILTKSRSVIEQGGIQTVDQLIKELPELLQRNREILDESLRLLDEEEATDNDLRAKFKERWQRTPSNELYKPLRAEGTNFRTVLDKAVQADGQVKECYQSHRDTIVLLCKPEPELNAAIPSANPAKTMQGSEVVNVLKSLLSNLDEVKKEREGLENDLKSVNFDMTSKFLTALAQDGVINEEALSVTELDRVYGGLTTKVQESLKKQEGLLKNIQVSHQEFSKMKQSNNEANLREEVLKNLATAYDNFVELVANLKEGTKFYNELTEILVRFQNKCSDIVFAR,NLYPDLSE,ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-TYR-TYR-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL-PRO-VAL-SER-VAL-GLN-GLN-SER-LEU-ALA-ALA-TYR-ASN-GLN-ARG-LYS-ALA-ASP-LEU-VAL-ASN-ARG-SER-ILE-ALA-GLN-MET-ARG-GLU-ALA-THR-THR-LEU-ALA-ASN-GLY-VAL-LEU-ALA-SER-LEU-ASN-LEU-PRO-ALA-ALA-ILE-GLU-ASP-VAL-SER-GLY-ASP-THR-VAL-PRO-GLN-SER-ILE-LEU-THR-LYS-SER-ARG-SER-VAL-ILE-GLU-GLN-GLY-GLY-ILE-GLN-THR-VAL-ASP-GLN-LEU-ILE-LYS-GLU-LEU-PRO-GLU-LEU-LEU-GLN-ARG-ASN-ARG-GLU-ILE-LEU-ASP-GLU-SER-LEU-ARG-LEU-LEU-ASP-GLU-GLU-GLU-ALA-THR-ASP-ASN-ASP-LEU-ARG-ALA-LYS-PHE-LYS-GLU-ARG-TRP-GLN-ARG-THR-PRO-SER-ASN-GLU-LEU-TYR-LYS-PRO-LEU-ARG-ALA-GLU-GLY-THR-ASN-PHE-ARG-THR-VAL-LEU-ASP-LYS-ALA-VAL-GLN-ALA-ASP-GLY-GLN-VAL-LYS-GLU-CYS-TYR-GLN-SER-HIS-ARG-ASP-THR-ILE-VAL-LEU-LEU-CYS-LYS-PRO-GLU-PRO-GLU-LEU-ASN-ALA-ALA-ILE-PRO-SER-ALA-ASN-PRO-ALA-LYS-THR-MET-GLN-GLY-SER-GLU-VAL-VAL-ASN-VAL-LEU-LYS-SER-LEU-LEU-SER-ASN-LEU-ASP-GLU-VAL-LYS-LYS-GLU-ARG-GLU-GLY-LEU-GLU-ASN-ASP-LEU-LYS-SER-VAL-ASN-PHE-ASP-MET-THR-SER-LYS-PHE-LEU-THR-ALA-LEU-ALA-GLN-ASP-GLY-VAL-ILE-ASN-GLU-GLU-ALA-LEU-SER-VAL-THR-GLU-LEU-ASP-ARG-VAL-TYR-GLY-GLY-LEU-THR-THR-LYS-VAL-GLN-GLU-SER-LEU-LYS-LYS-GLN-GLU-GLY-LEU-LEU-LYS-ASN-ILE-GLN-VAL-SER-HIS-GLN-GLU-PHE-SER-LYS-MET-LYS-GLN-SER-ASN-ASN-GLU-ALA-ASN-LEU-ARG-GLU-GLU-VAL-LEU-LYS-ASN-LEU-ALA-THR-ALA-TYR-ASP-ASN-PHE-VAL-GLU-LEU-VAL-ALA-ASN-LEU-LYS-GLU-GLY-THR-LYS-PHE-TYR-ASN-GLU-LEU-THR-GLU-ILE-LEU-VAL-ARG-PHE-GLN-ASN-LYS-CYS-SER-ASP-ILE-VAL-PHE-ALA-ARG,ASN-LEU-TYR-PRO-ASP-LEU-SER-GLU,697,8,OC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(C)C)Cc1ccc(cc1)O)CC(=O)O)CC(C)C,Kd=7uM,5.154902,5.15,1,A,A,1,A,A,0,,B,A,,1,1,697,8,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8231830596923828,0.679656982421875,60.27368927001953,55.396446228027344,0.5454474687576294,1.084421992301941,0.6645307540893555,0.638908863067627,0.8557539582252502,0.6898439526557922,NLYPDLSE,Low,"(5.105, 5.222]",train
2R05,protein-peptide,Q8WUM4 P35962,ATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQYYFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMVPVSVQQSLAAYNQRKADLVNRSIAQMREATTLANGVLASLNLPAAIEDVSGDTVPQSILTKSRSVIEQGGIQTVDQLIKELPELLQRNREILDESLRLLDEEEATDNDLRAKFKERWQRTPSNELYKPLRAEGTNFRTVLDKAVQADGQVKECYQSHRDTIVLLCKPEPELNAAIPSANPAKTMQGSEVVNVLKSLLSNLDEVKKEREGLENDLKSVNFDMTSKFLTALAQDGVINEEALSVTELDRVYGGLTTKVQESLKKQEGLLKNIQVSHQEFSKMKQSNNEANLREEVLKNLATAYDNFVELVANLKEGTKFYNELTEILVRFQNKCSDIVFAR,ELYPLASLRSL,ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-TYR-TYR-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL-PRO-VAL-SER-VAL-GLN-GLN-SER-LEU-ALA-ALA-TYR-ASN-GLN-ARG-LYS-ALA-ASP-LEU-VAL-ASN-ARG-SER-ILE-ALA-GLN-MET-ARG-GLU-ALA-THR-THR-LEU-ALA-ASN-GLY-VAL-LEU-ALA-SER-LEU-ASN-LEU-PRO-ALA-ALA-ILE-GLU-ASP-VAL-SER-GLY-ASP-THR-VAL-PRO-GLN-SER-ILE-LEU-THR-LYS-SER-ARG-SER-VAL-ILE-GLU-GLN-GLY-GLY-ILE-GLN-THR-VAL-ASP-GLN-LEU-ILE-LYS-GLU-LEU-PRO-GLU-LEU-LEU-GLN-ARG-ASN-ARG-GLU-ILE-LEU-ASP-GLU-SER-LEU-ARG-LEU-LEU-ASP-GLU-GLU-GLU-ALA-THR-ASP-ASN-ASP-LEU-ARG-ALA-LYS-PHE-LYS-GLU-ARG-TRP-GLN-ARG-THR-PRO-SER-ASN-GLU-LEU-TYR-LYS-PRO-LEU-ARG-ALA-GLU-GLY-THR-ASN-PHE-ARG-THR-VAL-LEU-ASP-LYS-ALA-VAL-GLN-ALA-ASP-GLY-GLN-VAL-LYS-GLU-CYS-TYR-GLN-SER-HIS-ARG-ASP-THR-ILE-VAL-LEU-LEU-CYS-LYS-PRO-GLU-PRO-GLU-LEU-ASN-ALA-ALA-ILE-PRO-SER-ALA-ASN-PRO-ALA-LYS-THR-MET-GLN-GLY-SER-GLU-VAL-VAL-ASN-VAL-LEU-LYS-SER-LEU-LEU-SER-ASN-LEU-ASP-GLU-VAL-LYS-LYS-GLU-ARG-GLU-GLY-LEU-GLU-ASN-ASP-LEU-LYS-SER-VAL-ASN-PHE-ASP-MET-THR-SER-LYS-PHE-LEU-THR-ALA-LEU-ALA-GLN-ASP-GLY-VAL-ILE-ASN-GLU-GLU-ALA-LEU-SER-VAL-THR-GLU-LEU-ASP-ARG-VAL-TYR-GLY-GLY-LEU-THR-THR-LYS-VAL-GLN-GLU-SER-LEU-LYS-LYS-GLN-GLU-GLY-LEU-LEU-LYS-ASN-ILE-GLN-VAL-SER-HIS-GLN-GLU-PHE-SER-LYS-MET-LYS-GLN-SER-ASN-ASN-GLU-ALA-ASN-LEU-ARG-GLU-GLU-VAL-LEU-LYS-ASN-LEU-ALA-THR-ALA-TYR-ASP-ASN-PHE-VAL-GLU-LEU-VAL-ALA-ASN-LEU-LYS-GLU-GLY-THR-LYS-PHE-TYR-ASN-GLU-LEU-THR-GLU-ILE-LEU-VAL-ARG-PHE-GLN-ASN-LYS-CYS-SER-ASP-ILE-VAL-PHE-ALA-ARG,GLU-LEU-TYR-PRO-LEU-ALA-SER-LEU-ARG-SER-LEU,697,11,OC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(C)C)Cc1ccc(cc1)O)CC(C)C)C)CO)CC(C)C)CCC[NH+]=C(N)N)CO)CC(C)C,Kd=7uM,5.154902,5.15,1,A,A,1,A,A,0,,B,A,,1,1,697,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8139793276786804,0.6767876744270325,60.28474807739258,59.83641815185547,0.5543522238731384,1.053138017654419,0.6571277976036072,0.6885468363761902,0.8434817790985107,0.6738478541374207,ELYPLASLRSL,Low,"(5.105, 5.222]",train
2R3Y,protein-peptide,P0AEE3,MTPASYNLAVRRAAPAVVNVYNRGLNTNSHNQLEIRTLGSGVIMDQRGYIITNKHVINDADQIIVALQDGRVFEALLVGSDSLTDLAVLKINATGGLPTIPINARRVPHIGDVVLAIGNPYNLGQTITQGIISATGRIGLNPTGRQNFLQTDASINHGNSGGALVNSLGELMGINTLSFDKSNDGETPEGIGFAIPFQLATKIMDKLIRDGRVIRGYIGIGGREIAPLHAQGGGIDQLQGIVVNEVSPDGPAANAGIQVNDLIISVDNKPAISALETMDQVAEIRPGSVIPVVVMRDDKQLTLQVTIQEYPATN,DNRLGLVYWF,MET-THR-PRO-ALA-SER-TYR-ASN-LEU-ALA-VAL-ARG-ARG-ALA-ALA-PRO-ALA-VAL-VAL-ASN-VAL-TYR-ASN-ARG-GLY-LEU-ASN-THR-ASN-SER-HIS-ASN-GLN-LEU-GLU-ILE-ARG-THR-LEU-GLY-SER-GLY-VAL-ILE-MET-ASP-GLN-ARG-GLY-TYR-ILE-ILE-THR-ASN-LYS-HIS-VAL-ILE-ASN-ASP-ALA-ASP-GLN-ILE-ILE-VAL-ALA-LEU-GLN-ASP-GLY-ARG-VAL-PHE-GLU-ALA-LEU-LEU-VAL-GLY-SER-ASP-SER-LEU-THR-ASP-LEU-ALA-VAL-LEU-LYS-ILE-ASN-ALA-THR-GLY-GLY-LEU-PRO-THR-ILE-PRO-ILE-ASN-ALA-ARG-ARG-VAL-PRO-HIS-ILE-GLY-ASP-VAL-VAL-LEU-ALA-ILE-GLY-ASN-PRO-TYR-ASN-LEU-GLY-GLN-THR-ILE-THR-GLN-GLY-ILE-ILE-SER-ALA-THR-GLY-ARG-ILE-GLY-LEU-ASN-PRO-THR-GLY-ARG-GLN-ASN-PHE-LEU-GLN-THR-ASP-ALA-SER-ILE-ASN-HIS-GLY-ASN-SER-GLY-GLY-ALA-LEU-VAL-ASN-SER-LEU-GLY-GLU-LEU-MET-GLY-ILE-ASN-THR-LEU-SER-PHE-ASP-LYS-SER-ASN-ASP-GLY-GLU-THR-PRO-GLU-GLY-ILE-GLY-PHE-ALA-ILE-PRO-PHE-GLN-LEU-ALA-THR-LYS-ILE-MET-ASP-LYS-LEU-ILE-ARG-ASP-GLY-ARG-VAL-ILE-ARG-GLY-TYR-ILE-GLY-ILE-GLY-GLY-ARG-GLU-ILE-ALA-PRO-LEU-HIS-ALA-GLN-GLY-GLY-GLY-ILE-ASP-GLN-LEU-GLN-GLY-ILE-VAL-VAL-ASN-GLU-VAL-SER-PRO-ASP-GLY-PRO-ALA-ALA-ASN-ALA-GLY-ILE-GLN-VAL-ASN-ASP-LEU-ILE-ILE-SER-VAL-ASP-ASN-LYS-PRO-ALA-ILE-SER-ALA-LEU-GLU-THR-MET-ASP-GLN-VAL-ALA-GLU-ILE-ARG-PRO-GLY-SER-VAL-ILE-PRO-VAL-VAL-VAL-MET-ARG-ASP-ASP-LYS-GLN-LEU-THR-LEU-GLN-VAL-THR-ILE-GLN-GLU-TYR-PRO-ALA-THR-ASN,ASP-ASN-ARG-LEU-GLY-LEU-VAL-TYR-TRP-PHE,314,10,Oc1ccc(cc1)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C(C)C)[NH3+],Kd=3.2uM,5.49485,5.49,1,A,A,1,A,A,0,,D,A,,1,1,314,10,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.776716411113739,0.7916233539581299,73.7210464477539,74.1290283203125,0.5621671676635742,0.7579824328422546,0.8220384120941162,0.8246647715568542,0.7460957765579224,0.7833629846572876,DNRLGLVYWF,Low,"(5.463, 5.6]",val
2RNW,protein-peptide,Q92831 P61830,GSHMSKEPRDPDQLYSTLKSILQQVKSHQSAWPFMEPVKRTEAPGYYEVIRFPMDLKTMSERLKNRYYVSKKLFMADLQRVFTNCKEYNPPESEYYKCANILEKFFFSKIKEAGLIDK,ARTKQTARKSTGGKA,GLY-SER-HIS-MET-SER-LYS-GLU-PRO-ARG-ASP-PRO-ASP-GLN-LEU-TYR-SER-THR-LEU-LYS-SER-ILE-LEU-GLN-GLN-VAL-LYS-SER-HIS-GLN-SER-ALA-TRP-PRO-PHE-MET-GLU-PRO-VAL-LYS-ARG-THR-GLU-ALA-PRO-GLY-TYR-TYR-GLU-VAL-ILE-ARG-PHE-PRO-MET-ASP-LEU-LYS-THR-MET-SER-GLU-ARG-LEU-LYS-ASN-ARG-TYR-TYR-VAL-SER-LYS-LYS-LEU-PHE-MET-ALA-ASP-LEU-GLN-ARG-VAL-PHE-THR-ASN-CYS-LYS-GLU-TYR-ASN-PRO-PRO-GLU-SER-GLU-TYR-TYR-LYS-CYS-ALA-ASN-ILE-LEU-GLU-LYS-PHE-PHE-PHE-SER-LYS-ILE-LYS-GLU-ALA-GLY-LEU-ILE-ASP-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-ALY-SER-THR-GLY-GLY-LYS-ALA,118,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[NH3+])[C@H](O)C)CO)CCCCNC(=O)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=1051uM,2.978397,2.98,1,A,A,1,A,A,0,,B,A,,1,1,118,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8102757930755615,0.7083997130393982,87.54975128173828,89.04852294921875,0.412241518497467,0.8211321830749512,0.87255859375,0.8063674569129944,0.7242163419723511,0.6839078068733215,ARTKQTARKSTGGKA,Low,"(2.044, 3.548]",train
2RNX,protein-peptide,Q92831 P61830,GSHMSKEPRDPDQLYSTLKSILQQVKSHQSAWPFMEPVKRTEAPGYYEVIRFPMDLKTMSERLKNRYYVSKKLFMADLQRVFTNCKEYNPPESEYYKCANILEKFFFSKIKEAGLIDK,STGGVKKPHRYKC,GLY-SER-HIS-MET-SER-LYS-GLU-PRO-ARG-ASP-PRO-ASP-GLN-LEU-TYR-SER-THR-LEU-LYS-SER-ILE-LEU-GLN-GLN-VAL-LYS-SER-HIS-GLN-SER-ALA-TRP-PRO-PHE-MET-GLU-PRO-VAL-LYS-ARG-THR-GLU-ALA-PRO-GLY-TYR-TYR-GLU-VAL-ILE-ARG-PHE-PRO-MET-ASP-LEU-LYS-THR-MET-SER-GLU-ARG-LEU-LYS-ASN-ARG-TYR-TYR-VAL-SER-LYS-LYS-LEU-PHE-MET-ALA-ASP-LEU-GLN-ARG-VAL-PHE-THR-ASN-CYS-LYS-GLU-TYR-ASN-PRO-PRO-GLU-SER-GLU-TYR-TYR-LYS-CYS-ALA-ASN-ILE-LEU-GLU-LYS-PHE-PHE-PHE-SER-LYS-ILE-LYS-GLU-ALA-GLY-LEU-ILE-ASP-LYS,SER-THR-GLY-GLY-VAL-ALY-LYS-PRO-HIS-ARG-TYR-LYS-CYS,118,13,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)CCCC[NH3+])Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CCCC[NH3+])CCCCNC(=O)C)C(C)C)[C@H](O)C)[NH3+],Kd=402uM,3.395774,3.4,1,A,A,1,A,A,0,,B,A,,1,1,118,13,0,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(C)C,CC(=O)NCCCCC(NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)O)[C@@H](C)O)C(C)C,0.8846036195755005,0.7690236568450928,86.5564193725586,87.32598114013672,0.3569251298904419,0.7301969528198242,0.8999196290969849,0.8323472738265991,0.813980758190155,0.7425994873046875,STGGVKKPHRYKC,Low,"(2.044, 3.548]",train
2RNY,protein-peptide,Q92793 P62805,GSHMRKKIFKPEELRQALMPTLEALYRQDPESLPFRQPVDPQLLGIPDYFDIVKNPMDLSTIKRKLDTGQYQEPWQYVDDVWLMFNNAWLYNRKTSRVYKFCSKLAEVFEQEIDPVMQSLG,GGAKRHRKVLRDNIQ,GLY-SER-HIS-MET-ARG-LYS-LYS-ILE-PHE-LYS-PRO-GLU-GLU-LEU-ARG-GLN-ALA-LEU-MET-PRO-THR-LEU-GLU-ALA-LEU-TYR-ARG-GLN-ASP-PRO-GLU-SER-LEU-PRO-PHE-ARG-GLN-PRO-VAL-ASP-PRO-GLN-LEU-LEU-GLY-ILE-PRO-ASP-TYR-PHE-ASP-ILE-VAL-LYS-ASN-PRO-MET-ASP-LEU-SER-THR-ILE-LYS-ARG-LYS-LEU-ASP-THR-GLY-GLN-TYR-GLN-GLU-PRO-TRP-GLN-TYR-VAL-ASP-ASP-VAL-TRP-LEU-MET-PHE-ASN-ASN-ALA-TRP-LEU-TYR-ASN-ARG-LYS-THR-SER-ARG-VAL-TYR-LYS-PHE-CYS-SER-LYS-LEU-ALA-GLU-VAL-PHE-GLU-GLN-GLU-ILE-ASP-PRO-VAL-MET-GLN-SER-LEU-GLY,GLY-GLY-ALA-LYS-ARG-HIS-ARG-ALY-VAL-LEU-ARG-ASP-ASN-ILE-GLN,121,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)[C@H](CC)C)CC(=O)N)CC(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)CCCCNC(=O)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])C,Kd=218uM,3.661544,3.66,1,A,A,1,A,A,0,,B,A,,1,1,121,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)CN)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCCNC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,0.9191030859947203,0.7475226521492004,81.10861206054688,87.60995483398438,0.343801349401474,0.8561983108520508,0.9069741368293762,0.8114940524101257,0.816436767578125,0.6902074813842773,GGAKRHRKVLRDNIQ,Low,"(3.548, 3.924]",train
2ROL,protein-peptide,Q8TE68 P07766,GSMGTAGKWVLCNYDFQARNSSELSVKQRDVLEVLDDSRKWWKVRDPAGQEGYVPYNILTPYPG,PPVPNPDYEPIR,GLY-SER-MET-GLY-THR-ALA-GLY-LYS-TRP-VAL-LEU-CYS-ASN-TYR-ASP-PHE-GLN-ALA-ARG-ASN-SER-SER-GLU-LEU-SER-VAL-LYS-GLN-ARG-ASP-VAL-LEU-GLU-VAL-LEU-ASP-ASP-SER-ARG-LYS-TRP-TRP-LYS-VAL-ARG-ASP-PRO-ALA-GLY-GLN-GLU-GLY-TYR-VAL-PRO-TYR-ASN-ILE-LEU-THR-PRO-TYR-PRO-GLY,PRO-PRO-VAL-PRO-ASN-PRO-ASP-TYR-GLU-PRO-ILE-ARG,64,12,O=C[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]1[NH2+]CCC1)CC(=O)N)CC(=O)O)Cc1ccc(cc1)O)CCC(=O)O)CCC[NH+]=C(N)N,Kd=24uM,4.619789,4.62,1,A,A,1,A,A,0,,B,A,,1,1,64,12,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.9165985584259032,0.892727255821228,95.72903442382812,93.380126953125,0.344617635011673,0.5367308259010315,0.8774123787879944,0.869881272315979,0.7783687710762024,0.8398450016975403,PPVPNPDYEPIR,Low,"(4.606, 4.745]",train
2RQU,protein-peptide,Q9ULH1 P25054,VRRVKTIYDCQADNDDELTFIEGEVIIVTGEEDQEWWIGHIEGQPERKGVFPVSFVHILSD,CIISAMPTKSSRKAKKPAQ,VAL-ARG-ARG-VAL-LYS-THR-ILE-TYR-ASP-CYS-GLN-ALA-ASP-ASN-ASP-ASP-GLU-LEU-THR-PHE-ILE-GLU-GLY-GLU-VAL-ILE-ILE-VAL-THR-GLY-GLU-GLU-ASP-GLN-GLU-TRP-TRP-ILE-GLY-HIS-ILE-GLU-GLY-GLN-PRO-GLU-ARG-LYS-GLY-VAL-PHE-PRO-VAL-SER-PHE-VAL-HIS-ILE-LEU-SER-ASP,CYS-ILE-ILE-SER-ALA-MET-PRO-THR-LYS-SER-SER-ARG-LYS-ALA-LYS-LYS-PRO-ALA-GLN,61,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)C)CCCC[NH3+])CCCC[NH3+])C)CCCC[NH3+])CCC[NH+]=C(N)N)CO)CO)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CS)[NH3+])CO)C)CCSC,Kd=23.6uM,4.627088,4.63,1,A,A,1,A,A,0,,B,A,,1,1,61,19,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)[C@@H](C)CC,0.8653771281242371,0.8159742951393127,94.7734375,91.90771484375,0.402946263551712,0.6056544184684753,0.851997971534729,0.8528310656547546,0.7202844023704529,0.8067601323127747,CIISAMPTKSSRKAKKPAQ,Low,"(4.606, 4.745]",train
2RR4,protein-peptide,Q9H0M4 P68431,GSSGSSGEISGFGQCLVWVQCSFPNCGKWRRLCGNIDPSVLPDNWSCDQNTDVQYNRCDIPEETWTGLE,ARTKQTARKS,GLY-SER-SER-GLY-SER-SER-GLY-GLU-ILE-SER-GLY-PHE-GLY-GLN-CYS-LEU-VAL-TRP-VAL-GLN-CYS-SER-PHE-PRO-ASN-CYS-GLY-LYS-TRP-ARG-ARG-LEU-CYS-GLY-ASN-ILE-ASP-PRO-SER-VAL-LEU-PRO-ASP-ASN-TRP-SER-CYS-ASP-GLN-ASN-THR-ASP-VAL-GLN-TYR-ASN-ARG-CYS-ASP-ILE-PRO-GLU-GLU-THR-TRP-THR-GLY-LEU-GLU,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER,69,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CCC(=O)N)C)CCC[NH+]=C(N)N,Kd=16.7uM,4.777284,4.78,1,A,A,1,A,A,0,,B,A,,1,1,69,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,1.019843578338623,0.9400725960731506,85.30033874511719,79.25260925292969,0.4389166235923767,0.7734756469726562,0.7624911665916443,0.7722242474555969,0.7993714809417725,0.7374693751335144,ARTKQTARKS,Low,"(4.745, 4.866]",val
2RT5,protein-peptide,Q96T58 Q9Y618,VDMVQLLKKYPIVWQGLLALKNDTAAVQLHFVSGNNVLAHRSLPLSEGGPPLRIAQRMRLEATQLEGVARRMTVETDYCLLLALPCGRDQEDVVSQTESLKAAFITYLQAKQAAGIINVPNPGSNQPAYVLQIFPPCEFSESHLSRLAPDLLASISNISPHLMIVIASV,YETLSDSE,VAL-ASP-MET-VAL-GLN-LEU-LEU-LYS-LYS-TYR-PRO-ILE-VAL-TRP-GLN-GLY-LEU-LEU-ALA-LEU-LYS-ASN-ASP-THR-ALA-ALA-VAL-GLN-LEU-HIS-PHE-VAL-SER-GLY-ASN-ASN-VAL-LEU-ALA-HIS-ARG-SER-LEU-PRO-LEU-SER-GLU-GLY-GLY-PRO-PRO-LEU-ARG-ILE-ALA-GLN-ARG-MET-ARG-LEU-GLU-ALA-THR-GLN-LEU-GLU-GLY-VAL-ALA-ARG-ARG-MET-THR-VAL-GLU-THR-ASP-TYR-CYS-LEU-LEU-LEU-ALA-LEU-PRO-CYS-GLY-ARG-ASP-GLN-GLU-ASP-VAL-VAL-SER-GLN-THR-GLU-SER-LEU-LYS-ALA-ALA-PHE-ILE-THR-TYR-LEU-GLN-ALA-LYS-GLN-ALA-ALA-GLY-ILE-ILE-ASN-VAL-PRO-ASN-PRO-GLY-SER-ASN-GLN-PRO-ALA-TYR-VAL-LEU-GLN-ILE-PHE-PRO-PRO-CYS-GLU-PHE-SER-GLU-SER-HIS-LEU-SER-ARG-LEU-ALA-PRO-ASP-LEU-LEU-ALA-SER-ILE-SER-ASN-ILE-SER-PRO-HIS-LEU-MET-ILE-VAL-ILE-ALA-SER-VAL,TYR-GLU-THR-LEU-SEP-ASP-SEP-GLU,169,8,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)COP(O)(O)O)CC(=O)O)COP(O)(O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCC(=O)O)C,Kd=0.19uM,6.721246,6.72,1,A,A,1,A,A,0,,B,A,,1,1,169,8,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)[C@@H](C)O,0.923089563846588,0.8801018595695496,92.6416244506836,92.98287963867188,0.3495635688304901,0.5039283037185669,0.9264951348304749,0.9262114763259888,0.8939895629882812,0.8685744404792786,YETLSDSE,Low,"(6.696, 6.824]",val
2RVN,protein-peptide,P84244 Q61686,GSHMGKKTKRTADSSSSEDEEEYVVEKVLDRRMVKGQVEYLLKWKGFSEEHNTWEPEKNLDCPELISEFMKKYKKMKEGENNK,ARTKQTARKSTGGKAPRY,GLY-SER-HIS-MET-GLY-LYS-LYS-THR-LYS-ARG-THR-ALA-ASP-SEP-SEP-SEP-SEP-GLU-ASP-GLU-GLU-GLU-TYR-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-MET-VAL-LYS-GLY-GLN-VAL-GLU-TYR-LEU-LEU-LYS-TRP-LYS-GLY-PHE-SER-GLU-GLU-HIS-ASN-THR-TRP-GLU-PRO-GLU-LYS-ASN-LEU-ASP-CYS-PRO-GLU-LEU-ILE-SER-GLU-PHE-MET-LYS-LYS-TYR-LYS-LYS-MET-LYS-GLU-GLY-GLU-ASN-ASN-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA-PRO-ARG-TYR,83,18,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)C)CCCC[NH3+])[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH3+])CCC(=O)N)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=0.17uM,6.769551,6.77,1,A,A,1,A,A,0,,B,A,,1,1,83,18,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,1.0700881481170654,0.8981797695159912,81.00910949707031,71.47278594970703,0.3946875631809234,0.9629530310630798,0.7795286774635315,0.7317208647727966,0.8518864512443542,0.6687101721763611,ARTKQTARKSTGGKAPRY,Low,"(6.696, 6.824]",train
2UZ6,protein-peptide,P0DM21 Q8WSF8,QANLMRLKSDLFNRSPMYPGPTKDDPLTVTLGFTLQDIVKVDSSTNEVDLVYYEQQRWKLNSLMWDPNEYGNITDFRTSAADIWTPDITAYSSTRPVQVLSPQIAVVTHDGSVMFIPAQRLSFMCDPTGVDSEEGVTCAVKFGSWVYSGFEIDLKTDTDQVDLSSYYASSKYEILSATQTRQVQHYSCCPEPYIDVNLVVKFRERRAGNGFFRNLFD,GCCSRPPCILNNPDLC,GLN-ALA-ASN-LEU-MET-ARG-LEU-LYS-SER-ASP-LEU-PHE-ASN-ARG-SER-PRO-MET-TYR-PRO-GLY-PRO-THR-LYS-ASP-ASP-PRO-LEU-THR-VAL-THR-LEU-GLY-PHE-THR-LEU-GLN-ASP-ILE-VAL-LYS-VAL-ASP-SER-SER-THR-ASN-GLU-VAL-ASP-LEU-VAL-TYR-TYR-GLU-GLN-GLN-ARG-TRP-LYS-LEU-ASN-SER-LEU-MET-TRP-ASP-PRO-ASN-GLU-TYR-GLY-ASN-ILE-THR-ASP-PHE-ARG-THR-SER-ALA-ALA-ASP-ILE-TRP-THR-PRO-ASP-ILE-THR-ALA-TYR-SER-SER-THR-ARG-PRO-VAL-GLN-VAL-LEU-SER-PRO-GLN-ILE-ALA-VAL-VAL-THR-HIS-ASP-GLY-SER-VAL-MET-PHE-ILE-PRO-ALA-GLN-ARG-LEU-SER-PHE-MET-CYS-ASP-PRO-THR-GLY-VAL-ASP-SER-GLU-GLU-GLY-VAL-THR-CYS-ALA-VAL-LYS-PHE-GLY-SER-TRP-VAL-TYR-SER-GLY-PHE-GLU-ILE-ASP-LEU-LYS-THR-ASP-THR-ASP-GLN-VAL-ASP-LEU-SER-SER-TYR-TYR-ALA-SER-SER-LYS-TYR-GLU-ILE-LEU-SER-ALA-THR-GLN-THR-ARG-GLN-VAL-GLN-HIS-TYR-SER-CYS-CYS-PRO-GLU-PRO-TYR-ILE-ASP-VAL-ASN-LEU-VAL-VAL-LYS-PHE-ARG-GLU-ARG-ARG-ALA-GLY-ASN-GLY-PHE-PHE-ARG-ASN-LEU-PHE-ASP,GLY-CYS-CYS-SER-ARG-PRO-PRO-CYS-ILE-LEU-ASN-ASN-PRO-ASP-LEU-CYS-NH2,217,17,[NH3+]CC(=O)N[C@H]1CSSC[C@@H]2NC(=O)[C@@H]3CCCN3C(=O)[C@H]3N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)[C@H](CC)C)CC(C)C)CC(=O)N)CC(=O)N)C(=O)N)CO)CCC[NH+]=C(N)N)CCC3,Ki=1.7nM,8.769551,8.77,1,A,A,1,A,A,0,,K,A,dimer,1,1,217,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CS)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8405309915542603,0.8300236463546753,83.9451675415039,86.10215759277344,0.451333612203598,0.6404183506965637,0.8645959496498108,0.8638575673103333,0.7674546241760254,0.7985237240791321,GCCSRPPCILNNPDLC,Moderate,"(8.383, 8.824]",train
2V7D,protein-peptide,P05107 P63103,GSMDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,KSATTTVMNP,GLY-SER-MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,LYS-SER-ALA-TPO-THR-THR-VAL-MET-ASN-PRO,247,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C(C)C)[C@H](O)C)[C@H](O)C)C)NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=260nM,6.585027,6.59,1,A,A,1,A,A,0,,P,A,,1,1,247,10,0,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)OP(=O)(O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)OP(=O)(O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,0.943172037601471,0.9005746245384216,85.62229919433594,87.43070983886719,0.3506804704666137,0.5134309530258179,0.9144995212554932,0.9065526723861694,0.8968381881713867,0.8737764358520508,KSATTTVMNP,Low,"(6.523, 6.696]",train
2VR3,protein-peptide,Q2G015 P02679,MRGSHHHHHHGSGTDITNQLTNVTVGIDSGTTVYPHQAGYVKLNYGFSVPNSAVKGDTFKITVPKELNLNGVTSTAKVPPIMAGDQVLANGVIDSDGNVIYTFTDYVNTKCDVKATLTMPAYIDPENVKKTGNVTLATGIGSTTANKTVLVDYEKYGKFYNLSIKGTIDQIDKTNNTYRQTIYVNPSGDNVIAPVLTGNLKPNTDSNALIDQQNTSIKVYKVDNAADLSESYFVNPENFEDVTNSVNITFPNPNQYKVEFNTPDDQITTPYIVVVNGHIDPNSKGDLALRSTLYGYNSNIIWRSMSWDNEVAFNNGSGSGDGIDCPVVP,QHHLGGAKQAGAV,MET-ARG-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-SER-GLY-THR-ASP-ILE-THR-ASN-GLN-LEU-THR-ASN-VAL-THR-VAL-GLY-ILE-ASP-SER-GLY-THR-THR-VAL-TYR-PRO-HIS-GLN-ALA-GLY-TYR-VAL-LYS-LEU-ASN-TYR-GLY-PHE-SER-VAL-PRO-ASN-SER-ALA-VAL-LYS-GLY-ASP-THR-PHE-LYS-ILE-THR-VAL-PRO-LYS-GLU-LEU-ASN-LEU-ASN-GLY-VAL-THR-SER-THR-ALA-LYS-VAL-PRO-PRO-ILE-MET-ALA-GLY-ASP-GLN-VAL-LEU-ALA-ASN-GLY-VAL-ILE-ASP-SER-ASP-GLY-ASN-VAL-ILE-TYR-THR-PHE-THR-ASP-TYR-VAL-ASN-THR-LYS-CYS-ASP-VAL-LYS-ALA-THR-LEU-THR-MET-PRO-ALA-TYR-ILE-ASP-PRO-GLU-ASN-VAL-LYS-LYS-THR-GLY-ASN-VAL-THR-LEU-ALA-THR-GLY-ILE-GLY-SER-THR-THR-ALA-ASN-LYS-THR-VAL-LEU-VAL-ASP-TYR-GLU-LYS-TYR-GLY-LYS-PHE-TYR-ASN-LEU-SER-ILE-LYS-GLY-THR-ILE-ASP-GLN-ILE-ASP-LYS-THR-ASN-ASN-THR-TYR-ARG-GLN-THR-ILE-TYR-VAL-ASN-PRO-SER-GLY-ASP-ASN-VAL-ILE-ALA-PRO-VAL-LEU-THR-GLY-ASN-LEU-LYS-PRO-ASN-THR-ASP-SER-ASN-ALA-LEU-ILE-ASP-GLN-GLN-ASN-THR-SER-ILE-LYS-VAL-TYR-LYS-VAL-ASP-ASN-ALA-ALA-ASP-LEU-SER-GLU-SER-TYR-PHE-VAL-ASN-PRO-GLU-ASN-PHE-GLU-ASP-VAL-THR-ASN-SER-VAL-ASN-ILE-THR-PHE-PRO-ASN-PRO-ASN-GLN-TYR-LYS-VAL-GLU-PHE-ASN-THR-PRO-ASP-ASP-GLN-ILE-THR-THR-PRO-TYR-ILE-VAL-VAL-VAL-ASN-GLY-HIS-ILE-ASP-PRO-ASN-SER-LYS-GLY-ASP-LEU-ALA-LEU-ARG-SER-THR-LEU-TYR-GLY-TYR-ASN-SER-ASN-ILE-ILE-TRP-ARG-SER-MET-SER-TRP-ASP-ASN-GLU-VAL-ALA-PHE-ASN-ASN-GLY-SER-GLY-SER-GLY-ASP-GLY-ILE-ASP-CYS-PRO-VAL-VAL-PRO,GLN-HIS-HIS-LEU-GLY-GLY-ALA-LYS-GLN-ALA-GLY-ALA-VAL,329,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])C)CC(C)C)C,Kd=10.5uM,4.978811,4.98,1,A,A,1,A,A,0,,C,A,,1,1,329,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9428441524505616,0.7539138197898865,86.81890869140625,81.55802917480469,0.3948034942150116,0.9346461296081544,0.8890876173973083,0.8186537623405457,0.9069411754608154,0.7111330628395081,QHHLGGAKQAGAV,Low,"(4.866, 5.014]",val
2VWF,protein-peptide,Q9UQC2 P62993,GPTYVQALFDFDPQEDGELGFRRGDFIHVMDNSDPNWWKGACHGQTGMFPRNYVTAVN,IQPPPVNRNLKPDRK,GLY-PRO-THR-TYR-VAL-GLN-ALA-LEU-PHE-ASP-PHE-ASP-PRO-GLN-GLU-ASP-GLY-GLU-LEU-GLY-PHE-ARG-ARG-GLY-ASP-PHE-ILE-HIS-VAL-MET-ASP-ASN-SER-ASP-PRO-ASN-TRP-TRP-LYS-GLY-ALA-CYS-HIS-GLY-GLN-THR-GLY-MET-PHE-PRO-ARG-ASN-TYR-VAL-THR-ALA-VAL-ASN,ILE-GLN-PRO-PRO-PRO-VAL-ASN-ARG-ASN-LEU-LYS-PRO-ASP-ARG-LYS,58,15,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CCC[NH+]=C(N)N)C=O)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CCC(=O)N)CC(=O)N)CCC[NH+]=C(N)N)CC(=O)N)CC(C)C,Kd=8.7uM,5.060481,5.06,1,A,A,1,A,A,0,,B,A,,1,1,58,15,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.9982052445411682,0.7730648517608643,97.54156494140624,93.66024780273438,0.2945257723331451,0.634871780872345,0.9169580340385436,0.8187278509140015,0.8900923132896423,0.7616490721702576,IQPPPVNRNLKPDRK,Low,"(5.014, 5.105]",train
2W0P,protein-peptide,Q8WUP2 P21333,GGAHKVRAGGPGLERAEAGVPAEFSIWTREAGAGGLAIAVEGPSKAEISFEDRKDGSCGVAYVVQEPGDYEVSVKFNEEHIPDSPFVVPVASPS,PEKRVASSVFITLAP,GLY-GLY-ALA-HIS-LYS-VAL-ARG-ALA-GLY-GLY-PRO-GLY-LEU-GLU-ARG-ALA-GLU-ALA-GLY-VAL-PRO-ALA-GLU-PHE-SER-ILE-TRP-THR-ARG-GLU-ALA-GLY-ALA-GLY-GLY-LEU-ALA-ILE-ALA-VAL-GLU-GLY-PRO-SER-LYS-ALA-GLU-ILE-SER-PHE-GLU-ASP-ARG-LYS-ASP-GLY-SER-CYS-GLY-VAL-ALA-TYR-VAL-VAL-GLN-GLU-PRO-GLY-ASP-TYR-GLU-VAL-SER-VAL-LYS-PHE-ASN-GLU-GLU-HIS-ILE-PRO-ASP-SER-PRO-PHE-VAL-VAL-PRO-VAL-ALA-SER-PRO-SER,PRO-GLU-LYS-ARG-VAL-ALA-SER-SER-VAL-PHE-ILE-THR-LEU-ALA-PRO,94,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C)CO)CO)Cc1ccccc1)C,Kd=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,C,A,dimer,1,1,94,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(C)C)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9672282338142396,0.8862718343734741,96.61653137207033,95.5470733642578,0.3278326392173767,0.4812589287757873,0.9206193089485168,0.9123716950416564,0.8928712010383606,0.8797469139099121,PEKRVASSVFITLAP,Low,"(6.398, 6.523]",train
2W0Z,protein-peptide,Q9UQC2 P62993,GPTYVQALFDFDPQEDGELGFRRGDFIHVMDNSDPNWWKGACHGQTGMFPRNYVTAVN,APPPRPPKP,GLY-PRO-THR-TYR-VAL-GLN-ALA-LEU-PHE-ASP-PHE-ASP-PRO-GLN-GLU-ASP-GLY-GLU-LEU-GLY-PHE-ARG-ARG-GLY-ASP-PHE-ILE-HIS-VAL-MET-ASP-ASN-SER-ASP-PRO-ASN-TRP-TRP-LYS-GLY-ALA-CYS-HIS-GLY-GLN-THR-GLY-MET-PHE-PRO-ARG-ASN-TYR-VAL-THR-ALA-VAL-ASN,ALA-PRO-PRO-PRO-ARG-PRO-PRO-LYS-PRO,58,9,O=C[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[NH3+],Kd=93.8uM,4.027797,4.03,1,A,A,1,A,A,0,,B,A,,1,1,58,9,0,C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9413346648216248,0.8080553412437439,97.0785903930664,96.59957122802734,0.2890199720859527,0.458495020866394,0.9140762686729432,0.8573058843612671,0.8641940355300903,0.7957426905632019,APPPRPPKP,Low,"(3.924, 4.155]",val
2W10,protein-peptide,O89100 Q6PB44,PLGSVRWARALYDFEALEEDELGFRSGEVVEVLDSSNPSWWTGRLHNKLGLFPANYVAPMMR,PPPRPTAPKPLL,PRO-LEU-GLY-SER-VAL-ARG-TRP-ALA-ARG-ALA-LEU-TYR-ASP-PHE-GLU-ALA-LEU-GLU-GLU-ASP-GLU-LEU-GLY-PHE-ARG-SER-GLY-GLU-VAL-VAL-GLU-VAL-LEU-ASP-SER-SER-ASN-PRO-SER-TRP-TRP-THR-GLY-ARG-LEU-HIS-ASN-LYS-LEU-GLY-LEU-PHE-PRO-ALA-ASN-TYR-VAL-ALA-PRO-MET-MET-ARG,PRO-PRO-PRO-ARG-PRO-THR-ALA-PRO-LYS-PRO-LEU-LEU,62,12,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C=O)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]1[NH2+]CCC1)CCC[NH+]=C(N)N)C,Kd=170nM,6.769551,6.77,1,A,A,1,A,A,0,,C,A,,0,1,62,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9934437870979308,0.7969201803207397,96.77186584472656,93.65505981445312,0.2875188291072845,0.5209941267967224,0.923494517803192,0.8400077819824219,0.9095797538757324,0.7861482501029968,PPPRPTAPKPLL,Low,"(6.696, 6.824]",train
2W2U,protein-peptide,Q4J924 Q877H3,MAHHHHHHMSAQVMLEEMARKYAINAVKADKEGNAEEAITNYKKAIEVLAQLVSLYRDGSTAAIYEQMINEYKRRIEVLKELI,VRELLPELPHPPSE,MET-ALA-HIS-HIS-HIS-HIS-HIS-HIS-MET-SER-ALA-GLN-VAL-MET-LEU-GLU-GLU-MET-ALA-ARG-LYS-TYR-ALA-ILE-ASN-ALA-VAL-LYS-ALA-ASP-LYS-GLU-GLY-ASN-ALA-GLU-GLU-ALA-ILE-THR-ASN-TYR-LYS-LYS-ALA-ILE-GLU-VAL-LEU-ALA-GLN-LEU-VAL-SER-LEU-TYR-ARG-ASP-GLY-SER-THR-ALA-ALA-ILE-TYR-GLU-GLN-MET-ILE-ASN-GLU-TYR-LYS-ARG-ARG-ILE-GLU-VAL-LEU-LYS-GLU-LEU-ILE,VAL-ARG-GLU-LEU-LEU-PRO-GLU-LEU-PRO-HIS-PRO-PRO-SER-GLU,83,14,O=C[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC(=O)O)CC(C)C)CC(C)C)CCC(=O)O)CC(C)C)Cc1nc[nH]c1,Kd=35uM,4.455932,4.46,1,A,A,1,A,A,0,,C,A,,1,1,83,14,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(=O)O,1.00228750705719,0.8775147795677185,95.47543334960938,93.510986328125,0.3121266365051269,0.5606650710105896,0.9061115980148317,0.8681924343109131,0.878135621547699,0.8346646428108215,VRELLPELPHPPSE,Low,"(4.319, 4.456]",train
2W85,protein-peptide,O75381 P40855,GAMATPGSENVLPREPLIATAVKFLQNSRVRQSPLATRRAFLKKKGLTDEEIDMAFQQSGTAADEPSSLW,SQEKFFQELFDS,GLY-ALA-MET-ALA-THR-PRO-GLY-SER-GLU-ASN-VAL-LEU-PRO-ARG-GLU-PRO-LEU-ILE-ALA-THR-ALA-VAL-LYS-PHE-LEU-GLN-ASN-SER-ARG-VAL-ARG-GLN-SER-PRO-LEU-ALA-THR-ARG-ARG-ALA-PHE-LEU-LYS-LYS-LYS-GLY-LEU-THR-ASP-GLU-GLU-ILE-ASP-MET-ALA-PHE-GLN-GLN-SER-GLY-THR-ALA-ALA-ASP-GLU-PRO-SER-SER-LEU-TRP,SER-GLN-GLU-LYS-PHE-PHE-GLN-GLU-LEU-PHE-ASP-SER,70,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(=O)O)Cc1ccccc1)CC(C)C)CCC(=O)O)CCC(=O)N)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC(=O)N)CCC(=O)O,Kd=9.17uM,5.037631,5.04,1,A,A,1,A,A,0,,B,A,,1,1,70,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(=O)O,1.0054444074630735,0.8967697620391846,94.7593994140625,83.20547485351562,0.343943327665329,0.6826047301292419,0.8611020445823669,0.8254568576812744,0.8586031794548035,0.7985265254974365,SQEKFFQELFDS,Low,"(5.014, 5.105]",train
2W9R,protein-peptide,P0ABT2 P0A8Q6,MGKTNDWLDFDQLAEEKVRDALKPPSMYKVILVNDDYTPMEFVIDVLQKFFSYDVERATQLMLAVHYQGKAICGVFTAEVAETKVAMVNKYARENEHPLLCTLEKAGA,LVKSKATNLLY,MET-GLY-LYS-THR-ASN-ASP-TRP-LEU-ASP-PHE-ASP-GLN-LEU-ALA-GLU-GLU-LYS-VAL-ARG-ASP-ALA-LEU-LYS-PRO-PRO-SER-MET-TYR-LYS-VAL-ILE-LEU-VAL-ASN-ASP-ASP-TYR-THR-PRO-MET-GLU-PHE-VAL-ILE-ASP-VAL-LEU-GLN-LYS-PHE-PHE-SER-TYR-ASP-VAL-GLU-ARG-ALA-THR-GLN-LEU-MET-LEU-ALA-VAL-HIS-TYR-GLN-GLY-LYS-ALA-ILE-CYS-GLY-VAL-PHE-THR-ALA-GLU-VAL-ALA-GLU-THR-LYS-VAL-ALA-MET-VAL-ASN-LYS-TYR-ALA-ARG-GLU-ASN-GLU-HIS-PRO-LEU-LEU-CYS-THR-LEU-GLU-LYS-ALA-GLY-ALA,LEU-VAL-LYS-SER-LYS-ALA-THR-ASN-LEU-LEU-TYR,108,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C=O)CC(C)C)CC(C)C)CC(=O)N)[C@H](O)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)[NH3+])CCCC[NH3+])CO,Kd=4.8uM,5.318759,5.32,1,A,A,1,A,A,0,,B,A,,1,1,108,11,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(=O)O,0.8613845109939575,0.9325861930847168,83.73916625976562,79.44522857666016,0.3804140985012054,0.6003318428993225,0.799553394317627,0.8106204271316528,0.7455397248268127,0.8184016942977905,LVKSKATNLLY,Low,"(5.31, 5.463]",train
2WA8,protein-peptide,P0A8Q6,MGKTNDWLDFDQLAEEKVRDALKPPSMYKVILVNDDYTPMEFVIDVLQKFFSYDVERATQLMLAVHYQGKAICGVFTAEVAETKVAMVNKYARENEHPLLCTLEKAF,FRSKGEELFT,MET-GLY-LYS-THR-ASN-ASP-TRP-LEU-ASP-PHE-ASP-GLN-LEU-ALA-GLU-GLU-LYS-VAL-ARG-ASP-ALA-LEU-LYS-PRO-PRO-SER-MET-TYR-LYS-VAL-ILE-LEU-VAL-ASN-ASP-ASP-TYR-THR-PRO-MET-GLU-PHE-VAL-ILE-ASP-VAL-LEU-GLN-LYS-PHE-PHE-SER-TYR-ASP-VAL-GLU-ARG-ALA-THR-GLN-LEU-MET-LEU-ALA-VAL-HIS-TYR-GLN-GLY-LYS-ALA-ILE-CYS-GLY-VAL-PHE-THR-ALA-GLU-VAL-ALA-GLU-THR-LYS-VAL-ALA-MET-VAL-ASN-LYS-TYR-ALA-ARG-GLU-ASN-GLU-HIS-PRO-LEU-LEU-CYS-THR-LEU-GLU-LYS-ALA-PHE,PHE-ARG-SER-LYS-GLY-GLU-GLU-LEU-PHE-THR,107,10,[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)C)C=O)Cc1ccccc1)CC(C)C)CCC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CCC[NH+]=C(N)N)CO,Kd=3.8uM,5.420216,5.42,1,A,A,1,A,A,0,,B,A,,1,1,107,10,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)O)C(=O)O,0.9276360273361206,0.9434345364570618,86.94871520996094,82.0706558227539,0.389072060585022,0.6202923655509949,0.7846275568008423,0.8200599551200867,0.8351830244064331,0.8282501101493835,FRSKGEELFT,Low,"(5.31, 5.463]",train
2WFJ,protein-peptide,Q13427,GAMGIKVQRPRCFFDIAINNQPAGRVVFELFSDVCPKTCENFRCLCTGEKGTGKSTQKPLHYKSCLFHRVVKDFMVQGGDFSEGNGRGGESIYGGFFEDESFAVKHNKEFLLSMANRGKDTNGSQFFITTKPTPHLDGHHVVFGQVISGQEVVREIENQKTDAASKPFAEVRILSCGEL,ALLVTAGLVLA,GLY-ALA-MET-GLY-ILE-LYS-VAL-GLN-ARG-PRO-ARG-CYS-PHE-PHE-ASP-ILE-ALA-ILE-ASN-ASN-GLN-PRO-ALA-GLY-ARG-VAL-VAL-PHE-GLU-LEU-PHE-SER-ASP-VAL-CYS-PRO-LYS-THR-CYS-GLU-ASN-PHE-ARG-CYS-LEU-CYS-THR-GLY-GLU-LYS-GLY-THR-GLY-LYS-SER-THR-GLN-LYS-PRO-LEU-HIS-TYR-LYS-SER-CYS-LEU-PHE-HIS-ARG-VAL-VAL-LYS-ASP-PHE-MET-VAL-GLN-GLY-GLY-ASP-PHE-SER-GLU-GLY-ASN-GLY-ARG-GLY-GLY-GLU-SER-ILE-TYR-GLY-GLY-PHE-PHE-GLU-ASP-GLU-SER-PHE-ALA-VAL-LYS-HIS-ASN-LYS-GLU-PHE-LEU-LEU-SER-MET-ALA-ASN-ARG-GLY-LYS-ASP-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-THR-THR-LYS-PRO-THR-PRO-HIS-LEU-ASP-GLY-HIS-HIS-VAL-VAL-PHE-GLY-GLN-VAL-ILE-SER-GLY-GLN-GLU-VAL-VAL-ARG-GLU-ILE-GLU-ASN-GLN-LYS-THR-ASP-ALA-ALA-SER-LYS-PRO-PHE-ALA-GLU-VAL-ARG-ILE-LEU-SER-CYS-GLY-GLU-LEU,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,179,11,C/C=C/C[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,Kd=70nM,7.154902,7.15,1,A,A,1,A,A,0,,B,A,,1,1,179,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9005317687988281,0.7839574813842773,94.82380676269533,93.83578491210938,0.3329950273036957,0.5919943451881409,0.9451183676719666,0.8914658427238464,0.8532009124755859,0.7570803761482239,ALLVTAGLVLA,Moderate,"(7.049, 7.268]",train
2WP1,protein-peptide,Q91Y44 P68433,QQQHKVLKTVKVTEQLKHCSEILKEMLAKKHLPYAWPFYNPVDADALGLHNYYDVVKNPMDLGTIKGKMDNQEYKDAYEFAADVRLMFMNCYKYNPPDHEVVAMARTLQDVFELHFAKIPDEPIES,KAPRKQLATK,GLN-GLN-GLN-HIS-LYS-VAL-LEU-LYS-THR-VAL-LYS-VAL-THR-GLU-GLN-LEU-LYS-HIS-CYS-SER-GLU-ILE-LEU-LYS-GLU-MET-LEU-ALA-LYS-LYS-HIS-LEU-PRO-TYR-ALA-TRP-PRO-PHE-TYR-ASN-PRO-VAL-ASP-ALA-ASP-ALA-LEU-GLY-LEU-HIS-ASN-TYR-TYR-ASP-VAL-VAL-LYS-ASN-PRO-MET-ASP-LEU-GLY-THR-ILE-LYS-GLY-LYS-MET-ASP-ASN-GLN-GLU-TYR-LYS-ASP-ALA-TYR-GLU-PHE-ALA-ALA-ASP-VAL-ARG-LEU-MET-PHE-MET-ASN-CYS-TYR-LYS-TYR-ASN-PRO-PRO-ASP-HIS-GLU-VAL-VAL-ALA-MET-ALA-ARG-THR-LEU-GLN-ASP-VAL-PHE-GLU-LEU-HIS-PHE-ALA-LYS-ILE-PRO-ASP-GLU-PRO-ILE-GLU-SER,LYS-ALA-PRO-ARG-ALY-GLN-LEU-ALA-THR-LYS,126,10,CC(C[C@@H](C(=O)N[C@H](C(=O)N)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCCNC(=O)C)CCC(=O)N)C,Kd=251uM,3.600326,3.6,1,A,A,1,A,A,0,,P,A,,1,1,126,10,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9115034341812134,0.8340733647346497,90.86573791503906,91.71142578125,0.3432413935661316,0.6086918115615845,0.90541809797287,0.8706435561180115,0.8348997235298157,0.7951688766479492,KAPRKQLATK,Low,"(3.548, 3.924]",train
2XHS,protein-peptide,P02835 P33244,GSHMLEDPLRVSPMIREFVQSIDDREWQTQLFALLQKQTYNQVEVDLFELMCKVLDQNLFSQVDWARNTVFFKDLKVDDQMKLLQHSWSDMLVLDHLHHRIHNGLPDETQLNNGQVFNLMSLGLLGVPQLGDYFNELQNKLQDLKFDMGDYVCMKFLILLNPSVRGIVNRKTVSEGHDNVQAALLDYTLTCYPSVNDKFRGLVNILPEIHAMAVRGEDHLYTKHCAGSAPTQTLLMEMLHAKRKG,STLRALLTN,GLY-SER-HIS-MSE-LEU-GLU-ASP-PRO-LEU-ARG-VAL-SER-PRO-MSE-ILE-ARG-GLU-PHE-VAL-GLN-SER-ILE-ASP-ASP-ARG-GLU-TRP-GLN-THR-GLN-LEU-PHE-ALA-LEU-LEU-GLN-LYS-GLN-THR-TYR-ASN-GLN-VAL-GLU-VAL-ASP-LEU-PHE-GLU-LEU-MSE-CYS-LYS-VAL-LEU-ASP-GLN-ASN-LEU-PHE-SER-GLN-VAL-ASP-TRP-ALA-ARG-ASN-THR-VAL-PHE-PHE-LYS-ASP-LEU-LYS-VAL-ASP-ASP-GLN-MSE-LYS-LEU-LEU-GLN-HIS-SER-TRP-SER-ASP-MSE-LEU-VAL-LEU-ASP-HIS-LEU-HIS-HIS-ARG-ILE-HIS-ASN-GLY-LEU-PRO-ASP-GLU-THR-GLN-LEU-ASN-ASN-GLY-GLN-VAL-PHE-ASN-LEU-MSE-SER-LEU-GLY-LEU-LEU-GLY-VAL-PRO-GLN-LEU-GLY-ASP-TYR-PHE-ASN-GLU-LEU-GLN-ASN-LYS-LEU-GLN-ASP-LEU-LYS-PHE-ASP-MSE-GLY-ASP-TYR-VAL-CYS-MSE-LYS-PHE-LEU-ILE-LEU-LEU-ASN-PRO-SER-VAL-ARG-GLY-ILE-VAL-ASN-ARG-LYS-THR-VAL-SER-GLU-GLY-HIS-ASP-ASN-VAL-GLN-ALA-ALA-LEU-LEU-ASP-TYR-THR-LEU-THR-CYS-TYR-PRO-SER-VAL-ASN-ASP-LYS-PHE-ARG-GLY-LEU-VAL-ASN-ILE-LEU-PRO-GLU-ILE-HIS-ALA-MSE-ALA-VAL-ARG-GLY-GLU-ASP-HIS-LEU-TYR-THR-LYS-HIS-CYS-ALA-GLY-SER-ALA-PRO-THR-GLN-THR-LEU-LEU-MSE-GLU-MSE-LEU-HIS-ALA-LYS-ARG-LYS-GLY,SER-THR-LEU-ARG-ALA-LEU-LEU-THR-ASN,245,9,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](/C/1=N/[C@@H](CCC[NH+]=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C[C@H](CO1)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)[C@H](O)C)CC(C)C)CC(C)C)[C@H](O)C)[NH3+],Kd=0.99uM,6.004365,6.0,1,A,A,1,A,A,0,,B,A,,1,1,245,9,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.9468722343444824,0.7972622513771057,95.37706756591795,87.1629409790039,0.3538334965705871,0.6586090922355652,0.9372304677963256,0.891116201877594,0.9271369576454164,0.7737987637519836,STLRALLTN,Low,"(5.959, 6.097]",train
2XL2,protein-peptide,P61965 Q8BX09,MATEEKKPETEAARAQPTPSSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,YAAEDEEVDVTSVD,MET-ALA-THR-GLU-GLU-LYS-LYS-PRO-GLU-THR-GLU-ALA-ALA-ARG-ALA-GLN-PRO-THR-PRO-SER-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,TYR-ALA-ALA-GLU-ASP-GLU-GLU-VAL-ASP-VAL-THR-SER-VAL-ASP,334,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])C)CCC(=O)O)CC(=O)O,Kd=5.6uM,5.251812,5.25,1,A,A,1,A,A,0,,C,A,,1,1,334,14,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8872065544128418,0.7026575207710266,88.79521179199219,87.279296875,0.3658161461353302,0.9857729077339172,0.8762933015823364,0.8087087869644165,0.8091158270835876,0.6181356906890869,YAAEDEEVDVTSVD,Low,"(5.222, 5.31]",train
2XRW,protein-peptide,Q12968 P45983,MGSRSKRDNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGLLNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMTPYVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMIKGGVLFPGTDHIDQWNKVIEQLGTPCPEFMKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKLKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSEAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLEHHHHHH,LERPSRDHLYLPLE,MET-GLY-SER-ARG-SER-LYS-ARG-ASP-ASN-ASN-PHE-TYR-SER-VAL-GLU-ILE-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-ILE-LEU-GLU-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-GLY-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-SER-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-ILE-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-THR-PRO-TYR-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-ILE-LYS-GLY-GLY-VAL-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-THR-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-TYR-SER-PHE-GLU-LYS-LEU-PHE-PRO-ASP-VAL-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-ALA-SER-LYS-ARG-ILE-SER-VAL-ASP-GLU-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-SER-GLU-ALA-GLU-ALA-PRO-PRO-PRO-LYS-ILE-PRO-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASP-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,LEU-GLU-ARG-PRO-SER-ARG-ASP-HIS-LEU-TYR-LEU-PRO-LEU-GLU,371,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(C)C)CC(C)C)Cc1ccc(cc1)O)CC(C)C)Cc1nc[nH]c1)CC(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C,Kd=7.1uM,5.148742,5.15,1,A,A,1,A,A,0,,B,A,,1,1,371,14,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.780133843421936,0.6898450255393982,75.9437484741211,74.365234375,0.633364737033844,1.1617757081985474,0.8429744839668274,0.8057886362075806,0.7416964173316956,0.6591744422912598,LERPSRDHLYLPLE,Low,"(5.105, 5.222]",train
2XS0,protein-peptide,Q12968 P45983,GSMSRSKRDNNFYSVEIGDSTFTVLKRYQNLKPIGSGAQGIVCAAYDAILERNVAIKKLSRPFQNQTHAKRAYRELVLMKCVNHKNIIGLLNVFTPQKSLEEFQDVYIVMELMDANLCQVIQMELDHERMSYLLYQMLCGIKHLHSAGIIHRDLKPSNIVVKSDCTLKILDFGLARTAGTSFMMVPFVVTRYYRAPEVILGMGYKENVDIWSVGCIMGEMIKGGVLFPGTDHIDQWNKVIEQLGTPCPEFMKKLQPTVRTYVENRPKYAGYSFEKLFPDVLFPADSEHNKLKASQARDLLSKMLVIDASKRISVDEALQHPYINVWYDPSEAEAPPPKIPDKQLDEREHTIEEWKELIYKEVMDLEERTKNGVIRGQPSPLAQVQQ,LERPSRDHLYLPLE,GLY-SER-MET-SER-ARG-SER-LYS-ARG-ASP-ASN-ASN-PHE-TYR-SER-VAL-GLU-ILE-GLY-ASP-SER-THR-PHE-THR-VAL-LEU-LYS-ARG-TYR-GLN-ASN-LEU-LYS-PRO-ILE-GLY-SER-GLY-ALA-GLN-GLY-ILE-VAL-CYS-ALA-ALA-TYR-ASP-ALA-ILE-LEU-GLU-ARG-ASN-VAL-ALA-ILE-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-ASN-GLN-THR-HIS-ALA-LYS-ARG-ALA-TYR-ARG-GLU-LEU-VAL-LEU-MET-LYS-CYS-VAL-ASN-HIS-LYS-ASN-ILE-ILE-GLY-LEU-LEU-ASN-VAL-PHE-THR-PRO-GLN-LYS-SER-LEU-GLU-GLU-PHE-GLN-ASP-VAL-TYR-ILE-VAL-MET-GLU-LEU-MET-ASP-ALA-ASN-LEU-CYS-GLN-VAL-ILE-GLN-MET-GLU-LEU-ASP-HIS-GLU-ARG-MET-SER-TYR-LEU-LEU-TYR-GLN-MET-LEU-CYS-GLY-ILE-LYS-HIS-LEU-HIS-SER-ALA-GLY-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-ILE-VAL-VAL-LYS-SER-ASP-CYS-THR-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-THR-ALA-GLY-THR-SER-PHE-MET-MET-VAL-PRO-PHE-VAL-VAL-THR-ARG-TYR-TYR-ARG-ALA-PRO-GLU-VAL-ILE-LEU-GLY-MET-GLY-TYR-LYS-GLU-ASN-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-GLY-GLU-MET-ILE-LYS-GLY-GLY-VAL-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-TRP-ASN-LYS-VAL-ILE-GLU-GLN-LEU-GLY-THR-PRO-CYS-PRO-GLU-PHE-MET-LYS-LYS-LEU-GLN-PRO-THR-VAL-ARG-THR-TYR-VAL-GLU-ASN-ARG-PRO-LYS-TYR-ALA-GLY-TYR-SER-PHE-GLU-LYS-LEU-PHE-PRO-ASP-VAL-LEU-PHE-PRO-ALA-ASP-SER-GLU-HIS-ASN-LYS-LEU-LYS-ALA-SER-GLN-ALA-ARG-ASP-LEU-LEU-SER-LYS-MET-LEU-VAL-ILE-ASP-ALA-SER-LYS-ARG-ILE-SER-VAL-ASP-GLU-ALA-LEU-GLN-HIS-PRO-TYR-ILE-ASN-VAL-TRP-TYR-ASP-PRO-SER-GLU-ALA-GLU-ALA-PRO-PRO-PRO-LYS-ILE-PRO-ASP-LYS-GLN-LEU-ASP-GLU-ARG-GLU-HIS-THR-ILE-GLU-GLU-TRP-LYS-GLU-LEU-ILE-TYR-LYS-GLU-VAL-MET-ASP-LEU-GLU-GLU-ARG-THR-LYS-ASN-GLY-VAL-ILE-ARG-GLY-GLN-PRO-SER-PRO-LEU-ALA-GLN-VAL-GLN-GLN,LEU-GLU-ARG-PRO-SER-ARG-ASP-HIS-LEU-TYR-LEU-PRO-LEU-GLU,386,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CC(C)C)CC(C)C)Cc1ccc(cc1)O)CC(C)C)Cc1nc[nH]c1)CC(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=7.1uM,5.148742,5.15,1,A,A,1,A,A,0,,B,A,,1,1,386,14,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.818259060382843,0.7482112050056458,74.1070785522461,73.17060089111328,0.6555577516555786,1.0161957740783691,0.837477445602417,0.8215999007225037,0.7634544372558594,0.7104339599609375,LERPSRDHLYLPLE,Low,"(5.105, 5.222]",val
2XS8,protein-peptide,Q02843 Q8WUM4,GIDPFTMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQYYFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMVPVSVQQSLAAYNQRKADLVNRSIAQMREATTLANGVLASLNLPAAIEDVSGDTVPQSILTKSRSVIEQGGIQTVDQLIKELPELLQRNREILDESLRLLDEEEATDNDLRAKFKERWQRTPSNELYKPLRAEGTNFRTVLDKAVQADGQVKECYQSHRDTIVLLCKPEPELNAAIPSANPAKTMQGSEVVNVLKSLLSNLDEVKKEREGLENDLKSVNFDMTSKFLTALAQDGVINEEALSVTELDRVYGGLTTKVQESLKKQEGLLKNIQVSHQEFSKMKQSNNEANLREEVLKNLATAYDNFVELVANLKEGTKFYNELTEILVRFQNKCSDIVFAR,AAGAYDPARKLLEQYAKK,GLY-ILE-ASP-PRO-PHE-THR-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-TYR-TYR-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL-PRO-VAL-SER-VAL-GLN-GLN-SER-LEU-ALA-ALA-TYR-ASN-GLN-ARG-LYS-ALA-ASP-LEU-VAL-ASN-ARG-SER-ILE-ALA-GLN-MET-ARG-GLU-ALA-THR-THR-LEU-ALA-ASN-GLY-VAL-LEU-ALA-SER-LEU-ASN-LEU-PRO-ALA-ALA-ILE-GLU-ASP-VAL-SER-GLY-ASP-THR-VAL-PRO-GLN-SER-ILE-LEU-THR-LYS-SER-ARG-SER-VAL-ILE-GLU-GLN-GLY-GLY-ILE-GLN-THR-VAL-ASP-GLN-LEU-ILE-LYS-GLU-LEU-PRO-GLU-LEU-LEU-GLN-ARG-ASN-ARG-GLU-ILE-LEU-ASP-GLU-SER-LEU-ARG-LEU-LEU-ASP-GLU-GLU-GLU-ALA-THR-ASP-ASN-ASP-LEU-ARG-ALA-LYS-PHE-LYS-GLU-ARG-TRP-GLN-ARG-THR-PRO-SER-ASN-GLU-LEU-TYR-LYS-PRO-LEU-ARG-ALA-GLU-GLY-THR-ASN-PHE-ARG-THR-VAL-LEU-ASP-LYS-ALA-VAL-GLN-ALA-ASP-GLY-GLN-VAL-LYS-GLU-CYS-TYR-GLN-SER-HIS-ARG-ASP-THR-ILE-VAL-LEU-LEU-CYS-LYS-PRO-GLU-PRO-GLU-LEU-ASN-ALA-ALA-ILE-PRO-SER-ALA-ASN-PRO-ALA-LYS-THR-MET-GLN-GLY-SER-GLU-VAL-VAL-ASN-VAL-LEU-LYS-SER-LEU-LEU-SER-ASN-LEU-ASP-GLU-VAL-LYS-LYS-GLU-ARG-GLU-GLY-LEU-GLU-ASN-ASP-LEU-LYS-SER-VAL-ASN-PHE-ASP-MET-THR-SER-LYS-PHE-LEU-THR-ALA-LEU-ALA-GLN-ASP-GLY-VAL-ILE-ASN-GLU-GLU-ALA-LEU-SER-VAL-THR-GLU-LEU-ASP-ARG-VAL-TYR-GLY-GLY-LEU-THR-THR-LYS-VAL-GLN-GLU-SER-LEU-LYS-LYS-GLN-GLU-GLY-LEU-LEU-LYS-ASN-ILE-GLN-VAL-SER-HIS-GLN-GLU-PHE-SER-LYS-MET-LYS-GLN-SER-ASN-ASN-GLU-ALA-ASN-LEU-ARG-GLU-GLU-VAL-LEU-LYS-ASN-LEU-ALA-THR-ALA-TYR-ASP-ASN-PHE-VAL-GLU-LEU-VAL-ALA-ASN-LEU-LYS-GLU-GLY-THR-LYS-PHE-TYR-ASN-GLU-LEU-THR-GLU-ILE-LEU-VAL-ARG-PHE-GLN-ASN-LYS-CYS-SER-ASP-ILE-VAL-PHE-ALA-ARG,ALA-ALA-GLY-ALA-TYR-ASP-PRO-ALA-ARG-LYS-LEU-LEU-GLU-GLN-TYR-ALA-LYS-LYS,704,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1ccc(cc1)O)CC(=O)O)C)CCC[NH+]=C(N)N,Kd=24.5uM,4.610834,4.61,1,A,A,1,A,A,0,,B,A,,1,1,704,18,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8103987574577332,0.5464820265769958,59.55760192871094,54.65629959106445,0.5890851020812988,1.5352956056594849,0.6234652996063232,0.5894600749015808,0.8415504097938538,0.5357375144958496,AAGAYDPARKLLEQYAKK,Low,"(4.606, 4.745]",train
2XXN,protein-peptide,Q2HR73 Q93009,TSWRSEATFQFTVERFSRLSESVLSPPCFVRNLPWKIMVMPRFYPDRPHQKSVGFFLQCNAESDSTSWSCHAQAVLKIINYRDDEKSFSRRISHLFFHKENDWGFSNFMAWSEVTDPEKGFIDDDKVTFEVFVQADAPHGVAW,SVWIPVNEGASTSGM,THR-SER-TRP-ARG-SER-GLU-ALA-THR-PHE-GLN-PHE-THR-VAL-GLU-ARG-PHE-SER-ARG-LEU-SER-GLU-SER-VAL-LEU-SER-PRO-PRO-CYS-PHE-VAL-ARG-ASN-LEU-PRO-TRP-LYS-ILE-MET-VAL-MET-PRO-ARG-PHE-TYR-PRO-ASP-ARG-PRO-HIS-GLN-LYS-SER-VAL-GLY-PHE-PHE-LEU-GLN-CYS-ASN-ALA-GLU-SER-ASP-SER-THR-SER-TRP-SER-CYS-HIS-ALA-GLN-ALA-VAL-LEU-LYS-ILE-ILE-ASN-TYR-ARG-ASP-ASP-GLU-LYS-SER-PHE-SER-ARG-ARG-ILE-SER-HIS-LEU-PHE-PHE-HIS-LYS-GLU-ASN-ASP-TRP-GLY-PHE-SER-ASN-PHE-MET-ALA-TRP-SER-GLU-VAL-THR-ASP-PRO-GLU-LYS-GLY-PHE-ILE-ASP-ASP-ASP-LYS-VAL-THR-PHE-GLU-VAL-PHE-VAL-GLN-ALA-ASP-ALA-PRO-HIS-GLY-VAL-ALA-TRP,SER-VAL-TRP-ILE-PRO-VAL-ASN-GLU-GLY-ALA-SER-THR-SER-GLY-MET,143,15,CSCC[C@@H](C(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)[NH3+])CC(=O)N)CCC(=O)O)C)CO)CO,Kd=0.39uM,6.408935,6.41,1,A,A,1,A,A,0,,B,A,,1,1,143,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C)C(C)C,0.8862587809562683,0.7338947057723999,94.25277709960938,92.99449920654295,0.3543549478054046,0.709507942199707,0.923723042011261,0.8433498740196228,0.8175572752952576,0.7065308690071106,SVWIPVNEGASTSGM,Low,"(6.398, 6.523]",val
2Y1N,protein-peptide,P22681 P43403,PPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTGLCEPTPQDHIKVTQEQYELYCEMGSTFQLCKICAENDKDVKIEPCGHLMCTSCLTSWQESEGQGCPFCRCEIKGTEPIVVDPFD,TLNSDGYTPEPA,PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY-LEU-CYS-GLU-PRO-THR-PRO-GLN-ASP-HIS-ILE-LYS-VAL-THR-GLN-GLU-GLN-TYR-GLU-LEU-TYR-CYS-GLU-MET-GLY-SER-THR-PHE-GLN-LEU-CYS-LYS-ILE-CYS-ALA-GLU-ASN-ASP-LYS-ASP-VAL-LYS-ILE-GLU-PRO-CYS-GLY-HIS-LEU-MET-CYS-THR-SER-CYS-LEU-THR-SER-TRP-GLN-GLU-SER-GLU-GLY-GLN-GLY-CYS-PRO-PHE-CYS-ARG-CYS-GLU-ILE-LYS-GLY-THR-GLU-PRO-ILE-VAL-VAL-ASP-PRO-PHE-ASP,THR-LEU-ASN-SER-ASP-GLY-PTR-THR-PRO-GLU-PRO-ALA,389,12,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)CCC(=O)O)[C@H](O)C)Cc1ccc(cc1)OP(O)(O)O)CC(=O)O)[NH3+],Kd=17uM,4.769551,4.77,1,A,A,1,A,A,0,,B,A,,1,1,389,12,0,CC(C)C[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CNC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)CNC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.7966530919075012,0.8347243070602417,80.67797088623047,77.56311798095703,0.4633137285709381,0.7035229802131653,0.8764730095863342,0.8809467554092407,0.7579948306083679,0.8231686353683472,TLNSDGYTPEPA,Low,"(4.745, 4.866]",train
2Y8O,protein-peptide,P52564 Q16539,GSMSQERPTFYRQELNKTIWEVPERYQNLSPVGSGAYGSVCAAFDTKTGLRVAVKKLSRPFQSIIHAKRTYRELRLLKHMKHENVIGLLDVFTPARSLEEFNDVYLVTHLMGADLNNIVKCQKLTDDHVQFLIYQILRGLKYIHSADIIHRDLKPSNLAVNEDSELKILDFGLARHTDDEMTGYVATRWYRAPEIMLNWMHYNQTVDIWSVGCIMAELLTGRTLFPGTDHIDQLKLILRLVGTPGAELLKKISSESARNYIQSLTQMPKMNFANVFIGANPLAVDLLEKMLVLDSDKRITAAQALAHAYFAQYHDPDDEPVADPYDQSFESRDLLIDEWKSLTYDEVISFVPPPLDQEEMES,SKGKKRNPGLKIPK,GLY-SER-MET-SER-GLN-GLU-ARG-PRO-THR-PHE-TYR-ARG-GLN-GLU-LEU-ASN-LYS-THR-ILE-TRP-GLU-VAL-PRO-GLU-ARG-TYR-GLN-ASN-LEU-SER-PRO-VAL-GLY-SER-GLY-ALA-TYR-GLY-SER-VAL-CYS-ALA-ALA-PHE-ASP-THR-LYS-THR-GLY-LEU-ARG-VAL-ALA-VAL-LYS-LYS-LEU-SER-ARG-PRO-PHE-GLN-SER-ILE-ILE-HIS-ALA-LYS-ARG-THR-TYR-ARG-GLU-LEU-ARG-LEU-LEU-LYS-HIS-MET-LYS-HIS-GLU-ASN-VAL-ILE-GLY-LEU-LEU-ASP-VAL-PHE-THR-PRO-ALA-ARG-SER-LEU-GLU-GLU-PHE-ASN-ASP-VAL-TYR-LEU-VAL-THR-HIS-LEU-MET-GLY-ALA-ASP-LEU-ASN-ASN-ILE-VAL-LYS-CYS-GLN-LYS-LEU-THR-ASP-ASP-HIS-VAL-GLN-PHE-LEU-ILE-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASP-ILE-ILE-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-ALA-VAL-ASN-GLU-ASP-SER-GLU-LEU-LYS-ILE-LEU-ASP-PHE-GLY-LEU-ALA-ARG-HIS-THR-ASP-ASP-GLU-MET-THR-GLY-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-TRP-MET-HIS-TYR-ASN-GLN-THR-VAL-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-MET-ALA-GLU-LEU-LEU-THR-GLY-ARG-THR-LEU-PHE-PRO-GLY-THR-ASP-HIS-ILE-ASP-GLN-LEU-LYS-LEU-ILE-LEU-ARG-LEU-VAL-GLY-THR-PRO-GLY-ALA-GLU-LEU-LEU-LYS-LYS-ILE-SER-SER-GLU-SER-ALA-ARG-ASN-TYR-ILE-GLN-SER-LEU-THR-GLN-MET-PRO-LYS-MET-ASN-PHE-ALA-ASN-VAL-PHE-ILE-GLY-ALA-ASN-PRO-LEU-ALA-VAL-ASP-LEU-LEU-GLU-LYS-MET-LEU-VAL-LEU-ASP-SER-ASP-LYS-ARG-ILE-THR-ALA-ALA-GLN-ALA-LEU-ALA-HIS-ALA-TYR-PHE-ALA-GLN-TYR-HIS-ASP-PRO-ASP-ASP-GLU-PRO-VAL-ALA-ASP-PRO-TYR-ASP-GLN-SER-PHE-GLU-SER-ARG-ASP-LEU-LEU-ILE-ASP-GLU-TRP-LYS-SER-LEU-THR-TYR-ASP-GLU-VAL-ILE-SER-PHE-VAL-PRO-PRO-PRO-LEU-ASP-GLN-GLU-GLU-MET-GLU-SER,SER-LYS-GLY-LYS-LYS-ARG-ASN-PRO-GLY-LEU-LYS-ILE-PRO-LYS,362,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)N)[NH3+])CC(C)C,Kd=7.5uM,5.124939,5.12,1,A,A,1,A,A,0,,B,A,,1,1,362,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,0.811321496963501,0.7777976989746094,82.20177459716797,79.27735137939453,0.5323221683502197,0.8913587331771851,0.8675650954246521,0.8537600040435791,0.749055802822113,0.7311828136444092,SKGKKRNPGLKIPK,Low,"(5.105, 5.222]",train
2Y9Q,protein-peptide,Q9BUB5 P28482,GSMAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,MKLSPPSKSRLARRRALA,GLY-SER-MET-ALA-ALA-ALA-ALA-ALA-ALA-GLY-ALA-GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-VAL-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ARG-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-THR-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-CYS-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-THR-GLU-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-ILE-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-GLU-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,MET-LYS-LEU-SER-PRO-PRO-SER-LYS-SER-ARG-LEU-ALA-ARG-ARG-ARG-ALA-LEU-ALA,362,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)CC(C)C)CCC[NH+]=C(N)N)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCSC)[NH3+])CCCC[NH3+])CC(C)C)CO)CO,Kd=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,B,A,,1,1,362,18,0,CSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.8331599235534668,0.6707718372344971,76.92021179199219,81.95789337158203,0.5560580492019653,1.0727840662002563,0.8620628118515015,0.8207346796989441,0.7733026146888733,0.6091098785400391,MKLSPPSKSRLARRRALA,Low,"(6.097, 6.26]",train
2YMT,protein-peptide,O75843,GGSAPIPDLKVFEREGVQLNLSFIRPPENPALLLITITATNFSEGDVTHFICQAAVPKSLQLQLQAPSGNTVPARGGLPITQLFRILNPNKAPLRLKLRLTYDHFHQSVQEIFEVNNLPVESWQ,GEEWGPWV,GLY-GLY-SER-ALA-PRO-ILE-PRO-ASP-LEU-LYS-VAL-PHE-GLU-ARG-GLU-GLY-VAL-GLN-LEU-ASN-LEU-SER-PHE-ILE-ARG-PRO-PRO-GLU-ASN-PRO-ALA-LEU-LEU-LEU-ILE-THR-ILE-THR-ALA-THR-ASN-PHE-SER-GLU-GLY-ASP-VAL-THR-HIS-PHE-ILE-CYS-GLN-ALA-ALA-VAL-PRO-LYS-SER-LEU-GLN-LEU-GLN-LEU-GLN-ALA-PRO-SER-GLY-ASN-THR-VAL-PRO-ALA-ARG-GLY-GLY-LEU-PRO-ILE-THR-GLN-LEU-PHE-ARG-ILE-LEU-ASN-PRO-ASN-LYS-ALA-PRO-LEU-ARG-LEU-LYS-LEU-ARG-LEU-THR-TYR-ASP-HIS-PHE-HIS-GLN-SER-VAL-GLN-GLU-ILE-PHE-GLU-VAL-ASN-ASN-LEU-PRO-VAL-GLU-SER-TRP-GLN,GLY-GLU-GLU-TRP-GLY-PRO-TRP-VAL-NH2,124,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C(C)C)Cc1c[nH]c2c1cccc2)Cc1c[nH]c2c1cccc2)[NH3+],Kd~10nM,8.0,8.0,1,A,A,1,A,A,0,,B,A,,1,1,124,9,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCC(=O)NCC(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O,0.9696180820465088,0.9137239456176758,96.42755126953124,96.78224182128906,0.3001163303852081,0.4733218252658844,0.9365860223770142,0.9231225848197936,0.9399973154067992,0.9113742709159852,GEEWGPWV,Moderate,"(7.921, 8.383]",train
2YNN,protein-peptide,P41811,MKLDIKKTFSNRSDRVKGIDFHPTEPWVLTTLYSGRVELWNYETQVEVRSIQVTETPVRAGKFIARKNWIIVGSDDFRIRVFNYNTGEKVVDFEAHPDYIRSIAVHPTKPYVLSGSDDLTVKLWNWENNWALEQTFEGHEHFVMCVAFNPKDPSTFASGCLDRTVKVWSLGQSTPNFTLTTGQERGVNYVDYYPLPDKPYMITASDDLTIKIWDYQTKSCVATLEGHMSNVSFAVFHPTLPIIISGSEDGTLKIWNSSTYKVEKTLNVGLERSWCIATHPTGRKNYIASGFDNGFTVLSLGNDE,CTFKTKTN,MET-LYS-LEU-ASP-ILE-LYS-LYS-THR-PHE-SER-ASN-ARG-SER-ASP-ARG-VAL-LYS-GLY-ILE-ASP-PHE-HIS-PRO-THR-GLU-PRO-TRP-VAL-LEU-THR-THR-LEU-TYR-SER-GLY-ARG-VAL-GLU-LEU-TRP-ASN-TYR-GLU-THR-GLN-VAL-GLU-VAL-ARG-SER-ILE-GLN-VAL-THR-GLU-THR-PRO-VAL-ARG-ALA-GLY-LYS-PHE-ILE-ALA-ARG-LYS-ASN-TRP-ILE-ILE-VAL-GLY-SER-ASP-ASP-PHE-ARG-ILE-ARG-VAL-PHE-ASN-TYR-ASN-THR-GLY-GLU-LYS-VAL-VAL-ASP-PHE-GLU-ALA-HIS-PRO-ASP-TYR-ILE-ARG-SER-ILE-ALA-VAL-HIS-PRO-THR-LYS-PRO-TYR-VAL-LEU-SER-GLY-SER-ASP-ASP-LEU-THR-VAL-LYS-LEU-TRP-ASN-TRP-GLU-ASN-ASN-TRP-ALA-LEU-GLU-GLN-THR-PHE-GLU-GLY-HIS-GLU-HIS-PHE-VAL-MET-CYS-VAL-ALA-PHE-ASN-PRO-LYS-ASP-PRO-SER-THR-PHE-ALA-SER-GLY-CYS-LEU-ASP-ARG-THR-VAL-LYS-VAL-TRP-SER-LEU-GLY-GLN-SER-THR-PRO-ASN-PHE-THR-LEU-THR-THR-GLY-GLN-GLU-ARG-GLY-VAL-ASN-TYR-VAL-ASP-TYR-TYR-PRO-LEU-PRO-ASP-LYS-PRO-TYR-MET-ILE-THR-ALA-SER-ASP-ASP-LEU-THR-ILE-LYS-ILE-TRP-ASP-TYR-GLN-THR-LYS-SER-CYS-VAL-ALA-THR-LEU-GLU-GLY-HIS-MET-SER-ASN-VAL-SER-PHE-ALA-VAL-PHE-HIS-PRO-THR-LEU-PRO-ILE-ILE-ILE-SER-GLY-SER-GLU-ASP-GLY-THR-LEU-LYS-ILE-TRP-ASN-SER-SER-THR-TYR-LYS-VAL-GLU-LYS-THR-LEU-ASN-VAL-GLY-LEU-GLU-ARG-SER-TRP-CYS-ILE-ALA-THR-HIS-PRO-THR-GLY-ARG-LYS-ASN-TYR-ILE-ALA-SER-GLY-PHE-ASP-ASN-GLY-PHE-THR-VAL-LEU-SER-LEU-GLY-ASN-ASP-GLU,CYS-THR-PHE-LYS-THR-LYS-THR-ASN,304,8,SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)[C@H](O)C)CCCC[NH3+])[C@H](O)C)CCCC[NH3+])Cc1ccccc1)[C@H](O)C)[NH3+],Kd=6.8uM,5.167491,5.17,1,A,A,1,A,A,0,,P,A,,1,1,304,8,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)O,0.8851850628852844,0.8195013999938965,95.77830505371094,94.7690658569336,0.3169558644294739,0.5720906853675842,0.9494421482086182,0.9211282134056092,0.8530951142311096,0.7940946817398071,CTFKTKTN,Low,"(5.105, 5.222]",train
2YNS,protein-peptide,Q71VM4,GSGMKETAAAKFERQHMDSPDLGTDDDDKAMADIGSSLPAMIGGVYSDDNNLQLEATTQFRKLLSIERSPPIEEVIQSGVVPRFVQFLTREDFPQLQFEAAWALTNIASGTSENTKVVIDHGAVPIFVKLLGSSSDDVREQAVWALGNVAGDSPKCRDLVLANGALLPLLAQLNEHTKLSMLRNATWTLSNFCRGKPQPSFEQTRPALPALARLIHSNDEEVLTDACWALSYLSDGTNDKIQAVIEAGVCPRLVELLLHPSPSVLIPALRTVGNIVTGDDAQTQCIIDHQALPCLLSLLTQNLKKSIKKEACWTISNITAGNKDQIQAVINAGIIGPLVNLLQTAEFDIKKEAAWAISNATSGGSHDQIKYLVSEGCIKPLCDLLICPDIRIVTVCLEGLENILKVGETDKTLAAGDVNVFSQMIDEAEGLEKIENLQSHDNNEIYEKAVKILEAYWMDEEDDTMGATTVAAPQGATFDFGQGGGAAQFK,SVLGKRKRHPKV,GLY-SER-GLY-MET-LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LYS-ALA-MET-ALA-ASP-ILE-GLY-SER-SER-LEU-PRO-ALA-MET-ILE-GLY-GLY-VAL-TYR-SER-ASP-ASP-ASN-ASN-LEU-GLN-LEU-GLU-ALA-THR-THR-GLN-PHE-ARG-LYS-LEU-LEU-SER-ILE-GLU-ARG-SER-PRO-PRO-ILE-GLU-GLU-VAL-ILE-GLN-SER-GLY-VAL-VAL-PRO-ARG-PHE-VAL-GLN-PHE-LEU-THR-ARG-GLU-ASP-PHE-PRO-GLN-LEU-GLN-PHE-GLU-ALA-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-ASN-THR-LYS-VAL-VAL-ILE-ASP-HIS-GLY-ALA-VAL-PRO-ILE-PHE-VAL-LYS-LEU-LEU-GLY-SER-SER-SER-ASP-ASP-VAL-ARG-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-VAL-ALA-GLY-ASP-SER-PRO-LYS-CYS-ARG-ASP-LEU-VAL-LEU-ALA-ASN-GLY-ALA-LEU-LEU-PRO-LEU-LEU-ALA-GLN-LEU-ASN-GLU-HIS-THR-LYS-LEU-SER-MET-LEU-ARG-ASN-ALA-THR-TRP-THR-LEU-SER-ASN-PHE-CYS-ARG-GLY-LYS-PRO-GLN-PRO-SER-PHE-GLU-GLN-THR-ARG-PRO-ALA-LEU-PRO-ALA-LEU-ALA-ARG-LEU-ILE-HIS-SER-ASN-ASP-GLU-GLU-VAL-LEU-THR-ASP-ALA-CYS-TRP-ALA-LEU-SER-TYR-LEU-SER-ASP-GLY-THR-ASN-ASP-LYS-ILE-GLN-ALA-VAL-ILE-GLU-ALA-GLY-VAL-CYS-PRO-ARG-LEU-VAL-GLU-LEU-LEU-LEU-HIS-PRO-SER-PRO-SER-VAL-LEU-ILE-PRO-ALA-LEU-ARG-THR-VAL-GLY-ASN-ILE-VAL-THR-GLY-ASP-ASP-ALA-GLN-THR-GLN-CYS-ILE-ILE-ASP-HIS-GLN-ALA-LEU-PRO-CYS-LEU-LEU-SER-LEU-LEU-THR-GLN-ASN-LEU-LYS-LYS-SER-ILE-LYS-LYS-GLU-ALA-CYS-TRP-THR-ILE-SER-ASN-ILE-THR-ALA-GLY-ASN-LYS-ASP-GLN-ILE-GLN-ALA-VAL-ILE-ASN-ALA-GLY-ILE-ILE-GLY-PRO-LEU-VAL-ASN-LEU-LEU-GLN-THR-ALA-GLU-PHE-ASP-ILE-LYS-LYS-GLU-ALA-ALA-TRP-ALA-ILE-SER-ASN-ALA-THR-SER-GLY-GLY-SER-HIS-ASP-GLN-ILE-LYS-TYR-LEU-VAL-SER-GLU-GLY-CYS-ILE-LYS-PRO-LEU-CYS-ASP-LEU-LEU-ILE-CYS-PRO-ASP-ILE-ARG-ILE-VAL-THR-VAL-CYS-LEU-GLU-GLY-LEU-GLU-ASN-ILE-LEU-LYS-VAL-GLY-GLU-THR-ASP-LYS-THR-LEU-ALA-ALA-GLY-ASP-VAL-ASN-VAL-PHE-SER-GLN-MET-ILE-ASP-GLU-ALA-GLU-GLY-LEU-GLU-LYS-ILE-GLU-ASN-LEU-GLN-SER-HIS-ASP-ASN-ASN-GLU-ILE-TYR-GLU-LYS-ALA-VAL-LYS-ILE-LEU-GLU-ALA-TYR-TRP-MET-ASP-GLU-GLU-ASP-ASP-THR-MET-GLY-ALA-THR-THR-VAL-ALA-ALA-PRO-GLN-GLY-ALA-THR-PHE-ASP-PHE-GLY-GLN-GLY-GLY-GLY-ALA-ALA-GLN-PHE-LYS,SER-VAL-LEU-GLY-LYS-ARG-LYS-ARG-HIS-PRO-LYS-VAL,490,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1[nH]cnc1)CCC[NH+]=C(N)N)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)[NH3+])CC(C)C,Kd=0.025uM,7.60206,7.6,1,A,A,1,A,A,0,,C,A,,1,1,490,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C,0.8495520353317261,0.7527291774749756,79.81201171875,79.21453094482422,0.4767211377620697,0.9724370837211608,0.8476887345314026,0.816342830657959,0.7703366279602051,0.6883563995361328,SVLGKRKRHPKV,Moderate,"(7.523, 7.921]",train
2YQ6,protein-peptide,O43521 Q07817,GPLGSMSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,WIAQELRLIGDLFNAYYA,GLY-PRO-LEU-GLY-SER-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,TRP-ILE-ALA-GLN-GLU-LEU-ARG-MK8-ILE-GLY-ASP-MK8-PHE-ASN-ALA-TYR-TYR-ALA-NH2,158,19,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@]1(C)CCC/C=C\CCC[C@](C)(NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C)CC(=O)N)Cc1ccccc1)CCC[NH+]=C(N)N)CC(C)C)CCC(=O)O)CCC(=O)N)C)NC(=O)[C@@H]([NH3+])C)C,Kd=45nM,7.346787,7.35,1,A,A,1,A,A,0,,B,A,,1,1,158,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,CCCCC(C)(N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,CCCCC(C)(N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)CC,0.9545356631278992,0.8500104546546936,79.72520446777344,76.44345092773438,0.5080934166908264,0.7361956238746643,0.8222171664237976,0.8566258549690247,0.902388036251068,0.8364894986152649,WIAQELRLIGDLFNAYYA,Moderate,"(7.268, 7.523]",train
2Z5T,protein-peptide,Q7ZUW7 P04637,MAHHHHHHDDDDKIRTLPGEGTQVHPRAPLLQILKVAGAQEEVFTVKEVMHYLGQYIMMKQLYDKQRQHIVHCHDDPLGELLEVGSFSVKNPSPLYEMLKRNLVILNNSDAAKNLSVGKDSNESPSEDPGQVSSGSINSA,SQETFSDLWKLLPEN,MET-ALA-HIS-HIS-HIS-HIS-HIS-HIS-ASP-ASP-ASP-ASP-LYS-ILE-ARG-THR-LEU-PRO-GLY-GLU-GLY-THR-GLN-VAL-HIS-PRO-ARG-ALA-PRO-LEU-LEU-GLN-ILE-LEU-LYS-VAL-ALA-GLY-ALA-GLN-GLU-GLU-VAL-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-MET-LYS-GLN-LEU-TYR-ASP-LYS-GLN-ARG-GLN-HIS-ILE-VAL-HIS-CYS-HIS-ASP-ASP-PRO-LEU-GLY-GLU-LEU-LEU-GLU-VAL-GLY-SER-PHE-SER-VAL-LYS-ASN-PRO-SER-PRO-LEU-TYR-GLU-MET-LEU-LYS-ARG-ASN-LEU-VAL-ILE-LEU-ASN-ASN-SER-ASP-ALA-ALA-LYS-ASN-LEU-SER-VAL-GLY-LYS-ASP-SER-ASN-GLU-SER-PRO-SER-GLU-ASP-PRO-GLY-GLN-VAL-SER-SER-GLY-SER-ILE-ASN-SER-ALA,SER-GLN-GLU-THR-PHE-SER-ASP-LEU-TRP-LYS-LEU-LEU-PRO-GLU-ASN,140,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccccc1)CO)CC(=O)O)CC(C)C,Kd=2.40uM,5.619789,5.62,1,A,A,1,A,A,0,,P,M,dimer,1,1,140,15,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,1.0286705493927002,0.8946755528450012,77.13446044921875,69.33295440673828,0.4894875288009643,0.8035743832588196,0.7382537722587585,0.7391824126243591,0.8674036860466003,0.7549774050712585,SQETFSDLWKLLPEN,Low,"(5.6, 5.699]",train
2Z6W,protein-peptide,P30405,MGNPLVYLDVDANGKPLGRVVLELKADVVPKTAENFRALCTGEKGFGYKGSTFHRVIPSFMCQAGDFTNHNGTGGKSIYGSRFPDENFTLKHVGPGVLSMANAGPNTNGSQFFICTIKTDWLDGKHVVFGHVIEGMDVVKKIESFGSKSGRTSKKIVITDCGQLS,ALLVTAGLVLA,MET-GLY-ASN-PRO-LEU-VAL-TYR-LEU-ASP-VAL-ASP-ALA-ASN-GLY-LYS-PRO-LEU-GLY-ARG-VAL-VAL-LEU-GLU-LEU-LYS-ALA-ASP-VAL-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-ALA-LEU-CYS-THR-GLY-GLU-LYS-GLY-PHE-GLY-TYR-LYS-GLY-SER-THR-PHE-HIS-ARG-VAL-ILE-PRO-SER-PHE-MET-CYS-GLN-ALA-GLY-ASP-PHE-THR-ASN-HIS-ASN-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-SER-ARG-PHE-PRO-ASP-GLU-ASN-PHE-THR-LEU-LYS-HIS-VAL-GLY-PRO-GLY-VAL-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-CYS-THR-ILE-LYS-THR-ASP-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-HIS-VAL-ILE-GLU-GLY-MET-ASP-VAL-VAL-LYS-LYS-ILE-GLU-SER-PHE-GLY-SER-LYS-SER-GLY-ARG-THR-SER-LYS-LYS-ILE-VAL-ILE-THR-ASP-CYS-GLY-GLN-LEU-SER,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,165,11,C/C=C/C[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,Kd=13.4nM,7.872895,7.87,1,A,A,1,A,A,0,,M,A,,1,1,165,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9363343715667723,0.8028032779693604,95.53978729248048,96.38610076904295,0.3118247389793396,0.5569876432418823,0.9550892114639282,0.9023019671440125,0.8925831317901611,0.7779285907745361,ALLVTAGLVLA,Moderate,"(7.523, 7.921]",train
2ZLF,protein-peptide,P21524,MYVYKRDGRKEPVQFDKITARISRLCYGLDPKHIDAVKVTQRIISGVYEGVTTIELDNLAAETCAYMTTVHPDYATLAARIAISNLHKQTTKQFSKVVEDLYRYVNAATGKPAPMISDDVYNIVMENKDKLNSAIVYDRDFQYSYFGFKTLERSYLLRINGQVAERPQHLIMRVALGIHGRDIEAALETYNLMSLKYFTHASPTLFNAGTPKPQMSSCFLVAMKEDSIEGIYDTLKECALISKTAGGIGLHIHNIRSTGSYIAGTNGTSNGLIPMIRVFNNTARYVDQGGNKRPGAFALYLEPWHADIFDFIDIRKNHGKEEIRARDLFPALWIPDLFMKRVEENGTWTLFSPTSAPGLSDCYGDEFEALYTRYEKEGRGKTIKAQKLWYSILEAQTETGTPFVVYKDACNRKSNQKNLGVIKSSNLCCEIVEYSAPDETAVCNLASVALPAFIETSEDGKTSTYNFKKLHEIAKVVTRNLNRVIDRNYYPVEEARKSNMRHRPIALGVQGLADTFMLLRLPFDSEEARLLNIQIFETIYHASMEASCELAQKDGPYETFQGSPASQGILQFDMWDQKPYGMWDWDTLRKDIMKHGVRNSLTMAPMPTASTSQILGYNECFEPVTSNMYSRRVLSGEFQVVNPYLLRDLVDLGIWDEGMKQYLITQNGSIQGLPNVPQELKDLYKTVWEISQKTIINMAADRSVYIDQSHSLNLFLRAPTMGKLTSMHFYGWKKGLKTGMYYLRTQAASAAIQFTIDQKIADQATENVADISNLKRPSYMPSSASYAASDFVPAAVTANATIPSLDSSSEASREASPAPTGSHSLTKGMAELNVQESKVEVPEVPAPTKNEEKAAPIVDDEETEFDIYNSKVIACAIDNPEACEMCSG,FTLDADF,MET-TYR-VAL-TYR-LYS-ARG-ASP-GLY-ARG-LYS-GLU-PRO-VAL-GLN-PHE-ASP-LYS-ILE-THR-ALA-ARG-ILE-SER-ARG-LEU-CYS-TYR-GLY-LEU-ASP-PRO-LYS-HIS-ILE-ASP-ALA-VAL-LYS-VAL-THR-GLN-ARG-ILE-ILE-SER-GLY-VAL-TYR-GLU-GLY-VAL-THR-THR-ILE-GLU-LEU-ASP-ASN-LEU-ALA-ALA-GLU-THR-CYS-ALA-TYR-MET-THR-THR-VAL-HIS-PRO-ASP-TYR-ALA-THR-LEU-ALA-ALA-ARG-ILE-ALA-ILE-SER-ASN-LEU-HIS-LYS-GLN-THR-THR-LYS-GLN-PHE-SER-LYS-VAL-VAL-GLU-ASP-LEU-TYR-ARG-TYR-VAL-ASN-ALA-ALA-THR-GLY-LYS-PRO-ALA-PRO-MET-ILE-SER-ASP-ASP-VAL-TYR-ASN-ILE-VAL-MET-GLU-ASN-LYS-ASP-LYS-LEU-ASN-SER-ALA-ILE-VAL-TYR-ASP-ARG-ASP-PHE-GLN-TYR-SER-TYR-PHE-GLY-PHE-LYS-THR-LEU-GLU-ARG-SER-TYR-LEU-LEU-ARG-ILE-ASN-GLY-GLN-VAL-ALA-GLU-ARG-PRO-GLN-HIS-LEU-ILE-MET-ARG-VAL-ALA-LEU-GLY-ILE-HIS-GLY-ARG-ASP-ILE-GLU-ALA-ALA-LEU-GLU-THR-TYR-ASN-LEU-MET-SER-LEU-LYS-TYR-PHE-THR-HIS-ALA-SER-PRO-THR-LEU-PHE-ASN-ALA-GLY-THR-PRO-LYS-PRO-GLN-MET-SER-SER-CYS-PHE-LEU-VAL-ALA-MET-LYS-GLU-ASP-SER-ILE-GLU-GLY-ILE-TYR-ASP-THR-LEU-LYS-GLU-CYS-ALA-LEU-ILE-SER-LYS-THR-ALA-GLY-GLY-ILE-GLY-LEU-HIS-ILE-HIS-ASN-ILE-ARG-SER-THR-GLY-SER-TYR-ILE-ALA-GLY-THR-ASN-GLY-THR-SER-ASN-GLY-LEU-ILE-PRO-MET-ILE-ARG-VAL-PHE-ASN-ASN-THR-ALA-ARG-TYR-VAL-ASP-GLN-GLY-GLY-ASN-LYS-ARG-PRO-GLY-ALA-PHE-ALA-LEU-TYR-LEU-GLU-PRO-TRP-HIS-ALA-ASP-ILE-PHE-ASP-PHE-ILE-ASP-ILE-ARG-LYS-ASN-HIS-GLY-LYS-GLU-GLU-ILE-ARG-ALA-ARG-ASP-LEU-PHE-PRO-ALA-LEU-TRP-ILE-PRO-ASP-LEU-PHE-MET-LYS-ARG-VAL-GLU-GLU-ASN-GLY-THR-TRP-THR-LEU-PHE-SER-PRO-THR-SER-ALA-PRO-GLY-LEU-SER-ASP-CYS-TYR-GLY-ASP-GLU-PHE-GLU-ALA-LEU-TYR-THR-ARG-TYR-GLU-LYS-GLU-GLY-ARG-GLY-LYS-THR-ILE-LYS-ALA-GLN-LYS-LEU-TRP-TYR-SER-ILE-LEU-GLU-ALA-GLN-THR-GLU-THR-GLY-THR-PRO-PHE-VAL-VAL-TYR-LYS-ASP-ALA-CYS-ASN-ARG-LYS-SER-ASN-GLN-LYS-ASN-LEU-GLY-VAL-ILE-LYS-SER-SER-ASN-LEU-CYS-CYS-GLU-ILE-VAL-GLU-TYR-SER-ALA-PRO-ASP-GLU-THR-ALA-VAL-CYS-ASN-LEU-ALA-SER-VAL-ALA-LEU-PRO-ALA-PHE-ILE-GLU-THR-SER-GLU-ASP-GLY-LYS-THR-SER-THR-TYR-ASN-PHE-LYS-LYS-LEU-HIS-GLU-ILE-ALA-LYS-VAL-VAL-THR-ARG-ASN-LEU-ASN-ARG-VAL-ILE-ASP-ARG-ASN-TYR-TYR-PRO-VAL-GLU-GLU-ALA-ARG-LYS-SER-ASN-MET-ARG-HIS-ARG-PRO-ILE-ALA-LEU-GLY-VAL-GLN-GLY-LEU-ALA-ASP-THR-PHE-MET-LEU-LEU-ARG-LEU-PRO-PHE-ASP-SER-GLU-GLU-ALA-ARG-LEU-LEU-ASN-ILE-GLN-ILE-PHE-GLU-THR-ILE-TYR-HIS-ALA-SER-MET-GLU-ALA-SER-CYS-GLU-LEU-ALA-GLN-LYS-ASP-GLY-PRO-TYR-GLU-THR-PHE-GLN-GLY-SER-PRO-ALA-SER-GLN-GLY-ILE-LEU-GLN-PHE-ASP-MET-TRP-ASP-GLN-LYS-PRO-TYR-GLY-MET-TRP-ASP-TRP-ASP-THR-LEU-ARG-LYS-ASP-ILE-MET-LYS-HIS-GLY-VAL-ARG-ASN-SER-LEU-THR-MET-ALA-PRO-MET-PRO-THR-ALA-SER-THR-SER-GLN-ILE-LEU-GLY-TYR-ASN-GLU-CYS-PHE-GLU-PRO-VAL-THR-SER-ASN-MET-TYR-SER-ARG-ARG-VAL-LEU-SER-GLY-GLU-PHE-GLN-VAL-VAL-ASN-PRO-TYR-LEU-LEU-ARG-ASP-LEU-VAL-ASP-LEU-GLY-ILE-TRP-ASP-GLU-GLY-MET-LYS-GLN-TYR-LEU-ILE-THR-GLN-ASN-GLY-SER-ILE-GLN-GLY-LEU-PRO-ASN-VAL-PRO-GLN-GLU-LEU-LYS-ASP-LEU-TYR-LYS-THR-VAL-TRP-GLU-ILE-SER-GLN-LYS-THR-ILE-ILE-ASN-MET-ALA-ALA-ASP-ARG-SER-VAL-TYR-ILE-ASP-GLN-SER-HIS-SER-LEU-ASN-LEU-PHE-LEU-ARG-ALA-PRO-THR-MET-GLY-LYS-LEU-THR-SER-MET-HIS-PHE-TYR-GLY-TRP-LYS-LYS-GLY-LEU-LYS-THR-GLY-MET-TYR-TYR-LEU-ARG-THR-GLN-ALA-ALA-SER-ALA-ALA-ILE-GLN-PHE-THR-ILE-ASP-GLN-LYS-ILE-ALA-ASP-GLN-ALA-THR-GLU-ASN-VAL-ALA-ASP-ILE-SER-ASN-LEU-LYS-ARG-PRO-SER-TYR-MET-PRO-SER-SER-ALA-SER-TYR-ALA-ALA-SER-ASP-PHE-VAL-PRO-ALA-ALA-VAL-THR-ALA-ASN-ALA-THR-ILE-PRO-SER-LEU-ASP-SER-SER-SER-GLU-ALA-SER-ARG-GLU-ALA-SER-PRO-ALA-PRO-THR-GLY-SER-HIS-SER-LEU-THR-LYS-GLY-MET-ALA-GLU-LEU-ASN-VAL-GLN-GLU-SER-LYS-VAL-GLU-VAL-PRO-GLU-VAL-PRO-ALA-PRO-THR-LYS-ASN-GLU-GLU-LYS-ALA-ALA-PRO-ILE-VAL-ASP-ASP-GLU-GLU-THR-GLU-PHE-ASP-ILE-TYR-ASN-SER-LYS-VAL-ILE-ALA-CYS-ALA-ILE-ASP-ASN-PRO-GLU-ALA-CYS-GLU-MET-CYS-SER-GLY,PHE-THR-LEU-ASP-ALA-ASP-PHE,888,7,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(=O)O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(C)C,IC50=31uM,4.508638,4.51,1,A,A,1,A,A,0,,B,A,,1,1,888,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O,0.6849657893180847,0.6930402517318726,74.09661865234375,74.56816864013672,0.7953259348869324,1.118194818496704,0.8283466100692749,0.8168002963066101,0.5862714052200317,0.6036824584007263,FTLDADF,Low,"(4.456, 4.606]",train
3AL3,protein-peptide,Q9BX63 Q92547,GPLGSLKKQYIFQLSSLNPQERIDYCHLIEKLGGLVIEKQCFDPTCTHIVVGHPLRNEKYLASVAAGKWVLHRSYLEACRTAGHFVQEEDYEWGSSSILDVLTGINVQQRRLALAAMRWRKKIQQRQESGIVEGAFSGWKVILHVDQSREAGFKRLLQSGGAKVLPGHSVPLFKEATHLFSDLNKLKPDDSGVNIAEAAAQNVYCLRTEYIADYLMQESPPHVENYCLPEAISFI,SIYFTPELYD,GLY-PRO-LEU-GLY-SER-LEU-LYS-LYS-GLN-TYR-ILE-PHE-GLN-LEU-SER-SER-LEU-ASN-PRO-GLN-GLU-ARG-ILE-ASP-TYR-CYS-HIS-LEU-ILE-GLU-LYS-LEU-GLY-GLY-LEU-VAL-ILE-GLU-LYS-GLN-CYS-PHE-ASP-PRO-THR-CYS-THR-HIS-ILE-VAL-VAL-GLY-HIS-PRO-LEU-ARG-ASN-GLU-LYS-TYR-LEU-ALA-SER-VAL-ALA-ALA-GLY-LYS-TRP-VAL-LEU-HIS-ARG-SER-TYR-LEU-GLU-ALA-CYS-ARG-THR-ALA-GLY-HIS-PHE-VAL-GLN-GLU-GLU-ASP-TYR-GLU-TRP-GLY-SER-SER-SER-ILE-LEU-ASP-VAL-LEU-THR-GLY-ILE-ASN-VAL-GLN-GLN-ARG-ARG-LEU-ALA-LEU-ALA-ALA-MET-ARG-TRP-ARG-LYS-LYS-ILE-GLN-GLN-ARG-GLN-GLU-SER-GLY-ILE-VAL-GLU-GLY-ALA-PHE-SER-GLY-TRP-LYS-VAL-ILE-LEU-HIS-VAL-ASP-GLN-SER-ARG-GLU-ALA-GLY-PHE-LYS-ARG-LEU-LEU-GLN-SER-GLY-GLY-ALA-LYS-VAL-LEU-PRO-GLY-HIS-SER-VAL-PRO-LEU-PHE-LYS-GLU-ALA-THR-HIS-LEU-PHE-SER-ASP-LEU-ASN-LYS-LEU-LYS-PRO-ASP-ASP-SER-GLY-VAL-ASN-ILE-ALA-GLU-ALA-ALA-ALA-GLN-ASN-VAL-TYR-CYS-LEU-ARG-THR-GLU-TYR-ILE-ALA-ASP-TYR-LEU-MET-GLN-GLU-SER-PRO-PRO-HIS-VAL-GLU-ASN-TYR-CYS-LEU-PRO-GLU-ALA-ILE-SER-PHE-ILE,SER-ILE-TYR-PHE-TPO-PRO-GLU-LEU-TYR-ASP,235,10,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccc(cc1)O)CC(C)C)CCC(=O)O)[C@H](OP(O)(O)O)C)Cc1ccccc1)Cc1ccc(cc1)O)NC(=O)[C@H](CO)[NH3+])C,Kd=2.1uM,5.677781,5.68,1,A,A,1,A,A,0,,B,A,,1,1,235,10,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8861829042434692,0.8043358325958252,88.95565032958984,89.73555755615234,0.3901058435440063,0.6953953504562378,0.9121464490890504,0.8838168382644653,0.8388756513595581,0.7844655513763428,SIYFTPELYD,Low,"(5.6, 5.699]",train
3ASK,protein-peptide,Q96T88 P84243,SLYKVNEYVDARDTNMGAWFEAQVVRVTRKAPSRPALEEDVIYHVKYDDYPENGVVQMNSRDVRARARTIIKWQDLEVGQVVMLNYNPDNPKERGFWYDAEISRKRETRTARELYANVVLGDDSLNDCRIIFVDEVFKIERPGEGSPMVDNPMRRKSGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRNDA,ARTKQTARKSTGG,SER-LEU-TYR-LYS-VAL-ASN-GLU-TYR-VAL-ASP-ALA-ARG-ASP-THR-ASN-MET-GLY-ALA-TRP-PHE-GLU-ALA-GLN-VAL-VAL-ARG-VAL-THR-ARG-LYS-ALA-PRO-SER-ARG-PRO-ALA-LEU-GLU-GLU-ASP-VAL-ILE-TYR-HIS-VAL-LYS-TYR-ASP-ASP-TYR-PRO-GLU-ASN-GLY-VAL-VAL-GLN-MET-ASN-SER-ARG-ASP-VAL-ARG-ALA-ARG-ALA-ARG-THR-ILE-ILE-LYS-TRP-GLN-ASP-LEU-GLU-VAL-GLY-GLN-VAL-VAL-MET-LEU-ASN-TYR-ASN-PRO-ASP-ASN-PRO-LYS-GLU-ARG-GLY-PHE-TRP-TYR-ASP-ALA-GLU-ILE-SER-ARG-LYS-ARG-GLU-THR-ARG-THR-ALA-ARG-GLU-LEU-TYR-ALA-ASN-VAL-VAL-LEU-GLY-ASP-ASP-SER-LEU-ASN-ASP-CYS-ARG-ILE-ILE-PHE-VAL-ASP-GLU-VAL-PHE-LYS-ILE-GLU-ARG-PRO-GLY-GLU-GLY-SER-PRO-MET-VAL-ASP-ASN-PRO-MET-ARG-ARG-LYS-SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY,226,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.37uM,6.431798,6.43,1,A,A,1,A,A,0,,P,A,,1,1,226,13,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.7997753024101257,0.7527410984039307,67.40613555908203,70.72698974609375,0.5624227523803711,0.8153242468833923,0.7543941736221313,0.8103965520858765,0.7745096683502197,0.7355616688728333,ARTKQTARKSTGG,Low,"(6.398, 6.523]",train
3ASL,protein-peptide,Q96T88 P84243,SGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRNDA,ARTKQTARKST,SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR,70,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=1.73uM,5.761954,5.76,1,A,A,1,A,A,0,,B,A,,1,1,70,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.8313798904418945,0.8478184938430786,88.00538635253906,85.82579040527344,0.412291944026947,0.5746281147003174,0.8193309307098389,0.8776243925094604,0.7495155930519104,0.8403670191764832,ARTKQTARKST,Low,"(5.699, 5.821]",train
3AV9,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SAKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-ALA-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50=435uM,3.361511,3.36,1,A,A,1,A,A,0,,X,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,0.7892984747886658,0.708662211894989,82.04047393798828,76.63215637207031,0.5901217460632324,0.8899950385093689,0.7744191884994507,0.7455368041992188,0.6981229782104492,0.6277222037315369,SAKIDNLD,Low,"(2.044, 3.548]",val
3AVA,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,ALKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,ALA-LEU-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50=39.7uM,4.401209,4.4,1,A,A,1,A,A,0,,X,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.816376268863678,0.7787488698959351,81.43962097167969,77.04158020019531,0.5928555727005005,0.927910566329956,0.772603452205658,0.7395616769790649,0.7324241995811462,0.7168243527412415,ALKIDNLD,Low,"(4.319, 4.456]",train
3AVB,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SLKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-LEU-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50=85.2uM,4.06956,4.07,1,A,A,1,A,A,0,,X,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8052456974983215,0.7869434952735901,81.01701354980469,76.36918640136719,0.5804860591888428,0.8277215957641602,0.7773343920707703,0.770514965057373,0.7173282504081726,0.719329297542572,SLKIDNLD,Low,"(3.924, 4.155]",val
3AVF,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQ,DLKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN,ASP-LEU-LYS-ILE-ASP-ASN-LEU-ASP,180,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50=295.0uM,3.530178,3.53,1,A,A,1,A,A,0,,D,A,dimer,1,1,180,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8409890532493591,0.7950752973556519,83.50279998779297,76.63639831542969,0.5718963742256165,0.9419738054275512,0.7750946879386902,0.752419114112854,0.7577285766601562,0.7328226566314697,DLKIDNLD,Low,"(2.044, 3.548]",train
3AVG,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,ADKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,ALA-ASP-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,D,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)O)C(=O)O,0.8284847736358643,0.7551253437995911,81.91690063476562,76.62030029296875,0.5796823501586914,0.9703291058540344,0.7791811227798462,0.7340832352638245,0.745915412902832,0.6886645555496216,ADKIDNLD,Low,"(2.044, 3.548]",train
3AVH,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,ARKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,ALA-ARG-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,E,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.8036611080169678,0.7868847250938416,82.02261352539062,76.76261138916016,0.5851978063583374,0.8484361171722412,0.7752832770347595,0.7723686099052429,0.7158602476119995,0.7187924385070801,ARKIDNLD,Low,"(2.044, 3.548]",train
3AVI,protein-peptide,P03366,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SLKIDNMD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-LEU-LYS-ILE-ASP-ASN-MET-ASP,183,8,CSCC[C@@H]1NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)O)CO)CC(C)C)CCCC[NH3+])[C@H](CC)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,D,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8190429210662842,0.7863331437110901,79.02128601074219,77.25328063964844,0.5888947248458862,0.88081955909729,0.7719755172729492,0.7555798888206482,0.7359144687652588,0.7223001718521118,SLKIDNMD,Low,"(2.044, 3.548]",val
3AVJ,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,ALKIDNMD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,ALA-LEU-LYS-ILE-ASP-ASN-MET-ASP,183,8,CSCC[C@@H]1NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)O)C)CC(C)C)CCCC[NH3+])[C@H](CC)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,D,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCSC)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.8198965191841125,0.777120053768158,79.84599304199219,77.8494873046875,0.5707799792289734,0.9437121152877808,0.7782490253448486,0.7451940774917603,0.7354130744934082,0.7133802175521851,ALKIDNMD,Low,"(2.044, 3.548]",train
3AVK,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SLKIDNED,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-LEU-LYS-ILE-ASP-ASN-GLU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CCC(=O)O,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,D,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8194646835327148,0.7911514043807983,81.484130859375,76.48921966552734,0.5703701376914978,0.8557097315788269,0.7792234420776367,0.7591866254806519,0.7346296906471252,0.7274212837219238,SLKIDNED,Low,"(2.044, 3.548]",train
3AVL,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,ATKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,ALA-THR-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C)[C@H](O)C,IC50=65.8uM,4.181774,4.18,1,A,A,1,A,A,0,,E,A,dimer,0,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.8081508874893188,0.7034024596214294,81.71469116210938,76.76477813720703,0.5912327170372009,0.9800246953964232,0.7745614051818848,0.7220925092697144,0.7216529250144958,0.6270086765289307,ATKIDNLD,Low,"(4.155, 4.319]",train
3AVM,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SRKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-ARG-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,D,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,0.8418081402778625,0.7575755715370178,81.86286926269531,77.1823959350586,0.5450417399406433,0.8288651704788208,0.7862464785575867,0.7708073854446411,0.76080322265625,0.6825463175773621,SRKIDNLD,Low,"(2.044, 3.548]",train
3AVN,protein-peptide,P12497,MGSSHHHHHHSSGLVPRGSHMHGQVDSSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEDGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNHKRKGGIGGYSAGERIVDIIATDIQTKE,SHKIDNLD,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-HIS-GLY-GLN-VAL-ASP-SER-SER-PRO-GLY-ILE-TRP-GLN-LEU-ASP-CYS-THR-HIS-LEU-GLU-GLY-LYS-VAL-ILE-LEU-VAL-ALA-VAL-HIS-VAL-ALA-SER-GLY-TYR-ILE-GLU-ALA-GLU-VAL-ILE-PRO-ALA-GLU-THR-GLY-GLN-GLU-THR-ALA-TYR-PHE-LEU-LEU-LYS-LEU-ALA-GLY-ARG-TRP-PRO-VAL-LYS-THR-VAL-HIS-THR-ASP-ASN-GLY-SER-ASN-PHE-THR-SER-THR-THR-VAL-LYS-ALA-ALA-CYS-TRP-TRP-ALA-GLY-ILE-LYS-GLN-GLU-ASP-GLY-ILE-PRO-TYR-ASN-PRO-GLN-SER-GLN-GLY-VAL-ILE-GLU-SER-MET-ASN-LYS-GLU-LEU-LYS-LYS-ILE-ILE-GLY-GLN-VAL-ARG-ASP-GLN-ALA-GLU-HIS-LEU-LYS-THR-ALA-VAL-GLN-MET-ALA-VAL-PHE-ILE-HIS-ASN-HIS-LYS-ARG-LYS-GLY-GLY-ILE-GLY-GLY-TYR-SER-ALA-GLY-GLU-ARG-ILE-VAL-ASP-ILE-ILE-ALA-THR-ASP-ILE-GLN-THR-LYS-GLU,SER-HIS-LYS-ILE-ASP-ASN-LEU-ASP,183,8,[NH3+]CCCC[C@@H]1NC(=O)[C@H](Cc2nc[nH]c2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)CC(=O)N)CC(C)C,IC50>500uM,3.3,3.3,1,A,A,1,A,A,0,,G,A,dimer,1,1,183,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O,0.7916533946990967,0.8261831402778625,81.603759765625,77.24286651611328,0.5966298580169678,0.782468855381012,0.7721608877182007,0.7922810912132263,0.7016311883926392,0.7629373669624329,SHKIDNLD,Low,"(2.044, 3.548]",val
3AVZ,protein-peptide,P0C6U8,SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICTAEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSNPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDIQTAQAAGTDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFDVVRQCSGVTFQ,SAVAH,SER-GLY-PHE-ARG-LYS-MET-ALA-PHE-PRO-SER-GLY-LYS-VAL-GLU-GLY-CYS-MET-VAL-GLN-VAL-THR-CYS-GLY-THR-THR-THR-LEU-ASN-GLY-LEU-TRP-LEU-ASP-ASP-THR-VAL-TYR-CYS-PRO-ARG-HIS-VAL-ILE-CYS-THR-ALA-GLU-ASP-MET-LEU-ASN-PRO-ASN-TYR-GLU-ASP-LEU-LEU-ILE-ARG-LYS-SER-ASN-HIS-SER-PHE-LEU-VAL-GLN-ALA-GLY-ASN-VAL-GLN-LEU-ARG-VAL-ILE-GLY-HIS-SER-MET-GLN-ASN-CYS-LEU-LEU-ARG-LEU-LYS-VAL-ASP-THR-SER-ASN-PRO-LYS-THR-PRO-LYS-TYR-LYS-PHE-VAL-ARG-ILE-GLN-PRO-GLY-GLN-THR-PHE-SER-VAL-LEU-ALA-CYS-TYR-ASN-GLY-SER-PRO-SER-GLY-VAL-TYR-GLN-CYS-ALA-MET-ARG-PRO-ASN-HIS-THR-ILE-LYS-GLY-SER-PHE-LEU-ASN-GLY-SER-CYS-GLY-SER-VAL-GLY-PHE-ASN-ILE-ASP-TYR-ASP-CYS-VAL-SER-PHE-CYS-TYR-MET-HIS-HIS-MET-GLU-LEU-PRO-THR-GLY-VAL-HIS-ALA-GLY-THR-ASP-LEU-GLU-GLY-LYS-PHE-TYR-GLY-PRO-PHE-VAL-ASP-ILE-GLN-THR-ALA-GLN-ALA-ALA-GLY-THR-ASP-THR-THR-ILE-THR-LEU-ASN-VAL-LEU-ALA-TRP-LEU-TYR-ALA-ALA-VAL-ILE-ASN-GLY-ASP-ARG-TRP-PHE-LEU-ASN-ARG-PHE-THR-THR-THR-LEU-ASN-ASP-PHE-ASN-LEU-VAL-ALA-MET-LYS-TYR-ASN-TYR-GLU-PRO-LEU-THR-GLN-ASP-HIS-VAL-ASP-ILE-LEU-GLY-PRO-LEU-SER-ALA-GLN-THR-GLY-ILE-ALA-VAL-LEU-ASP-MET-CYS-ALA-ALA-LEU-LYS-GLU-LEU-LEU-GLN-ASN-GLY-MET-ASN-GLY-ARG-THR-ILE-LEU-GLY-SER-THR-ILE-LEU-GLU-ASP-GLU-PHE-THR-PRO-PHE-ASP-VAL-VAL-ARG-GLN-CYS-SER-GLY-VAL-THR-PHE-GLN,ACE-SER-ALA-VAL-ALC-HSV,306,6,O=C[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CO)C)CC1CCCCC1,IC50=65nM,7.187087,7.19,1,A,A,1,A,A,0,,B,A,,1,1,306,6,0,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,,CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.8952280879020691,0.9309823513031006,90.57308959960938,91.38152313232422,0.3444032073020935,0.4222569465637207,0.9253869652748108,0.9123863577842712,0.8776401281356812,0.935631275177002,SAVAH,Moderate,"(7.049, 7.268]",train
3AW0,protein-peptide,P0C6U8,SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDTVYCPRHVICTAEDMLNPNYEDLLIRKSNHSFLVQAGNVQLRVIGHSMQNCLLRLKVDTSNPKTPKYKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNHTIKGSFLNGSCGSVGFNIDYDCVSFCYMHHMELPTGVHAGTDLEGKFYGPFVDIQTAQAAGTDTTITLNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDILGPLSAQTGIAVLDMCAALKELLQNGMNGRTILGSTILEDEFTPFDVVRQCSGVTFQ,SAVLH,SER-GLY-PHE-ARG-LYS-MET-ALA-PHE-PRO-SER-GLY-LYS-VAL-GLU-GLY-CYS-MET-VAL-GLN-VAL-THR-CYS-GLY-THR-THR-THR-LEU-ASN-GLY-LEU-TRP-LEU-ASP-ASP-THR-VAL-TYR-CYS-PRO-ARG-HIS-VAL-ILE-CYS-THR-ALA-GLU-ASP-MET-LEU-ASN-PRO-ASN-TYR-GLU-ASP-LEU-LEU-ILE-ARG-LYS-SER-ASN-HIS-SER-PHE-LEU-VAL-GLN-ALA-GLY-ASN-VAL-GLN-LEU-ARG-VAL-ILE-GLY-HIS-SER-MET-GLN-ASN-CYS-LEU-LEU-ARG-LEU-LYS-VAL-ASP-THR-SER-ASN-PRO-LYS-THR-PRO-LYS-TYR-LYS-PHE-VAL-ARG-ILE-GLN-PRO-GLY-GLN-THR-PHE-SER-VAL-LEU-ALA-CYS-TYR-ASN-GLY-SER-PRO-SER-GLY-VAL-TYR-GLN-CYS-ALA-MET-ARG-PRO-ASN-HIS-THR-ILE-LYS-GLY-SER-PHE-LEU-ASN-GLY-SER-CYS-GLY-SER-VAL-GLY-PHE-ASN-ILE-ASP-TYR-ASP-CYS-VAL-SER-PHE-CYS-TYR-MET-HIS-HIS-MET-GLU-LEU-PRO-THR-GLY-VAL-HIS-ALA-GLY-THR-ASP-LEU-GLU-GLY-LYS-PHE-TYR-GLY-PRO-PHE-VAL-ASP-ILE-GLN-THR-ALA-GLN-ALA-ALA-GLY-THR-ASP-THR-THR-ILE-THR-LEU-ASN-VAL-LEU-ALA-TRP-LEU-TYR-ALA-ALA-VAL-ILE-ASN-GLY-ASP-ARG-TRP-PHE-LEU-ASN-ARG-PHE-THR-THR-THR-LEU-ASN-ASP-PHE-ASN-LEU-VAL-ALA-MET-LYS-TYR-ASN-TYR-GLU-PRO-LEU-THR-GLN-ASP-HIS-VAL-ASP-ILE-LEU-GLY-PRO-LEU-SER-ALA-GLN-THR-GLY-ILE-ALA-VAL-LEU-ASP-MET-CYS-ALA-ALA-LEU-LYS-GLU-LEU-LEU-GLN-ASN-GLY-MET-ASN-GLY-ARG-THR-ILE-LEU-GLY-SER-THR-ILE-LEU-GLU-ASP-GLU-PHE-THR-PRO-PHE-ASP-VAL-VAL-ARG-GLN-CYS-SER-GLY-VAL-THR-PHE-GLN,ACE-SER-ALA-VAL-LEU-HSV,306,6,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]cn1)CC(C)C)C(C)C)C)NC(=O)C,IC50=5.7uM,5.244125,5.24,1,A,A,1,A,A,0,,B,A,,1,1,306,6,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.9508078694343568,0.8934476971626282,90.82866668701172,89.80255889892578,0.3529976904392242,0.4764204025268554,0.916025161743164,0.8955690264701843,0.9494552612304688,0.8929173350334167,SAVLH,Low,"(5.222, 5.31]",train
3B95,protein-peptide,Q9H9B1 P68431,HMNFKMEHQNKRSPLHAAAEAGHVDICHMLVQAGANIDTCSEDQRTPLMEAAENNHLEAVKYLIKAGALVDPKDAEGSTCLHLAAKKGHYEVVQYLLSNGQMDVNCQDDGGWTPMIWATEYKHVDLVKLLLSKGSDINIRDNEENICLHWAAFSGCVDIAEILLAAKCDLHAVNIHGDSPLHIAARENRYDCVVLFLSRDSDVTLKNKEGETPLQCASLNSQVWSALQMSKALQDSA,ARTKQTARKSTGGKA,HIS-MET-ASN-PHE-LYS-MET-GLU-HIS-GLN-ASN-LYS-ARG-SER-PRO-LEU-HIS-ALA-ALA-ALA-GLU-ALA-GLY-HIS-VAL-ASP-ILE-CYS-HIS-MET-LEU-VAL-GLN-ALA-GLY-ALA-ASN-ILE-ASP-THR-CYS-SER-GLU-ASP-GLN-ARG-THR-PRO-LEU-MET-GLU-ALA-ALA-GLU-ASN-ASN-HIS-LEU-GLU-ALA-VAL-LYS-TYR-LEU-ILE-LYS-ALA-GLY-ALA-LEU-VAL-ASP-PRO-LYS-ASP-ALA-GLU-GLY-SER-THR-CYS-LEU-HIS-LEU-ALA-ALA-LYS-LYS-GLY-HIS-TYR-GLU-VAL-VAL-GLN-TYR-LEU-LEU-SER-ASN-GLY-GLN-MET-ASP-VAL-ASN-CYS-GLN-ASP-ASP-GLY-GLY-TRP-THR-PRO-MET-ILE-TRP-ALA-THR-GLU-TYR-LYS-HIS-VAL-ASP-LEU-VAL-LYS-LEU-LEU-LEU-SER-LYS-GLY-SER-ASP-ILE-ASN-ILE-ARG-ASP-ASN-GLU-GLU-ASN-ILE-CYS-LEU-HIS-TRP-ALA-ALA-PHE-SER-GLY-CYS-VAL-ASP-ILE-ALA-GLU-ILE-LEU-LEU-ALA-ALA-LYS-CYS-ASP-LEU-HIS-ALA-VAL-ASN-ILE-HIS-GLY-ASP-SER-PRO-LEU-HIS-ILE-ALA-ALA-ARG-GLU-ASN-ARG-TYR-ASP-CYS-VAL-VAL-LEU-PHE-LEU-SER-ARG-ASP-SER-ASP-VAL-THR-LEU-LYS-ASN-LYS-GLU-GLY-GLU-THR-PRO-LEU-GLN-CYS-ALA-SER-LEU-ASN-SER-GLN-VAL-TRP-SER-ALA-LEU-GLN-MET-SER-LYS-ALA-LEU-GLN-ASP-SER-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA,237,15,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CCCC[NH+](C)C,Kd=7uM,5.154902,5.15,1,A,A,1,A,A,0,,P,A,,0,1,237,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.8961918950080872,0.814009428024292,87.4367904663086,89.59213256835938,0.35052689909935,0.7369389533996582,0.9188755750656128,0.8727699518203735,0.8533185720443726,0.7755851149559021,ARTKQTARKSTGGKA,Low,"(5.105, 5.222]",train
3BTR,protein-peptide,P10275 P52293,NQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYF,EAGMTLGARKLKKLG,ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE,GLU-ALA-GLY-MET-THR-LEU-GLY-ALA-ARG-LYS-LEU-LYS-LYS-LEU-GLY,427,15,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)CCCC[NH3+])CCCC[NH3+])CC(C)C)CCCC[NH3+])CCC[NH+]=C(N)N)C)CC(C)C)[C@H](O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])C,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,C,,1,1,427,15,0,CSCC[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8233412504196167,0.7032650113105774,93.20580291748048,92.4047622680664,0.3729288578033447,0.9483680129051208,0.9230669736862184,0.8716978430747986,0.777199387550354,0.6611567735671997,EAGMTLGARKLKKLG,Low,"(5.222, 5.31]",train
3BU6,protein-peptide,P81122 P06213,VFPSSVYVPDEWEVSREKITLLRELGQGSFGMVYEGNARDIIKGEAETRVAVKTVNESASLRERIEFLNEASVMKGFTCHHVVRLLGVVSKGQPTLVVMELMAHGDLKSYLRSLRPEAENNPGRPPPTLQEMIQMAAEIADGMAYLNAKKFVHRDLAARNCMVAHDFTVKIGDFGMTRDIYETDYYRKGGKGLLPVRWMAPESLKDGVFTTSSDMWSFGVVLWEITSLAEQPYQGLSNEQVLKFVMDGGYLDQPDNCPERVTDLMRMCWQFNPNMRPTFLEIVNLLKDDLHPSFPEVSFFHSEENK,AYNPYPEDYGDIEIG,VAL-PHE-PRO-SER-SER-VAL-TYR-VAL-PRO-ASP-GLU-TRP-GLU-VAL-SER-ARG-GLU-LYS-ILE-THR-LEU-LEU-ARG-GLU-LEU-GLY-GLN-GLY-SER-PHE-GLY-MET-VAL-TYR-GLU-GLY-ASN-ALA-ARG-ASP-ILE-ILE-LYS-GLY-GLU-ALA-GLU-THR-ARG-VAL-ALA-VAL-LYS-THR-VAL-ASN-GLU-SER-ALA-SER-LEU-ARG-GLU-ARG-ILE-GLU-PHE-LEU-ASN-GLU-ALA-SER-VAL-MET-LYS-GLY-PHE-THR-CYS-HIS-HIS-VAL-VAL-ARG-LEU-LEU-GLY-VAL-VAL-SER-LYS-GLY-GLN-PRO-THR-LEU-VAL-VAL-MET-GLU-LEU-MET-ALA-HIS-GLY-ASP-LEU-LYS-SER-TYR-LEU-ARG-SER-LEU-ARG-PRO-GLU-ALA-GLU-ASN-ASN-PRO-GLY-ARG-PRO-PRO-PRO-THR-LEU-GLN-GLU-MET-ILE-GLN-MET-ALA-ALA-GLU-ILE-ALA-ASP-GLY-MET-ALA-TYR-LEU-ASN-ALA-LYS-LYS-PHE-VAL-HIS-ARG-ASP-LEU-ALA-ALA-ARG-ASN-CYS-MET-VAL-ALA-HIS-ASP-PHE-THR-VAL-LYS-ILE-GLY-ASP-PHE-GLY-MET-THR-ARG-ASP-ILE-PTR-GLU-THR-ASP-PTR-PTR-ARG-LYS-GLY-GLY-LYS-GLY-LEU-LEU-PRO-VAL-ARG-TRP-MET-ALA-PRO-GLU-SER-LEU-LYS-ASP-GLY-VAL-PHE-THR-THR-SER-SER-ASP-MET-TRP-SER-PHE-GLY-VAL-VAL-LEU-TRP-GLU-ILE-THR-SER-LEU-ALA-GLU-GLN-PRO-TYR-GLN-GLY-LEU-SER-ASN-GLU-GLN-VAL-LEU-LYS-PHE-VAL-MET-ASP-GLY-GLY-TYR-LEU-ASP-GLN-PRO-ASP-ASN-CYS-PRO-GLU-ARG-VAL-THR-ASP-LEU-MET-ARG-MET-CYS-TRP-GLN-PHE-ASN-PRO-ASN-MET-ARG-PRO-THR-PHE-LEU-GLU-ILE-VAL-ASN-LEU-LEU-LYS-ASP-ASP-LEU-HIS-PRO-SER-PHE-PRO-GLU-VAL-SER-PHE-PHE-HIS-SER-GLU-GLU-ASN-LYS,ALA-TYR-ASN-PRO-TYR-PRO-GLU-ASP-PTR-GLY-ASP-ILE-GLU-ILE-GLY,306,15,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](CC)C)CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)N)Cc1ccc(cc1)O)CCC(=O)O)CC(=O)O)Cc1ccc(cc1)OP(O)(O)O)C,Kd=1.3uM,5.886057,5.89,1,A,A,1,A,A,0,,B,A,,0,1,306,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)N)[C@@H](C)CC)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9111048579216005,0.8026617169380188,87.28019714355469,82.66926574707031,0.4283123016357422,0.7765653133392334,0.9179233312606812,0.8896472454071045,0.8801946043968201,0.7809153199195862,AYNPYPEDYGDIEIG,Low,"(5.821, 5.959]",val
3BUM,protein-peptide,O43597 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,IRNTNEYTEGPTV,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,ILE-ARG-ASN-THR-ASN-GLU-PTR-THR-GLU-GLY-PRO-THR-VAL,329,13,OC(=O)CC[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(=O)N)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O,Kd=0.32uM,6.49485,6.49,1,A,A,1,A,A,0,,A,B,,1,1,329,13,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(=O)O,0.8604521155357361,0.8401764035224915,84.06887817382812,78.4159164428711,0.4053171277046203,0.7553308606147766,0.8963769674301147,0.8444666862487793,0.7911638617515564,0.7916114330291748,IRNTNEYTEGPTV,Low,"(6.398, 6.523]",train
3BUN,protein-peptide,Q9C004 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,SHVENDYIDNPSL,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,SER-HIS-VAL-GLU-ASN-ASP-PTR-ILE-ASP-ASN-PRO-SER-LEU,329,13,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(=O)N)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(=O)O)Cc1ccc(cc1)OP(O)(O)O)C,Kd=0.61uM,6.21467,6.21,1,A,A,1,A,A,0,,A,B,,1,1,329,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8002601861953735,0.8824045658111572,80.89253234863281,79.33956909179688,0.4902854561805725,0.6388938426971436,0.856515109539032,0.8700476884841919,0.7167519330978394,0.8437004685401917,SHVENDYIDNPSL,Low,"(6.097, 6.26]",train
3BUO,protein-peptide,P22681 P00533,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,DSFLQRYSSDPTG,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,ASP-SER-PHE-LEU-GLN-ARG-PTR-SER-SER-ASP-PRO-THR-GLY,329,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(=O)O)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1ccccc1)CC(C)C)CCC(=O)N)CCC[NH+]=C(N)N)Cc1ccc(cc1)OP(O)(O)O,Kd=0.88uM,6.055517,6.06,1,A,A,1,A,A,0,,A,B,,1,1,329,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O,0.785853385925293,0.8193944096565247,80.7174301147461,80.92547607421875,0.4948309659957886,0.6899277567863464,0.8600301742553711,0.8751017451286316,0.6978646516799927,0.8054675459861755,DSFLQRYSSDPTG,Low,"(5.959, 6.097]",train
3BUW,protein-peptide,P43405 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,TVSFNPYEPELAP,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,THR-VAL-SER-PHE-ASN-PRO-PTR-GLU-PRO-GLU-LEU-ALA-PRO,329,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC(=O)O)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O)CC(=O)N)Cc1ccccc1)[NH3+],Kd=1.49uM,5.826814,5.83,1,A,A,1,A,A,0,,A,B,,1,1,329,13,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.7807347178459167,0.829537034034729,82.39573669433594,79.45887756347656,0.4567476809024811,0.7097774744033813,0.8766908049583435,0.8468265533447266,0.6873012185096741,0.7777222990989685,TVSFNPYEPELAP,Low,"(5.821, 5.959]",train
3BUX,protein-peptide,P08581 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,SNESVDYRATFPE,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,SER-ASN-GLU-SER-VAL-ASP-PTR-ARG-ALA-THR-PHE-PRO-GLU,329,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)Cc1ccc(cc1)OP(O)(O)O)CC(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC(=O)O,Kd=2.36uM,5.627088,5.63,1,A,A,1,A,A,0,,A,B,,1,1,329,13,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.7035022377967834,0.810916543006897,80.73917388916016,79.61870574951172,0.4729299247264862,0.6923437714576721,0.8788468241691589,0.8709773421287537,0.6030140519142151,0.7959012985229492,SNESVDYRATFPE,Low,"(5.6, 5.699]",val
3BZI,protein-peptide,P53350 P30307,ETGEVVDCHLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSRSASNRLKAS,LLCSTPNGL,GLU-THR-GLY-GLU-VAL-VAL-ASP-CYS-HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG-SER-ALA-SER-ASN-ARG-LEU-LYS-ALA-SER,LEU-LEU-CYS-SER-TPO-PRO-ASN-GLY-LEU,239,9,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(=O)N)[C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CS,Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,E,A,,0,1,239,9,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@@H]1CCCN1)C(C)OP(=O)(O)O)C(=O)O,0.8528648018836975,0.9063846468925476,84.80789947509766,89.44073486328125,0.4186045527458191,0.4999704658985138,0.9112263917922974,0.9141572713851928,0.815592885017395,0.9044414758682252,LLCSTPNGL,Low,"(5.699, 5.821]",train
3C3O,protein-peptide,Q9BY43 Q8WUM4,MHHHHHHHHHHSGQNLYFQGHMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQKKFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMV,DEEALKQLAEWVS,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLY-GLN-ASN-LEU-TYR-PHE-GLN-GLY-HIS-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-LYS-LYS-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL,ASP-GLU-GLU-ALA-LEU-LYS-GLN-LEU-ALA-GLU-TRP-VAL-SER,380,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)C(C)C)Cc1c[nH]c2c1cccc2)CCC(=O)O)C)CC(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)CCC(=O)O)C)CC(C)C,Kd=44uM,4.356547,4.36,1,A,A,1,A,A,0,,B,A,,1,1,380,13,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)C(C)C)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9417251348495485,0.7525855302810669,87.3792495727539,82.68583679199219,0.4520227015018463,0.7959820032119751,0.8859847784042358,0.848141074180603,0.9143115282058716,0.7040256261825562,DEEALKQLAEWVS,Low,"(4.319, 4.456]",train
3C3Q,protein-peptide,Q9H444 Q8WUM4,MHHHHHHHHHHSGQNLYFQGHMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQKKFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMV,KEEEDDDMKELENWAGSM,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLY-GLN-ASN-LEU-TYR-PHE-GLN-GLY-HIS-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-LYS-LYS-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL,LYS-GLU-GLU-GLU-ASP-ASP-ASP-MET-LYS-GLU-LEU-GLU-ASN-TRP-ALA-GLY-SER-MET,380,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCSC)CO)C)Cc1c[nH]c2c1cccc2)CC(=O)N)CCC(=O)O)CC(C)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)O)CC(=O)O)CC(=O)O)CCSC,Kd=48uM,4.318759,4.32,1,A,A,1,A,A,0,,B,A,,1,1,380,18,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCSC)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCSC)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9173955917358398,0.7410926222801208,86.67912292480469,82.17936706542969,0.464585393667221,0.9091401100158693,0.8830885291099548,0.8366871476173401,0.8741506934165955,0.6941676735877991,KEEEDDDMKELENWAGSM,Low,"(4.155, 4.319]",val
3C3R,protein-peptide,Q8WUM4 Q96CF2,MHHHHHHHHHHSGQNLYFQGHMATFISVQLKKTSEVDLAKPLVKFIQQTYPSGGEEQAQYCRAAEELSKLRRAAVGRPLDKHEGALETLLRYYDQICSIEPKFPFSENQICLTFTWKDAFDKGSLFGGSVKLALASLGYEKSCVLFNCAALASQIAAEQNLDNDEGLKIAAKHYQFASGAFLHIKETVLSALSREPTVDISPDTVGTLSLIMLAQAQEVFFLKATRDKMKDAIIAKLANQAADYFGDAFKQCQYKDTLPKEVFPVLAAKHCIMQANAEYHQSILAKQQKKFGEEIARLQHAAELIKTVASRYDEYVNVKDFSDKINRALAAAKKDNDFIYHDRVPDLKDLDPIGKATLVKSTPVNVPISQKFTDLFEKMV,EDDDIKQLAAWAT,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-HIS-SER-GLY-GLN-ASN-LEU-TYR-PHE-GLN-GLY-HIS-MET-ALA-THR-PHE-ILE-SER-VAL-GLN-LEU-LYS-LYS-THR-SER-GLU-VAL-ASP-LEU-ALA-LYS-PRO-LEU-VAL-LYS-PHE-ILE-GLN-GLN-THR-TYR-PRO-SER-GLY-GLY-GLU-GLU-GLN-ALA-GLN-TYR-CYS-ARG-ALA-ALA-GLU-GLU-LEU-SER-LYS-LEU-ARG-ARG-ALA-ALA-VAL-GLY-ARG-PRO-LEU-ASP-LYS-HIS-GLU-GLY-ALA-LEU-GLU-THR-LEU-LEU-ARG-TYR-TYR-ASP-GLN-ILE-CYS-SER-ILE-GLU-PRO-LYS-PHE-PRO-PHE-SER-GLU-ASN-GLN-ILE-CYS-LEU-THR-PHE-THR-TRP-LYS-ASP-ALA-PHE-ASP-LYS-GLY-SER-LEU-PHE-GLY-GLY-SER-VAL-LYS-LEU-ALA-LEU-ALA-SER-LEU-GLY-TYR-GLU-LYS-SER-CYS-VAL-LEU-PHE-ASN-CYS-ALA-ALA-LEU-ALA-SER-GLN-ILE-ALA-ALA-GLU-GLN-ASN-LEU-ASP-ASN-ASP-GLU-GLY-LEU-LYS-ILE-ALA-ALA-LYS-HIS-TYR-GLN-PHE-ALA-SER-GLY-ALA-PHE-LEU-HIS-ILE-LYS-GLU-THR-VAL-LEU-SER-ALA-LEU-SER-ARG-GLU-PRO-THR-VAL-ASP-ILE-SER-PRO-ASP-THR-VAL-GLY-THR-LEU-SER-LEU-ILE-MET-LEU-ALA-GLN-ALA-GLN-GLU-VAL-PHE-PHE-LEU-LYS-ALA-THR-ARG-ASP-LYS-MET-LYS-ASP-ALA-ILE-ILE-ALA-LYS-LEU-ALA-ASN-GLN-ALA-ALA-ASP-TYR-PHE-GLY-ASP-ALA-PHE-LYS-GLN-CYS-GLN-TYR-LYS-ASP-THR-LEU-PRO-LYS-GLU-VAL-PHE-PRO-VAL-LEU-ALA-ALA-LYS-HIS-CYS-ILE-MET-GLN-ALA-ASN-ALA-GLU-TYR-HIS-GLN-SER-ILE-LEU-ALA-LYS-GLN-GLN-LYS-LYS-PHE-GLY-GLU-GLU-ILE-ALA-ARG-LEU-GLN-HIS-ALA-ALA-GLU-LEU-ILE-LYS-THR-VAL-ALA-SER-ARG-TYR-ASP-GLU-TYR-VAL-ASN-VAL-LYS-ASP-PHE-SER-ASP-LYS-ILE-ASN-ARG-ALA-LEU-ALA-ALA-ALA-LYS-LYS-ASP-ASN-ASP-PHE-ILE-TYR-HIS-ASP-ARG-VAL-PRO-ASP-LEU-LYS-ASP-LEU-ASP-PRO-ILE-GLY-LYS-ALA-THR-LEU-VAL-LYS-SER-THR-PRO-VAL-ASN-VAL-PRO-ILE-SER-GLN-LYS-PHE-THR-ASP-LEU-PHE-GLU-LYS-MET-VAL,GLU-ASP-ASP-ASP-ILE-LYS-GLN-LEU-ALA-ALA-TRP-ALA-THR,380,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C)Cc1c[nH]c2c1cccc2)C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(=O)O)CC(=O)O)CC(=O)O,Kd=41uM,4.387216,4.39,1,A,A,1,A,A,0,,B,A,,1,1,380,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9264687299728394,0.7438694834709167,87.3919448852539,82.9088134765625,0.4495502412319183,0.7895256876945496,0.8870900273323059,0.8494799733161926,0.891784131526947,0.6895062923431396,EDDDIKQLAAWAT,Low,"(4.319, 4.456]",train
3CFS,protein-peptide,Q16576 P62805,HMAMASKEMFEDTVEERVINEEYKIWKKNTPFLYDLVMTHALQWPSLTVQWLPEVTKPEGKDYALHWLVLGTHTSDEQNHLVVARVHIPNDDAQFDASHCDSDKGEFGGFGSVTGKIECEIKINHEGEVNRARYMPQNPHIIATKTPSSDVLVFDYTKHPAKPDPSGECNPDLRLRGHQKEGYGLSWNSNLSGHLLSASDDHTVCLWDINAGPKEGKIVDAKAIFTGHSAVVEDVAWHLLHESLFGSVADDQKLMIWDTRSNTTSKPSHLVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHTFESHKDEIFQVHWSPHNETILASSGTDRRLNVWDLSKIGEEQSAEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQIWQMAENIYNDE,QGITKPAIRRLARRG,HIS-MSE-ALA-MSE-ALA-SER-LYS-GLU-MSE-PHE-GLU-ASP-THR-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MET-THR-HIS-ALA-LEU-GLN-TRP-PRO-SER-LEU-THR-VAL-GLN-TRP-LEU-PRO-GLU-VAL-THR-LYS-PRO-GLU-GLY-LYS-ASP-TYR-ALA-LEU-HIS-TRP-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-VAL-ALA-ARG-VAL-HIS-ILE-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-CYS-ASP-SER-ASP-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-THR-GLY-LYS-ILE-GLU-CYS-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MET-PRO-GLN-ASN-PRO-HIS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-ALA-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-SER-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-VAL-CYS-LEU-TRP-ASP-ILE-ASN-ALA-GLY-PRO-LYS-GLU-GLY-LYS-ILE-VAL-ASP-ALA-LYS-ALA-ILE-PHE-THR-GLY-HIS-SER-ALA-VAL-VAL-GLU-ASP-VAL-ALA-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MET-ILE-TRP-ASP-THR-ARG-SER-ASN-THR-THR-SER-LYS-PRO-SER-HIS-LEU-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-THR-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-HIS-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-ALA-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MET-GLN-ILE-TRP-GLN-MET-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU,GLN-GLY-ILE-THR-LYS-PRO-ALA-ILE-ARG-ARG-LEU-ALA-ARG-ARG-GLY,414,15,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](CC)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)CNC(=O)[C@H](CCC(=O)N)[NH3+],Kd=1.1uM,5.958607,5.96,1,A,A,1,A,A,0,,E,B,,1,1,414,15,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.8700581192970276,0.6010022759437561,86.49242401123047,85.48395538330078,0.4853673577308655,1.18647301197052,0.8994783759117126,0.8214329481124878,0.8277379870414734,0.5307980179786682,QGITKPAIRRLARRG,Low,"(5.821, 5.959]",train
3CFV,protein-peptide,Q16576 P62805,HMAMASKEMFEDTVEERVINEEYKIWKKNTPFLYDLVMTHALQWPSLTVQWLPEVTKPEGKDYALHWLVLGTHTSDEQNHLVVARVHIPNDDAQFDASHCDSDKGEFGGFGSVTGKIECEIKINHEGEVNRARYMPQNPHIIATKTPSSDVLVFDYTKHPAKPDPSGECNPDLRLRGHQKEGYGLSWNSNLSGHLLSASDDHTVCLWDINAGPKEGKIVDAKAIFTGHSAVVEDVAWHLLHESLFGSVADDQKLMIWDTRSNTTSKPSHLVDAHTAEVNCLSFNPYSEFILATGSADKTVALWDLRNLKLKLHTFESHKDEIFQVHWSPHNETILASSGTDRRLNVWDLSKIGEEQSAEDAEDGPPELLFIHGGHTAKISDFSWNPNEPWVICSVSEDNIMQIWQMAENIYNDE,DNIQGITKPAIRRLARRG,HIS-MSE-ALA-MSE-ALA-SER-LYS-GLU-MSE-PHE-GLU-ASP-THR-VAL-GLU-GLU-ARG-VAL-ILE-ASN-GLU-GLU-TYR-LYS-ILE-TRP-LYS-LYS-ASN-THR-PRO-PHE-LEU-TYR-ASP-LEU-VAL-MSE-THR-HIS-ALA-LEU-GLN-TRP-PRO-SER-LEU-THR-VAL-GLN-TRP-LEU-PRO-GLU-VAL-THR-LYS-PRO-GLU-GLY-LYS-ASP-TYR-ALA-LEU-HIS-TRP-LEU-VAL-LEU-GLY-THR-HIS-THR-SER-ASP-GLU-GLN-ASN-HIS-LEU-VAL-VAL-ALA-ARG-VAL-HIS-ILE-PRO-ASN-ASP-ASP-ALA-GLN-PHE-ASP-ALA-SER-HIS-CYS-ASP-SER-ASP-LYS-GLY-GLU-PHE-GLY-GLY-PHE-GLY-SER-VAL-THR-GLY-LYS-ILE-GLU-CYS-GLU-ILE-LYS-ILE-ASN-HIS-GLU-GLY-GLU-VAL-ASN-ARG-ALA-ARG-TYR-MSE-PRO-GLN-ASN-PRO-HIS-ILE-ILE-ALA-THR-LYS-THR-PRO-SER-SER-ASP-VAL-LEU-VAL-PHE-ASP-TYR-THR-LYS-HIS-PRO-ALA-LYS-PRO-ASP-PRO-SER-GLY-GLU-CYS-ASN-PRO-ASP-LEU-ARG-LEU-ARG-GLY-HIS-GLN-LYS-GLU-GLY-TYR-GLY-LEU-SER-TRP-ASN-SER-ASN-LEU-SER-GLY-HIS-LEU-LEU-SER-ALA-SER-ASP-ASP-HIS-THR-VAL-CYS-LEU-TRP-ASP-ILE-ASN-ALA-GLY-PRO-LYS-GLU-GLY-LYS-ILE-VAL-ASP-ALA-LYS-ALA-ILE-PHE-THR-GLY-HIS-SER-ALA-VAL-VAL-GLU-ASP-VAL-ALA-TRP-HIS-LEU-LEU-HIS-GLU-SER-LEU-PHE-GLY-SER-VAL-ALA-ASP-ASP-GLN-LYS-LEU-MSE-ILE-TRP-ASP-THR-ARG-SER-ASN-THR-THR-SER-LYS-PRO-SER-HIS-LEU-VAL-ASP-ALA-HIS-THR-ALA-GLU-VAL-ASN-CYS-LEU-SER-PHE-ASN-PRO-TYR-SER-GLU-PHE-ILE-LEU-ALA-THR-GLY-SER-ALA-ASP-LYS-THR-VAL-ALA-LEU-TRP-ASP-LEU-ARG-ASN-LEU-LYS-LEU-LYS-LEU-HIS-THR-PHE-GLU-SER-HIS-LYS-ASP-GLU-ILE-PHE-GLN-VAL-HIS-TRP-SER-PRO-HIS-ASN-GLU-THR-ILE-LEU-ALA-SER-SER-GLY-THR-ASP-ARG-ARG-LEU-ASN-VAL-TRP-ASP-LEU-SER-LYS-ILE-GLY-GLU-GLU-GLN-SER-ALA-GLU-ASP-ALA-GLU-ASP-GLY-PRO-PRO-GLU-LEU-LEU-PHE-ILE-HIS-GLY-GLY-HIS-THR-ALA-LYS-ILE-SER-ASP-PHE-SER-TRP-ASN-PRO-ASN-GLU-PRO-TRP-VAL-ILE-CYS-SER-VAL-SER-GLU-ASP-ASN-ILE-MSE-GLN-ILE-TRP-GLN-MSE-ALA-GLU-ASN-ILE-TYR-ASN-ASP-GLU,ASP-ASN-ILE-GLN-GLY-ILE-THR-LYS-PRO-ALA-ILE-ARG-ARG-LEU-ALA-ARG-ARG-GLY,414,18,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)[C@H](CC)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(=O)N)CCC(=O)N,Kd=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,E,A,,0,1,414,18,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8136070966720581,0.5889291167259216,84.7850112915039,84.88046264648438,0.5247845649719238,1.2506171464920044,0.8938220739364624,0.8103263974189758,0.754490852355957,0.5199928283691406,DNIQGITKPAIRRLARRG,Low,"(5.959, 6.097]",train
3CS8,protein-peptide,P37231 Q9UBK2,RGGSPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDL,PSLLKKLLLAPA,ARG-GLY-GLY-SER-PRO-GLU-SER-ALA-ASP-LEU-ARG-ALA-LEU-ALA-LYS-HIS-LEU-TYR-ASP-SER-TYR-ILE-LYS-SER-PHE-PRO-LEU-THR-LYS-ALA-LYS-ALA-ARG-ALA-ILE-LEU-THR-GLY-LYS-THR-THR-ASP-LYS-SER-PRO-PHE-VAL-ILE-TYR-ASP-MET-ASN-SER-LEU-MET-MET-GLY-GLU-ASP-LYS-ILE-LYS-PHE-LYS-HIS-ILE-THR-PRO-LEU-GLN-GLU-GLN-SER-LYS-GLU-VAL-ALA-ILE-ARG-ILE-PHE-GLN-GLY-CYS-GLN-PHE-ARG-SER-VAL-GLU-ALA-VAL-GLN-GLU-ILE-THR-GLU-TYR-ALA-LYS-SER-ILE-PRO-GLY-PHE-VAL-ASN-LEU-ASP-LEU-ASN-ASP-GLN-VAL-THR-LEU-LEU-LYS-TYR-GLY-VAL-HIS-GLU-ILE-ILE-TYR-THR-MET-LEU-ALA-SER-LEU-MET-ASN-LYS-ASP-GLY-VAL-LEU-ILE-SER-GLU-GLY-GLN-GLY-PHE-MET-THR-ARG-GLU-PHE-LEU-LYS-SER-LEU-ARG-LYS-PRO-PHE-GLY-ASP-PHE-MET-GLU-PRO-LYS-PHE-GLU-PHE-ALA-VAL-LYS-PHE-ASN-ALA-LEU-GLU-LEU-ASP-ASP-SER-ASP-LEU-ALA-ILE-PHE-ILE-ALA-VAL-ILE-ILE-LEU-SER-GLY-ASP-ARG-PRO-GLY-LEU-LEU-ASN-VAL-LYS-PRO-ILE-GLU-ASP-ILE-GLN-ASP-ASN-LEU-LEU-GLN-ALA-LEU-GLU-LEU-GLN-LEU-LYS-LEU-ASN-HIS-PRO-GLU-SER-SER-GLN-LEU-PHE-ALA-LYS-LEU-LEU-GLN-LYS-MET-THR-ASP-LEU-ARG-GLN-ILE-VAL-THR-GLU-HIS-VAL-GLN-LEU-LEU-GLN-VAL-ILE-LYS-LYS-THR-GLU-THR-ASP-MET-SER-LEU-HIS-PRO-LEU-LEU-GLN-GLU-ILE-TYR-LYS-ASP-LEU,PRO-SER-LEU-LEU-LYS-LYS-LEU-LEU-LEU-ALA-PRO-ALA,275,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C=O)C)C)CC(C)C)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CO)CC(C)C)CC(C)C)CCCC[NH3+],IC50=1.7uM,5.769551,5.77,1,A,A,1,A,A,0,,B,A,,1,1,275,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,0.9317023158073424,0.8100800514221191,88.11880493164062,82.3956527709961,0.4102994799613952,0.7525594830513,0.916326642036438,0.8801113367080688,0.9094138145446776,0.7925722002983093,PSLLKKLLLAPA,Low,"(5.699, 5.821]",train
3CYY,protein-peptide,Q07157 P08050,AKPTKVTLVKSAKNEEYGLRLASHIFVKEISQDSLAARDGNIQEGDVVLKINGTVTENMSLTDAKTLIERSKGKLKMVVQRDERATLLNVPD,RPRPDDLEI,ALA-LYS-PRO-THR-LYS-VAL-THR-LEU-VAL-LYS-SER-ALA-LYS-ASN-GLU-GLU-TYR-GLY-LEU-ARG-LEU-ALA-SER-HIS-ILE-PHE-VAL-LYS-GLU-ILE-SER-GLN-ASP-SER-LEU-ALA-ALA-ARG-ASP-GLY-ASN-ILE-GLN-GLU-GLY-ASP-VAL-VAL-LEU-LYS-ILE-ASN-GLY-THR-VAL-THR-GLU-ASN-MET-SER-LEU-THR-ASP-ALA-LYS-THR-LEU-ILE-GLU-ARG-SER-LYS-GLY-LYS-LEU-LYS-MET-VAL-VAL-GLN-ARG-ASP-GLU-ARG-ALA-THR-LEU-LEU-ASN-VAL-PRO-ASP,ARG-PRO-ARG-PRO-ASP-ASP-LEU-GLU-ILE,92,9,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)CC(=O)O)CC(=O)O)CC(C)C)CCC(=O)O)C,Kd=16.8uM,4.774691,4.77,1,A,A,1,A,A,0,,C,A,dimer,1,1,92,9,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O,0.7894420027732849,1.0217645168304443,83.93869018554688,84.33435821533203,0.5479771494865417,0.630500078201294,0.7123310565948486,0.787207841873169,0.6230761408805847,0.7950775027275085,RPRPDDLEI,Low,"(4.745, 4.866]",train
3D1E,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,TLMTGQLGLF,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,THR-LEU-MET-THR-GLY-GLN-LEU-GLY-LEU-PHE,366,10,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CC(C)C)CC(C)C)CCC(=O)N,Kd=1.7uM,5.769551,5.77,1,A,A,1,A,A,0,,P,A,,1,1,366,10,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8717231154441833,0.845541775226593,89.70096588134766,88.1048583984375,0.4050934612751007,0.5982832908630371,0.8984082937240601,0.8911170363426208,0.8484295010566711,0.8341479301452637,TLMTGQLGLF,Low,"(5.699, 5.821]",val
3D1F,protein-peptide,P0A988,MKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,SEQVELEFD,MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,SER-GLU-GLN-VAL-GLU-LEU-GLU-PHE-ASP,366,9,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)Cc1ccccc1)CCC(=O)O)CC(C)C)CCC(=O)O)C(C)C)CCC(=O)N)CCC(=O)O)[NH3+],Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,P,A,,1,1,366,9,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)C(C)C)C(=O)O,0.919404685497284,0.9107653498649596,90.74331665039062,88.12149047851562,0.3889563977718353,0.5093873739242554,0.9006489515304565,0.9110519289970398,0.9090936183929444,0.9106937050819396,SEQVELEFD,Low,"(5.699, 5.821]",train
3D9O,protein-peptide,Q9UPN6 P24928,MEAVKTFNSELYSLMDMKPPISKAKMTQITKAAIKAIKFYKHVVQSVEKFIQKCKPEYKVPGLYVIDSIVRQSRHQFGQEKDVFAPRFSNNIISTFQNLYRCPGDDKSKIVRVLNLWQKNNVFKSEIIQPLLDMAAALEHHHHHH,YSPTSPSYSPTSPS,MSE-GLU-ALA-VAL-LYS-THR-PHE-ASN-SER-GLU-LEU-TYR-SER-LEU-MSE-ASP-MSE-LYS-PRO-PRO-ILE-SER-LYS-ALA-LYS-MSE-THR-GLN-ILE-THR-LYS-ALA-ALA-ILE-LYS-ALA-ILE-LYS-PHE-TYR-LYS-HIS-VAL-VAL-GLN-SER-VAL-GLU-LYS-PHE-ILE-GLN-LYS-CYS-LYS-PRO-GLU-TYR-LYS-VAL-PRO-GLY-LEU-TYR-VAL-ILE-ASP-SER-ILE-VAL-ARG-GLN-SER-ARG-HIS-GLN-PHE-GLY-GLN-GLU-LYS-ASP-VAL-PHE-ALA-PRO-ARG-PHE-SER-ASN-ASN-ILE-ILE-SER-THR-PHE-GLN-ASN-LEU-TYR-ARG-CYS-PRO-GLY-ASP-ASP-LYS-SER-LYS-ILE-VAL-ARG-VAL-LEU-ASN-LEU-TRP-GLN-LYS-ASN-ASN-VAL-PHE-LYS-SER-GLU-ILE-ILE-GLN-PRO-LEU-LEU-ASP-MSE-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,TYR-SER-PRO-THR-SER-PRO-SER-TYR-SER-PRO-THR-SER-PRO-SER,145,14,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C=O)CO)CO)[C@H](O)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CO,Kd=1mM,3.0,3.0,1,A,A,1,A,A,0,,Z,A,,0,1,145,14,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,0.9204705953598022,0.7817195653915405,92.6378402709961,91.24897003173828,0.3255389034748077,0.6626667380332947,0.9358947277069092,0.8702711462974548,0.8615830540657043,0.7595816850662231,YSPTSPSYSPTSPS,Low,"(2.044, 3.548]",train
3D9P,protein-peptide,Q9UPN6 P24928,MEAVKTFNSELYSLNDYKPPISKAKMTQITKAAIKAIKFYKHVVQSVEKFIQKCKPEYKVPGLYVIDSIVRQSRHQFGQEKDVFAPRFSNNIISTFQNLYRCPGDDKSKIVTVLNLWQKNNVFKSEIIQPLLDMAAALEHHHHHH,YSPTSPSYSPTSPS,MET-GLU-ALA-VAL-LYS-THR-PHE-ASN-SER-GLU-LEU-TYR-SER-LEU-ASN-ASP-TYR-LYS-PRO-PRO-ILE-SER-LYS-ALA-LYS-MET-THR-GLN-ILE-THR-LYS-ALA-ALA-ILE-LYS-ALA-ILE-LYS-PHE-TYR-LYS-HIS-VAL-VAL-GLN-SER-VAL-GLU-LYS-PHE-ILE-GLN-LYS-CYS-LYS-PRO-GLU-TYR-LYS-VAL-PRO-GLY-LEU-TYR-VAL-ILE-ASP-SER-ILE-VAL-ARG-GLN-SER-ARG-HIS-GLN-PHE-GLY-GLN-GLU-LYS-ASP-VAL-PHE-ALA-PRO-ARG-PHE-SER-ASN-ASN-ILE-ILE-SER-THR-PHE-GLN-ASN-LEU-TYR-ARG-CYS-PRO-GLY-ASP-ASP-LYS-SER-LYS-ILE-VAL-THR-VAL-LEU-ASN-LEU-TRP-GLN-LYS-ASN-ASN-VAL-PHE-LYS-SER-GLU-ILE-ILE-GLN-PRO-LEU-LEU-ASP-MET-ALA-ALA-ALA-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,TYR-SEP-PRO-THR-SEP-PRO-SER-TYR-SEP-PRO-THR-SEP-PRO-SER,145,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C=O)COP(O)(O)O)[C@H](O)C)COP(O)(O)O)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCC[NH2+]1,Kd=29uM,4.537602,4.54,1,A,A,1,A,A,0,,Y,A,,1,1,145,14,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,0.9138556718826294,0.7662045955657959,92.95836639404295,91.3960189819336,0.3241358995437622,0.6934995651245117,0.9351677894592284,0.8588614463806152,0.8534961342811584,0.7430403828620911,YSPTSPSYSPTSPS,Low,"(4.456, 4.606]",train
3DDA,protein-peptide,P60880 P0DPI1,MPFVNKQFNYKDPVNGVDIAYIKIPNAGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTGLFEHHHHHH,QRATKM,MET-PRO-PHE-VAL-ASN-LYS-GLN-PHE-ASN-TYR-LYS-ASP-PRO-VAL-ASN-GLY-VAL-ASP-ILE-ALA-TYR-ILE-LYS-ILE-PRO-ASN-ALA-GLY-GLN-MET-GLN-PRO-VAL-LYS-ALA-PHE-LYS-ILE-HIS-ASN-LYS-ILE-TRP-VAL-ILE-PRO-GLU-ARG-ASP-THR-PHE-THR-ASN-PRO-GLU-GLU-GLY-ASP-LEU-ASN-PRO-PRO-PRO-GLU-ALA-LYS-GLN-VAL-PRO-VAL-SER-TYR-TYR-ASP-SER-THR-TYR-LEU-SER-THR-ASP-ASN-GLU-LYS-ASP-ASN-TYR-LEU-LYS-GLY-VAL-THR-LYS-LEU-PHE-GLU-ARG-ILE-TYR-SER-THR-ASP-LEU-GLY-ARG-MET-LEU-LEU-THR-SER-ILE-VAL-ARG-GLY-ILE-PRO-PHE-TRP-GLY-GLY-SER-THR-ILE-ASP-THR-GLU-LEU-LYS-VAL-ILE-ASP-THR-ASN-CYS-ILE-ASN-VAL-ILE-GLN-PRO-ASP-GLY-SER-TYR-ARG-SER-GLU-GLU-LEU-ASN-LEU-VAL-ILE-ILE-GLY-PRO-SER-ALA-ASP-ILE-ILE-GLN-PHE-GLU-CYS-LYS-SER-PHE-GLY-HIS-GLU-VAL-LEU-ASN-LEU-THR-ARG-ASN-GLY-TYR-GLY-SER-THR-GLN-TYR-ILE-ARG-PHE-SER-PRO-ASP-PHE-THR-PHE-GLY-PHE-GLU-GLU-SER-LEU-GLU-VAL-ASP-THR-ASN-PRO-LEU-LEU-GLY-ALA-GLY-LYS-PHE-ALA-THR-ASP-PRO-ALA-VAL-THR-LEU-ALA-HIS-GLU-LEU-ILE-HIS-ALA-GLY-HIS-ARG-LEU-TYR-GLY-ILE-ALA-ILE-ASN-PRO-ASN-ARG-VAL-PHE-LYS-VAL-ASN-THR-ASN-ALA-TYR-TYR-GLU-MET-SER-GLY-LEU-GLU-VAL-SER-PHE-GLU-GLU-LEU-ARG-THR-PHE-GLY-GLY-HIS-ASP-ALA-LYS-PHE-ILE-ASP-SER-LEU-GLN-GLU-ASN-GLU-PHE-ARG-LEU-TYR-TYR-TYR-ASN-LYS-PHE-LYS-ASP-ILE-ALA-SER-THR-LEU-ASN-LYS-ALA-LYS-SER-ILE-VAL-GLY-THR-THR-ALA-SER-LEU-GLN-TYR-MET-LYS-ASN-VAL-PHE-LYS-GLU-LYS-TYR-LEU-LEU-SER-GLU-ASP-THR-SER-GLY-LYS-PHE-SER-VAL-ASP-LYS-LEU-LYS-PHE-ASP-LYS-LEU-TYR-LYS-MET-LEU-THR-GLU-ILE-TYR-THR-GLU-ASP-ASN-PHE-VAL-LYS-PHE-PHE-LYS-VAL-LEU-ASN-ARG-LYS-THR-TYR-LEU-ASN-PHE-ASP-LYS-ALA-VAL-PHE-LYS-ILE-ASN-ILE-VAL-PRO-LYS-VAL-ASN-TYR-THR-ILE-TYR-ASP-GLY-PHE-ASN-LEU-ARG-ASN-THR-ASN-LEU-ALA-ALA-ASN-PHE-ASN-GLY-GLN-ASN-THR-GLU-ILE-ASN-ASN-MET-ASN-PHE-THR-LYS-LEU-LYS-ASN-PHE-THR-GLY-LEU-PHE-GLU-HIS-HIS-HIS-HIS-HIS-HIS,GLN-ARG-ALA-THR-LYS-MET-NH2,430,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N)CCSC)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC[NH+]=C(N)N)C,IC50=133uM,3.876148,3.88,1,A,A,1,A,A,0,,B,A,,1,1,430,7,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,CSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.4901486933231354,0.5274458527565002,37.3640022277832,36.66902542114258,1.7277681827545166,1.8228416442871092,0.6519985198974609,0.6681363582611084,0.4324843883514404,0.4922732412815094,QRATKM,Low,"(3.548, 3.924]",train
3DDB,protein-peptide,P60880 P0DPI1,MPFVNKQFNYKDPVNGVDIAYIKIPNAGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTGLFEHHHHHH,RRATKM,MET-PRO-PHE-VAL-ASN-LYS-GLN-PHE-ASN-TYR-LYS-ASP-PRO-VAL-ASN-GLY-VAL-ASP-ILE-ALA-TYR-ILE-LYS-ILE-PRO-ASN-ALA-GLY-GLN-MET-GLN-PRO-VAL-LYS-ALA-PHE-LYS-ILE-HIS-ASN-LYS-ILE-TRP-VAL-ILE-PRO-GLU-ARG-ASP-THR-PHE-THR-ASN-PRO-GLU-GLU-GLY-ASP-LEU-ASN-PRO-PRO-PRO-GLU-ALA-LYS-GLN-VAL-PRO-VAL-SER-TYR-TYR-ASP-SER-THR-TYR-LEU-SER-THR-ASP-ASN-GLU-LYS-ASP-ASN-TYR-LEU-LYS-GLY-VAL-THR-LYS-LEU-PHE-GLU-ARG-ILE-TYR-SER-THR-ASP-LEU-GLY-ARG-MET-LEU-LEU-THR-SER-ILE-VAL-ARG-GLY-ILE-PRO-PHE-TRP-GLY-GLY-SER-THR-ILE-ASP-THR-GLU-LEU-LYS-VAL-ILE-ASP-THR-ASN-CYS-ILE-ASN-VAL-ILE-GLN-PRO-ASP-GLY-SER-TYR-ARG-SER-GLU-GLU-LEU-ASN-LEU-VAL-ILE-ILE-GLY-PRO-SER-ALA-ASP-ILE-ILE-GLN-PHE-GLU-CYS-LYS-SER-PHE-GLY-HIS-GLU-VAL-LEU-ASN-LEU-THR-ARG-ASN-GLY-TYR-GLY-SER-THR-GLN-TYR-ILE-ARG-PHE-SER-PRO-ASP-PHE-THR-PHE-GLY-PHE-GLU-GLU-SER-LEU-GLU-VAL-ASP-THR-ASN-PRO-LEU-LEU-GLY-ALA-GLY-LYS-PHE-ALA-THR-ASP-PRO-ALA-VAL-THR-LEU-ALA-HIS-GLU-LEU-ILE-HIS-ALA-GLY-HIS-ARG-LEU-TYR-GLY-ILE-ALA-ILE-ASN-PRO-ASN-ARG-VAL-PHE-LYS-VAL-ASN-THR-ASN-ALA-TYR-TYR-GLU-MET-SER-GLY-LEU-GLU-VAL-SER-PHE-GLU-GLU-LEU-ARG-THR-PHE-GLY-GLY-HIS-ASP-ALA-LYS-PHE-ILE-ASP-SER-LEU-GLN-GLU-ASN-GLU-PHE-ARG-LEU-TYR-TYR-TYR-ASN-LYS-PHE-LYS-ASP-ILE-ALA-SER-THR-LEU-ASN-LYS-ALA-LYS-SER-ILE-VAL-GLY-THR-THR-ALA-SER-LEU-GLN-TYR-MET-LYS-ASN-VAL-PHE-LYS-GLU-LYS-TYR-LEU-LEU-SER-GLU-ASP-THR-SER-GLY-LYS-PHE-SER-VAL-ASP-LYS-LEU-LYS-PHE-ASP-LYS-LEU-TYR-LYS-MET-LEU-THR-GLU-ILE-TYR-THR-GLU-ASP-ASN-PHE-VAL-LYS-PHE-PHE-LYS-VAL-LEU-ASN-ARG-LYS-THR-TYR-LEU-ASN-PHE-ASP-LYS-ALA-VAL-PHE-LYS-ILE-ASN-ILE-VAL-PRO-LYS-VAL-ASN-TYR-THR-ILE-TYR-ASP-GLY-PHE-ASN-LEU-ARG-ASN-THR-ASN-LEU-ALA-ALA-ASN-PHE-ASN-GLY-GLN-ASN-THR-GLU-ILE-ASN-ASN-MET-ASN-PHE-THR-LYS-LEU-LYS-ASN-PHE-THR-GLY-LEU-PHE-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ARG-ARG-ALA-THR-LYS-MET-NH2,430,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N)CCSC)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)C,IC50=95uM,4.022276,4.02,1,A,A,1,A,A,0,,B,A,,1,1,430,7,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)C(=O)O,CSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CSCC[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.562593936920166,0.6980667114257812,41.2717170715332,41.93991470336914,1.441030502319336,1.5459818840026855,0.7078051567077637,0.7092504501342773,0.517690122127533,0.6705613732337952,RRATKM,Low,"(3.924, 4.155]",train
3DIW,protein-peptide,Q9DBG9 P35222,MSYTPGQPVTAVVQRVEIHKLRQGENLILGFSIGGGIDQDPSQNPFSEDKTDKGIYVTRVSEGGPAEIAGLQIGDKIMQVNGWDMTMVTHDQARKRLTKRSEEVVRLLVTRQSLQKAVQQSMLS,NQLAWFDTDL,MET-SER-TYR-THR-PRO-GLY-GLN-PRO-VAL-THR-ALA-VAL-VAL-GLN-ARG-VAL-GLU-ILE-HIS-LYS-LEU-ARG-GLN-GLY-GLU-ASN-LEU-ILE-LEU-GLY-PHE-SER-ILE-GLY-GLY-GLY-ILE-ASP-GLN-ASP-PRO-SER-GLN-ASN-PRO-PHE-SER-GLU-ASP-LYS-THR-ASP-LYS-GLY-ILE-TYR-VAL-THR-ARG-VAL-SER-GLU-GLY-GLY-PRO-ALA-GLU-ILE-ALA-GLY-LEU-GLN-ILE-GLY-ASP-LYS-ILE-MET-GLN-VAL-ASN-GLY-TRP-ASP-MET-THR-MET-VAL-THR-HIS-ASP-GLN-ALA-ARG-LYS-ARG-LEU-THR-LYS-ARG-SER-GLU-GLU-VAL-VAL-ARG-LEU-LEU-VAL-THR-ARG-GLN-SER-LEU-GLN-LYS-ALA-VAL-GLN-GLN-SER-MET-LEU-SER,ASN-GLN-LEU-ALA-TRP-PHE-ASP-THR-ASP-LEU,124,10,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)O)[C@H](O)C)CC(=O)O)Cc1ccccc1)Cc1c[nH]c2c1cccc2)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C,Kd=0.19uM,6.721246,6.72,1,A,A,1,A,A,0,,C,A,,1,1,124,10,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.987111508846283,0.8947162628173828,88.35120391845703,82.81596374511719,0.3486218452453613,0.6064308285713196,0.9043205976486206,0.8675069212913513,0.9145256876945496,0.851115345954895,NQLAWFDTDL,Low,"(6.696, 6.824]",train
3DNJ,protein-peptide,Q9A5I0,TQKPSLYRVLILNDDYTPMEFVVYVLERFFNKSREDATRIMLHVHQNGVGVCGVYTYEVAETKVAQVIDSARRHQHPLQCTMEKD,YLFVQRDSKE,THR-GLN-LYS-PRO-SER-LEU-TYR-ARG-VAL-LEU-ILE-LEU-ASN-ASP-ASP-TYR-THR-PRO-MET-GLU-PHE-VAL-VAL-TYR-VAL-LEU-GLU-ARG-PHE-PHE-ASN-LYS-SER-ARG-GLU-ASP-ALA-THR-ARG-ILE-MET-LEU-HIS-VAL-HIS-GLN-ASN-GLY-VAL-GLY-VAL-CYS-GLY-VAL-TYR-THR-TYR-GLU-VAL-ALA-GLU-THR-LYS-VAL-ALA-GLN-VAL-ILE-ASP-SER-ALA-ARG-ARG-HIS-GLN-HIS-PRO-LEU-GLN-CYS-THR-MET-GLU-LYS-ASP,TYR-LEU-PHE-VAL-GLN-ARG-ASP-SER-LYS-GLU,85,10,CC(C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])C,Kd=150nM,6.823909,6.82,1,A,A,1,A,A,0,,C,A,,1,1,85,10,0,CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.8766528964042664,0.7597684860229492,96.17764282226562,93.37123107910156,0.3306351602077484,0.664180338382721,0.8963160514831543,0.8381952047348022,0.8059476017951965,0.7401618361473083,YLFVQRDSKE,Low,"(6.696, 6.824]",train
3DOW,protein-peptide,P27797 O95166,GSMKFVYKEEHPFEKRRSEGEKIRKKYPDRVPVIVEKAPKARIGDLDKKKYLVPSDLTVGQFYFLIRKRIHLRAEDALFFFVNNVIPPTSATMGQLYQEHHEEDFFLYIAYSDESVYGL,SLEDDWDFLPP,GLY-SER-MET-LYS-PHE-VAL-TYR-LYS-GLU-GLU-HIS-PRO-PHE-GLU-LYS-ARG-ARG-SER-GLU-GLY-GLU-LYS-ILE-ARG-LYS-LYS-TYR-PRO-ASP-ARG-VAL-PRO-VAL-ILE-VAL-GLU-LYS-ALA-PRO-LYS-ALA-ARG-ILE-GLY-ASP-LEU-ASP-LYS-LYS-LYS-TYR-LEU-VAL-PRO-SER-ASP-LEU-THR-VAL-GLY-GLN-PHE-TYR-PHE-LEU-ILE-ARG-LYS-ARG-ILE-HIS-LEU-ARG-ALA-GLU-ASP-ALA-LEU-PHE-PHE-PHE-VAL-ASN-ASN-VAL-ILE-PRO-PRO-THR-SER-ALA-THR-MET-GLY-GLN-LEU-TYR-GLN-GLU-HIS-HIS-GLU-GLU-ASP-PHE-PHE-LEU-TYR-ILE-ALA-TYR-SER-ASP-GLU-SER-VAL-TYR-GLY-LEU,SER-LEU-GLU-ASP-ASP-TRP-ASP-PHE-LEU-PRO-PRO-NH2,119,12,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])Cc1c[nH]c2c1cccc2)CC(=O)O)Cc1ccccc1)C,Kd=11.5uM,4.939302,4.94,1,A,A,1,A,A,0,,B,A,,1,1,119,12,0,CC(C)C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.9669306874275208,0.8000749349594116,93.42100524902344,92.66545104980467,0.305202841758728,0.6662623286247253,0.9430117011070251,0.8678911328315735,0.9200258255004884,0.78312087059021,SLEDDWDFLPP,Low,"(4.866, 5.014]",train
3DPC,protein-peptide,P00634,TPEMPVLENRAAQGDITAPGGARRLTGDQTAALRDSLSDKPAKNIILLIGDGMGDSEITAARNYAEGAGGFFKGIDALPLTGQYTHYALNKKTGKPDYVTDLAASATAWSTGVKTYNGALGVDIHEKDHPTILEMAKAAGLATGNVSTAELQDATPAALVAHVTSRKCYGPSATSEKCPGNALEKGGKGSITEQLLNARADVTLGGGAKTFAETATAGEWQGKTLREQAQARGYQLVSDAASLNSVTEANQQKPLLGLFADGNMPVRWLGPKATYHGNIDKPAVTCTPNPQRNDSVPTLAQMTDKAIELLSKNEKGFFLQVEGASIDKQDHAANPCGQIGETVDLDEAVQRALEFAKKEGNTLVIVTADHAHASQIVAPDTKAPGLTQALNTKDGAVMVMSYGNSEEDSQEHTGSQLRIAAYGPHAANVVGLTDQTDLFYTMKAALGLKHHHHHH,HATPPKKEAD,THR-PRO-GLU-MET-PRO-VAL-LEU-GLU-ASN-ARG-ALA-ALA-GLN-GLY-ASP-ILE-THR-ALA-PRO-GLY-GLY-ALA-ARG-ARG-LEU-THR-GLY-ASP-GLN-THR-ALA-ALA-LEU-ARG-ASP-SER-LEU-SER-ASP-LYS-PRO-ALA-LYS-ASN-ILE-ILE-LEU-LEU-ILE-GLY-ASP-GLY-MET-GLY-ASP-SER-GLU-ILE-THR-ALA-ALA-ARG-ASN-TYR-ALA-GLU-GLY-ALA-GLY-GLY-PHE-PHE-LYS-GLY-ILE-ASP-ALA-LEU-PRO-LEU-THR-GLY-GLN-TYR-THR-HIS-TYR-ALA-LEU-ASN-LYS-LYS-THR-GLY-LYS-PRO-ASP-TYR-VAL-THR-ASP-LEU-ALA-ALA-SER-ALA-THR-ALA-TRP-SER-THR-GLY-VAL-LYS-THR-TYR-ASN-GLY-ALA-LEU-GLY-VAL-ASP-ILE-HIS-GLU-LYS-ASP-HIS-PRO-THR-ILE-LEU-GLU-MET-ALA-LYS-ALA-ALA-GLY-LEU-ALA-THR-GLY-ASN-VAL-SER-THR-ALA-GLU-LEU-GLN-ASP-ALA-THR-PRO-ALA-ALA-LEU-VAL-ALA-HIS-VAL-THR-SER-ARG-LYS-CYS-TYR-GLY-PRO-SER-ALA-THR-SER-GLU-LYS-CYS-PRO-GLY-ASN-ALA-LEU-GLU-LYS-GLY-GLY-LYS-GLY-SER-ILE-THR-GLU-GLN-LEU-LEU-ASN-ALA-ARG-ALA-ASP-VAL-THR-LEU-GLY-GLY-GLY-ALA-LYS-THR-PHE-ALA-GLU-THR-ALA-THR-ALA-GLY-GLU-TRP-GLN-GLY-LYS-THR-LEU-ARG-GLU-GLN-ALA-GLN-ALA-ARG-GLY-TYR-GLN-LEU-VAL-SER-ASP-ALA-ALA-SER-LEU-ASN-SER-VAL-THR-GLU-ALA-ASN-GLN-GLN-LYS-PRO-LEU-LEU-GLY-LEU-PHE-ALA-ASP-GLY-ASN-MET-PRO-VAL-ARG-TRP-LEU-GLY-PRO-LYS-ALA-THR-TYR-HIS-GLY-ASN-ILE-ASP-LYS-PRO-ALA-VAL-THR-CYS-THR-PRO-ASN-PRO-GLN-ARG-ASN-ASP-SER-VAL-PRO-THR-LEU-ALA-GLN-MET-THR-ASP-LYS-ALA-ILE-GLU-LEU-LEU-SER-LYS-ASN-GLU-LYS-GLY-PHE-PHE-LEU-GLN-VAL-GLU-GLY-ALA-SER-ILE-ASP-LYS-GLN-ASP-HIS-ALA-ALA-ASN-PRO-CYS-GLY-GLN-ILE-GLY-GLU-THR-VAL-ASP-LEU-ASP-GLU-ALA-VAL-GLN-ARG-ALA-LEU-GLU-PHE-ALA-LYS-LYS-GLU-GLY-ASN-THR-LEU-VAL-ILE-VAL-THR-ALA-ASP-HIS-ALA-HIS-ALA-SER-GLN-ILE-VAL-ALA-PRO-ASP-THR-LYS-ALA-PRO-GLY-LEU-THR-GLN-ALA-LEU-ASN-THR-LYS-ASP-GLY-ALA-VAL-MET-VAL-MET-SER-TYR-GLY-ASN-SER-GLU-GLU-ASP-SER-GLN-GLU-HIS-THR-GLY-SER-GLN-LEU-ARG-ILE-ALA-ALA-TYR-GLY-PRO-HIS-ALA-ALA-ASN-VAL-VAL-GLY-LEU-THR-ASP-GLN-THR-ASP-LEU-PHE-TYR-THR-MET-LYS-ALA-ALA-LEU-GLY-LEU-LYS-HIS-HIS-HIS-HIS-HIS-HIS,HIS-ALA-TPO-PRO-PRO-LYS-LYS-GLU-ALA-ASP,455,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C)CCC(=O)O)CCCC[NH3+])NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])C,Kd=44uM,4.356547,4.36,1,A,A,1,A,A,0,,C,A,,0,1,455,10,0,C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](C)C(=O)O,0.6799871325492859,0.7618305683135986,84.73336029052734,85.64473724365234,0.5479925274848938,0.773405134677887,0.8991247415542603,0.8830324411392212,0.5902565121650696,0.7260355949401855,HATPPKKEAD,Low,"(4.319, 4.456]",train
3DPO,protein-peptide,P37362 P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,VDKLYALPRPT,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,VAL-ASP-LYS-LEU-TYR-ALC-LEU-PRO-ARG-PRO-THR,219,11,O=C[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(C)C)CC1CCCCC1)CC(C)C)CCC[NH+]=C(N)N,Kd=5.5nM,8.259637,8.26,1,A,A,1,A,A,0,,C,A,dimer,1,1,219,11,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8972336649894714,0.8748996257781982,93.0329132080078,87.87326049804688,0.3505007922649383,0.51957106590271,0.9157581925392152,0.8969072699546814,0.8627111911773682,0.869397759437561,VDKLYALPRPT,Moderate,"(7.921, 8.383]",train
3DRF,protein-peptide,A2RJ53,MGSNQSSSTSTKKLKAGNFDVAYQNPDKAIKGGNLKVAYQSDSPMKAQWLSGLSNDATFATMSGPGGGQDGLFFTDSGFKFIKGGAADVALDKESKTATITLRKDLKWSDGSEVTAKDYEFTYETIANPAYGSDRWTDSLANIVGLSDYHTGKAKTISGITFPDGENGKVIKVQFKEMKPGMTQSGNGYFLETVAPYQYLKDVAPKDLASSPKTTTKPLVTGPFKPENVVAGESIKYVPNPYYWGEKPKLNSITYEVVSTAKSVAALSSSKYDIINGMVSSQYKQVKNLKGYKVLGQQAMYISLMYYNLGHYDAKNSINVQDRKTPLQDQNVRQAIGYARNVAEVDNKFSNGLSTPANSLIPPIFKQFTSSSVKGYEKQDLDKANKLLDEDGWKLNKSTGYREKDGKELSLVYAARVGDANAETIAQNYIQQWKKIGVKVSLYNGKLMEFNSWVDHMTTPPGANDWDITDGSWSLASEPSQQDLFSAAAPYNFGHFNDSEITKDLNDIDSAKSENPTYRKAAFVKYQEDMNKKAYVIPTNFMLNYTPVNKRVVGMTLDYGAMNTWSEIGVSSAKLATKGSIEGRHHHHHH,ASNSIASG,MET-GLY-SER-ASN-GLN-SER-SER-SER-THR-SER-THR-LYS-LYS-LEU-LYS-ALA-GLY-ASN-PHE-ASP-VAL-ALA-TYR-GLN-ASN-PRO-ASP-LYS-ALA-ILE-LYS-GLY-GLY-ASN-LEU-LYS-VAL-ALA-TYR-GLN-SER-ASP-SER-PRO-MET-LYS-ALA-GLN-TRP-LEU-SER-GLY-LEU-SER-ASN-ASP-ALA-THR-PHE-ALA-THR-MET-SER-GLY-PRO-GLY-GLY-GLY-GLN-ASP-GLY-LEU-PHE-PHE-THR-ASP-SER-GLY-PHE-LYS-PHE-ILE-LYS-GLY-GLY-ALA-ALA-ASP-VAL-ALA-LEU-ASP-LYS-GLU-SER-LYS-THR-ALA-THR-ILE-THR-LEU-ARG-LYS-ASP-LEU-LYS-TRP-SER-ASP-GLY-SER-GLU-VAL-THR-ALA-LYS-ASP-TYR-GLU-PHE-THR-TYR-GLU-THR-ILE-ALA-ASN-PRO-ALA-TYR-GLY-SER-ASP-ARG-TRP-THR-ASP-SER-LEU-ALA-ASN-ILE-VAL-GLY-LEU-SER-ASP-TYR-HIS-THR-GLY-LYS-ALA-LYS-THR-ILE-SER-GLY-ILE-THR-PHE-PRO-ASP-GLY-GLU-ASN-GLY-LYS-VAL-ILE-LYS-VAL-GLN-PHE-LYS-GLU-MET-LYS-PRO-GLY-MET-THR-GLN-SER-GLY-ASN-GLY-TYR-PHE-LEU-GLU-THR-VAL-ALA-PRO-TYR-GLN-TYR-LEU-LYS-ASP-VAL-ALA-PRO-LYS-ASP-LEU-ALA-SER-SER-PRO-LYS-THR-THR-THR-LYS-PRO-LEU-VAL-THR-GLY-PRO-PHE-LYS-PRO-GLU-ASN-VAL-VAL-ALA-GLY-GLU-SER-ILE-LYS-TYR-VAL-PRO-ASN-PRO-TYR-TYR-TRP-GLY-GLU-LYS-PRO-LYS-LEU-ASN-SER-ILE-THR-TYR-GLU-VAL-VAL-SER-THR-ALA-LYS-SER-VAL-ALA-ALA-LEU-SER-SER-SER-LYS-TYR-ASP-ILE-ILE-ASN-GLY-MET-VAL-SER-SER-GLN-TYR-LYS-GLN-VAL-LYS-ASN-LEU-LYS-GLY-TYR-LYS-VAL-LEU-GLY-GLN-GLN-ALA-MET-TYR-ILE-SER-LEU-MET-TYR-TYR-ASN-LEU-GLY-HIS-TYR-ASP-ALA-LYS-ASN-SER-ILE-ASN-VAL-GLN-ASP-ARG-LYS-THR-PRO-LEU-GLN-ASP-GLN-ASN-VAL-ARG-GLN-ALA-ILE-GLY-TYR-ALA-ARG-ASN-VAL-ALA-GLU-VAL-ASP-ASN-LYS-PHE-SER-ASN-GLY-LEU-SER-THR-PRO-ALA-ASN-SER-LEU-ILE-PRO-PRO-ILE-PHE-LYS-GLN-PHE-THR-SER-SER-SER-VAL-LYS-GLY-TYR-GLU-LYS-GLN-ASP-LEU-ASP-LYS-ALA-ASN-LYS-LEU-LEU-ASP-GLU-ASP-GLY-TRP-LYS-LEU-ASN-LYS-SER-THR-GLY-TYR-ARG-GLU-LYS-ASP-GLY-LYS-GLU-LEU-SER-LEU-VAL-TYR-ALA-ALA-ARG-VAL-GLY-ASP-ALA-ASN-ALA-GLU-THR-ILE-ALA-GLN-ASN-TYR-ILE-GLN-GLN-TRP-LYS-LYS-ILE-GLY-VAL-LYS-VAL-SER-LEU-TYR-ASN-GLY-LYS-LEU-MET-GLU-PHE-ASN-SER-TRP-VAL-ASP-HIS-MET-THR-THR-PRO-PRO-GLY-ALA-ASN-ASP-TRP-ASP-ILE-THR-ASP-GLY-SER-TRP-SER-LEU-ALA-SER-GLU-PRO-SER-GLN-GLN-ASP-LEU-PHE-SER-ALA-ALA-ALA-PRO-TYR-ASN-PHE-GLY-HIS-PHE-ASN-ASP-SER-GLU-ILE-THR-LYS-ASP-LEU-ASN-ASP-ILE-ASP-SER-ALA-LYS-SER-GLU-ASN-PRO-THR-TYR-ARG-LYS-ALA-ALA-PHE-VAL-LYS-TYR-GLN-GLU-ASP-MET-ASN-LYS-LYS-ALA-TYR-VAL-ILE-PRO-THR-ASN-PHE-MET-LEU-ASN-TYR-THR-PRO-VAL-ASN-LYS-ARG-VAL-VAL-GLY-MET-THR-LEU-ASP-TYR-GLY-ALA-MET-ASN-THR-TRP-SER-GLU-ILE-GLY-VAL-SER-SER-ALA-LYS-LEU-ALA-THR-LYS-GLY-SER-ILE-GLU-GLY-ARG-HIS-HIS-HIS-HIS-HIS-HIS,ALA-SER-ASN-SER-ILE-ALA-SER-GLY,590,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)CC(=O)N)CO)C,Kd=0.1uM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,590,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,0.8223503232002258,0.825329065322876,72.53357696533203,73.79167938232422,0.5635554194450378,0.706635057926178,0.7992841005325317,0.8108822107315063,0.7946720123291016,0.8035169839859009,ASNSIASG,Moderate,"(6.824, 7.049]",train
3DRG,protein-peptide,A2RJ53,MGSNQSSSTSTKKLKAGNFDVAYQNPDKAIKGGNLKVAYQSDSPMKAQWLSGLSNDATFATMSGPGGGQDGLFFTDSGFKFIKGGAADVALDKESKTATITLRKDLKWSDGSEVTAKDYEFTYETIANPAYGSDRWTDSLANIVGLSDYHTGKAKTISGITFPDGENGKVIKVQFKEMKPGMTQSGNGYFLETVAPYQYLKDVAPKDLASSPKTTTKPLVTGPFKPENVVAGESIKYVPNPYYWGEKPKLNSITYEVVSTAKSVAALSSSKYDIINGMVSSQYKQVKNLKGYKVLGQQAMYISLMYYNLGHYDAKNSINVQDRKTPLQDQNVRQAIGYARNVAEVDNKFSNGLSTPANSLIPPIFKQFTSSSVKGYEKQDLDKANKLLDEDGWKLNKSTGYREKDGKELSLVYAARVGDANAETIAQNYIQQWKKIGVKVSLYNGKLMEFNSWVDHMTTPPGANDWDITDGSWSLASEPSQQDLFSAAAPYNFGHFNDSEITKDLNDIDSAKSENPTYRKAAFVKYQEDMNKKAYVIPTNFMLNYTPVNKRVVGMTLDYGAMNTWSEIGVSSAKLATKGSIEGRHHHHHH,RPPGFSPFA,MET-GLY-SER-ASN-GLN-SER-SER-SER-THR-SER-THR-LYS-LYS-LEU-LYS-ALA-GLY-ASN-PHE-ASP-VAL-ALA-TYR-GLN-ASN-PRO-ASP-LYS-ALA-ILE-LYS-GLY-GLY-ASN-LEU-LYS-VAL-ALA-TYR-GLN-SER-ASP-SER-PRO-MET-LYS-ALA-GLN-TRP-LEU-SER-GLY-LEU-SER-ASN-ASP-ALA-THR-PHE-ALA-THR-MET-SER-GLY-PRO-GLY-GLY-GLY-GLN-ASP-GLY-LEU-PHE-PHE-THR-ASP-SER-GLY-PHE-LYS-PHE-ILE-LYS-GLY-GLY-ALA-ALA-ASP-VAL-ALA-LEU-ASP-LYS-GLU-SER-LYS-THR-ALA-THR-ILE-THR-LEU-ARG-LYS-ASP-LEU-LYS-TRP-SER-ASP-GLY-SER-GLU-VAL-THR-ALA-LYS-ASP-TYR-GLU-PHE-THR-TYR-GLU-THR-ILE-ALA-ASN-PRO-ALA-TYR-GLY-SER-ASP-ARG-TRP-THR-ASP-SER-LEU-ALA-ASN-ILE-VAL-GLY-LEU-SER-ASP-TYR-HIS-THR-GLY-LYS-ALA-LYS-THR-ILE-SER-GLY-ILE-THR-PHE-PRO-ASP-GLY-GLU-ASN-GLY-LYS-VAL-ILE-LYS-VAL-GLN-PHE-LYS-GLU-MET-LYS-PRO-GLY-MET-THR-GLN-SER-GLY-ASN-GLY-TYR-PHE-LEU-GLU-THR-VAL-ALA-PRO-TYR-GLN-TYR-LEU-LYS-ASP-VAL-ALA-PRO-LYS-ASP-LEU-ALA-SER-SER-PRO-LYS-THR-THR-THR-LYS-PRO-LEU-VAL-THR-GLY-PRO-PHE-LYS-PRO-GLU-ASN-VAL-VAL-ALA-GLY-GLU-SER-ILE-LYS-TYR-VAL-PRO-ASN-PRO-TYR-TYR-TRP-GLY-GLU-LYS-PRO-LYS-LEU-ASN-SER-ILE-THR-TYR-GLU-VAL-VAL-SER-THR-ALA-LYS-SER-VAL-ALA-ALA-LEU-SER-SER-SER-LYS-TYR-ASP-ILE-ILE-ASN-GLY-MET-VAL-SER-SER-GLN-TYR-LYS-GLN-VAL-LYS-ASN-LEU-LYS-GLY-TYR-LYS-VAL-LEU-GLY-GLN-GLN-ALA-MET-TYR-ILE-SER-LEU-MET-TYR-TYR-ASN-LEU-GLY-HIS-TYR-ASP-ALA-LYS-ASN-SER-ILE-ASN-VAL-GLN-ASP-ARG-LYS-THR-PRO-LEU-GLN-ASP-GLN-ASN-VAL-ARG-GLN-ALA-ILE-GLY-TYR-ALA-ARG-ASN-VAL-ALA-GLU-VAL-ASP-ASN-LYS-PHE-SER-ASN-GLY-LEU-SER-THR-PRO-ALA-ASN-SER-LEU-ILE-PRO-PRO-ILE-PHE-LYS-GLN-PHE-THR-SER-SER-SER-VAL-LYS-GLY-TYR-GLU-LYS-GLN-ASP-LEU-ASP-LYS-ALA-ASN-LYS-LEU-LEU-ASP-GLU-ASP-GLY-TRP-LYS-LEU-ASN-LYS-SER-THR-GLY-TYR-ARG-GLU-LYS-ASP-GLY-LYS-GLU-LEU-SER-LEU-VAL-TYR-ALA-ALA-ARG-VAL-GLY-ASP-ALA-ASN-ALA-GLU-THR-ILE-ALA-GLN-ASN-TYR-ILE-GLN-GLN-TRP-LYS-LYS-ILE-GLY-VAL-LYS-VAL-SER-LEU-TYR-ASN-GLY-LYS-LEU-MET-GLU-PHE-ASN-SER-TRP-VAL-ASP-HIS-MET-THR-THR-PRO-PRO-GLY-ALA-ASN-ASP-TRP-ASP-ILE-THR-ASP-GLY-SER-TRP-SER-LEU-ALA-SER-GLU-PRO-SER-GLN-GLN-ASP-LEU-PHE-SER-ALA-ALA-ALA-PRO-TYR-ASN-PHE-GLY-HIS-PHE-ASN-ASP-SER-GLU-ILE-THR-LYS-ASP-LEU-ASN-ASP-ILE-ASP-SER-ALA-LYS-SER-GLU-ASN-PRO-THR-TYR-ARG-LYS-ALA-ALA-PHE-VAL-LYS-TYR-GLN-GLU-ASP-MET-ASN-LYS-LYS-ALA-TYR-VAL-ILE-PRO-THR-ASN-PHE-MET-LEU-ASN-TYR-THR-PRO-VAL-ASN-LYS-ARG-VAL-VAL-GLY-MET-THR-LEU-ASP-TYR-GLY-ALA-MET-ASN-THR-TRP-SER-GLU-ILE-GLY-VAL-SER-SER-ALA-LYS-LEU-ALA-THR-LYS-GLY-SER-ILE-GLU-GLY-ARG-HIS-HIS-HIS-HIS-HIS-HIS,ARG-PRO-PRO-GLY-PHE-SER-PRO-PHE-ALA,590,9,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=0.1uM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,590,9,0,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8156266212463379,0.7921216487884521,73.439208984375,71.34913635253906,0.5589249730110168,0.8253142833709717,0.80052649974823,0.7812919020652771,0.7860127091407776,0.7683459520339966,RPPGFSPFA,Moderate,"(6.824, 7.049]",train
3DS0,protein-peptide,P12497,SPTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKAWMTETLLVQNANPDCKTILKALGPGATLEEMMTACQGVGGPGHKARVL,ITFEDLLDYYGP,SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ALA-TRP-MET-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,ILE-THR-PHE-GLU-ASP-LEU-LEU-ASP-TYR-TYR-GLY-PRO,86,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CCC(=O)O)Cc1ccccc1)[C@H](O)C)[NH3+])C,Kd=14.9uM,4.826814,4.83,1,A,A,1,A,A,0,,T,A,,1,1,86,12,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,1.026505947113037,0.8484970331192017,93.60076141357422,85.39939880371094,0.3521418869495392,0.7458931803703308,0.8794772028923035,0.8113211393356323,0.9038243293762208,0.7633143067359924,ITFEDLLDYYGP,Low,"(4.745, 4.866]",train
3DS1,protein-peptide,P12497,SPTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKNWMTATLLVQNANPDCKTILKALGPGATLEEMMTACQGVGGPGHKARVL,ITFEDLLDYYGP,SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-TRP-MET-THR-ALA-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,ILE-THR-PHE-GLU-ASP-LEU-LEU-ASP-TYR-TYR-GLY-PRO,86,12,O=CCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)[NH3+])Cc1ccccc1)CCC(=O)O)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O,Kd=2.0uM,5.69897,5.7,1,A,A,1,A,A,0,,T,A,,1,1,86,12,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,1.0294604301452637,0.8966292142868042,94.48399353027344,87.12295532226562,0.3442931771278381,0.6640436053276062,0.8857885599136353,0.8496739864349365,0.9123170971870422,0.8138912916183472,ITFEDLLDYYGP,Low,"(5.6, 5.699]",train
3DS3,protein-peptide,P12497,SPTSILDIRQGPKEPFRDYVDRFAKTLRAEQASQEVKNWMTETLLVQNANPDCKTILKALGPGATLEEMMTACQGVGGPGHKARVL,ITFEDLLDYYGP,SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-ALA-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-TRP-MET-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-LEU-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,ILE-THR-PHE-GLU-ASP-LEU-LEU-ASP-TYR-TYR-GLY-PRO,86,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CCC(=O)O)Cc1ccccc1)[C@H](O)C)[NH3+])C,Kd=6.0uM,5.221849,5.22,1,A,A,1,A,A,0,,C,A,,1,1,86,12,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,1.0325779914855957,0.8092684745788574,94.01192474365234,87.79969787597656,0.338284820318222,0.7065090537071228,0.8878951072692871,0.8385711908340454,0.9093099236488342,0.794675350189209,ITFEDLLDYYGP,Low,"(5.105, 5.222]",val
3DS4,protein-peptide,P12497,SPTSILDIRQGPKEPFRDYVDRFYKTLRAEQASQEVKNWMTETLLVQNANPDCKTILKALGPGATSEEMMTACQGVGGPGHKARVL,ITFEDLLDYYGP,SER-PRO-THR-SER-ILE-LEU-ASP-ILE-ARG-GLN-GLY-PRO-LYS-GLU-PRO-PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER-GLN-GLU-VAL-LYS-ASN-TRP-MET-THR-GLU-THR-LEU-LEU-VAL-GLN-ASN-ALA-ASN-PRO-ASP-CYS-LYS-THR-ILE-LEU-LYS-ALA-LEU-GLY-PRO-GLY-ALA-THR-SER-GLU-GLU-MET-MET-THR-ALA-CYS-GLN-GLY-VAL-GLY-GLY-PRO-GLY-HIS-LYS-ALA-ARG-VAL-LEU,ILE-THR-PHE-GLU-ASP-LEU-LEU-ASP-TYR-TYR-GLY-PRO,86,12,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)CC(=O)O)CC(C)C)CC(C)C)CC(=O)O)CCC(=O)O)Cc1ccccc1)[C@H](O)C)[NH3+])C,Kd=64.5uM,4.19044,4.19,1,A,A,1,A,A,0,,T,A,,1,1,86,12,0,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,1.0267510414123535,0.7699777483940125,92.72789764404295,85.91459655761719,0.351601779460907,0.7991988658905029,0.8813758492469788,0.8060179948806763,0.9100334644317628,0.7609676718711853,ITFEDLLDYYGP,Low,"(4.155, 4.319]",val
3DVP,protein-peptide,Q24117 Q13153,MDMSDRKAVIKNADMSEEMQQDAVDCATQALEKYNIEPDIAAYIKKEFDKKYNPTWHCIVGRNFGSYVTHETRHFIYFYLGQVAILLFKSG,TPTRDVATSP,MET-ASP-MET-SER-ASP-ARG-LYS-ALA-VAL-ILE-LYS-ASN-ALA-ASP-MET-SER-GLU-GLU-MET-GLN-GLN-ASP-ALA-VAL-ASP-CYS-ALA-THR-GLN-ALA-LEU-GLU-LYS-TYR-ASN-ILE-GLU-PRO-ASP-ILE-ALA-ALA-TYR-ILE-LYS-LYS-GLU-PHE-ASP-LYS-LYS-TYR-ASN-PRO-THR-TRP-HIS-CYS-ILE-VAL-GLY-ARG-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-THR-ARG-HIS-PHE-ILE-TYR-PHE-TYR-LEU-GLY-GLN-VAL-ALA-ILE-LEU-LEU-PHE-LYS-SER-GLY,THR-PRO-THR-ARG-ASP-VAL-ALA-THR-SER-PRO,91,10,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CC(=O)O)C,Kd=0.01mM,5.0,5.0,1,A,A,1,A,A,0,,C,A,dimer,1,1,91,10,0,CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9628483653068542,0.9096523523330688,94.41779327392578,95.50474548339844,0.303840309381485,0.4240159392356872,0.9330639243125916,0.9286845326423644,0.908413290977478,0.9048942923545836,TPTRDVATSP,Low,"(4.866, 5.014]",train
3E1R,protein-peptide,Q53EZ4 Q8WUM4,FNSSINNIHEMEIQLKDALEKNQQWLVYDQQREVYVKGLLAKIFELEKKTETAAHSLP,QAQGPPYPTYPGY,PHE-ASN-SER-SER-ILE-ASN-ASN-ILE-HIS-GLU-MET-GLU-ILE-GLN-LEU-LYS-ASP-ALA-LEU-GLU-LYS-ASN-GLN-GLN-TRP-LEU-VAL-TYR-ASP-GLN-GLN-ARG-GLU-VAL-TYR-VAL-LYS-GLY-LEU-LEU-ALA-LYS-ILE-PHE-GLU-LEU-GLU-LYS-LYS-THR-GLU-THR-ALA-ALA-HIS-SER-LEU-PRO,GLN-ALA-GLN-GLY-PRO-PRO-TYR-PRO-THR-TYR-PRO-GLY-TYR,58,13,O=C(N[C@H](C(=O)O)Cc1ccc(cc1)O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC(=O)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,C,A,dimer,1,1,58,13,0,C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,1.03836190700531,0.982685923576355,90.1801528930664,83.17037963867188,0.3605942726135254,0.6625224947929382,0.7564893960952759,0.7545883655548096,0.7479145526885986,0.7272103428840637,QAQGPPYPTYPGY,Low,"(5.821, 5.959]",train
3EBB,protein-peptide,Q9Y263 P55072,MGSSHHHHHHSSGLVPRGSMAGVDPFTGNSAYRSAASKTMNIYFPKKEAVTFDQANPTQILGKLKELNGTAPEEKKLTEDDLILLEKILSLICNSSSEKPTVQQLQILWKAINCPEDIVFPALDILRLSIKHPSVNENFCNEKEGAQFSSHLINLLNPKGKPANQLLALRTFCNCFVGQAGQKLMMSQRESLMSHAIELKSGSNKNIHIALATLALNYSVCFHKDHNIEGKAQCLSLISTILEVVQDLEATFRLLVALGTLISDDSNAVQLAKSLGVDSQIKKYSSVSEPAKVSECCRFILNLL,TEDNDDDLYG,MSE-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-MSE-ALA-GLY-VAL-ASP-PRO-PHE-THR-GLY-ASN-SER-ALA-TYR-ARG-SER-ALA-ALA-SER-LYS-THR-MSE-ASN-ILE-TYR-PHE-PRO-LYS-LYS-GLU-ALA-VAL-THR-PHE-ASP-GLN-ALA-ASN-PRO-THR-GLN-ILE-LEU-GLY-LYS-LEU-LYS-GLU-LEU-ASN-GLY-THR-ALA-PRO-GLU-GLU-LYS-LYS-LEU-THR-GLU-ASP-ASP-LEU-ILE-LEU-LEU-GLU-LYS-ILE-LEU-SER-LEU-ILE-CYS-ASN-SER-SER-SER-GLU-LYS-PRO-THR-VAL-GLN-GLN-LEU-GLN-ILE-LEU-TRP-LYS-ALA-ILE-ASN-CYS-PRO-GLU-ASP-ILE-VAL-PHE-PRO-ALA-LEU-ASP-ILE-LEU-ARG-LEU-SER-ILE-LYS-HIS-PRO-SER-VAL-ASN-GLU-ASN-PHE-CYS-ASN-GLU-LYS-GLU-GLY-ALA-GLN-PHE-SER-SER-HIS-LEU-ILE-ASN-LEU-LEU-ASN-PRO-LYS-GLY-LYS-PRO-ALA-ASN-GLN-LEU-LEU-ALA-LEU-ARG-THR-PHE-CYS-ASN-CYS-PHE-VAL-GLY-GLN-ALA-GLY-GLN-LYS-LEU-MSE-MSE-SER-GLN-ARG-GLU-SER-LEU-MSE-SER-HIS-ALA-ILE-GLU-LEU-LYS-SER-GLY-SER-ASN-LYS-ASN-ILE-HIS-ILE-ALA-LEU-ALA-THR-LEU-ALA-LEU-ASN-TYR-SER-VAL-CYS-PHE-HIS-LYS-ASP-HIS-ASN-ILE-GLU-GLY-LYS-ALA-GLN-CYS-LEU-SER-LEU-ILE-SER-THR-ILE-LEU-GLU-VAL-VAL-GLN-ASP-LEU-GLU-ALA-THR-PHE-ARG-LEU-LEU-VAL-ALA-LEU-GLY-THR-LEU-ILE-SER-ASP-ASP-SER-ASN-ALA-VAL-GLN-LEU-ALA-LYS-SER-LEU-GLY-VAL-ASP-SER-GLN-ILE-LYS-LYS-TYR-SER-SER-VAL-SER-GLU-PRO-ALA-LYS-VAL-SER-GLU-CYS-CYS-ARG-PHE-ILE-LEU-ASN-LEU-LEU,THR-GLU-ASP-ASN-ASP-ASP-ASP-LEU-TYR-GLY,304,10,CC(C[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@H](CC(=O)O)[NH3+])C,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,E,A,,1,1,304,10,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9328298568725586,0.8829542994499207,84.11135864257812,82.99153137207031,0.4554641544818878,0.7414662837982178,0.8420118689537048,0.8376654982566833,0.8580025434494019,0.8079278469085693,TEDNDDDLYG,Low,"(5.222, 5.31]",train
3EG6,protein-peptide,P61964 Q03164,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GSARAEVHLRKS,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ACE-GLY-SER-ALA-ARG-ALA-GLU-VAL-HIS-LEU-ARG-LYS-SER,312,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)Cc1nc[nH]c1)C(C)C)CCC(=O)O)C)CCC[NH+]=C(N)N)C)NC(=O)CNC(=O)C,Kd=1.7uM,5.769551,5.77,1,A,A,1,A,A,0,,C,A,,1,1,312,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O,0.9287557601928712,0.7542575001716614,96.1463851928711,93.32349395751952,0.323926031589508,0.7841852903366089,0.9431176781654358,0.8861029744148254,0.8846560120582581,0.6992608904838562,GSARAEVHLRKS,Low,"(5.699, 5.821]",train
3EHT,protein-peptide,P06850 P34998 P0AEX9,MAKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPETWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALKDAQTNAAAEFSLQDQHCESLSLASNISGLQCNASVDLIGTCWPRSPAGQLVVRPCPAFFYGVRYNTTNNGYRECLANGSWAARVNYSECQEILNEEKKSKVHYHVAHHHHHH,LAQQAHSNRKLMEII,MET-ALA-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-GLU-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-LYS-ASP-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-SER-LEU-GLN-ASP-GLN-HIS-CYS-GLU-SER-LEU-SER-LEU-ALA-SER-ASN-ILE-SER-GLY-LEU-GLN-CYS-ASN-ALA-SER-VAL-ASP-LEU-ILE-GLY-THR-CYS-TRP-PRO-ARG-SER-PRO-ALA-GLY-GLN-LEU-VAL-VAL-ARG-PRO-CYS-PRO-ALA-PHE-PHE-TYR-GLY-VAL-ARG-TYR-ASN-THR-THR-ASN-ASN-GLY-TYR-ARG-GLU-CYS-LEU-ALA-ASN-GLY-SER-TRP-ALA-ALA-ARG-VAL-ASN-TYR-SER-GLU-CYS-GLN-GLU-ILE-LEU-ASN-GLU-GLU-LYS-LYS-SER-LYS-VAL-HIS-TYR-HIS-VAL-ALA-HIS-HIS-HIS-HIS-HIS-HIS,LEU-ALA-GLN-GLN-ALA-HIS-SER-ASN-ARG-LYS-LEU-MET-GLU-ILE-ILE-NH2,476,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)N)[C@H](CC)C)CCC(=O)O)CCSC)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1nc[nH]c1)CO)CC(=O)N)CCC[NH+]=C(N)N,IC50=6.8uM,5.167491,5.17,1,A,A,1,A,A,0,,B,A,,1,1,476,16,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O)[C@@H](C)CC,0.6370712518692017,0.6416381597518921,63.60567474365234,65.77200317382812,0.7206951379776001,1.3178889751434326,0.7527182102203369,0.750298023223877,0.5623345971107483,0.593464732170105,LAQQAHSNRKLMEII,Low,"(5.105, 5.222]",val
3EMH,protein-peptide,P61964 Q03164,GPLGSPEFQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,ARAEVHLRKSAFD,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ALA-ARG-ALA-GLU-VAL-HIS-LEU-ARG-LYS-SER-ALA-PHE-ASP,318,13,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1nc[nH]c1)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)C,Kd=140nM,6.853872,6.85,1,A,A,1,A,A,0,,B,A,,1,1,318,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(C)C,0.8716383576393127,0.775299608707428,94.25484466552734,94.69395446777344,0.3799836337566376,0.7527574300765991,0.9148008227348328,0.8972439169883728,0.8079776763916016,0.7448135018348694,ARAEVHLRKSAFD,Low,"(6.824, 7.049]",train
3EOV,protein-peptide,Q9U9R3,HHHHHHEPEVTAKVYFDVMIDSEPLGRITIGLFGKDAPLTTENFRQLCTGEHGFGYKDSIFHRVIQNFMIQGGDFTNFDGTGGKSIYGEKFADENLNVKHFVGALSMANAGPNTNGSQFFITTAPTPWLDGRHVVFGKVLDGMDVVLRIEKTKTNSHDRPVKPVKIVASGEL,ALLVTAGLVLA,HIS-HIS-HIS-HIS-HIS-HIS-GLU-PRO-GLU-VAL-THR-ALA-LYS-VAL-TYR-PHE-ASP-VAL-MET-ILE-ASP-SER-GLU-PRO-LEU-GLY-ARG-ILE-THR-ILE-GLY-LEU-PHE-GLY-LYS-ASP-ALA-PRO-LEU-THR-THR-GLU-ASN-PHE-ARG-GLN-LEU-CYS-THR-GLY-GLU-HIS-GLY-PHE-GLY-TYR-LYS-ASP-SER-ILE-PHE-HIS-ARG-VAL-ILE-GLN-ASN-PHE-MET-ILE-GLN-GLY-GLY-ASP-PHE-THR-ASN-PHE-ASP-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-GLU-LYS-PHE-ALA-ASP-GLU-ASN-LEU-ASN-VAL-LYS-HIS-PHE-VAL-GLY-ALA-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-THR-THR-ALA-PRO-THR-PRO-TRP-LEU-ASP-GLY-ARG-HIS-VAL-VAL-PHE-GLY-LYS-VAL-LEU-ASP-GLY-MET-ASP-VAL-VAL-LEU-ARG-ILE-GLU-LYS-THR-LYS-THR-ASN-SER-HIS-ASP-ARG-PRO-VAL-LYS-PRO-VAL-LYS-ILE-VAL-ALA-SER-GLY-GLU-LEU,DAL-MLE-MLE-MVA-BMT-ABA-SAR-MLE-VAL-MLE-ALA,172,11,CCCC[C@H]([C@H]([C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)O)C,Kd=63nM,7.200659,7.2,1,A,A,1,A,A,0,,C,A,,1,1,172,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,CCC(NC(=O)C(C)NC(=O)C(CC(C)C)NC)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)C(C)C,0.9666551947593688,0.7891259789466858,94.19104766845705,93.04753875732422,0.3128111660480499,0.5950757265090942,0.9492542147636414,0.8937458992004395,0.923191249370575,0.7629709243774414,ALLVTAGLVLA,Moderate,"(7.049, 7.268]",val
3EQS,protein-peptide,Q00987,ETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVV,TSFAEYWNLLSP,GLU-THR-LEU-VAL-ARG-PRO-LYS-PRO-LEU-LEU-LEU-LYS-LEU-LEU-LYS-SER-VAL-GLY-ALA-GLN-LYS-ASP-THR-TYR-THR-MET-LYS-GLU-VAL-LEU-PHE-TYR-LEU-GLY-GLN-TYR-ILE-MET-THR-LYS-ARG-LEU-TYR-ASP-GLU-LYS-GLN-GLN-HIS-ILE-VAL-TYR-CYS-SER-ASN-ASP-LEU-LEU-GLY-ASP-LEU-PHE-GLY-VAL-PRO-SER-PHE-SER-VAL-LYS-GLU-HIS-ARG-LYS-ILE-TYR-THR-MET-ILE-TYR-ARG-ASN-LEU-VAL-VAL,THR-SER-PHE-ALA-GLU-TYR-TRP-ASN-LEU-LEU-SER-PRO,85,12,OC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CO)Cc1ccccc1)C)CCC(=O)O)Cc1ccc(cc1)O)CC(=O)N)CC(C)C)CC(C)C)C=O,Kd=3.3nM,8.481486,8.48,1,A,A,1,A,A,0,,B,A,,1,1,85,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.978783905506134,0.7903173565864563,97.10257720947266,94.09247589111328,0.2968269288539886,0.6658982634544373,0.9325489401817322,0.849605143070221,0.913023054599762,0.7754953503608704,TSFAEYWNLLSP,Moderate,"(8.383, 8.824]",train
3EQY,protein-peptide,O15151,INQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDAAAQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVT,TSFAEYWNLLSP,ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-ALA-ALA-ALA-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-TYR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR,THR-SER-PHE-ALA-GLU-TYR-TRP-ASN-LEU-LEU-SER-PRO,85,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CO)CC(C)C)CC(C)C)CC(=O)N)Cc1c[nH]c2c1cccc2)Cc1ccc(cc1)O)CCC(=O)O)C)Cc1ccccc1)NC(=O)[C@H]([C@H](O)C)[NH3+],Kd=8.9nM,8.05061,8.05,1,A,A,1,A,A,0,,C,A,,1,1,85,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O,0.9710738658905028,0.8281937837600708,93.71484375,77.42247009277344,0.3072303235530853,0.6301213502883911,0.9276205897331238,0.870309591293335,0.9046176075935364,0.8176648020744324,TSFAEYWNLLSP,Moderate,"(7.921, 8.383]",train
3ERY,protein-peptide,Q02218 P01897,GPHSMRYYETATSRRGLGEPRYTSVGYVDDKEFVRFDSDAENPRYEPQVPWMEQEGPEYWERITQVAKGQEQWFRVNLRTLLGYYNQSAGGTHTLQRMYGCDVGSDGRLLRGYEQFAYDGCDYIALNEDLRTWTAADMAAQITRRKWEQAGAAEYYRAYLEGECVEWLHRYLKN,QLSPFPFDL,GLY-PRO-HIS-SER-MET-ARG-TYR-TYR-GLU-THR-ALA-THR-SER-ARG-ARG-GLY-LEU-GLY-GLU-PRO-ARG-TYR-THR-SER-VAL-GLY-TYR-VAL-ASP-ASP-LYS-GLU-PHE-VAL-ARG-PHE-ASP-SER-ASP-ALA-GLU-ASN-PRO-ARG-TYR-GLU-PRO-GLN-VAL-PRO-TRP-MET-GLU-GLN-GLU-GLY-PRO-GLU-TYR-TRP-GLU-ARG-ILE-THR-GLN-VAL-ALA-LYS-GLY-GLN-GLU-GLN-TRP-PHE-ARG-VAL-ASN-LEU-ARG-THR-LEU-LEU-GLY-TYR-TYR-ASN-GLN-SER-ALA-GLY-GLY-THR-HIS-THR-LEU-GLN-ARG-MET-TYR-GLY-CYS-ASP-VAL-GLY-SER-ASP-GLY-ARG-LEU-LEU-ARG-GLY-TYR-GLU-GLN-PHE-ALA-TYR-ASP-GLY-CYS-ASP-TYR-ILE-ALA-LEU-ASN-GLU-ASP-LEU-ARG-THR-TRP-THR-ALA-ALA-ASP-MET-ALA-ALA-GLN-ILE-THR-ARG-ARG-LYS-TRP-GLU-GLN-ALA-GLY-ALA-ALA-GLU-TYR-TYR-ARG-ALA-TYR-LEU-GLU-GLY-GLU-CYS-VAL-GLU-TRP-LEU-HIS-ARG-TYR-LEU-LYS-ASN,GLN-LEU-SER-PRO-PHE-PRO-PHE-ASP-LEU,174,9,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)O)Cc1ccccc1)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CC(C)C,Kd=2200nM,5.657577,5.66,1,A,A,1,A,A,0,,P,A,,0,1,174,9,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9709206819534302,0.9288503527641296,93.99820709228516,93.08419799804688,0.2966730892658233,0.4126470685005188,0.9493165016174316,0.9460216164588928,0.945583999156952,0.9245575070381165,QLSPFPFDL,Low,"(5.6, 5.699]",train
3EU7,protein-peptide,P51587 Q86YC2,GPHMSVEQTETAELPASDSINPGNLQLVSELKNPSGSCSVDVSAMFWERAGCKEPCIITACEDVVSLWKALDAWQWEKLYTWHFAEVPVLQIVPVPDVYNLVCVALGNLEIREIRALFCSSDDESEKQVLLKSGNIKAVLGLTKRRLVSSSGTLSDQQVEVMTFAEDGGGKENQFLMPPEETILTFAEVQGMQEALLGTTIMNNIVIWNLKTGQLLKKMHIDDSYQASVCHKAYSEMGLLFIVLSHPCAKESESLRSPVFQLIVINPKTTLSVGVMLYCLPPGQAGRFLEGDVKDHCAAAILTSGTIAIWDLLLGQCTALLPPVSDQHWSFVKWSGTDSHLLAGQKDGNIFVYHYS,KADLGPISLNWFEELSSEA,GLY-PRO-HIS-MET-SER-VAL-GLU-GLN-THR-GLU-THR-ALA-GLU-LEU-PRO-ALA-SER-ASP-SER-ILE-ASN-PRO-GLY-ASN-LEU-GLN-LEU-VAL-SER-GLU-LEU-LYS-ASN-PRO-SER-GLY-SER-CYS-SER-VAL-ASP-VAL-SER-ALA-MET-PHE-TRP-GLU-ARG-ALA-GLY-CYS-LYS-GLU-PRO-CYS-ILE-ILE-THR-ALA-CYS-GLU-ASP-VAL-VAL-SER-LEU-TRP-LYS-ALA-LEU-ASP-ALA-TRP-GLN-TRP-GLU-LYS-LEU-TYR-THR-TRP-HIS-PHE-ALA-GLU-VAL-PRO-VAL-LEU-GLN-ILE-VAL-PRO-VAL-PRO-ASP-VAL-TYR-ASN-LEU-VAL-CYS-VAL-ALA-LEU-GLY-ASN-LEU-GLU-ILE-ARG-GLU-ILE-ARG-ALA-LEU-PHE-CYS-SER-SER-ASP-ASP-GLU-SER-GLU-LYS-GLN-VAL-LEU-LEU-LYS-SER-GLY-ASN-ILE-LYS-ALA-VAL-LEU-GLY-LEU-THR-LYS-ARG-ARG-LEU-VAL-SER-SER-SER-GLY-THR-LEU-SER-ASP-GLN-GLN-VAL-GLU-VAL-MET-THR-PHE-ALA-GLU-ASP-GLY-GLY-GLY-LYS-GLU-ASN-GLN-PHE-LEU-MET-PRO-PRO-GLU-GLU-THR-ILE-LEU-THR-PHE-ALA-GLU-VAL-GLN-GLY-MET-GLN-GLU-ALA-LEU-LEU-GLY-THR-THR-ILE-MET-ASN-ASN-ILE-VAL-ILE-TRP-ASN-LEU-LYS-THR-GLY-GLN-LEU-LEU-LYS-LYS-MET-HIS-ILE-ASP-ASP-SER-TYR-GLN-ALA-SER-VAL-CYS-HIS-LYS-ALA-TYR-SER-GLU-MET-GLY-LEU-LEU-PHE-ILE-VAL-LEU-SER-HIS-PRO-CYS-ALA-LYS-GLU-SER-GLU-SER-LEU-ARG-SER-PRO-VAL-PHE-GLN-LEU-ILE-VAL-ILE-ASN-PRO-LYS-THR-THR-LEU-SER-VAL-GLY-VAL-MET-LEU-TYR-CYS-LEU-PRO-PRO-GLY-GLN-ALA-GLY-ARG-PHE-LEU-GLU-GLY-ASP-VAL-LYS-ASP-HIS-CSD-ALA-ALA-ALA-ILE-LEU-THR-SER-GLY-THR-ILE-ALA-ILE-TRP-ASP-LEU-LEU-LEU-GLY-GLN-CYS-THR-ALA-LEU-LEU-PRO-PRO-VAL-SER-ASP-GLN-HIS-TRP-SER-PHE-VAL-LYS-TRP-SER-GLY-THR-ASP-SER-HIS-LEU-LEU-ALA-GLY-GLN-LYS-ASP-GLY-ASN-ILE-PHE-VAL-TYR-HIS-TYR-SER,LYS-ALA-ASP-LEU-GLY-PRO-ILE-SER-LEU-ASN-TRP-PHE-GLU-GLU-LEU-SER-SER-GLU-ALA,356,19,O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]([NH3+])C)CO)CC(C)C)CC(=O)N)Cc1ccccc1)CCC(=O)O)CCC(=O)O)CC(C)C)CO)C,Kd=0.66uM,6.180456,6.18,1,A,A,1,A,A,0,,X,A,,1,1,356,19,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,0.9233336448669434,0.6952018141746521,80.65495300292969,75.6975326538086,0.571750819683075,1.1007883548736572,0.8517292737960815,0.7738826274871826,0.876234769821167,0.6404192447662354,KADLGPISLNWFEELSSEA,Low,"(6.097, 6.26]",train
3FDT,protein-peptide,P45973 P68431,GEEYVVEKVLDRRVVKGQVEYLLKWKGFSEEHNTWEPEKNLDCPELISEFMKKYKKMKE,ARTKQTARKSTGGKA,GLY-GLU-GLU-TYR-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-VAL-VAL-LYS-GLY-GLN-VAL-GLU-TYR-LEU-LEU-LYS-TRP-LYS-GLY-PHE-SER-GLU-GLU-HIS-ASN-THR-TRP-GLU-PRO-GLU-LYS-ASN-LEU-ASP-CYS-PRO-GLU-LEU-ILE-SER-GLU-PHE-MET-LYS-LYS-TYR-LYS-LYS-MET-LYS-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,59,15,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)C)CCC(=O)N)C)C)CCCC[N+](C)(C)C,Kd=30uM,4.522879,4.52,1,A,A,1,A,A,0,,T,A,,1,1,59,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9366559982299804,0.7100633978843689,91.90412139892578,89.4808349609375,0.3337291479110718,0.7640768885612488,0.8806105852127075,0.7799053192138672,0.8239781260490417,0.6926028728485107,ARTKQTARKSTGGKA,Low,"(4.456, 4.606]",val
3FWV,protein-peptide,P31948 P08238,SKQALKEKELGNDAYKKKDFDTALKHYDKAKELDPTNMTYIVNQAAVYFEKGDYNKCRELCEKAIEVGRENREDYRMIAYAYARIGNSYFKEEKYKDAIHFYNKSLAEHRTPKVLKKCQQAEKILKEQ,MEEVF,SER-LYS-GLN-ALA-LEU-LYS-GLU-LYS-GLU-LEU-GLY-ASN-ASP-ALA-TYR-LYS-LYS-LYS-ASP-PHE-ASP-THR-ALA-LEU-LYS-HIS-TYR-ASP-LYS-ALA-LYS-GLU-LEU-ASP-PRO-THR-ASN-MET-THR-TYR-ILE-VAL-ASN-GLN-ALA-ALA-VAL-TYR-PHE-GLU-LYS-GLY-ASP-TYR-ASN-LYS-CYS-ARG-GLU-LEU-CYS-GLU-LYS-ALA-ILE-GLU-VAL-GLY-ARG-GLU-ASN-ARG-GLU-ASP-TYR-ARG-MET-ILE-ALA-TYR-ALA-TYR-ALA-ARG-ILE-GLY-ASN-SER-TYR-PHE-LYS-GLU-GLU-LYS-TYR-LYS-ASP-ALA-ILE-HIS-PHE-TYR-ASN-LYS-SER-LEU-ALA-GLU-HIS-ARG-THR-PRO-LYS-VAL-LEU-LYS-LYS-CYS-GLN-GLN-ALA-GLU-LYS-ILE-LEU-LYS-GLU-GLN,ACE-MET-GLU-GLU-VAL-PHE,128,6,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)C(C)C)CCC(=O)O)CCC(=O)O)NC(=O)C,Kd=2.3uM,5.638272,5.64,1,A,A,1,A,A,0,,C,A,,1,1,128,6,0,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,,CSCC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.9745617508888244,0.9164654016494752,96.13782501220705,96.11089324951172,0.2744459807872772,0.4129022061824798,0.9493436217308044,0.939025104045868,0.9573699831962584,0.910825490951538,MEEVF,Low,"(5.6, 5.699]",val
3G2W,protein-peptide,Q9UJY5,GSMEPAMEPETLEARINRATNPLNKELDWASINGFCEQLNEDFEGPPLATRLLAHKIQSPQEWEAIQALTVLETCMKSCGKRFHDEVGKFRFLNELIKVVSPKYLGSRTSEKVKNKILELLYSWTVGLPEEVKIAEAYQMLKKQGIVKS,SASVSLLDDELMSL,GLY-SER-MET-GLU-PRO-ALA-MET-GLU-PRO-GLU-THR-LEU-GLU-ALA-ARG-ILE-ASN-ARG-ALA-THR-ASN-PRO-LEU-ASN-LYS-GLU-LEU-ASP-TRP-ALA-SER-ILE-ASN-GLY-PHE-CYS-GLU-GLN-LEU-ASN-GLU-ASP-PHE-GLU-GLY-PRO-PRO-LEU-ALA-THR-ARG-LEU-LEU-ALA-HIS-LYS-ILE-GLN-SER-PRO-GLN-GLU-TRP-GLU-ALA-ILE-GLN-ALA-LEU-THR-VAL-LEU-GLU-THR-CYS-MET-LYS-SER-CYS-GLY-LYS-ARG-PHE-HIS-ASP-GLU-VAL-GLY-LYS-PHE-ARG-PHE-LEU-ASN-GLU-LEU-ILE-LYS-VAL-VAL-SER-PRO-LYS-TYR-LEU-GLY-SER-ARG-THR-SER-GLU-LYS-VAL-LYS-ASN-LYS-ILE-LEU-GLU-LEU-LEU-TYR-SER-TRP-THR-VAL-GLY-LEU-PRO-GLU-GLU-VAL-LYS-ILE-ALA-GLU-ALA-TYR-GLN-MET-LEU-LYS-LYS-GLN-GLY-ILE-VAL-LYS-SER,SER-ALA-SER-VAL-SEP-LEU-LEU-ASP-ASP-GLU-LEU-MET-SER-LEU,149,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CC(=O)O)CC(=O)O)CCC(=O)O)CC(C)C,Kd=2.2uM,5.657577,5.66,1,A,A,1,A,A,0,,C,A,,1,1,149,14,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)NC(COP(=O)(O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)O,0.9353402256965636,0.7654757499694824,92.7780990600586,91.6575164794922,0.3086987435817718,0.6912789344787598,0.9313147664070128,0.8565287590026855,0.8558250665664673,0.7427124381065369,SASVSLLDDELMSL,Low,"(5.6, 5.699]",train
3G7L,protein-peptide,P09988 Q10103,GETDADVYEVEDILADRVNKNGINEYYIKWAGYDWYDNTWEPEQNLFGAEKVLKKWKKRKK,ARTKQTARKSTGGKAY,GLY-GLU-THR-ASP-ALA-ASP-VAL-TYR-GLU-VAL-GLU-ASP-ILE-LEU-ALA-ASP-ARG-VAL-ASN-LYS-ASN-GLY-ILE-ASN-GLU-TYR-TYR-ILE-LYS-TRP-ALA-GLY-TYR-ASP-TRP-TYR-ASP-ASN-THR-TRP-GLU-PRO-GLU-GLN-ASN-LEU-PHE-GLY-ALA-GLU-LYS-VAL-LEU-LYS-LYS-TRP-LYS-LYS-ARG-LYS-LYS,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA-TYR,61,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)[C@H](O)C)CCC(=O)N)[NH3+],Kd=0.19uM,6.721246,6.72,1,A,A,1,A,A,0,,P,A,,1,1,61,16,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9264492392539978,0.788787841796875,91.10355377197266,88.2375259399414,0.3483114242553711,0.6551253795623779,0.8730000853538513,0.822546124458313,0.8099414110183716,0.7701023817062378,ARTKQTARKSTGGKAY,Low,"(6.696, 6.824]",train
3GDS,protein-peptide,P0AEE3,MRGSHHHHHHGRSLNPLSTPQFDSTDETPASYNLAVRRAAPAVVNVYNRGLNTNSHNQLEIRTLGSGVIMDQRGYIITNKHVINDADQIIVALQDGRVFEALLVGSDSLTDLAVLKINATGGLPTIPINARRVPHIGDVVLAIGNPYNLGQTITQGIISATGRIGLNPTGRQNFLQTDASINPGNSGGALVNSLGELMGINTLSFDKSNDGETPEGIGFAIPFQLATKIMDKLIRDGRVIRGYIGIGGREIAPLHAQGGGIDQLQGIVVNEVSPDGPAANAGIQVNDLIISVDNKPAISALETMAQVAEIRPGSVIPVVVMRDDKQLTLQVTIQEYPATN,DNRDGNVYYF,MET-ARG-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLY-ARG-SER-LEU-ASN-PRO-LEU-SER-THR-PRO-GLN-PHE-ASP-SER-THR-ASP-GLU-THR-PRO-ALA-SER-TYR-ASN-LEU-ALA-VAL-ARG-ARG-ALA-ALA-PRO-ALA-VAL-VAL-ASN-VAL-TYR-ASN-ARG-GLY-LEU-ASN-THR-ASN-SER-HIS-ASN-GLN-LEU-GLU-ILE-ARG-THR-LEU-GLY-SER-GLY-VAL-ILE-MET-ASP-GLN-ARG-GLY-TYR-ILE-ILE-THR-ASN-LYS-HIS-VAL-ILE-ASN-ASP-ALA-ASP-GLN-ILE-ILE-VAL-ALA-LEU-GLN-ASP-GLY-ARG-VAL-PHE-GLU-ALA-LEU-LEU-VAL-GLY-SER-ASP-SER-LEU-THR-ASP-LEU-ALA-VAL-LEU-LYS-ILE-ASN-ALA-THR-GLY-GLY-LEU-PRO-THR-ILE-PRO-ILE-ASN-ALA-ARG-ARG-VAL-PRO-HIS-ILE-GLY-ASP-VAL-VAL-LEU-ALA-ILE-GLY-ASN-PRO-TYR-ASN-LEU-GLY-GLN-THR-ILE-THR-GLN-GLY-ILE-ILE-SER-ALA-THR-GLY-ARG-ILE-GLY-LEU-ASN-PRO-THR-GLY-ARG-GLN-ASN-PHE-LEU-GLN-THR-ASP-ALA-SER-ILE-ASN-PRO-GLY-ASN-MIS-GLY-GLY-ALA-LEU-VAL-ASN-SER-LEU-GLY-GLU-LEU-MET-GLY-ILE-ASN-THR-LEU-SER-PHE-ASP-LYS-SER-ASN-ASP-GLY-GLU-THR-PRO-GLU-GLY-ILE-GLY-PHE-ALA-ILE-PRO-PHE-GLN-LEU-ALA-THR-LYS-ILE-MET-ASP-LYS-LEU-ILE-ARG-ASP-GLY-ARG-VAL-ILE-ARG-GLY-TYR-ILE-GLY-ILE-GLY-GLY-ARG-GLU-ILE-ALA-PRO-LEU-HIS-ALA-GLN-GLY-GLY-GLY-ILE-ASP-GLN-LEU-GLN-GLY-ILE-VAL-VAL-ASN-GLU-VAL-SER-PRO-ASP-GLY-PRO-ALA-ALA-ASN-ALA-GLY-ILE-GLN-VAL-ASN-ASP-LEU-ILE-ILE-SER-VAL-ASP-ASN-LYS-PRO-ALA-ILE-SER-ALA-LEU-GLU-THR-MET-ALA-GLN-VAL-ALA-GLU-ILE-ARG-PRO-GLY-SER-VAL-ILE-PRO-VAL-VAL-VAL-MET-ARG-ASP-ASP-LYS-GLN-LEU-THR-LEU-GLN-VAL-THR-ILE-GLN-GLU-TYR-PRO-ALA-THR-ASN,ASP-ASN-ARG-ASP-GLY-ASN-VAL-TYR-TYR-PHE,340,10,Oc1ccc(cc1)C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])Cc1ccc(cc1)O,Kd=0.31uM,6.508638,6.51,1,A,A,1,A,A,0,,B,A,,1,1,340,10,0,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.8171527981758118,0.8125335574150085,67.96286010742188,68.19120025634766,0.6224302649497986,0.9258325695991516,0.7610273361206055,0.7759345769882202,0.7615412473678589,0.7683744430541992,DNRDGNVYYF,Low,"(6.398, 6.523]",val
3GV6,protein-peptide,O95503 P84233,ERVFAAESIIKRRIRKGRIEYLVKWKGWAIKYSTWEPEENILDSRLIAAFEQKERERE,ARTKQTARKSTGGKA,GLU-ARG-VAL-PHE-ALA-ALA-GLU-SER-ILE-ILE-LYS-ARG-ARG-ILE-ARG-LYS-GLY-ARG-ILE-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-ALA-ILE-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-ASN-ILE-LEU-ASP-SER-ARG-LEU-ILE-ALA-ALA-PHE-GLU-GLN-LYS-GLU-ARG-GLU-ARG-GLU,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS-ALA,58,15,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd>500uM,3.3,3.3,1,A,A,1,A,A,0,,B,A,,1,1,58,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.9416127800941468,0.8749805688858032,92.38057708740234,95.3346939086914,0.3305251598358154,0.4861165285110473,0.8805132508277893,0.897712230682373,0.8284629583358765,0.8692976236343384,ARTKQTARKSTGGKA,Low,"(2.044, 3.548]",val
3H1Z,protein-peptide,O60331 P62944,MGSSHHHHHHSSGLVPRGSHMASGMAPGGYVAPKAVWLPAVKAKGLEISGTFTHRQGHIYMEMNFTNKALQHMTDFAIQFNKNSFGVIPSTPLAIHTPLMPNQSIDVSLPLNTLGPVMKMEPLNNLQVAVKNNIDVFYFSCLIPLNVLFVEDGKMERQVFLATWKDIPNENELQFQIKECHLNADTVSSKLQNNNVYTIAKRNVEGQDMLYQSLKLTNGIWILAELRIQPGNPNYTLSLKCRAPEVSQYIYQVYDSILKN,YFPTDERSWVYSPLH,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-SER-GLY-MET-ALA-PRO-GLY-GLY-TYR-VAL-ALA-PRO-LYS-ALA-VAL-TRP-LEU-PRO-ALA-VAL-LYS-ALA-LYS-GLY-LEU-GLU-ILE-SER-GLY-THR-PHE-THR-HIS-ARG-GLN-GLY-HIS-ILE-TYR-MET-GLU-MET-ASN-PHE-THR-ASN-LYS-ALA-LEU-GLN-HIS-MET-THR-ASP-PHE-ALA-ILE-GLN-PHE-ASN-LYS-ASN-SER-PHE-GLY-VAL-ILE-PRO-SER-THR-PRO-LEU-ALA-ILE-HIS-THR-PRO-LEU-MET-PRO-ASN-GLN-SER-ILE-ASP-VAL-SER-LEU-PRO-LEU-ASN-THR-LEU-GLY-PRO-VAL-MET-LYS-MET-GLU-PRO-LEU-ASN-ASN-LEU-GLN-VAL-ALA-VAL-LYS-ASN-ASN-ILE-ASP-VAL-PHE-TYR-PHE-SER-CYS-LEU-ILE-PRO-LEU-ASN-VAL-LEU-PHE-VAL-GLU-ASP-GLY-LYS-MET-GLU-ARG-GLN-VAL-PHE-LEU-ALA-THR-TRP-LYS-ASP-ILE-PRO-ASN-GLU-ASN-GLU-LEU-GLN-PHE-GLN-ILE-LYS-GLU-CYS-HIS-LEU-ASN-ALA-ASP-THR-VAL-SER-SER-LYS-LEU-GLN-ASN-ASN-ASN-VAL-TYR-THR-ILE-ALA-LYS-ARG-ASN-VAL-GLU-GLY-GLN-ASP-MET-LEU-TYR-GLN-SER-LEU-LYS-LEU-THR-ASN-GLY-ILE-TRP-ILE-LEU-ALA-GLU-LEU-ARG-ILE-GLN-PRO-GLY-ASN-PRO-ASN-TYR-THR-LEU-SER-LEU-LYS-CYS-ARG-ALA-PRO-GLU-VAL-SER-GLN-TYR-ILE-TYR-GLN-VAL-TYR-ASP-SER-ILE-LEU-LYS-ASN,TYR-PHE-PRO-THR-ASP-GLU-ARG-SER-TRP-VAL-TYR-SER-PRO-LEU-HIS,260,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1nc[nH]c1)CC(C)C)CO)Cc1ccc(cc1)O)C(C)C)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1C=CCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])Cc1ccccc1)CC(=O)O)CCC(=O)O)CCC[NH+]=C(N)N,Kd=22uM,4.657577,4.66,1,A,A,1,A,A,0,,P,A,,1,1,260,15,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)O,0.8126115202903748,0.7988644242286682,83.19319152832031,83.3888168334961,0.4747017025947571,0.8521609306335449,0.8259138464927673,0.7964580655097961,0.7070132493972778,0.727350652217865,YFPTDERSWVYSPLH,Low,"(4.606, 4.745]",train
3H52,protein-peptide,O75376 P04150,GSHMLTPTLVSLLEVIEPEVLYAGYDSSVPDSTWRIMTTLNMLGGRQVIAAVKWAKAIPGFRNLHLDDQMTLLQYSWMSLMAFALGWRSYRQSSANLLCFAPDLIINEQRMTLPDMYDQCKHMLYVSSELHRLQVSYEEYLCMKTLLLLSSVPKDGLKSQALFDAIRMTYIKELGKAIVKREGNSSQNSQRFYQLTKLLDSMHEVVENLLNYCFQTFLDKTMSIEFPEMLAEIITNQIPKYSNGNIKKLLFHQK,ASNLGLEDIIRKALMGSFD,GLY-SER-HIS-MET-LEU-THR-PRO-THR-LEU-VAL-SER-LEU-LEU-GLU-VAL-ILE-GLU-PRO-GLU-VAL-LEU-TYR-ALA-GLY-TYR-ASP-SER-SER-VAL-PRO-ASP-SER-THR-TRP-ARG-ILE-MET-THR-THR-LEU-ASN-MET-LEU-GLY-GLY-ARG-GLN-VAL-ILE-ALA-ALA-VAL-LYS-TRP-ALA-LYS-ALA-ILE-PRO-GLY-PHE-ARG-ASN-LEU-HIS-LEU-ASP-ASP-GLN-MET-THR-LEU-LEU-GLN-TYR-SER-TRP-MET-SER-LEU-MET-ALA-PHE-ALA-LEU-GLY-TRP-ARG-SER-TYR-ARG-GLN-SER-SER-ALA-ASN-LEU-LEU-CYS-PHE-ALA-PRO-ASP-LEU-ILE-ILE-ASN-GLU-GLN-ARG-MET-THR-LEU-PRO-ASP-MET-TYR-ASP-GLN-CYS-LYS-HIS-MET-LEU-TYR-VAL-SER-SER-GLU-LEU-HIS-ARG-LEU-GLN-VAL-SER-TYR-GLU-GLU-TYR-LEU-CYS-MET-LYS-THR-LEU-LEU-LEU-LEU-SER-SER-VAL-PRO-LYS-ASP-GLY-LEU-LYS-SER-GLN-ALA-LEU-PHE-ASP-ALA-ILE-ARG-MET-THR-TYR-ILE-LYS-GLU-LEU-GLY-LYS-ALA-ILE-VAL-LYS-ARG-GLU-GLY-ASN-SER-SER-GLN-ASN-SER-GLN-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-MET-HIS-GLU-VAL-VAL-GLU-ASN-LEU-LEU-ASN-TYR-CYS-PHE-GLN-THR-PHE-LEU-ASP-LYS-THR-MET-SER-ILE-GLU-PHE-PRO-GLU-MET-LEU-ALA-GLU-ILE-ILE-THR-ASN-GLN-ILE-PRO-LYS-TYR-SER-ASN-GLY-ASN-ILE-LYS-LYS-LEU-LEU-PHE-HIS-GLN-LYS,ALA-SER-ASN-LEU-GLY-LEU-GLU-ASP-ILE-ILE-ARG-LYS-ALA-LEU-MET-GLY-SER-PHE-ASP,254,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C=O)CO)CCSC)CC(C)C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)CC(C)C)CCC(=O)O)CC(=O)O)CCC[NH+]=C(N)N,Kd=14uM,4.853872,4.85,1,A,A,1,A,A,0,,M,A,,0,1,254,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)[C@@H](C)CC,0.8929696083068848,0.7287890911102295,87.32675170898438,82.97752380371094,0.3908759355545044,0.9453166127204896,0.9192700386047364,0.8400274515151978,0.8406068682670593,0.6960581541061401,ASNLGLEDIIRKALMGSFD,Low,"(4.745, 4.866]",train
3H6Z,protein-peptide,Q9VK33,GAMGSYDWLPRLSKENFNAAPVTCFPHAPGCEVWDNLGVGMKVEVENTDCDSIEVIQPGQTPTSFWVATILEIKGYKALMSYEGFDTDSHDFWVNLCNAEVHSVGWCATRGKPLIPPRTIEHKYKDWKDFLVGRLSGARTLPSNFYNKINDSLQSRFRLGLNLECVDKDRISQVRLATVTKIVGDRLFLRYFDSDDGFWCHEDSPIIHPVGWATTVGHNLAAPQDYLERMLAGREAMIEVHEDDATIELFKMNFTFDEYYSDGKTNSFVEGMKLEAVDPLNLSSICPATVMAVLKFGYMMIRIDSYQPDASGSDWFCYHEKSPCIFPAGFCSVNNISVTPPNGYDSRTFTWEGYLSDTGAVAAGQHLFHDIIPDHGFEVGMSLECADLMDPRLVCVATVARVVGRLLKVHFDGWTDEYDQWLDCESADIYPVGWCVLVNHKLEGPPR,HRKVLR,GLY-ALA-MET-GLY-SER-TYR-ASP-TRP-LEU-PRO-ARG-LEU-SER-LYS-GLU-ASN-PHE-ASN-ALA-ALA-PRO-VAL-THR-CYS-PHE-PRO-HIS-ALA-PRO-GLY-CYS-GLU-VAL-TRP-ASP-ASN-LEU-GLY-VAL-GLY-MET-LYS-VAL-GLU-VAL-GLU-ASN-THR-ASP-CYS-ASP-SER-ILE-GLU-VAL-ILE-GLN-PRO-GLY-GLN-THR-PRO-THR-SER-PHE-TRP-VAL-ALA-THR-ILE-LEU-GLU-ILE-LYS-GLY-TYR-LYS-ALA-LEU-MET-SER-TYR-GLU-GLY-PHE-ASP-THR-ASP-SER-HIS-ASP-PHE-TRP-VAL-ASN-LEU-CYS-ASN-ALA-GLU-VAL-HIS-SER-VAL-GLY-TRP-CYS-ALA-THR-ARG-GLY-LYS-PRO-LEU-ILE-PRO-PRO-ARG-THR-ILE-GLU-HIS-LYS-TYR-LYS-ASP-TRP-LYS-ASP-PHE-LEU-VAL-GLY-ARG-LEU-SER-GLY-ALA-ARG-THR-LEU-PRO-SER-ASN-PHE-TYR-ASN-LYS-ILE-ASN-ASP-SER-LEU-GLN-SER-ARG-PHE-ARG-LEU-GLY-LEU-ASN-LEU-GLU-CYS-VAL-ASP-LYS-ASP-ARG-ILE-SER-GLN-VAL-ARG-LEU-ALA-THR-VAL-THR-LYS-ILE-VAL-GLY-ASP-ARG-LEU-PHE-LEU-ARG-TYR-PHE-ASP-SER-ASP-ASP-GLY-PHE-TRP-CYS-HIS-GLU-ASP-SER-PRO-ILE-ILE-HIS-PRO-VAL-GLY-TRP-ALA-THR-THR-VAL-GLY-HIS-ASN-LEU-ALA-ALA-PRO-GLN-ASP-TYR-LEU-GLU-ARG-MET-LEU-ALA-GLY-ARG-GLU-ALA-MET-ILE-GLU-VAL-HIS-GLU-ASP-ASP-ALA-THR-ILE-GLU-LEU-PHE-LYS-MET-ASN-PHE-THR-PHE-ASP-GLU-TYR-TYR-SER-ASP-GLY-LYS-THR-ASN-SER-PHE-VAL-GLU-GLY-MET-LYS-LEU-GLU-ALA-VAL-ASP-PRO-LEU-ASN-LEU-SER-SER-ILE-CYS-PRO-ALA-THR-VAL-MET-ALA-VAL-LEU-LYS-PHE-GLY-TYR-MET-MET-ILE-ARG-ILE-ASP-SER-TYR-GLN-PRO-ASP-ALA-SER-GLY-SER-ASP-TRP-PHE-CYS-TYR-HIS-GLU-LYS-SER-PRO-CYS-ILE-PHE-PRO-ALA-GLY-PHE-CYS-SER-VAL-ASN-ASN-ILE-SER-VAL-THR-PRO-PRO-ASN-GLY-TYR-ASP-SER-ARG-THR-PHE-THR-TRP-GLU-GLY-TYR-LEU-SER-ASP-THR-GLY-ALA-VAL-ALA-ALA-GLY-GLN-HIS-LEU-PHE-HIS-ASP-ILE-ILE-PRO-ASP-HIS-GLY-PHE-GLU-VAL-GLY-MET-SER-LEU-GLU-CYS-ALA-ASP-LEU-MET-ASP-PRO-ARG-LEU-VAL-CYS-VAL-ALA-THR-VAL-ALA-ARG-VAL-VAL-GLY-ARG-LEU-LEU-LYS-VAL-HIS-PHE-ASP-GLY-TRP-THR-ASP-GLU-TYR-ASP-GLN-TRP-LEU-ASP-CYS-GLU-SER-ALA-ASP-ILE-TYR-PRO-VAL-GLY-TRP-CYS-VAL-LEU-VAL-ASN-HIS-LYS-LEU-GLU-GLY-PRO-PRO-ARG,HIS-ARG-MLZ-VAL-LEU-ARG,447,6,C[NH2+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1[nH]cnc1)[NH3+])CCC[NH+]=C(N)N,Kd=1.5uM,5.823909,5.82,1,A,A,1,A,A,0,,L,A,,1,1,447,6,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CNCCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CNCCCCC(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.7988236546516418,0.8338444232940674,86.261962890625,84.80072784423828,0.437597244977951,0.6391040682792664,0.9030648469924928,0.8895957469940186,0.7644851803779602,0.8199065923690796,HRKVLR,Low,"(5.821, 5.959]",val
3H85,protein-peptide,O60331 P84092,MGSSHHHHHHSSGLVPRGSHMQIGWRREGIKYRRNELFLDVLESVNLLMSPQGQVLSAHVSGRVVMKSYLSGMPECKFGMNDKIVIEKQGKGTADETSKSGKQSIAIDDCTFHQCVRLSKFDSERSISFIPPDGEFELMRYRTTKDIILPFRVIPLVREVGRTKLEVKVVIKSNFKPSLLAQKIEVRIPTPLNTSGVQVICMKGKAKYKASENAIVWKIKRMAGMKESQISAEIELLPTNDKKKWARPPISMNFEVPFAPSGLKVRYLKVFEPKLNYSDHDVIKWVRYIGRSGIYETRC,SWVYSPLH,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-GLN-ILE-GLY-TRP-ARG-ARG-GLU-GLY-ILE-LYS-TYR-ARG-ARG-ASN-GLU-LEU-PHE-LEU-ASP-VAL-LEU-GLU-SER-VAL-ASN-LEU-LEU-MET-SER-PRO-GLN-GLY-GLN-VAL-LEU-SER-ALA-HIS-VAL-SER-GLY-ARG-VAL-VAL-MET-LYS-SER-TYR-LEU-SER-GLY-MET-PRO-GLU-CYS-LYS-PHE-GLY-MET-ASN-ASP-LYS-ILE-VAL-ILE-GLU-LYS-GLN-GLY-LYS-GLY-THR-ALA-ASP-GLU-THR-SER-LYS-SER-GLY-LYS-GLN-SER-ILE-ALA-ILE-ASP-ASP-CYS-THR-PHE-HIS-GLN-CYS-VAL-ARG-LEU-SER-LYS-PHE-ASP-SER-GLU-ARG-SER-ILE-SER-PHE-ILE-PRO-PRO-ASP-GLY-GLU-PHE-GLU-LEU-MET-ARG-TYR-ARG-THR-THR-LYS-ASP-ILE-ILE-LEU-PRO-PHE-ARG-VAL-ILE-PRO-LEU-VAL-ARG-GLU-VAL-GLY-ARG-THR-LYS-LEU-GLU-VAL-LYS-VAL-VAL-ILE-LYS-SER-ASN-PHE-LYS-PRO-SER-LEU-LEU-ALA-GLN-LYS-ILE-GLU-VAL-ARG-ILE-PRO-THR-PRO-LEU-ASN-THR-SER-GLY-VAL-GLN-VAL-ILE-CYS-MET-LYS-GLY-LYS-ALA-LYS-TYR-LYS-ALA-SER-GLU-ASN-ALA-ILE-VAL-TRP-LYS-ILE-LYS-ARG-MET-ALA-GLY-MET-LYS-GLU-SER-GLN-ILE-SER-ALA-GLU-ILE-GLU-LEU-LEU-PRO-THR-ASN-ASP-LYS-LYS-LYS-TRP-ALA-ARG-PRO-PRO-ILE-SER-MET-ASN-PHE-GLU-VAL-PRO-PHE-ALA-PRO-SER-GLY-LEU-LYS-VAL-ARG-TYR-LEU-LYS-VAL-PHE-GLU-PRO-LYS-LEU-ASN-TYR-SER-ASP-HIS-ASP-VAL-ILE-LYS-TRP-VAL-ARG-TYR-ILE-GLY-ARG-SER-GLY-ILE-TYR-GLU-THR-ARG-CYS,SER-TRP-VAL-TYR-SER-PRO-LEU-HIS,299,8,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]cn1)CC(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](CO)[NH3+],Kd=6uM,5.221849,5.22,1,A,A,1,A,A,0,,P,A,,1,1,299,8,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.9514604806900024,0.8938884139060974,81.27593994140625,76.23439025878906,0.5170299410820007,0.6853235960006714,0.8167483806610107,0.8112204074859619,0.9057410955429076,0.8455754518508911,SWVYSPLH,Low,"(5.105, 5.222]",train
3H91,protein-peptide,Q92133 Q14781,EQVFAAECILSKRLRKGKLEYLVKWRGWSSKHNSWEPEENILDPRLLLAFQKKE,QLATKAARKSAPATG,GLU-GLN-VAL-PHE-ALA-ALA-GLU-CYS-ILE-LEU-SER-LYS-ARG-LEU-ARG-LYS-GLY-LYS-LEU-GLU-TYR-LEU-VAL-LYS-TRP-ARG-GLY-TRP-SER-SER-LYS-HIS-ASN-SER-TRP-GLU-PRO-GLU-GLU-ASN-ILE-LEU-ASP-PRO-ARG-LEU-LEU-LEU-ALA-PHE-GLN-LYS-LYS-GLU,GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-M3L-SER-ALA-PRO-ALA-THR-GLY,54,15,OC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])C)CCCC[NH3+])C)C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=185uM,3.732828,3.73,1,A,A,1,A,A,0,,C,A,,1,1,54,15,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,0.964158058166504,0.848391056060791,89.99104309082031,93.0630111694336,0.3153629004955292,0.5148728489875793,0.8911422491073608,0.8780272603034973,0.846542477607727,0.8409819602966309,QLATKAARKSAPATG,Low,"(3.548, 3.924]",val
3HIK,protein-peptide,P53350,GEVVDCHLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSRSASNRLKAS,PLHST,GLY-GLU-VAL-VAL-ASP-CYS-HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG-SER-ALA-SER-ASN-ARG-LEU-LYS-ALA-SER,ACE-PRO-LEU-HIS-SER-TPO,237,6,OC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C)CC(C)C,Kd=0.445uM,6.35164,6.35,1,A,A,1,A,A,0,,B,A,,1,1,237,6,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O,,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.9283312559127808,0.8876820802688599,87.07963562011719,89.92424774169922,0.357967346906662,0.5120075941085815,0.9298192262649536,0.9073762893676758,0.9150460362434388,0.8827584981918335,PLHST,Low,"(6.26, 6.398]",train
3HQH,protein-peptide,O75367 O43791,GSGGSGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAMESQRAYRFVQGKDWGFKKFIRRGFLLDEANGLLPDDKLTLFCEVSVVQD,KAASADSTTEGTPAD,GLY-SER-GLY-GLY-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-MET-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-GLY-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,LYS-ALA-ALA-SER-ALA-ASP-SER-THR-THR-GLU-GLY-THR-PRO-ALA-ASP,145,15,O=CCNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)C)CC(=O)O)CO)CCC(=O)O,Kd=63.6uM,4.196543,4.2,1,A,A,1,A,A,0,,M,A,,1,1,145,15,0,C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)[C@@H](C)O)[C@@H](C)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9841238856315612,0.7758000493049622,91.9032211303711,90.9663314819336,0.3457946181297302,0.7182354927062988,0.9275411367416382,0.8445260524749756,0.9006132483482361,0.7155150771141052,KAASADSTTEGTPAD,Low,"(4.155, 4.319]",train
3HS8,protein-peptide,Q9Z0R4 P17427,MGSSHHHHHHSSGLVPRGSHMASMTGGQQMGRGSEFEDNFARFVCKNNGVLFENQLLQIGLKSEFRQNLGRMFIFYGNKTSTQFLNFTPTLICADDLQTNLNLQTKPVDPTVDGGAQVQQVVNIECISDFTEAPVLNIQFRYGGTFQNVSVKLPITLNKFFQPTEMASQDFFQRWKQLSNPQQEVQNIFKAKHPMDTEITKAKIIGFGSALLEEVDPNPANFVGAGIIHTKTTQIGCLLRLEPNLQAQMYRLTLRTSKDTVSQRLCELLSEQF,PNNWADFSSTWP,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-SER-MET-THR-GLY-GLY-GLN-GLN-MET-GLY-ARG-GLY-SER-GLU-PHE-GLU-ASP-ASN-PHE-ALA-ARG-PHE-VAL-CYS-LYS-ASN-ASN-GLY-VAL-LEU-PHE-GLU-ASN-GLN-LEU-LEU-GLN-ILE-GLY-LEU-LYS-SER-GLU-PHE-ARG-GLN-ASN-LEU-GLY-ARG-MET-PHE-ILE-PHE-TYR-GLY-ASN-LYS-THR-SER-THR-GLN-PHE-LEU-ASN-PHE-THR-PRO-THR-LEU-ILE-CYS-ALA-ASP-ASP-LEU-GLN-THR-ASN-LEU-ASN-LEU-GLN-THR-LYS-PRO-VAL-ASP-PRO-THR-VAL-ASP-GLY-GLY-ALA-GLN-VAL-GLN-GLN-VAL-VAL-ASN-ILE-GLU-CYS-ILE-SER-ASP-PHE-THR-GLU-ALA-PRO-VAL-LEU-ASN-ILE-GLN-PHE-ARG-TYR-GLY-GLY-THR-PHE-GLN-ASN-VAL-SER-VAL-LYS-LEU-PRO-ILE-THR-LEU-ASN-LYS-PHE-PHE-GLN-PRO-THR-GLU-MET-ALA-SER-GLN-ASP-PHE-PHE-GLN-ARG-TRP-LYS-GLN-LEU-SER-ASN-PRO-GLN-GLN-GLU-VAL-GLN-ASN-ILE-PHE-LYS-ALA-LYS-HIS-PRO-MET-ASP-THR-GLU-ILE-THR-LYS-ALA-LYS-ILE-ILE-GLY-PHE-GLY-SER-ALA-LEU-LEU-GLU-GLU-VAL-ASP-PRO-ASN-PRO-ALA-ASN-PHE-VAL-GLY-ALA-GLY-ILE-ILE-HIS-THR-LYS-THR-THR-GLN-ILE-GLY-CYS-LEU-LEU-ARG-LEU-GLU-PRO-ASN-LEU-GLN-ALA-GLN-MET-TYR-ARG-LEU-THR-LEU-ARG-THR-SER-LYS-ASP-THR-VAL-SER-GLN-ARG-LEU-CYS-GLU-LEU-LEU-SER-GLU-GLN-PHE,PRO-ASN-ASN-TRP-ALA-ASP-PHE-SER-SER-THR-TRP-PRO,273,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CC(=O)N)CC(=O)N)C)CC(=O)O)Cc1ccccc1,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,P,A,,1,1,273,12,0,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.7368009686470032,0.7637836933135986,79.79248809814453,78.88117980957031,0.5526164174079895,1.0191508531570437,0.7980891466140747,0.7775219082832336,0.6293736100196838,0.6916677951812744,PNNWADFSSTWP,Low,"(5.222, 5.31]",train
3HS9,protein-peptide,P62944 Q9WVE9,MGSSHHHHHHSSGLVPRGSHMASGMAPGGYVAPKAVWLPAVKAKGLEISGTFTHRQGHIYMEMNFTNKALQHMTDFAIQFNKNSFGVIPSTPLAIHTPLMPNQSIDVSLPLNTLGPVMKMEPLNNLQVAVKNNIDVFYFSCLIPLNVLFVEDGKMERQVFLATWKDIPNENELQFQIKECHLNADTVSSKLQNNNVYTIAKRNVEGQDMLYQSLKLTNGIWILAELRIQPGNPNYTLSLKCRAPEVSQYIYQVYDSILKN,PNNWADFSSTWP,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ALA-SER-GLY-MET-ALA-PRO-GLY-GLY-TYR-VAL-ALA-PRO-LYS-ALA-VAL-TRP-LEU-PRO-ALA-VAL-LYS-ALA-LYS-GLY-LEU-GLU-ILE-SER-GLY-THR-PHE-THR-HIS-ARG-GLN-GLY-HIS-ILE-TYR-MET-GLU-MET-ASN-PHE-THR-ASN-LYS-ALA-LEU-GLN-HIS-MET-THR-ASP-PHE-ALA-ILE-GLN-PHE-ASN-LYS-ASN-SER-PHE-GLY-VAL-ILE-PRO-SER-THR-PRO-LEU-ALA-ILE-HIS-THR-PRO-LEU-MET-PRO-ASN-GLN-SER-ILE-ASP-VAL-SER-LEU-PRO-LEU-ASN-THR-LEU-GLY-PRO-VAL-MET-LYS-MET-GLU-PRO-LEU-ASN-ASN-LEU-GLN-VAL-ALA-VAL-LYS-ASN-ASN-ILE-ASP-VAL-PHE-TYR-PHE-SER-CYS-LEU-ILE-PRO-LEU-ASN-VAL-LEU-PHE-VAL-GLU-ASP-GLY-LYS-MET-GLU-ARG-GLN-VAL-PHE-LEU-ALA-THR-TRP-LYS-ASP-ILE-PRO-ASN-GLU-ASN-GLU-LEU-GLN-PHE-GLN-ILE-LYS-GLU-CYS-HIS-LEU-ASN-ALA-ASP-THR-VAL-SER-SER-LYS-LEU-GLN-ASN-ASN-ASN-VAL-TYR-THR-ILE-ALA-LYS-ARG-ASN-VAL-GLU-GLY-GLN-ASP-MET-LEU-TYR-GLN-SER-LEU-LYS-LEU-THR-ASN-GLY-ILE-TRP-ILE-LEU-ALA-GLU-LEU-ARG-ILE-GLN-PRO-GLY-ASN-PRO-ASN-TYR-THR-LEU-SER-LEU-LYS-CYS-ARG-ALA-PRO-GLU-VAL-SER-GLN-TYR-ILE-TYR-GLN-VAL-TYR-ASP-SER-ILE-LEU-LYS-ASN,PRO-ASN-ASN-TRP-ALA-ASP-PHE-SER-SER-THR-TRP-PRO,260,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)Cc1c[nH]c2c1cccc2)[C@H](O)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(=O)N)C)CC(=O)O)Cc1ccccc1,Kd=490nM,6.309804,6.31,1,A,A,1,A,A,0,,P,A,,1,1,260,12,0,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,0.7556869387626648,0.7889427542686462,84.94828033447266,84.18081665039062,0.4792686998844147,0.8683822154998779,0.8202569484710693,0.7956600189208984,0.6522281765937805,0.7151480317115784,PNNWADFSSTWP,Low,"(6.26, 6.398]",train
3I5R,protein-peptide,P27986,MSAEGYQYRALYDYKKEREEDIDLHLGDILTVNKGSLVALGFSDGQEARPEEIGWLNGYNETTGERGDFPGTYVEYIGRKKIS,HSKRPLPPLPSL,MET-SER-ALA-GLU-GLY-TYR-GLN-TYR-ARG-ALA-LEU-TYR-ASP-TYR-LYS-LYS-GLU-ARG-GLU-GLU-ASP-ILE-ASP-LEU-HIS-LEU-GLY-ASP-ILE-LEU-THR-VAL-ASN-LYS-GLY-SER-LEU-VAL-ALA-LEU-GLY-PHE-SER-ASP-GLY-GLN-GLU-ALA-ARG-PRO-GLU-GLU-ILE-GLY-TRP-LEU-ASN-GLY-TYR-ASN-GLU-THR-THR-GLY-GLU-ARG-GLY-ASP-PHE-PRO-GLY-THR-TYR-VAL-GLU-TYR-ILE-GLY-ARG-LYS-LYS-ILE-SER,HIS-SER-LYS-ARG-PRO-LEU-PRO-PRO-LEU-PRO-SER-LEU,83,12,OC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC[NH+]=C(N)N)CC(C)C)CC(C)C,Kd=40uM,4.39794,4.4,1,A,A,1,A,A,0,,B,A,,1,1,83,12,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9387540817260742,0.7723826169967651,97.32601165771484,88.91645050048828,0.3167105913162231,0.5636652708053589,0.9126678705215454,0.8407865166664124,0.866328239440918,0.7552815675735474,HSKRPLPPLPSL,Low,"(4.319, 4.456]",train
3I90,protein-peptide,O95503,RVFAAESIIKRRIRKGRIEYLVKWKGWAIKYSTWEPEENILDSRLIAAFEQ,QLATKAARKSA,ARG-VAL-PHE-ALA-ALA-GLU-SER-ILE-ILE-LYS-ARG-ARG-ILE-ARG-LYS-GLY-ARG-ILE-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-ALA-ILE-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-ASN-ILE-LEU-ASP-SER-ARG-LEU-ILE-ALA-ALA-PHE-GLU-GLN,GLN-LEU-ALA-THR-LYS-ALA-ALA-ARG-M3L-SER-ALA,51,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)CCCC[N+](C)(C)C)CCC[NH+]=C(N)N)C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(C)C)C,Kd>500uM,3.3,3.3,1,A,A,1,A,A,0,,C,A,,1,1,51,11,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.9242165684700012,0.8708918690681458,95.7691650390625,95.80663299560548,0.3120189607143402,0.4567689597606659,0.8853334188461304,0.8976477980613708,0.8230502605438232,0.8642028570175171,QLATKAARKSA,Low,"(2.044, 3.548]",train
3I91,protein-peptide,Q9HC52,ERVFAAEALLKRRIRKGRMEYLVKWKGWSQKYSTWEPEENILDARLLAAFEERE,QTARKSTG,GLU-ARG-VAL-PHE-ALA-ALA-GLU-ALA-LEU-LEU-LYS-ARG-ARG-ILE-ARG-LYS-GLY-ARG-MET-GLU-TYR-LEU-VAL-LYS-TRP-LYS-GLY-TRP-SER-GLN-LYS-TYR-SER-THR-TRP-GLU-PRO-GLU-GLU-ASN-ILE-LEU-ASP-ALA-ARG-LEU-LEU-ALA-ALA-PHE-GLU-GLU-ARG-GLU,GLN-THR-ALA-ARG-M3L-SER-THR-GLY,54,8,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd>500uM,3.3,3.3,1,A,A,1,A,A,0,,C,A,,1,1,54,8,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,0.9356874823570251,0.8305816650390625,95.15363311767578,96.03421020507812,0.306543618440628,0.5051716566085815,0.897956907749176,0.8707199692726135,0.8644750118255615,0.8205470442771912,QTARKSTG,Low,"(2.044, 3.548]",val
3IIW,protein-peptide,O75530,KCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,TKAARKSAPAT,LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,THR-LYS-ALA-ALA-ARG-M3L-SER-ALA-PRO-ALA-THR,365,11,OC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=36.4uM,4.438899,4.44,1,A,A,1,A,A,0,,B,A,,1,1,365,11,0,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9179865717887878,0.843290388584137,95.88770294189452,96.06692504882812,0.331371396780014,0.5481326580047607,0.9533592462539672,0.930497109889984,0.8908588290214539,0.8214887380599976,TKAARKSAPAT,Low,"(4.319, 4.456]",train
3IIY,protein-peptide,O75530,KCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSTDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,KKKARKSAGAA,LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-THR-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,LYS-LYS-LYS-ALA-ARG-M3L-SER-ALA-GLY-ALA-ALA,365,11,O=C[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CO)C)C)C,Kd=16uM,4.79588,4.8,1,A,A,1,A,A,0,,B,A,,1,1,365,11,0,C[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)O,C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,0.8823619484901428,0.8613830804824829,95.74299621582033,95.89053344726562,0.332293689250946,0.555410623550415,0.9541325569152832,0.9365411996841432,0.8461347222328186,0.8425934910774231,KKKARKSAGAA,Low,"(4.745, 4.866]",train
3IJ0,protein-peptide,O75530,KCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSTDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,KQTARKSTGGK,LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-THR-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY-GLY-LYS,365,11,OC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=13.2uM,4.879426,4.88,1,A,A,1,A,A,0,,B,A,,1,1,365,11,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9078853726387024,0.8463115096092224,95.38561248779295,95.86222839355467,0.3347709774971008,0.5694831013679504,0.9509970545768738,0.9326637387275696,0.8788228631019592,0.8247234225273132,KQTARKSTGGK,Low,"(4.866, 5.014]",val
3IJ1,protein-peptide,O75530 P62805,KCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSTDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,AKRHRKVLRDN,LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-THR-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,ALA-LYS-ARG-HIS-ARG-M3L-VAL-LEU-ARG-ASP-ASN,365,11,O=C[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1c[nH]cn1)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)CC(C)C)CCC[NH+]=C(N)N,Kd=20uM,4.69897,4.7,1,A,A,1,A,A,0,,B,A,,1,1,365,11,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)C(C)C,0.8878471255302429,0.8160075545310974,95.08177185058594,95.38412475585938,0.3334378600120544,0.6350036859512329,0.9526888132095336,0.9222168326377868,0.8533521294593811,0.789455235004425,AKRHRKVLRDN,Low,"(4.606, 4.745]",train
3IQG,protein-peptide,P45040,MAIYADNSYSIGNTPLVRLKHFGHNGNVVVKIEGRNPSYSVKCRIGANMVWQAEKDGTLTKGKEIVDATSGNTGIALAYVAAARGYKITLTMPETMSLERKRLLCGLGVNLVLTEGAKGMKGAIAKAEEIVASDPSRYVMLKQFENPANPQIHRETTGPEIWKDTDGKVDVVVAGVGTGGSITGISRAIKLDFGKQITSVAVEPVESPVISQTLAGEEVKPGPHKIQGIGAGFIPKNLDLSIIDRVETVDSDTALATARRLMAEEGILAGISSGAAVAAADRLAKLPEFADKLIVVILPSASERYLSTALFEGIEG,MNWNI,MET-ALA-ILE-TYR-ALA-ASP-ASN-SER-TYR-SER-ILE-GLY-ASN-THR-PRO-LEU-VAL-ARG-LEU-LYS-HIS-PHE-GLY-HIS-ASN-GLY-ASN-VAL-VAL-VAL-LYS-ILE-GLU-GLY-ARG-ASN-PRO-SER-TYR-SER-VAL-LLP-CYS-ARG-ILE-GLY-ALA-ASN-MET-VAL-TRP-GLN-ALA-GLU-LYS-ASP-GLY-THR-LEU-THR-LYS-GLY-LYS-GLU-ILE-VAL-ASP-ALA-THR-SER-GLY-ASN-THR-GLY-ILE-ALA-LEU-ALA-TYR-VAL-ALA-ALA-ALA-ARG-GLY-TYR-LYS-ILE-THR-LEU-THR-MET-PRO-GLU-THR-MET-SER-LEU-GLU-ARG-LYS-ARG-LEU-LEU-CYS-GLY-LEU-GLY-VAL-ASN-LEU-VAL-LEU-THR-GLU-GLY-ALA-LYS-GLY-MET-LYS-GLY-ALA-ILE-ALA-LYS-ALA-GLU-GLU-ILE-VAL-ALA-SER-ASP-PRO-SER-ARG-TYR-VAL-MET-LEU-LYS-GLN-PHE-GLU-ASN-PRO-ALA-ASN-PRO-GLN-ILE-HIS-ARG-GLU-THR-THR-GLY-PRO-GLU-ILE-TRP-LYS-ASP-THR-ASP-GLY-LYS-VAL-ASP-VAL-VAL-VAL-ALA-GLY-VAL-GLY-THR-GLY-GLY-SER-ILE-THR-GLY-ILE-SER-ARG-ALA-ILE-LYS-LEU-ASP-PHE-GLY-LYS-GLN-ILE-THR-SER-VAL-ALA-VAL-GLU-PRO-VAL-GLU-SER-PRO-VAL-ILE-SER-GLN-THR-LEU-ALA-GLY-GLU-GLU-VAL-LYS-PRO-GLY-PRO-HIS-LYS-ILE-GLN-GLY-ILE-GLY-ALA-GLY-PHE-ILE-PRO-LYS-ASN-LEU-ASP-LEU-SER-ILE-ILE-ASP-ARG-VAL-GLU-THR-VAL-ASP-SER-ASP-THR-ALA-LEU-ALA-THR-ALA-ARG-ARG-LEU-MET-ALA-GLU-GLU-GLY-ILE-LEU-ALA-GLY-ILE-SER-SER-GLY-ALA-ALA-VAL-ALA-ALA-ALA-ASP-ARG-LEU-ALA-LYS-LEU-PRO-GLU-PHE-ALA-ASP-LYS-LEU-ILE-VAL-VAL-ILE-LEU-PRO-SER-ALA-SER-GLU-ARG-TYR-LEU-SER-THR-ALA-LEU-PHE-GLU-GLY-ILE-GLU-GLY,MET-ASN-TRP-ASN-ILE,316,5,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])Cc1c[nH]c2c1cccc2)CC(=O)N)C,Kd=24.9uM,4.603801,4.6,1,A,A,1,A,A,0,,P,X,,1,1,316,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O,0.8735334277153015,0.8109729886054993,88.79878997802734,85.5003890991211,0.3534993827342987,0.6695433259010315,0.9347098469734192,0.8993247747421265,0.8485040664672852,0.7888850569725037,MNWNI,Low,"(4.456, 4.606]",train
3IQH,protein-peptide,P45040,MAIYADNSYSIGNTPLVRLKHFGHNGNVVVKIEGRNPSYSVKCRIGANMVWQAEKDGTLTKGKEIVDATSGNTGIALAYVAAARGYKITLTMPETMSLERKRLLCGLGVNLVLTEGAKGMKGAIAKAEEIVASDPSRYVMLKQFENPANPQIHRETTGPEIWKDTDGKVDVVVAGVGTGGSITGISRAIKLDFGKQITSVAVEPVESPVISQTLAGEEVKPGPHKIQGIGAGFIPKNLDLSIIDRVETVDSDTALATARRLMAEEGILAGISSGAAVAAADRLAKLPEFADKLIVVILPSASERYLSTALFEGIEG,MNYDI,MET-ALA-ILE-TYR-ALA-ASP-ASN-SER-TYR-SER-ILE-GLY-ASN-THR-PRO-LEU-VAL-ARG-LEU-LYS-HIS-PHE-GLY-HIS-ASN-GLY-ASN-VAL-VAL-VAL-LYS-ILE-GLU-GLY-ARG-ASN-PRO-SER-TYR-SER-VAL-LLP-CYS-ARG-ILE-GLY-ALA-ASN-MET-VAL-TRP-GLN-ALA-GLU-LYS-ASP-GLY-THR-LEU-THR-LYS-GLY-LYS-GLU-ILE-VAL-ASP-ALA-THR-SER-GLY-ASN-THR-GLY-ILE-ALA-LEU-ALA-TYR-VAL-ALA-ALA-ALA-ARG-GLY-TYR-LYS-ILE-THR-LEU-THR-MET-PRO-GLU-THR-MET-SER-LEU-GLU-ARG-LYS-ARG-LEU-LEU-CYS-GLY-LEU-GLY-VAL-ASN-LEU-VAL-LEU-THR-GLU-GLY-ALA-LYS-GLY-MET-LYS-GLY-ALA-ILE-ALA-LYS-ALA-GLU-GLU-ILE-VAL-ALA-SER-ASP-PRO-SER-ARG-TYR-VAL-MET-LEU-LYS-GLN-PHE-GLU-ASN-PRO-ALA-ASN-PRO-GLN-ILE-HIS-ARG-GLU-THR-THR-GLY-PRO-GLU-ILE-TRP-LYS-ASP-THR-ASP-GLY-LYS-VAL-ASP-VAL-VAL-VAL-ALA-GLY-VAL-GLY-THR-GLY-GLY-SER-ILE-THR-GLY-ILE-SER-ARG-ALA-ILE-LYS-LEU-ASP-PHE-GLY-LYS-GLN-ILE-THR-SER-VAL-ALA-VAL-GLU-PRO-VAL-GLU-SER-PRO-VAL-ILE-SER-GLN-THR-LEU-ALA-GLY-GLU-GLU-VAL-LYS-PRO-GLY-PRO-HIS-LYS-ILE-GLN-GLY-ILE-GLY-ALA-GLY-PHE-ILE-PRO-LYS-ASN-LEU-ASP-LEU-SER-ILE-ILE-ASP-ARG-VAL-GLU-THR-VAL-ASP-SER-ASP-THR-ALA-LEU-ALA-THR-ALA-ARG-ARG-LEU-MET-ALA-GLU-GLU-GLY-ILE-LEU-ALA-GLY-ILE-SER-SER-GLY-ALA-ALA-VAL-ALA-ALA-ALA-ASP-ARG-LEU-ALA-LYS-LEU-PRO-GLU-PHE-ALA-ASP-LYS-LEU-ILE-VAL-VAL-ILE-LEU-PRO-SER-ALA-SER-GLU-ARG-TYR-LEU-SER-THR-ALA-LEU-PHE-GLU-GLY-ILE-GLU-GLY,MET-ASN-TYR-ASP-ILE,316,5,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(=O)O)C,Kd=25.8uM,4.58838,4.59,1,A,A,1,A,A,0,,P,X,,1,1,316,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,0.8798196315765381,0.8541631698608398,91.8260269165039,86.51728057861328,0.3482764065265655,0.604196310043335,0.9378564953804016,0.9082580804824828,0.8555752038955688,0.8406394124031067,MNYDI,Low,"(4.456, 4.606]",train
3IQI,protein-peptide,P45040,MAIYADNSYSIGNTPLVRLKHFGHNGNVVVKIEGRNPSYSVKCRIGANMVWQAEKDGTLTKGKEIVDATSGNTGIALAYVAAARGYKITLTMPETMSLERKRLLCGLGVNLVLTEGAKGMKGAIAKAEEIVASDPSRYVMLKQFENPANPQIHRETTGPEIWKDTDGKVDVVVAGVGTGGSITGISRAIKLDFGKQITSVAVEPVESPVISQTLAGEEVKPGPHKIQGIGAGFIPKNLDLSIIDRVETVDSDTALATARRLMAEEGILAGISSGAAVAAADRLAKLPEFADKLIVVILPSASERYLSTALFEGIEG,MNENI,MET-ALA-ILE-TYR-ALA-ASP-ASN-SER-TYR-SER-ILE-GLY-ASN-THR-PRO-LEU-VAL-ARG-LEU-LYS-HIS-PHE-GLY-HIS-ASN-GLY-ASN-VAL-VAL-VAL-LYS-ILE-GLU-GLY-ARG-ASN-PRO-SER-TYR-SER-VAL-LLP-CYS-ARG-ILE-GLY-ALA-ASN-MET-VAL-TRP-GLN-ALA-GLU-LYS-ASP-GLY-THR-LEU-THR-LYS-GLY-LYS-GLU-ILE-VAL-ASP-ALA-THR-SER-GLY-ASN-THR-GLY-ILE-ALA-LEU-ALA-TYR-VAL-ALA-ALA-ALA-ARG-GLY-TYR-LYS-ILE-THR-LEU-THR-MET-PRO-GLU-THR-MET-SER-LEU-GLU-ARG-LYS-ARG-LEU-LEU-CYS-GLY-LEU-GLY-VAL-ASN-LEU-VAL-LEU-THR-GLU-GLY-ALA-LYS-GLY-MET-LYS-GLY-ALA-ILE-ALA-LYS-ALA-GLU-GLU-ILE-VAL-ALA-SER-ASP-PRO-SER-ARG-TYR-VAL-MET-LEU-LYS-GLN-PHE-GLU-ASN-PRO-ALA-ASN-PRO-GLN-ILE-HIS-ARG-GLU-THR-THR-GLY-PRO-GLU-ILE-TRP-LYS-ASP-THR-ASP-GLY-LYS-VAL-ASP-VAL-VAL-VAL-ALA-GLY-VAL-GLY-THR-GLY-GLY-SER-ILE-THR-GLY-ILE-SER-ARG-ALA-ILE-LYS-LEU-ASP-PHE-GLY-LYS-GLN-ILE-THR-SER-VAL-ALA-VAL-GLU-PRO-VAL-GLU-SER-PRO-VAL-ILE-SER-GLN-THR-LEU-ALA-GLY-GLU-GLU-VAL-LYS-PRO-GLY-PRO-HIS-LYS-ILE-GLN-GLY-ILE-GLY-ALA-GLY-PHE-ILE-PRO-LYS-ASN-LEU-ASP-LEU-SER-ILE-ILE-ASP-ARG-VAL-GLU-THR-VAL-ASP-SER-ASP-THR-ALA-LEU-ALA-THR-ALA-ARG-ARG-LEU-MET-ALA-GLU-GLU-GLY-ILE-LEU-ALA-GLY-ILE-SER-SER-GLY-ALA-ALA-VAL-ALA-ALA-ALA-ASP-ARG-LEU-ALA-LYS-LEU-PRO-GLU-PHE-ALA-ASP-LYS-LEU-ILE-VAL-VAL-ILE-LEU-PRO-SER-ALA-SER-GLU-ARG-TYR-LEU-SER-THR-ALA-LEU-PHE-GLU-GLY-ILE-GLU-GLY,MET-ASN-GLU-ASN-ILE,316,5,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC(=O)O)CC(=O)N)C,Kd=38.7uM,4.412289,4.41,1,A,A,1,A,A,0,,P,X,,1,1,316,5,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(=O)O)C(=O)O,0.8777275085449219,0.8885717391967773,90.1114730834961,89.58946228027344,0.3519746959209442,0.5155437588691711,0.9344853162765504,0.9311190843582152,0.8538028001785278,0.8779349327087402,MNENI,Low,"(4.319, 4.456]",train
3IQJ,protein-peptide,P31947 P04049,GAMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,QRSTSTPNVH,GLY-ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CSO-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,GLN-ARG-SER-THR-SEP-THR-PRO-ASN-VAL-HIS,236,10,OC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])C)CO)COP(O)(O)O)CC(=O)N,Kd=11.7uM,4.931814,4.93,1,A,A,1,A,A,0,,P,A,,1,1,236,10,0,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.951565146446228,0.8598424196243286,90.75106811523438,90.57746887207033,0.3201722204685211,0.5689979791641235,0.943882167339325,0.9177753925323486,0.9280794262886048,0.8453591465950012,QRSTSTPNVH,Low,"(4.866, 5.014]",val
3IQQ,protein-peptide,P02638,MSELEKAVVALIDVFHQYSGREGDKHKLKKSELKELINNELSHFLEEIKEQEVVDKVMETLDSDGDGECDFQEFMAFVAMITTACHEFFEHE,TRTKIDWNKILS,MET-SER-GLU-LEU-GLU-LYS-ALA-VAL-VAL-ALA-LEU-ILE-ASP-VAL-PHE-HIS-GLN-TYR-SER-GLY-ARG-GLU-GLY-ASP-LYS-HIS-LYS-LEU-LYS-LYS-SER-GLU-LEU-LYS-GLU-LEU-ILE-ASN-ASN-GLU-LEU-SER-HIS-PHE-LEU-GLU-GLU-ILE-LYS-GLU-GLN-GLU-VAL-VAL-ASP-LYS-VAL-MET-GLU-THR-LEU-ASP-SER-ASP-GLY-ASP-GLY-GLU-CYS-ASP-PHE-GLN-GLU-PHE-MET-ALA-PHE-VAL-ALA-MET-ILE-THR-THR-ALA-CYS-HIS-GLU-PHE-PHE-GLU-HIS-GLU,THR-ARG-THR-LYS-ILE-ASP-TRP-ASN-LYS-ILE-LEU-SER,92,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CCCC[NH3+])CC(=O)O)CC(=O)N,Kd=2.9uM,5.537602,5.54,1,A,A,1,A,A,0,,B,A,,1,1,92,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8669821619987488,0.7409105896949768,71.9217758178711,82.544677734375,0.3880968689918518,0.7846345901489258,0.8615242838859558,0.8170467019081116,0.7962312698364258,0.7218765020370483,TRTKIDWNKILS,Low,"(5.463, 5.6]",val
3ISW,protein-peptide,P21333 P13569,GAMPDGGAHKVRAGGPGLERAEAGVPAEFSIWTREAGAGGLAIAVEGPSKAEISFEDRKDGSCGVAYVVQEPGDYEVSVKFNEEHIPDSPFVVPVASPS,PLEKASVVSKLFFSWTAP,GLY-ALA-MET-PRO-ASP-GLY-GLY-ALA-HIS-LYS-VAL-ARG-ALA-GLY-GLY-PRO-GLY-LEU-GLU-ARG-ALA-GLU-ALA-GLY-VAL-PRO-ALA-GLU-PHE-SER-ILE-TRP-THR-ARG-GLU-ALA-GLY-ALA-GLY-GLY-LEU-ALA-ILE-ALA-VAL-GLU-GLY-PRO-SER-LYS-ALA-GLU-ILE-SER-PHE-GLU-ASP-ARG-LYS-ASP-GLY-SER-CYS-GLY-VAL-ALA-TYR-VAL-VAL-GLN-GLU-PRO-GLY-ASP-TYR-GLU-VAL-SER-VAL-LYS-PHE-ASN-GLU-GLU-HIS-ILE-PRO-ASP-SER-PRO-PHE-VAL-VAL-PRO-VAL-ALA-SER-PRO-SER,PRO-LEU-GLU-LYS-ALA-SER-VAL-VAL-SER-LYS-LEU-PHE-PHE-SER-TRP-THR-ALA-PRO,99,18,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)[C@H](O)C)Cc1c[nH]c2c1cccc2)CO)Cc1ccccc1)Cc1ccccc1)CC(C)C)CCCC[NH3+])NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CC(C)C)CCC(=O)O)CCCC[NH3+])C)CO,Kd=90uM,4.045757,4.05,1,A,A,1,A,A,0,,C,A,dimer,1,1,99,18,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)O)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C,0.9248310327529908,0.8609353303909302,90.77335357666016,90.80997467041016,0.3679463565349579,0.5557657480239868,0.8905896544456482,0.8924088478088379,0.837237536907196,0.8530669808387756,PLEKASVVSKLFFSWTAP,Low,"(3.924, 4.155]",train
3IUX,protein-peptide,Q00987,ETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVV,CNCKAPETFLCYWRCLQH,GLU-THR-LEU-VAL-ARG-PRO-LYS-PRO-LEU-LEU-LEU-LYS-LEU-LEU-LYS-SER-VAL-GLY-ALA-GLN-LYS-ASP-THR-TYR-THR-MET-LYS-GLU-VAL-LEU-PHE-TYR-LEU-GLY-GLN-TYR-ILE-MET-THR-LYS-ARG-LEU-TYR-ASP-GLU-LYS-GLN-GLN-HIS-ILE-VAL-TYR-CYS-SER-ASN-ASP-LEU-LEU-GLY-ASP-LEU-PHE-GLY-VAL-PRO-SER-PHE-SER-VAL-LYS-GLU-HIS-ARG-LYS-ILE-TYR-THR-MET-ILE-TYR-ARG-ASN-LEU-VAL-VAL,CYS-ASN-CYS-LYS-ALA-PRO-GLU-THR-PHE-LEU-CYS-TYR-TRP-ARG-CYS-LEU-GLN-HIA,85,18,[NH3+]CCCC[C@@H]1NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2)CC(=O)N)[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC1=O)C)CCC2)CCC(=O)O)[C@H](O)C)Cc1ccccc1)CC(C)C)Cc1ccc(cc1)O)Cc1c[nH]c2c1cccc2)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]cn1)CCC(=O)N)CC(C)C,Kd=25.1nM,7.600326,7.6,1,A,A,1,A,A,0,,B,A,dimer,1,1,85,18,0,CC(C)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(Cc1cnc[nH]1)C(N)=O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(N)=O)C(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(Cc1cnc[nH]1)C(N)=O,0.9714936017990112,0.7518581748008728,96.1299285888672,90.24078369140624,0.3244537711143493,0.7877848744392395,0.9134106636047364,0.8139239549636841,0.8767910003662109,0.7363417148590088,CNCKAPETFLCYWRCLQH,Moderate,"(7.523, 7.921]",train
3IVQ,protein-peptide,O43791,GSGGSGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAMESQRAYRFVQGKDWGFKKFIRRDFLLDEANGLLPDDKLTLFCEVSVVQD,NTLFPDVSSSTH,GLY-SER-GLY-GLY-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-MET-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-ASP-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,ASN-THR-LEU-PHE-PRO-ASP-VAL-SER-SER-SER-THR-HIS,145,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)CO)CO)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CC(=O)O,Kd=76.1uM,4.118615,4.12,1,A,A,1,A,A,0,,C,A,,1,1,145,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O,0.9624577164649964,0.8473024368286133,93.32479095458984,92.9300765991211,0.338477224111557,0.5648500919342041,0.92619788646698,0.898071825504303,0.91579008102417,0.8346100449562073,NTLFPDVSSSTH,Low,"(3.924, 4.155]",train
3IVV,protein-peptide,O43791,GSGGSGKVVKFSYMWTINNFSFCREEMGEVIKSSTFSSGANDKLKWCLRVNPKGLDEESKDYLSLYLLLVSCPKSEVRAKFKFSILNAKGEETKAMESQRAYRFVQGKDWGFKKFIRRDFLLDEANGLLPDDKLTLFCEVSVVQD,DEVTSTTSSS,GLY-SER-GLY-GLY-SER-GLY-LYS-VAL-VAL-LYS-PHE-SER-TYR-MET-TRP-THR-ILE-ASN-ASN-PHE-SER-PHE-CYS-ARG-GLU-GLU-MET-GLY-GLU-VAL-ILE-LYS-SER-SER-THR-PHE-SER-SER-GLY-ALA-ASN-ASP-LYS-LEU-LYS-TRP-CYS-LEU-ARG-VAL-ASN-PRO-LYS-GLY-LEU-ASP-GLU-GLU-SER-LYS-ASP-TYR-LEU-SER-LEU-TYR-LEU-LEU-LEU-VAL-SER-CYS-PRO-LYS-SER-GLU-VAL-ARG-ALA-LYS-PHE-LYS-PHE-SER-ILE-LEU-ASN-ALA-LYS-GLY-GLU-GLU-THR-LYS-ALA-MET-GLU-SER-GLN-ARG-ALA-TYR-ARG-PHE-VAL-GLN-GLY-LYS-ASP-TRP-GLY-PHE-LYS-LYS-PHE-ILE-ARG-ARG-ASP-PHE-LEU-LEU-ASP-GLU-ALA-ASN-GLY-LEU-LEU-PRO-ASP-ASP-LYS-LEU-THR-LEU-PHE-CYS-GLU-VAL-SER-VAL-VAL-GLN-ASP,ASP-GLU-VAL-THR-SER-THR-THR-SER-SER-SER,145,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)CO)[C@H](O)C)[C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,D,A,,1,1,145,10,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.9838714003562928,0.9164515733718872,93.6264190673828,93.0091781616211,0.3267177939414978,0.4760121703147888,0.932270050048828,0.920310914516449,0.916126549243927,0.8766936659812927,DEVTSTTSSS,Low,"(5.31, 5.463]",train
3JPX,protein-peptide,O75530 P62805,DAVSIESGTNTERPDTPTNTPNAPGRKSWGKGKWKSKKCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,GGAKRHRKVLRDNIQ,ASP-ALA-VAL-SER-ILE-GLU-SER-GLY-THR-ASN-THR-GLU-ARG-PRO-ASP-THR-PRO-THR-ASN-THR-PRO-ASN-ALA-PRO-GLY-ARG-LYS-SER-TRP-GLY-LYS-GLY-LYS-TRP-LYS-SER-LYS-LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,GLY-GLY-ALA-LYS-ARG-HIS-ARG-M3L-VAL-LEU-ARG-ASP-ASN-ILE-GLN,402,15,CC(C[C@@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCC[NH+]=C(N)N)CCCC[N+](C)(C)C)C,Kd=235uM,3.628932,3.63,1,A,A,1,A,A,0,,B,A,,1,1,402,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)CN)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)O)C(C)C)C(=O)O,0.8113759756088257,0.7981959581375122,86.06261444091797,86.74736022949219,0.5340942144393921,0.8756552934646606,0.8613609075546265,0.8395711183547974,0.7194432616233826,0.7287725806236267,GGAKRHRKVLRDNIQ,Low,"(3.548, 3.924]",train
3JVK,protein-peptide,Q9ESU6 P84243,GAMGSTNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,GGKAPRKQ,GLY-ALA-MET-GLY-SER-THR-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,GLY-GLY-ALY-ALA-PRO-ARG-LYS-GLN,131,8,[NH3+]CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCCNC(=O)C,Kd=118uM,3.928118,3.93,1,A,A,1,A,A,0,,C,A,,1,1,131,8,0,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O,0.8885871767997742,0.8868467807769775,90.8464126586914,94.7537841796875,0.3323795795440674,0.5337536931037903,0.9322822690010072,0.9053499102592468,0.8237066268920898,0.8345110416412354,GGKAPRKQ,Low,"(3.924, 4.155]",train
3JZH,protein-peptide,O75530,DAVSIESGTNTERPDTPTNTPNAPGRKSWGKGKWKSKKCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,DFKTD,ASP-ALA-VAL-SER-ILE-GLU-SER-GLY-THR-ASN-THR-GLU-ARG-PRO-ASP-THR-PRO-THR-ASN-THR-PRO-ASN-ALA-PRO-GLY-ARG-LYS-SER-TRP-GLY-LYS-GLY-LYS-TRP-LYS-SER-LYS-LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,ASP-PHE-M3L-THR-ASP,402,5,OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)[C@H](O)C)CCCC[N+](C)(C)C)Cc1ccccc1)[NH3+],Kd=400uM,3.39794,3.4,1,A,A,1,A,A,0,,B,A,,1,1,402,5,0,C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8115032911300659,0.9113996624946594,87.28792572021484,88.91913604736328,0.5151483416557312,0.6401057839393616,0.8771533370018005,0.8751108050346375,0.7290588021278381,0.8613921999931335,DFKTD,Low,"(2.044, 3.548]",train
3JZO,protein-peptide,O15151,QINQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDQQEQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVTLAT,LTFEHYWAQLTS,GLN-ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-GLN-GLN-GLU-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-TYR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR-LEU-ALA-THR,LEU-THR-PHE-GLU-HIS-TYR-TRP-ALA-GLN-LEU-THR-SER,89,12,OC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1nc[nH]c1)Cc1ccc(cc1)O)C)CCC(=O)N)CC(C)C,Kd=3nM,8.522879,8.52,1,A,A,1,A,A,0,,P,A,,1,1,89,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9783228635787964,0.8310546278953552,94.68171691894533,65.42634582519531,0.3020137250423431,0.64738529920578,0.9323142170906068,0.8694366216659546,0.9155676364898682,0.8214591145515442,LTFEHYWAQLTS,Moderate,"(8.383, 8.824]",val
3JZP,protein-peptide,O15151,QINQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDQQEQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVTLAT,LTFEHWWAQLTS,GLN-ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-GLN-GLN-GLU-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-TYR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR-LEU-ALA-THR,LEU-THR-PHE-GLU-HIS-TRP-TRP-ALA-GLN-LEU-THR-SER,89,12,OC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1nc[nH]c1)C)CCC(=O)N)CC(C)C,IC50=250nM,6.60206,6.6,1,A,A,1,A,A,0,,P,A,,1,1,89,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9744073152542114,0.8253894448280334,93.6241226196289,65.73693084716797,0.3064238131046295,0.6705150604248047,0.9291316866874696,0.867370069026947,0.9114688038825988,0.8148942589759827,LTFEHWWAQLTS,Low,"(6.523, 6.696]",train
3JZQ,protein-peptide,O15151,QINQVRPKLPLLKILHAAGAQGEMFTVKEVMHYLGQYIMVKQLYDQQEQHMVYCGGDLLGELLGRQSFSVKDPSPLYDMLRKNLVTLAT,ETFEHWWSQLLS,GLN-ILE-ASN-GLN-VAL-ARG-PRO-LYS-LEU-PRO-LEU-LEU-LYS-ILE-LEU-HIS-ALA-ALA-GLY-ALA-GLN-GLY-GLU-MET-PHE-THR-VAL-LYS-GLU-VAL-MET-HIS-TYR-LEU-GLY-GLN-TYR-ILE-MET-VAL-LYS-GLN-LEU-TYR-ASP-GLN-GLN-GLU-GLN-HIS-MET-VAL-TYR-CYS-GLY-GLY-ASP-LEU-LEU-GLY-GLU-LEU-LEU-GLY-ARG-GLN-SER-PHE-SER-VAL-LYS-ASP-PRO-SER-PRO-LEU-TYR-ASP-MET-LEU-ARG-LYS-ASN-LEU-VAL-THR-LEU-ALA-THR,GLU-THR-PHE-GLU-HIS-TRP-TRP-SER-GLN-LEU-LEU-SER,89,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1nc[nH]c1,IC50=110nM,6.958607,6.96,1,A,A,1,A,A,0,,P,A,,1,1,89,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9733648896217346,0.8397737741470337,91.9228515625,65.73905181884766,0.3125756978988647,0.6313251256942749,0.9241458177566528,0.8743070363998413,0.911412239074707,0.831140398979187,ETFEHWWSQLLS,Low,"(6.824, 7.049]",train
3JZR,protein-peptide,Q00987,GSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVVVNQQESSDSGTSVSEN,LTFEHWWAQLTS,GLY-SER-GLN-ILE-PRO-ALA-SER-GLU-GLN-GLU-THR-LEU-VAL-ARG-PRO-LYS-PRO-LEU-LEU-LEU-LYS-LEU-LEU-LYS-SER-VAL-GLY-ALA-GLN-LYS-ASP-THR-TYR-THR-MET-LYS-GLU-VAL-LEU-PHE-TYR-LEU-GLY-GLN-TYR-ILE-MET-THR-LYS-ARG-LEU-TYR-ASP-GLU-LYS-GLN-GLN-HIS-ILE-VAL-TYR-CYS-SER-ASN-ASP-LEU-LEU-GLY-ASP-LEU-PHE-GLY-VAL-PRO-SER-PHE-SER-VAL-LYS-GLU-HIS-ARG-LYS-ILE-TYR-THR-MET-ILE-TYR-ARG-ASN-LEU-VAL-VAL-VAL-ASN-GLN-GLN-GLU-SER-SER-ASP-SER-GLY-THR-SER-VAL-SER-GLU-ASN,LEU-THR-PHE-GLU-HIS-TRP-TRP-ALA-GLN-LEU-THR-SER,110,12,OC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CC(C)C)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1nc[nH]c1)C)CCC(=O)N)CC(C)C,IC50=36nM,7.443697,7.44,1,A,A,1,A,A,0,,P,A,,1,1,110,12,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)O,1.0168198347091677,0.8156574368476868,86.26766967773438,83.15982055664062,0.3272173702716827,0.7069513201713562,0.90233713388443,0.8463119268417358,0.9276127219200134,0.8079937696456909,LTFEHWWAQLTS,Moderate,"(7.268, 7.523]",val
3JZS,protein-peptide,Q00987,QETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVV,ETFEHWWSQLLS,GLN-GLU-THR-LEU-VAL-ARG-PRO-LYS-PRO-LEU-LEU-LEU-LYS-LEU-LEU-LYS-SER-VAL-GLY-ALA-GLN-LYS-ASP-THR-TYR-THR-MET-LYS-GLU-VAL-LEU-PHE-TYR-LEU-GLY-GLN-TYR-ILE-MET-THR-LYS-ARG-LEU-TYR-ASP-GLU-LYS-GLN-GLN-HIS-ILE-VAL-TYR-CYS-SER-ASN-ASP-LEU-LEU-GLY-ASP-LEU-PHE-GLY-VAL-PRO-SER-PHE-SER-VAL-LYS-GLU-HIS-ARG-LYS-ILE-TYR-THR-MET-ILE-TYR-ARG-ASN-LEU-VAL-VAL,GLU-THR-PHE-GLU-HIS-TRP-TRP-SER-GLN-LEU-LEU-SER,86,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)CC(C)C)CCC(=O)N)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccccc1)CCC(=O)O)Cc1nc[nH]c1,IC50=8nM,8.09691,8.1,1,A,A,1,A,A,0,,P,A,,1,1,86,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.9827837944030762,0.8079479336738586,95.09468841552734,92.4407196044922,0.2979953587055206,0.6688635349273682,0.930039882659912,0.8587098717689514,0.919439136981964,0.7952574491500854,ETFEHWWSQLLS,Moderate,"(7.921, 8.383]",train
3K27,protein-peptide,O75530,KKCKYSFKCVNSLKEDHNQPLFGVQFNWHSKEGDPLVFATVGSNRVTLYECHSQGEIRLLQSYVDADADENFYTCAWTYDSNTSHPLLAVAGSRGIIRIINPITMQCIKHYVGHGNAINELKFHPRDPNLLLSVSKDHALRLWNIQTDTLVAIFGGVEGHRDEVLSADYDLLGEKIMSCGMDHSLKLWRINSKRMMNAIKESYDYNPNKTNRPFISQKIHFPDFSTRDIHRNYVDCVRWLGDLILSKSCENAIVCWKPGKMEDDIDKIKPSESNVTILGRFDYSQCDIWYMRFSMDFWQKMLALGNQVGKLYVWDLEVEDPHKAKCTTLTHHKCGAAIRQTSFSRDSSILIAVCDDASIWRWDRLR,KQTARKSTG,LYS-LYS-CYS-LYS-TYR-SER-PHE-LYS-CYS-VAL-ASN-SER-LEU-LYS-GLU-ASP-HIS-ASN-GLN-PRO-LEU-PHE-GLY-VAL-GLN-PHE-ASN-TRP-HIS-SER-LYS-GLU-GLY-ASP-PRO-LEU-VAL-PHE-ALA-THR-VAL-GLY-SER-ASN-ARG-VAL-THR-LEU-TYR-GLU-CYS-HIS-SER-GLN-GLY-GLU-ILE-ARG-LEU-LEU-GLN-SER-TYR-VAL-ASP-ALA-ASP-ALA-ASP-GLU-ASN-PHE-TYR-THR-CYS-ALA-TRP-THR-TYR-ASP-SER-ASN-THR-SER-HIS-PRO-LEU-LEU-ALA-VAL-ALA-GLY-SER-ARG-GLY-ILE-ILE-ARG-ILE-ILE-ASN-PRO-ILE-THR-MET-GLN-CYS-ILE-LYS-HIS-TYR-VAL-GLY-HIS-GLY-ASN-ALA-ILE-ASN-GLU-LEU-LYS-PHE-HIS-PRO-ARG-ASP-PRO-ASN-LEU-LEU-LEU-SER-VAL-SER-LYS-ASP-HIS-ALA-LEU-ARG-LEU-TRP-ASN-ILE-GLN-THR-ASP-THR-LEU-VAL-ALA-ILE-PHE-GLY-GLY-VAL-GLU-GLY-HIS-ARG-ASP-GLU-VAL-LEU-SER-ALA-ASP-TYR-ASP-LEU-LEU-GLY-GLU-LYS-ILE-MET-SER-CYS-GLY-MET-ASP-HIS-SER-LEU-LYS-LEU-TRP-ARG-ILE-ASN-SER-LYS-ARG-MET-MET-ASN-ALA-ILE-LYS-GLU-SER-TYR-ASP-TYR-ASN-PRO-ASN-LYS-THR-ASN-ARG-PRO-PHE-ILE-SER-GLN-LYS-ILE-HIS-PHE-PRO-ASP-PHE-SER-THR-ARG-ASP-ILE-HIS-ARG-ASN-TYR-VAL-ASP-CYS-VAL-ARG-TRP-LEU-GLY-ASP-LEU-ILE-LEU-SER-LYS-SER-CYS-GLU-ASN-ALA-ILE-VAL-CYS-TRP-LYS-PRO-GLY-LYS-MET-GLU-ASP-ASP-ILE-ASP-LYS-ILE-LYS-PRO-SER-GLU-SER-ASN-VAL-THR-ILE-LEU-GLY-ARG-PHE-ASP-TYR-SER-GLN-CYS-ASP-ILE-TRP-TYR-MET-ARG-PHE-SER-MET-ASP-PHE-TRP-GLN-LYS-MET-LEU-ALA-LEU-GLY-ASN-GLN-VAL-GLY-LYS-LEU-TYR-VAL-TRP-ASP-LEU-GLU-VAL-GLU-ASP-PRO-HIS-LYS-ALA-LYS-CYS-THR-THR-LEU-THR-HIS-HIS-LYS-CYS-GLY-ALA-ALA-ILE-ARG-GLN-THR-SER-PHE-SER-ARG-ASP-SER-SER-ILE-LEU-ILE-ALA-VAL-CYS-ASP-ASP-ALA-SER-ILE-TRP-ARG-TRP-ASP-ARG-LEU-ARG,LYS-GLN-THR-ALA-ARG-M3L-SER-THR-GLY,366,9,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=36uM,4.443697,4.44,1,A,A,1,A,A,0,,B,A,,1,1,366,9,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9022955894470216,0.8606959581375122,95.07070922851562,95.85356903076172,0.3324127793312073,0.5307460427284241,0.9518105387687684,0.9389875531196594,0.8749167919158936,0.841123104095459,KQTARKSTG,Low,"(4.319, 4.456]",train
3K48,protein-peptide,Q9D777,GSKKHSVLHLVPVNITSKADSDVTEVMWQPVLRRGRGLEAQGDIVRVWDTGIYLLYSQVLFHDVTFTMGQVVSREGQGRRETLFRCIRSMPSDPDRAYNSCYSAGVFHLHQGDIITVKIPRANAKLSLSPHGTFLGFVKL,SGWCDPRWYDPFMCEH,GLY-SER-LYS-LYS-HIS-SER-VAL-LEU-HIS-LEU-VAL-PRO-VAL-ASN-ILE-THR-SER-LYS-ALA-ASP-SER-ASP-VAL-THR-GLU-VAL-MET-TRP-GLN-PRO-VAL-LEU-ARG-ARG-GLY-ARG-GLY-LEU-GLU-ALA-GLN-GLY-ASP-ILE-VAL-ARG-VAL-TRP-ASP-THR-GLY-ILE-TYR-LEU-LEU-TYR-SER-GLN-VAL-LEU-PHE-HIS-ASP-VAL-THR-PHE-THR-MET-GLY-GLN-VAL-VAL-SER-ARG-GLU-GLY-GLN-GLY-ARG-ARG-GLU-THR-LEU-PHE-ARG-CYS-ILE-ARG-SER-MET-PRO-SER-ASP-PRO-ASP-ARG-ALA-TYR-ASN-SER-CYS-TYR-SER-ALA-GLY-VAL-PHE-HIS-LEU-HIS-GLN-GLY-ASP-ILE-ILE-THR-VAL-LYS-ILE-PRO-ARG-ALA-ASN-ALA-LYS-LEU-SER-LEU-SER-PRO-HIS-GLY-THR-PHE-LEU-GLY-PHE-VAL-LYS-LEU,SER-GLY-TRP-CYS-ASP-PRO-ARG-TRP-TYR-ASP-PRO-PHE-MET-CYS-GLU-HIS,140,16,CSCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1cnc[nH]1)CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c3c1cccc3)NC(=O)CNC(=O)[C@H](CO)[NH3+])CC(=O)O)CCC2)CCC[NH+]=C(N)N)Cc1c[nH]c2c1cccc2,IC50~0.49uM,6.31,6.31,1,A,A,1,A,A,0,,R,A,dimer,1,1,140,16,0,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8144461512565613,0.7722592949867249,91.1508560180664,91.47080993652344,0.3646363317966461,0.7476224899291992,0.9183581471443176,0.8436426520347595,0.7844616770744324,0.7544134259223938,SGWCDPRWYDPFMCEH,Low,"(6.26, 6.398]",val
3KTR,protein-peptide,Q99700 P11940,GPLGSPLTASMLASAPPQEQKQMLGERLFPLIQAMHPTLAGKITGMLLEIDNSELLHMLESPESLRSKVDEAVAVLQAHQAKEAAQKA,STLNPNAKEFNPRSFSQ,GLY-PRO-LEU-GLY-SER-PRO-LEU-THR-ALA-SER-MET-LEU-ALA-SER-ALA-PRO-PRO-GLN-GLU-GLN-LYS-GLN-MET-LEU-GLY-GLU-ARG-LEU-PHE-PRO-LEU-ILE-GLN-ALA-MET-HIS-PRO-THR-LEU-ALA-GLY-LYS-ILE-THR-GLY-MET-LEU-LEU-GLU-ILE-ASP-ASN-SER-GLU-LEU-LEU-HIS-MET-LEU-GLU-SER-PRO-GLU-SER-LEU-ARG-SER-LYS-VAL-ASP-GLU-ALA-VAL-ALA-VAL-LEU-GLN-ALA-HIS-GLN-ALA-LYS-GLU-ALA-ALA-GLN-LYS-ALA,SER-THR-LEU-ASN-PRO-ASN-ALA-LYS-GLU-PHE-ASN-PRO-ARG-SER-PHE-SER-GLN,88,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CO)Cc1ccccc1)CO)CCC[NH+]=C(N)N)CC(=O)N)Cc1ccccc1)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(C)C)CC(=O)N)CC(=O)N)C,Kd=0.7uM,6.154902,6.15,1,A,A,1,A,A,0,,B,A,,1,1,88,17,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,1.0632476806640625,0.9198142886161804,95.04370880126952,89.5355453491211,0.3029234707355499,0.5826945900917053,0.9231881499290466,0.8894374370574951,0.9196910858154296,0.8563857078552246,STLNPNAKEFNPRSFSQ,Low,"(6.097, 6.26]",train
3L3X,protein-peptide,Q9Y6Q9 P10275,SQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHT,HKKLLQLLTCSS,SER-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR,HIS-LYS-LYS-LEU-LEU-GLN-LEU-LEU-THR-CYS-SER-SER,250,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CO)CS)[C@H](O)C)CC(C)C)CC(C)C)CCC(=O)N)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CCCC[NH3+],IC50=0.71uM,6.148742,6.15,1,A,A,1,A,A,0,,B,A,,1,1,250,12,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.957082450389862,0.675405740737915,95.36339569091795,93.80416107177734,0.3224052488803863,0.838897705078125,0.949833869934082,0.8568311333656311,0.9302685856819152,0.6300494074821472,HKKLLQLLTCSS,Low,"(6.097, 6.26]",val
3L3Z,protein-peptide,Q9Y6Q9 P10275,SQPIFLNVLEAIEPGVVCAGHDNNQPDSFAALLSSLNELGERQLVHVVKWAKALPGFRNLHVDDQMAVIQYSWMGLMVFAMGWRSFTNVNSRMLYFAPDLVFNEYRMHKSRMYSQCVRMRHLSQEFGWLQITPQEFLCMKALLLFSIIPVDGLKNQKFFDELRMNYIKELDRIIACKRKNPTSCSRRFYQLTKLLDSVQPIARELHQFTFDLLIKSHMVSVDFPEMMAEIISVQVPKILSGKVKPIYFHT,NALLRYLLDRDD,SER-GLN-PRO-ILE-PHE-LEU-ASN-VAL-LEU-GLU-ALA-ILE-GLU-PRO-GLY-VAL-VAL-CYS-ALA-GLY-HIS-ASP-ASN-ASN-GLN-PRO-ASP-SER-PHE-ALA-ALA-LEU-LEU-SER-SER-LEU-ASN-GLU-LEU-GLY-GLU-ARG-GLN-LEU-VAL-HIS-VAL-VAL-LYS-TRP-ALA-LYS-ALA-LEU-PRO-GLY-PHE-ARG-ASN-LEU-HIS-VAL-ASP-ASP-GLN-MET-ALA-VAL-ILE-GLN-TYR-SER-TRP-MET-GLY-LEU-MET-VAL-PHE-ALA-MET-GLY-TRP-ARG-SER-PHE-THR-ASN-VAL-ASN-SER-ARG-MET-LEU-TYR-PHE-ALA-PRO-ASP-LEU-VAL-PHE-ASN-GLU-TYR-ARG-MET-HIS-LYS-SER-ARG-MET-TYR-SER-GLN-CYS-VAL-ARG-MET-ARG-HIS-LEU-SER-GLN-GLU-PHE-GLY-TRP-LEU-GLN-ILE-THR-PRO-GLN-GLU-PHE-LEU-CYS-MET-LYS-ALA-LEU-LEU-LEU-PHE-SER-ILE-ILE-PRO-VAL-ASP-GLY-LEU-LYS-ASN-GLN-LYS-PHE-PHE-ASP-GLU-LEU-ARG-MET-ASN-TYR-ILE-LYS-GLU-LEU-ASP-ARG-ILE-ILE-ALA-CYS-LYS-ARG-LYS-ASN-PRO-THR-SER-CYS-SER-ARG-ARG-PHE-TYR-GLN-LEU-THR-LYS-LEU-LEU-ASP-SER-VAL-GLN-PRO-ILE-ALA-ARG-GLU-LEU-HIS-GLN-PHE-THR-PHE-ASP-LEU-LEU-ILE-LYS-SER-HIS-MET-VAL-SER-VAL-ASP-PHE-PRO-GLU-MET-MET-ALA-GLU-ILE-ILE-SER-VAL-GLN-VAL-PRO-LYS-ILE-LEU-SER-GLY-LYS-VAL-LYS-PRO-ILE-TYR-PHE-HIS-THR,ASN-ALA-LEU-LEU-ARG-TYR-LEU-LEU-ASP-ARG-ASP-ASP,250,12,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CC(=O)O)CCC[NH+]=C(N)N)CC(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])C)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)C,IC50=13.6uM,4.866461,4.87,1,A,A,1,A,A,0,,B,A,,1,1,250,12,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9592328667640686,0.7665544152259827,95.38822174072266,94.77423858642578,0.3220302164554596,0.764492392539978,0.948876976966858,0.8897284269332886,0.9331958293914796,0.7357609272003174,NALLRYLLDRDD,Low,"(4.866, 5.014]",train
3L6X,protein-peptide,O60716 P12830,GSPEFMIGEEVPSDQYYWAPLAQHERGSLASLDSLRKGGPPPPNWRQPELPEVIAMLGFRLDAVKSNAAAYLQHLCYRNDKVKTDVRKLKGIPVLVGLLDHPKKEVHLGACGALKNISFGRDQDNKIAIKNCDGVPALVRLLRKARDMDLTEVITGTLWNLSSHDSIKMEIVDHALHALTDEVIIPHSGWEREPNEDCKPRHIEWESVLTNTAGCLRNVSSERSEARRKLRECDGLVDALIFIVQAEIGQKDSDSKLVENCVCLLRNLSYQVHREIPQAERYQEAAPNVANNTGTSPARGYELLFQPEVVRIYISLLKESKTPAILEASAGAIQNLCAGRWTYGRYIRSALRQEKALSAIADLLTNEHERVVKAASGALRNLAVDARNKELIGKHAIPNLVKNLPGGQQNSSWNFSEDTVISILNTINEVIAENLEAAKKLRETQGIEKLVLINKSGNRSEKEVRAAALVLQTIWGYKELRKPLEKEGWKKSDFQVNLNNASRSQSSHSYDDSTLPLIDRNQKSDKKPDREEIQMSNMGSNTKSLDNNYSTPNERGDHNRTLDRSGDLGDMEPLKGTTPLMQKI,DEEGGGEEDQDFDLSQLH,GLY-SER-PRO-GLU-PHE-MET-ILE-GLY-GLU-GLU-VAL-PRO-SER-ASP-GLN-TYR-TYR-TRP-ALA-PRO-LEU-ALA-GLN-HIS-GLU-ARG-GLY-SER-LEU-ALA-SER-LEU-ASP-SER-LEU-ARG-LYS-GLY-GLY-PRO-PRO-PRO-PRO-ASN-TRP-ARG-GLN-PRO-GLU-LEU-PRO-GLU-VAL-ILE-ALA-MET-LEU-GLY-PHE-ARG-LEU-ASP-ALA-VAL-LYS-SER-ASN-ALA-ALA-ALA-TYR-LEU-GLN-HIS-LEU-CYS-TYR-ARG-ASN-ASP-LYS-VAL-LYS-THR-ASP-VAL-ARG-LYS-LEU-LYS-GLY-ILE-PRO-VAL-LEU-VAL-GLY-LEU-LEU-ASP-HIS-PRO-LYS-LYS-GLU-VAL-HIS-LEU-GLY-ALA-CYS-GLY-ALA-LEU-LYS-ASN-ILE-SER-PHE-GLY-ARG-ASP-GLN-ASP-ASN-LYS-ILE-ALA-ILE-LYS-ASN-CYS-ASP-GLY-VAL-PRO-ALA-LEU-VAL-ARG-LEU-LEU-ARG-LYS-ALA-ARG-ASP-MET-ASP-LEU-THR-GLU-VAL-ILE-THR-GLY-THR-LEU-TRP-ASN-LEU-SER-SER-HIS-ASP-SER-ILE-LYS-MET-GLU-ILE-VAL-ASP-HIS-ALA-LEU-HIS-ALA-LEU-THR-ASP-GLU-VAL-ILE-ILE-PRO-HIS-SER-GLY-TRP-GLU-ARG-GLU-PRO-ASN-GLU-ASP-CYS-LYS-PRO-ARG-HIS-ILE-GLU-TRP-GLU-SER-VAL-LEU-THR-ASN-THR-ALA-GLY-CYS-LEU-ARG-ASN-VAL-SER-SER-GLU-ARG-SER-GLU-ALA-ARG-ARG-LYS-LEU-ARG-GLU-CYS-ASP-GLY-LEU-VAL-ASP-ALA-LEU-ILE-PHE-ILE-VAL-GLN-ALA-GLU-ILE-GLY-GLN-LYS-ASP-SER-ASP-SER-LYS-LEU-VAL-GLU-ASN-CYS-VAL-CYS-LEU-LEU-ARG-ASN-LEU-SER-TYR-GLN-VAL-HIS-ARG-GLU-ILE-PRO-GLN-ALA-GLU-ARG-TYR-GLN-GLU-ALA-ALA-PRO-ASN-VAL-ALA-ASN-ASN-THR-GLY-THR-SER-PRO-ALA-ARG-GLY-TYR-GLU-LEU-LEU-PHE-GLN-PRO-GLU-VAL-VAL-ARG-ILE-TYR-ILE-SER-LEU-LEU-LYS-GLU-SER-LYS-THR-PRO-ALA-ILE-LEU-GLU-ALA-SER-ALA-GLY-ALA-ILE-GLN-ASN-LEU-CYS-ALA-GLY-ARG-TRP-THR-TYR-GLY-ARG-TYR-ILE-ARG-SER-ALA-LEU-ARG-GLN-GLU-LYS-ALA-LEU-SER-ALA-ILE-ALA-ASP-LEU-LEU-THR-ASN-GLU-HIS-GLU-ARG-VAL-VAL-LYS-ALA-ALA-SER-GLY-ALA-LEU-ARG-ASN-LEU-ALA-VAL-ASP-ALA-ARG-ASN-LYS-GLU-LEU-ILE-GLY-LYS-HIS-ALA-ILE-PRO-ASN-LEU-VAL-LYS-ASN-LEU-PRO-GLY-GLY-GLN-GLN-ASN-SER-SER-TRP-ASN-PHE-SER-GLU-ASP-THR-VAL-ILE-SER-ILE-LEU-ASN-THR-ILE-ASN-GLU-VAL-ILE-ALA-GLU-ASN-LEU-GLU-ALA-ALA-LYS-LYS-LEU-ARG-GLU-THR-GLN-GLY-ILE-GLU-LYS-LEU-VAL-LEU-ILE-ASN-LYS-SER-GLY-ASN-ARG-SER-GLU-LYS-GLU-VAL-ARG-ALA-ALA-ALA-LEU-VAL-LEU-GLN-THR-ILE-TRP-GLY-TYR-LYS-GLU-LEU-ARG-LYS-PRO-LEU-GLU-LYS-GLU-GLY-TRP-LYS-LYS-SER-ASP-PHE-GLN-VAL-ASN-LEU-ASN-ASN-ALA-SER-ARG-SER-GLN-SER-SER-HIS-SER-TYR-ASP-ASP-SER-THR-LEU-PRO-LEU-ILE-ASP-ARG-ASN-GLN-LYS-SER-ASP-LYS-LYS-PRO-ASP-ARG-GLU-GLU-ILE-GLN-MET-SER-ASN-MET-GLY-SER-ASN-THR-LYS-SER-LEU-ASP-ASN-ASN-TYR-SER-THR-PRO-ASN-GLU-ARG-GLY-ASP-HIS-ASN-ARG-THR-LEU-ASP-ARG-SER-GLY-ASP-LEU-GLY-ASP-MET-GLU-PRO-LEU-LYS-GLY-THR-THR-PRO-LEU-MET-GLN-LYS-ILE,ASP-GLU-GLU-GLY-GLY-GLY-GLU-GLU-ASP-GLN-ASP-PHE-ASP-LEU-SER-GLN-LEU-HIS,584,18,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1nc[nH]c1)CC(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CCC(=O)O)CCC(=O)O)CCC(=O)O)CCC(=O)O)CC(=O)O)CCC(=O)N)CC(=O)O)Cc1ccccc1)CC(=O)O)CC(C)C,Kd=40uM,4.39794,4.4,1,A,A,1,A,A,0,,B,A,,1,1,584,18,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)CNC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9347660541534424,0.8605436682701111,65.9068374633789,65.4544906616211,0.6102470755577087,1.010577917098999,0.7649645805358887,0.7512694597244263,0.8256383538246155,0.7626482248306274,DEEGGGEEDQDFDLSQLH,Low,"(4.319, 4.456]",train
3L81,protein-peptide,O00189 P05067,GAMDPEFQQSKVAPSSAASRPVLSSRSDQSQKNEVFLDVVERLSVLIASNGSLLKVDVQGEIRLKSFLPSGSEMRIGLTEEFSVGKSELRGYGPGIRVDEVSFHSSVNLDEFESHRILRLQPPQGELTVMRYQLSDDLPSPLPFRLFPSVQWDRGSGRLQVYLKLRCDLLSKSQALNVRLHLPLPRGVVSLSQELSSPEQKAELAEGALRWDLPRVQGGSQLSGLFQMDVPGPPGPPSHGLSTSASPLGLGPASLSFELPRHTCSGLQVRFLRLAFRPSGNANPHKWVRHLSHSDAYVIRI,TYKFFEQ,GLY-ALA-MET-ASP-PRO-GLU-PHE-GLN-GLN-SER-LYS-VAL-ALA-PRO-SER-SER-ALA-ALA-SER-ARG-PRO-VAL-LEU-SER-SER-ARG-SER-ASP-GLN-SER-GLN-LYS-ASN-GLU-VAL-PHE-LEU-ASP-VAL-VAL-GLU-ARG-LEU-SER-VAL-LEU-ILE-ALA-SER-ASN-GLY-SER-LEU-LEU-LYS-VAL-ASP-VAL-GLN-GLY-GLU-ILE-ARG-LEU-LYS-SER-PHE-LEU-PRO-SER-GLY-SER-GLU-MET-ARG-ILE-GLY-LEU-THR-GLU-GLU-PHE-SER-VAL-GLY-LYS-SER-GLU-LEU-ARG-GLY-TYR-GLY-PRO-GLY-ILE-ARG-VAL-ASP-GLU-VAL-SER-PHE-HIS-SER-SER-VAL-ASN-LEU-ASP-GLU-PHE-GLU-SER-HIS-ARG-ILE-LEU-ARG-LEU-GLN-PRO-PRO-GLN-GLY-GLU-LEU-THR-VAL-MET-ARG-TYR-GLN-LEU-SER-ASP-ASP-LEU-PRO-SER-PRO-LEU-PRO-PHE-ARG-LEU-PHE-PRO-SER-VAL-GLN-TRP-ASP-ARG-GLY-SER-GLY-ARG-LEU-GLN-VAL-TYR-LEU-LYS-LEU-ARG-CYS-ASP-LEU-LEU-SER-LYS-SER-GLN-ALA-LEU-ASN-VAL-ARG-LEU-HIS-LEU-PRO-LEU-PRO-ARG-GLY-VAL-VAL-SER-LEU-SER-GLN-GLU-LEU-SER-SER-PRO-GLU-GLN-LYS-ALA-GLU-LEU-ALA-GLU-GLY-ALA-LEU-ARG-TRP-ASP-LEU-PRO-ARG-VAL-GLN-GLY-GLY-SER-GLN-LEU-SER-GLY-LEU-PHE-GLN-MET-ASP-VAL-PRO-GLY-PRO-PRO-GLY-PRO-PRO-SER-HIS-GLY-LEU-SER-THR-SER-ALA-SER-PRO-LEU-GLY-LEU-GLY-PRO-ALA-SER-LEU-SER-PHE-GLU-LEU-PRO-ARG-HIS-THR-CYS-SER-GLY-LEU-GLN-VAL-ARG-PHE-LEU-ARG-LEU-ALA-PHE-ARG-PRO-SER-GLY-ASN-ALA-ASN-PRO-HIS-LYS-TRP-VAL-ARG-HIS-LEU-SER-HIS-SER-ASP-ALA-TYR-VAL-ILE-ARG-ILE,THR-TYR-LYS-PHE-PHE-GLU-GLN,301,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)O)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])Cc1ccc(cc1)O,Kd=29.6uM,4.528708,4.53,1,A,A,1,A,A,0,,B,A,,1,1,301,7,0,C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)C(=O)O,0.8926344513893127,0.8563944101333618,80.21126556396484,77.39958953857422,0.5306905508041382,0.8460267186164856,0.8105961680412292,0.7908514738082886,0.8461797833442688,0.8167170882225037,TYKFFEQ,Low,"(4.456, 4.606]",val
3MEA,protein-peptide,Q92133 Q96ES7,MHHHHHHSSRENLYFQGTLPLWIGKPGDKPPPLCGAIPASGDYVARPGDKVAARVKAVDGDEQWILAEVVSYSHATNKYEVDDIDEEGKERHTLSRRRVIPLPQWKANPETDPEALFQKEQLVLALYPQTTCFYRALIHAPPQRPQDDYSVLFEDTSYADGYSPPLNVAQRYVVACKEPK,ARTKQTARKST,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-THR-LEU-PRO-LEU-TRP-ILE-GLY-LYS-PRO-GLY-ASP-LYS-PRO-PRO-PRO-LEU-CYS-GLY-ALA-ILE-PRO-ALA-SER-GLY-ASP-TYR-VAL-ALA-ARG-PRO-GLY-ASP-LYS-VAL-ALA-ALA-ARG-VAL-LYS-ALA-VAL-ASP-GLY-ASP-GLU-GLN-TRP-ILE-LEU-ALA-GLU-VAL-VAL-SER-TYR-SER-HIS-ALA-THR-ASN-LYS-TYR-GLU-VAL-ASP-ASP-ILE-ASP-GLU-GLU-GLY-LYS-GLU-ARG-HIS-THR-LEU-SER-ARG-ARG-ARG-VAL-ILE-PRO-LEU-PRO-GLN-TRP-LYS-ALA-ASN-PRO-GLU-THR-ASP-PRO-GLU-ALA-LEU-PHE-GLN-LYS-GLU-GLN-LEU-VAL-LEU-ALA-LEU-TYR-PRO-GLN-THR-THR-CYS-PHE-TYR-ARG-ALA-LEU-ILE-HIS-ALA-PRO-PRO-GLN-ARG-PRO-GLN-ASP-ASP-TYR-SER-VAL-LEU-PHE-GLU-ASP-THR-SER-TYR-ALA-ASP-GLY-TYR-SER-PRO-PRO-LEU-ASN-VAL-ALA-GLN-ARG-TYR-VAL-VAL-ALA-CYS-LYS-GLU-PRO-LYS,ALA-ARG-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR,180,11,NC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[N+](C)(C)C)[C@H](O)C)NC(=O)[C@@H]([NH3+])C)N,Kd=0.5uM,6.30103,6.3,1,A,A,1,A,A,0,,B,A,,1,1,180,11,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.9291637539863586,0.8407042026519775,85.53569030761719,83.10017395019531,0.384375125169754,0.7250047326087952,0.8937403559684753,0.8452942967414856,0.8431243300437927,0.7770566344261169,ARTKQTARKST,Low,"(6.26, 6.398]",val
3MEU,protein-peptide,Q92133 Q96ES7,GRRGVLMTLLQQSAMTLPLWIGKPGDKPPPLCGAIPASGDYVARPGDKVAARVKAVDGDEQWILAEVVSYSHATNKYEVDDIDEEGKERHTLSRRRVIPLPQWKANPETDPEALFQKEQLVLALYPQTTCFYRALIHAPPQRPQDDYSVLFEDTSYADGYSPPLNVAQRYVVACKEPKKK,ARTKQTARKSTGGY,GLY-ARG-ARG-GLY-VAL-LEU-MSE-THR-LEU-LEU-GLN-GLN-SER-ALA-MSE-THR-LEU-PRO-LEU-TRP-ILE-GLY-LYS-PRO-GLY-ASP-LYS-PRO-PRO-PRO-LEU-CYS-GLY-ALA-ILE-PRO-ALA-SER-GLY-ASP-TYR-VAL-ALA-ARG-PRO-GLY-ASP-LYS-VAL-ALA-ALA-ARG-VAL-LYS-ALA-VAL-ASP-GLY-ASP-GLU-GLN-TRP-ILE-LEU-ALA-GLU-VAL-VAL-SER-TYR-SER-HIS-ALA-THR-ASN-LYS-TYR-GLU-VAL-ASP-ASP-ILE-ASP-GLU-GLU-GLY-LYS-GLU-ARG-HIS-THR-LEU-SER-ARG-ARG-ARG-VAL-ILE-PRO-LEU-PRO-GLN-TRP-LYS-ALA-ASN-PRO-GLU-THR-ASP-PRO-GLU-ALA-LEU-PHE-GLN-LYS-GLU-GLN-LEU-VAL-LEU-ALA-LEU-TYR-PRO-GLN-THR-THR-CYS-PHE-TYR-ARG-ALA-LEU-ILE-HIS-ALA-PRO-PRO-GLN-ARG-PRO-GLN-ASP-ASP-TYR-SER-VAL-LEU-PHE-GLU-ASP-THR-SER-TYR-ALA-ASP-GLY-TYR-SER-PRO-PRO-LEU-ASN-VAL-ALA-GLN-ARG-TYR-VAL-VAL-ALA-CYS-LYS-GLU-PRO-LYS-LYS-LYS,ALA-2MR-THR-M3L-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-TYR,180,14,CNC(=[NH+]CCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCCC[N+](C)(C)C)[C@H](O)C)NC(=O)[C@@H]([NH3+])C)NC,Kd=0.5uM,6.30103,6.3,1,A,A,1,A,A,0,,C,A,,1,1,180,14,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CN=C(NC)NCCCC(NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,CN=C(NC)NCCCC(NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)O,0.8770462870597839,0.8224034309387207,91.61222839355467,90.17424774169922,0.3721984028816223,0.6900438070297241,0.92276793718338,0.8901458382606506,0.8205128312110901,0.8054677844047546,ARTKQTARKSTGGY,Low,"(6.26, 6.398]",val
3ML4,protein-peptide,Q18PE0 Q61006,GSEFMTEAALVEGQVKLRDGKKWKSRWLVLRKPSPVADCLLMLVYKDKCERSKGLRERSSLTLEDICGLEPALPYEGLAHTLAIICLSQAVMLGFDSHEAMCAWDTRIRYALGEVHRFHVTVAPGTKLESGPATLHLCNDILVLARDIPPTVMGQWKLSDLRRYGAVPNGFIFEGGTRCGYWAGVFFLSSAEGEQMSFLFDCIVRGISPTKGPFGLRPVLPDPS,LDRLHPNPMYQRM,GLY-SER-GLU-PHE-MSE-THR-GLU-ALA-ALA-LEU-VAL-GLU-GLY-GLN-VAL-LYS-LEU-ARG-ASP-GLY-LYS-LYS-TRP-LYS-SER-ARG-TRP-LEU-VAL-LEU-ARG-LYS-PRO-SER-PRO-VAL-ALA-ASP-CYS-LEU-LEU-MSE-LEU-VAL-TYR-LYS-ASP-LYS-CYS-GLU-ARG-SER-LYS-GLY-LEU-ARG-GLU-ARG-SER-SER-LEU-THR-LEU-GLU-ASP-ILE-CYS-GLY-LEU-GLU-PRO-ALA-LEU-PRO-TYR-GLU-GLY-LEU-ALA-HIS-THR-LEU-ALA-ILE-ILE-CYS-LEU-SER-GLN-ALA-VAL-MSE-LEU-GLY-PHE-ASP-SER-HIS-GLU-ALA-MSE-CYS-ALA-TRP-ASP-THR-ARG-ILE-ARG-TYR-ALA-LEU-GLY-GLU-VAL-HIS-ARG-PHE-HIS-VAL-THR-VAL-ALA-PRO-GLY-THR-LYS-LEU-GLU-SER-GLY-PRO-ALA-THR-LEU-HIS-LEU-CYS-ASN-ASP-ILE-LEU-VAL-LEU-ALA-ARG-ASP-ILE-PRO-PRO-THR-VAL-MSE-GLY-GLN-TRP-LYS-LEU-SER-ASP-LEU-ARG-ARG-TYR-GLY-ALA-VAL-PRO-ASN-GLY-PHE-ILE-PHE-GLU-GLY-GLY-THR-ARG-CYS-GLY-TYR-TRP-ALA-GLY-VAL-PHE-PHE-LEU-SER-SER-ALA-GLU-GLY-GLU-GLN-MSE-SER-PHE-LEU-PHE-ASP-CYS-ILE-VAL-ARG-GLY-ILE-SER-PRO-THR-LYS-GLY-PRO-PHE-GLY-LEU-ARG-PRO-VAL-LEU-PRO-ASP-PRO-SER,LEU-ASP-ARG-LEU-HIS-PRO-ASN-PRO-MET-PTR-GLN-ARG-MET,224,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)C)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])Cc1nc[nH]c1)CC(=O)N,Kd=4.7uM,5.327902,5.33,1,A,A,1,A,A,0,,E,A,dimer,1,1,224,13,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.907351016998291,0.7979179620742798,87.8868408203125,82.52629852294922,0.3985476791858673,0.70268714427948,0.8986870646476746,0.8553395867347717,0.8725971579551697,0.7835624814033508,LDRLHPNPMYQRM,Low,"(5.31, 5.463]",val
3MO8,protein-peptide,Q71DI3 P55201,GEDSPLDALDLVWAKCRGYPSYPALIIDPKMPREGMFHHGVPIPVPPLEVLKLGEQMTQEAREHLYLVLFFDNKRTWQWLPRTKLVPLGVNQDLDKEKMLEGRKSNIRKSVQIAYHRALQHRSKVQGEQS,PATGGVKKPHRY,GLY-GLU-ASP-SER-PRO-LEU-ASP-ALA-LEU-ASP-LEU-VAL-TRP-ALA-LYS-CYS-ARG-GLY-TYR-PRO-SER-TYR-PRO-ALA-LEU-ILE-ILE-ASP-PRO-LYS-MET-PRO-ARG-GLU-GLY-MET-PHE-HIS-HIS-GLY-VAL-PRO-ILE-PRO-VAL-PRO-PRO-LEU-GLU-VAL-LEU-LYS-LEU-GLY-GLU-GLN-MET-THR-GLN-GLU-ALA-ARG-GLU-HIS-LEU-TYR-LEU-VAL-LEU-PHE-PHE-ASP-ASN-LYS-ARG-THR-TRP-GLN-TRP-LEU-PRO-ARG-THR-LYS-LEU-VAL-PRO-LEU-GLY-VAL-ASN-GLN-ASP-LEU-ASP-LYS-GLU-LYS-MET-LEU-GLU-GLY-ARG-LYS-SER-ASN-ILE-ARG-LYS-SER-VAL-GLN-ILE-ALA-TYR-HIS-ARG-ALA-LEU-GLN-HIS-ARG-SER-LYS-VAL-GLN-GLY-GLU-GLN-SER,PRO-ALA-THR-GLY-GLY-VAL-M3L-LYS-PRO-HIS-ARG-TYR,130,12,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)C)CCCC[N+](C)(C)C,Kd=0.8mM,3.09691,3.1,1,A,A,1,A,A,0,,B,A,,1,1,130,12,0,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(CCCC[N+](C)(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9144666194915771,0.8483339548110962,90.2581787109375,92.85970306396484,0.3491889536380768,0.6042315363883972,0.9242619276046752,0.897043764591217,0.8592008948326111,0.83615642786026,PATGGVKKPHRY,Low,"(2.044, 3.548]",train
3MP1,protein-peptide,P25554 P68431 P0AEX9 P61830,MKIEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDEALAAAQTNAAAEFGSSYWTSEYNPNAPILVGSEVAYKPRRGSADGEWIQCEVLKVVADGTRFEVRDPEPDELGNSGKVYKCNRKELLLIPPGFPTKNYPPGTKVLARYPETTTFYPAIVIGTKRDGTCRLRFDGEEEVDKETEVTRRLVLPSPTALANLARK,ARTKQ,MET-LYS-ILE-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-ALA-ALA-PHE-ASN-LYS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-GLU-ALA-LEU-ALA-ALA-ALA-GLN-THR-ASN-ALA-ALA-ALA-GLU-PHE-GLY-SER-SER-TYR-TRP-THR-SER-GLU-TYR-ASN-PRO-ASN-ALA-PRO-ILE-LEU-VAL-GLY-SER-GLU-VAL-ALA-TYR-LYS-PRO-ARG-ARG-GLY-SER-ALA-ASP-GLY-GLU-TRP-ILE-GLN-CYS-GLU-VAL-LEU-LYS-VAL-VAL-ALA-ASP-GLY-THR-ARG-PHE-GLU-VAL-ARG-ASP-PRO-GLU-PRO-ASP-GLU-LEU-GLY-ASN-SER-GLY-LYS-VAL-TYR-LYS-CYS-ASN-ARG-LYS-GLU-LEU-LEU-LEU-ILE-PRO-PRO-GLY-PHE-PRO-THR-LYS-ASN-TYR-PRO-PRO-GLY-THR-LYS-VAL-LEU-ALA-ARG-TYR-PRO-GLU-THR-THR-THR-PHE-TYR-PRO-ALA-ILE-VAL-ILE-GLY-THR-LYS-ARG-ASP-GLY-THR-CYS-ARG-LEU-ARG-PHE-ASP-GLY-GLU-GLU-GLU-VAL-ASP-LYS-GLU-THR-GLU-VAL-THR-ARG-ARG-LEU-VAL-LEU-PRO-SER-PRO-THR-ALA-LEU-ALA-ASN-LEU-ALA-ARG-LYS,ALA-ARG-THR-M3L-GLN,522,5,NC(=O)CC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCCC[N+](C)(C)C,Kd=0.8uM,6.09691,6.1,1,A,A,1,A,A,0,,P,A,,1,1,522,5,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,0.7011138200759888,0.826840341091156,56.81978988647461,64.04679870605469,0.728164792060852,0.7926746010780334,0.6856499314308167,0.7679673433303833,0.6990500688552856,0.841558575630188,ARTKQ,Low,"(5.959, 6.097]",train
3MXC,protein-peptide,P62993 P05067,GSHMKPHPWFFGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVVKFNSLNELVDYHRSTSVSRNQQIFLRDIE,QNGYENPTY,GLY-SER-HIS-MET-LYS-PRO-HIS-PRO-TRP-PHE-PHE-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLU,GLN-ASN-GLY-PTR-GLU-ASN-PRO-THR-TYR,101,9,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC)[C@H](O)C)CC(=O)N)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O,Kd=286.1nM,6.543482,6.54,1,A,A,1,A,A,0,,L,A,,1,1,101,9,0,C[C@@H](O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)O,C[C@@H](O)[C@H](NC(=O)[C@H](CCC(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9960722923278807,0.8854118585586548,96.72931671142578,95.8519058227539,0.3001013696193695,0.5782893300056458,0.93123459815979,0.8889780640602112,0.91000896692276,0.8288272619247437,QNGYENPTY,Low,"(6.523, 6.696]",train
3MXY,protein-peptide,P62993 P05067,GSHMKPHPWFFGKIPRAKAEEMLSKQRHDGAFLIRESESAPGDFSLSVKFGNDVQHFKVLRDGAGKYFLWVVKFNSLNELVDYHRSTSVSRNQQIFLRDIE,QNGYVNPTY,GLY-SER-HIS-MET-LYS-PRO-HIS-PRO-TRP-PHE-PHE-GLY-LYS-ILE-PRO-ARG-ALA-LYS-ALA-GLU-GLU-MET-LEU-SER-LYS-GLN-ARG-HIS-ASP-GLY-ALA-PHE-LEU-ILE-ARG-GLU-SER-GLU-SER-ALA-PRO-GLY-ASP-PHE-SER-LEU-SER-VAL-LYS-PHE-GLY-ASN-ASP-VAL-GLN-HIS-PHE-LYS-VAL-LEU-ARG-ASP-GLY-ALA-GLY-LYS-TYR-PHE-LEU-TRP-VAL-VAL-LYS-PHE-ASN-SER-LEU-ASN-GLU-LEU-VAL-ASP-TYR-HIS-ARG-SER-THR-SER-VAL-SER-ARG-ASN-GLN-GLN-ILE-PHE-LEU-ARG-ASP-ILE-GLU,GLN-ASN-GLY-PTR-VAL-ASN-PRO-THR-TYR,101,9,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)[C@H](O)C)CC(=O)N)C(C)C)Cc1ccc(cc1)OP(O)(O)O,Kd=384.8nM,6.414765,6.41,1,A,A,1,A,A,0,,L,A,,1,1,101,9,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NC(Cc1ccc(OP(=O)(O)O)cc1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,1.007945537567139,0.8872784972190857,97.0167007446289,95.7265625,0.2967605888843536,0.5522475242614746,0.9344300627708436,0.8911430835723877,0.9240515828132628,0.8306192755699158,QNGYVNPTY,Low,"(6.398, 6.523]",val
3N5U,protein-peptide,P06400 P62136,MSDSEKLNLDSIIGRLLEVQGSRPGKNVQLTENEIRGLCLKSREIFLSQPILLELEAPLKICGDIHGQYYDLLRLFEYGGFPPESNYLFLGDYVDRGKQSLETICLLLAYKIKYPENFFLLRGNHECASINRIYGFYDECKRRYNIKLWKTFTDCFNCLPIAAIVDEKIFCCHGGLSPDLQSMEQIRRIMRPTDVPDQGLLCDLLWSDPDKDVQGWGENDRGVSFTFGAEVVAKFLHKHDLDLICRAHQVVEDGYEFFAKRQLVTLFSAPNYCGEFDNAGAMMSVDETLMCSFQILKPAD,KPLKKLRFDIEGS,MET-SER-ASP-SER-GLU-LYS-LEU-ASN-LEU-ASP-SER-ILE-ILE-GLY-ARG-LEU-LEU-GLU-VAL-GLN-GLY-SER-ARG-PRO-GLY-LYS-ASN-VAL-GLN-LEU-THR-GLU-ASN-GLU-ILE-ARG-GLY-LEU-CYS-LEU-LYS-SER-ARG-GLU-ILE-PHE-LEU-SER-GLN-PRO-ILE-LEU-LEU-GLU-LEU-GLU-ALA-PRO-LEU-LYS-ILE-CYS-GLY-ASP-ILE-HIS-GLY-GLN-TYR-TYR-ASP-LEU-LEU-ARG-LEU-PHE-GLU-TYR-GLY-GLY-PHE-PRO-PRO-GLU-SER-ASN-TYR-LEU-PHE-LEU-GLY-ASP-TYR-VAL-ASP-ARG-GLY-LYS-GLN-SER-LEU-GLU-THR-ILE-CYS-LEU-LEU-LEU-ALA-TYR-LYS-ILE-LYS-TYR-PRO-GLU-ASN-PHE-PHE-LEU-LEU-ARG-GLY-ASN-HIS-GLU-CYS-ALA-SER-ILE-ASN-ARG-ILE-TYR-GLY-PHE-TYR-ASP-GLU-CYS-LYS-ARG-ARG-TYR-ASN-ILE-LYS-LEU-TRP-LYS-THR-PHE-THR-ASP-CYS-PHE-ASN-CYS-LEU-PRO-ILE-ALA-ALA-ILE-VAL-ASP-GLU-LYS-ILE-PHE-CYS-CYS-HIS-GLY-GLY-LEU-SER-PRO-ASP-LEU-GLN-SER-MET-GLU-GLN-ILE-ARG-ARG-ILE-MET-ARG-PRO-THR-ASP-VAL-PRO-ASP-GLN-GLY-LEU-LEU-CYS-ASP-LEU-LEU-TRP-SER-ASP-PRO-ASP-LYS-ASP-VAL-GLN-GLY-TRP-GLY-GLU-ASN-ASP-ARG-GLY-VAL-SER-PHE-THR-PHE-GLY-ALA-GLU-VAL-VAL-ALA-LYS-PHE-LEU-HIS-LYS-HIS-ASP-LEU-ASP-LEU-ILE-CYS-ARG-ALA-HIS-GLN-VAL-VAL-GLU-ASP-GLY-TYR-GLU-PHE-PHE-ALA-LYS-ARG-GLN-LEU-VAL-THR-LEU-PHE-SER-ALA-PRO-ASN-TYR-CYS-GLY-GLU-PHE-ASP-ASN-ALA-GLY-ALA-MET-MET-SER-VAL-ASP-GLU-THR-LEU-MET-CYS-SER-PHE-GLN-ILE-LEU-LYS-PRO-ALA-ASP,LYS-PRO-LEU-LYS-LYS-LEU-ARG-PHE-ASP-ILE-GLU-GLY-SER,300,13,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCCC[NH3+])CC(C)C)CCC[NH+]=C(N)N)CC(=O)O)C,Kd=1.2uM,5.920819,5.92,1,A,A,1,A,A,0,,C,A,,1,1,300,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)O,0.8438308238983154,0.8039535284042358,91.99757385253906,92.65457153320312,0.3657191693782806,0.6600055694580078,0.9406803846359252,0.906785786151886,0.7936599254608154,0.7782454490661621,KPLKKLRFDIEGS,Low,"(5.821, 5.959]",train
3NF3,protein-peptide,Q7B8V4,MPFVNKQFNYKDPVNGVDIAYIKIPNAGQMQPVKAFKIHNKIWVIPERDTFTNPEEGDLNPPPEAKQVPVSYYDSTYLSTDNEKDNYLKGVTKLFERIYSTDLGRMLLTSIVRGIPFWGGSTIDTELKVIDTNCINVIQPDGSYRSEELNLVIIGPSADIIQFECKSFGHEVLNLTRNGYGSTQYIRFSPDFTFGFEESLEVDTNPLLGAGKFATDPAVTLAHELIHAGHRLYGIAINPNRVFKVNTNAYYEMSGLEVSFEELRTFGGHDAKFIDSLQENEFRLYYYNKFKDIASTLNKAKSIVGTTASLQYMKNVFKEKYLLSEDTSGKFSVDKLKFDKLYKMLTEIYTEDNFVKFFKVLNRKTYLNFDKAVFKINIVPKVNYTIYDGFNLRNTNLAANFNGQNTEINNMNFTKLKNFTPLVPR,RRFAAMLA,MET-PRO-PHE-VAL-ASN-LYS-GLN-PHE-ASN-TYR-LYS-ASP-PRO-VAL-ASN-GLY-VAL-ASP-ILE-ALA-TYR-ILE-LYS-ILE-PRO-ASN-ALA-GLY-GLN-MET-GLN-PRO-VAL-LYS-ALA-PHE-LYS-ILE-HIS-ASN-LYS-ILE-TRP-VAL-ILE-PRO-GLU-ARG-ASP-THR-PHE-THR-ASN-PRO-GLU-GLU-GLY-ASP-LEU-ASN-PRO-PRO-PRO-GLU-ALA-LYS-GLN-VAL-PRO-VAL-SER-TYR-TYR-ASP-SER-THR-TYR-LEU-SER-THR-ASP-ASN-GLU-LYS-ASP-ASN-TYR-LEU-LYS-GLY-VAL-THR-LYS-LEU-PHE-GLU-ARG-ILE-TYR-SER-THR-ASP-LEU-GLY-ARG-MET-LEU-LEU-THR-SER-ILE-VAL-ARG-GLY-ILE-PRO-PHE-TRP-GLY-GLY-SER-THR-ILE-ASP-THR-GLU-LEU-LYS-VAL-ILE-ASP-THR-ASN-CYS-ILE-ASN-VAL-ILE-GLN-PRO-ASP-GLY-SER-TYR-ARG-SER-GLU-GLU-LEU-ASN-LEU-VAL-ILE-ILE-GLY-PRO-SER-ALA-ASP-ILE-ILE-GLN-PHE-GLU-CYS-LYS-SER-PHE-GLY-HIS-GLU-VAL-LEU-ASN-LEU-THR-ARG-ASN-GLY-TYR-GLY-SER-THR-GLN-TYR-ILE-ARG-PHE-SER-PRO-ASP-PHE-THR-PHE-GLY-PHE-GLU-GLU-SER-LEU-GLU-VAL-ASP-THR-ASN-PRO-LEU-LEU-GLY-ALA-GLY-LYS-PHE-ALA-THR-ASP-PRO-ALA-VAL-THR-LEU-ALA-HIS-GLU-LEU-ILE-HIS-ALA-GLY-HIS-ARG-LEU-TYR-GLY-ILE-ALA-ILE-ASN-PRO-ASN-ARG-VAL-PHE-LYS-VAL-ASN-THR-ASN-ALA-TYR-TYR-GLU-MET-SER-GLY-LEU-GLU-VAL-SER-PHE-GLU-GLU-LEU-ARG-THR-PHE-GLY-GLY-HIS-ASP-ALA-LYS-PHE-ILE-ASP-SER-LEU-GLN-GLU-ASN-GLU-PHE-ARG-LEU-TYR-TYR-TYR-ASN-LYS-PHE-LYS-ASP-ILE-ALA-SER-THR-LEU-ASN-LYS-ALA-LYS-SER-ILE-VAL-GLY-THR-THR-ALA-SER-LEU-GLN-TYR-MET-LYS-ASN-VAL-PHE-LYS-GLU-LYS-TYR-LEU-LEU-SER-GLU-ASP-THR-SER-GLY-LYS-PHE-SER-VAL-ASP-LYS-LEU-LYS-PHE-ASP-LYS-LEU-TYR-LYS-MET-LEU-THR-GLU-ILE-TYR-THR-GLU-ASP-ASN-PHE-VAL-LYS-PHE-PHE-LYS-VAL-LEU-ASN-ARG-LYS-THR-TYR-LEU-ASN-PHE-ASP-LYS-ALA-VAL-PHE-LYS-ILE-ASN-ILE-VAL-PRO-LYS-VAL-ASN-TYR-THR-ILE-TYR-ASP-GLY-PHE-ASN-LEU-ARG-ASN-THR-ASN-LEU-ALA-ALA-ASN-PHE-ASN-GLY-GLN-ASN-THR-GLU-ILE-ASN-ASN-MET-ASN-PHE-THR-LYS-LEU-LYS-ASN-PHE-THR-PRO-LEU-VAL-PRO-ARG,ARG-ARG-PHE-AIB-ALA-MET-LEU-ALA,425,8,CSCC[C@@H](C(=O)N[C@H](C(=O)N)CC(C)C)NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)Cc1ccccc1)(C)C)C,Ki=638.1nM,6.195111,6.2,1,A,A,1,A,A,0,,C,A,,1,1,425,8,0,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(C)(C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(C)(C)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O,0.6579115986824036,0.6698409914970398,56.90193939208984,39.65308380126953,1.2146490812301636,1.526126265525818,0.7537392377853394,0.7076283693313599,0.6224073171615601,0.6603941321372986,RRFAAMLA,Low,"(6.097, 6.26]",train
3NFL,protein-peptide,Q12879 P29074,GSSPEKPTPNGGIPHDNLVLIRMKPDENGRFGFNVKGGYDQKMPVIVSRVAPGTPADLCVPRLNEGDQVVLINGRDIAEHTHDQVVLFIKASCERHSGELMLLVRPN,SNRRVYKKMPSIESDV,GLY-SER-SER-PRO-GLU-LYS-PRO-THR-PRO-ASN-GLY-GLY-ILE-PRO-HIS-ASP-ASN-LEU-VAL-LEU-ILE-ARG-MET-LYS-PRO-ASP-GLU-ASN-GLY-ARG-PHE-GLY-PHE-ASN-VAL-LYS-GLY-GLY-TYR-ASP-GLN-LYS-MET-PRO-VAL-ILE-VAL-SER-ARG-VAL-ALA-PRO-GLY-THR-PRO-ALA-ASP-LEU-CYS-VAL-PRO-ARG-LEU-ASN-GLU-GLY-ASP-GLN-VAL-VAL-LEU-ILE-ASN-GLY-ARG-ASP-ILE-ALA-GLU-HIS-THR-HIS-ASP-GLN-VAL-VAL-LEU-PHE-ILE-LYS-ALA-SER-CYS-GLU-ARG-HIS-SER-GLY-GLU-LEU-MET-LEU-LEU-VAL-ARG-PRO-ASN,SER-ASN-ARG-ARG-VAL-TYR-LYS-LYS-MET-PRO-SER-ILE-GLU-SER-ASP-VAL,107,16,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CCC(=O)O,Kd=42uM,4.376751,4.38,1,A,A,1,A,A,0,,E,A,,1,1,107,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C,0.963551938533783,0.8063757419586182,90.79437255859376,88.619140625,0.3414508402347564,0.7277444005012512,0.8926600813865662,0.8210943937301636,0.8339172005653381,0.7442848086357117,SNRRVYKKMPSIESDV,Low,"(4.319, 4.456]",val
3NIN,protein-peptide,P19812,GSVHKHTGRNCGRKFKIGEPLYRCHECGCDDTCVLCIHCFNPKDHVNHHVCTDICTEFTSGICDCGDEEAWNSPLHCKAEEQ,RLGES,GLY-SER-VAL-HIS-LYS-HIS-THR-GLY-ARG-ASN-CYS-GLY-ARG-LYS-PHE-LYS-ILE-GLY-GLU-PRO-LEU-TYR-ARG-CYS-HIS-GLU-CYS-GLY-CYS-ASP-ASP-THR-CYS-VAL-LEU-CYS-ILE-HIS-CYS-PHE-ASN-PRO-LYS-ASP-HIS-VAL-ASN-HIS-HIS-VAL-CYS-THR-ASP-ILE-CYS-THR-GLU-PHE-THR-SER-GLY-ILE-CYS-ASP-CYS-GLY-ASP-GLU-GLU-ALA-TRP-ASN-SER-PRO-LEU-HIS-CYS-LYS-ALA-GLU-GLU-GLN,ARG-LEU-GLY-GLU-SER,82,5,CC(C[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])C,Kd=12.4uM,4.906578,4.91,1,A,A,1,A,A,0,,D,A,,1,1,82,5,0,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)CC[C@H](NC(=O)[C@@H](N)CO)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8631657361984253,0.8407024145126343,94.59027862548828,91.51827239990234,0.3805648684501648,0.5256351232528687,0.8832122087478638,0.8831484317779541,0.8222345113754272,0.8300908207893372,RLGES,Low,"(4.866, 5.014]",val
3NKX,protein-peptide,P04049 P63104,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,QRSTSTPNVH,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,GLN-ARG-SER-THR-SEP-THR-PRO-ASN-VAL-HIS,245,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]cn1)C(C)C)CC(=O)N)[C@H](O)C)COP(O)(O)O)[C@H](O)C)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=7.5uM,5.124939,5.12,1,A,A,1,A,A,0,,P,A,,1,1,245,10,0,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.9416028261184692,0.8412003517150879,85.50894927978516,85.57131958007812,0.3528686463832855,0.6378647685050964,0.915624499320984,0.8866822719573975,0.8990777730941772,0.806870698928833,QRSTSTPNVH,Low,"(5.105, 5.222]",train
3NTH,protein-peptide,O76922 P25823,LEAELHNCVVVQFDGPMSFYVQMESDVPALEQMTDKLLDAEQDLPAFSDLKEGALCVAQFPEDEVFYRAQIRKVLDDGKCEVHFIDFGNNAVTQQFRQLPEELAKPARYSRHCELDASTISKCDAALLQSFIDTRFSETFQVEILATKGTGTHVVRLFYQSKNISEKLQECQ,ARGRGR,LEU-GLU-ALA-GLU-LEU-HIS-ASN-CYS-VAL-VAL-VAL-GLN-PHE-ASP-GLY-PRO-MET-SER-PHE-TYR-VAL-GLN-MET-GLU-SER-ASP-VAL-PRO-ALA-LEU-GLU-GLN-MET-THR-ASP-LYS-LEU-LEU-ASP-ALA-GLU-GLN-ASP-LEU-PRO-ALA-PHE-SER-ASP-LEU-LYS-GLU-GLY-ALA-LEU-CYS-VAL-ALA-GLN-PHE-PRO-GLU-ASP-GLU-VAL-PHE-TYR-ARG-ALA-GLN-ILE-ARG-LYS-VAL-LEU-ASP-ASP-GLY-LYS-CYS-GLU-VAL-HIS-PHE-ILE-ASP-PHE-GLY-ASN-ASN-ALA-VAL-THR-GLN-GLN-PHE-ARG-GLN-LEU-PRO-GLU-GLU-LEU-ALA-LYS-PRO-ALA-ARG-TYR-SER-ARG-HIS-CYS-GLU-LEU-ASP-ALA-SER-THR-ILE-SER-LYS-CYS-ASP-ALA-ALA-LEU-LEU-GLN-SER-PHE-ILE-ASP-THR-ARG-PHE-SER-GLU-THR-PHE-GLN-VAL-GLU-ILE-LEU-ALA-THR-LYS-GLY-THR-GLY-THR-HIS-VAL-VAL-ARG-LEU-PHE-TYR-GLN-SER-LYS-ASN-ILE-SER-GLU-LYS-LEU-GLN-GLU-CYS-GLN,ALA-ARG-GLY-2MR-GLY-ARG,172,6,CNC(=[NH+]CCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)NC,Kd=48uM,4.318759,4.32,1,A,A,1,A,A,0,,C,A,,1,1,172,6,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.8864842057228088,0.794752836227417,91.8663558959961,85.72914123535156,0.3395006358623504,0.6529232859611511,0.9291964769363404,0.8899784684181213,0.854738712310791,0.7709464430809021,ARGRGR,Low,"(4.155, 4.319]",train
3NTI,protein-peptide,O76922 P25823,LEAELHNCVVVQFDGPMSFYVQMESDVPALEQMTDKLLDAEQDLPAFSDLKEGALCVAQFPEDEVFYRAQIRKVLDDGKCEVHFIDFGNNAVTQQFRQLPEELAKPARYSRHCELDASTISKCDAALLQSFIDTRFSETFQVEILATKGTGTHVVRLFYQSKNISEKLQECQ,NPVIARGRGRGRK,LEU-GLU-ALA-GLU-LEU-HIS-ASN-CYS-VAL-VAL-VAL-GLN-PHE-ASP-GLY-PRO-MET-SER-PHE-TYR-VAL-GLN-MET-GLU-SER-ASP-VAL-PRO-ALA-LEU-GLU-GLN-MET-THR-ASP-LYS-LEU-LEU-ASP-ALA-GLU-GLN-ASP-LEU-PRO-ALA-PHE-SER-ASP-LEU-LYS-GLU-GLY-ALA-LEU-CYS-VAL-ALA-GLN-PHE-PRO-GLU-ASP-GLU-VAL-PHE-TYR-ARG-ALA-GLN-ILE-ARG-LYS-VAL-LEU-ASP-ASP-GLY-LYS-CYS-GLU-VAL-HIS-PHE-ILE-ASP-PHE-GLY-ASN-ASN-ALA-VAL-THR-GLN-GLN-PHE-ARG-GLN-LEU-PRO-GLU-GLU-LEU-ALA-LYS-PRO-ALA-ARG-TYR-SER-ARG-HIS-CYS-GLU-LEU-ASP-ALA-SER-THR-ILE-SER-LYS-CYS-ASP-ALA-ALA-LEU-LEU-GLN-SER-PHE-ILE-ASP-THR-ARG-PHE-SER-GLU-THR-PHE-GLN-VAL-GLU-ILE-LEU-ALA-THR-LYS-GLY-THR-GLY-THR-HIS-VAL-VAL-ARG-LEU-PHE-TYR-GLN-SER-LYS-ASN-ILE-SER-GLU-LYS-LEU-GLN-GLU-CYS-GLN,ASN-PRO-VAL-ILE-ALA-ARG-GLY-ARG-GLY-2MR-GLY-ARG-LYS,172,13,CNC(=[NH+]CCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)NC,Kd=6uM,5.221849,5.22,1,A,A,1,A,A,0,,C,A,,1,1,172,13,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NC(CCCNC(=NC)NC)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NC(CCCNC(=NC)NC)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9265284538269044,0.8322165012359619,91.736572265625,85.44850158691406,0.3532803058624267,0.6544346213340759,0.9226900935173036,0.8939791917800903,0.8835691213607788,0.8167757987976074,NPVIARGRGRGRK,Low,"(5.105, 5.222]",val
3NZI,protein-peptide,Q92743 Q9CZU6,MGQEDPNSLRHKYNFIADVVEKIAPAVVHIELFRKLPFSKREVPVASGSGFIVSEDGLIVTNAHVVTNKHRVKVELKNGATYEAKIKDVDEKADIALIKIDHQGKLPVLLLGRSSELRPGEFVVAIGSPFSLQNTVTTGIVSTTQRGGKELGLRNSDMDYIQTDAIINYGNSGGPLVNLDGEVIGINTLKVTAGISFAIPSDKIKKFLTESHDRQAKGKAITKKKYIGIRMMSLTSSKAKELKDRHRDFPDVISGAYIIEVIPDTPAEAGGLKENDVIISINGQSVVSANDVSDVIKRESTLNMVVRRGNEDIMITVIPEEIDPRSLEHHHHHH,DPMFKLV,MET-GLY-GLN-GLU-ASP-PRO-ASN-SER-LEU-ARG-HIS-LYS-TYR-ASN-PHE-ILE-ALA-ASP-VAL-VAL-GLU-LYS-ILE-ALA-PRO-ALA-VAL-VAL-HIS-ILE-GLU-LEU-PHE-ARG-LYS-LEU-PRO-PHE-SER-LYS-ARG-GLU-VAL-PRO-VAL-ALA-SER-GLY-SER-GLY-PHE-ILE-VAL-SER-GLU-ASP-GLY-LEU-ILE-VAL-THR-ASN-ALA-HIS-VAL-VAL-THR-ASN-LYS-HIS-ARG-VAL-LYS-VAL-GLU-LEU-LYS-ASN-GLY-ALA-THR-TYR-GLU-ALA-LYS-ILE-LYS-ASP-VAL-ASP-GLU-LYS-ALA-ASP-ILE-ALA-LEU-ILE-LYS-ILE-ASP-HIS-GLN-GLY-LYS-LEU-PRO-VAL-LEU-LEU-LEU-GLY-ARG-SER-SER-GLU-LEU-ARG-PRO-GLY-GLU-PHE-VAL-VAL-ALA-ILE-GLY-SER-PRO-PHE-SER-LEU-GLN-ASN-THR-VAL-THR-THR-GLY-ILE-VAL-SER-THR-THR-GLN-ARG-GLY-GLY-LYS-GLU-LEU-GLY-LEU-ARG-ASN-SER-ASP-MET-ASP-TYR-ILE-GLN-THR-ASP-ALA-ILE-ILE-ASN-TYR-GLY-ASN-SER-GLY-GLY-PRO-LEU-VAL-ASN-LEU-ASP-GLY-GLU-VAL-ILE-GLY-ILE-ASN-THR-LEU-LYS-VAL-THR-ALA-GLY-ILE-SER-PHE-ALA-ILE-PRO-SER-ASP-LYS-ILE-LYS-LYS-PHE-LEU-THR-GLU-SER-HIS-ASP-ARG-GLN-ALA-LYS-GLY-LYS-ALA-ILE-THR-LYS-LYS-LYS-TYR-ILE-GLY-ILE-ARG-MET-MET-SER-LEU-THR-SER-SER-LYS-ALA-LYS-GLU-LEU-LYS-ASP-ARG-HIS-ARG-ASP-PHE-PRO-ASP-VAL-ILE-SER-GLY-ALA-TYR-ILE-ILE-GLU-VAL-ILE-PRO-ASP-THR-PRO-ALA-GLU-ALA-GLY-GLY-LEU-LYS-GLU-ASN-ASP-VAL-ILE-ILE-SER-ILE-ASN-GLY-GLN-SER-VAL-VAL-SER-ALA-ASN-ASP-VAL-SER-ASP-VAL-ILE-LYS-ARG-GLU-SER-THR-LEU-ASN-MET-VAL-VAL-ARG-ARG-GLY-ASN-GLU-ASP-ILE-MET-ILE-THR-VAL-ILE-PRO-GLU-GLU-ILE-ASP-PRO-ARG-SER-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,ASP-PRO-MET-PHE-LYS-LEU-B2V,334,7,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(C)C)B(O)O)CC(C)C)C)Cc1ccccc1)[NH3+],IC50=2.6uM,5.585027,5.59,1,A,A,1,A,A,0,,B,A,,1,1,334,7,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)O,0.8842492699623108,0.855817437171936,69.49551391601562,59.87796401977539,0.5811827182769775,0.8136293888092041,0.8023896217346191,0.7496013045310974,0.8772215247154236,0.8636588454246521,DPMFKLV,Low,"(5.463, 5.6]",val
3O0E,protein-peptide,P02931 P09883,AEIYNKDGNKVDLYGKAVGLHYFSKGNGENSYGGNGDMTYARLGFKGETQINSDLTGYGQWEYNFQGNNSEGADAQTGNKTRLAFAGLKYADVGSFDYGRNYGVVYDALGYTDMLPEFGGDTAYSDDFFVGRVGGVATYRNSNFFGLVDGLNFAVQYLGKNERDTARRSNGDGVGGSISYEYEGFGIVGAYGAADRTNLQEAQPLGNGKKAEQWATGLKYDANNIYLAANYGETRNATPITNKFTNTSGFANKTQDVLLVAQYQFDFGLRPSIAYTKSKAKDVEGIGDVDLVNYFEVGATYYFNKNMSTYVDYIINQIDSDNKLGVGSDDTVAVGIVYQF,SGGDGRGHNTGAHSTSG,ALA-GLU-ILE-TYR-ASN-LYS-ASP-GLY-ASN-LYS-VAL-ASP-LEU-TYR-GLY-LYS-ALA-VAL-GLY-LEU-HIS-TYR-PHE-SER-LYS-GLY-ASN-GLY-GLU-ASN-SER-TYR-GLY-GLY-ASN-GLY-ASP-MET-THR-TYR-ALA-ARG-LEU-GLY-PHE-LYS-GLY-GLU-THR-GLN-ILE-ASN-SER-ASP-LEU-THR-GLY-TYR-GLY-GLN-TRP-GLU-TYR-ASN-PHE-GLN-GLY-ASN-ASN-SER-GLU-GLY-ALA-ASP-ALA-GLN-THR-GLY-ASN-LYS-THR-ARG-LEU-ALA-PHE-ALA-GLY-LEU-LYS-TYR-ALA-ASP-VAL-GLY-SER-PHE-ASP-TYR-GLY-ARG-ASN-TYR-GLY-VAL-VAL-TYR-ASP-ALA-LEU-GLY-TYR-THR-ASP-MET-LEU-PRO-GLU-PHE-GLY-GLY-ASP-THR-ALA-TYR-SER-ASP-ASP-PHE-PHE-VAL-GLY-ARG-VAL-GLY-GLY-VAL-ALA-THR-TYR-ARG-ASN-SER-ASN-PHE-PHE-GLY-LEU-VAL-ASP-GLY-LEU-ASN-PHE-ALA-VAL-GLN-TYR-LEU-GLY-LYS-ASN-GLU-ARG-ASP-THR-ALA-ARG-ARG-SER-ASN-GLY-ASP-GLY-VAL-GLY-GLY-SER-ILE-SER-TYR-GLU-TYR-GLU-GLY-PHE-GLY-ILE-VAL-GLY-ALA-TYR-GLY-ALA-ALA-ASP-ARG-THR-ASN-LEU-GLN-GLU-ALA-GLN-PRO-LEU-GLY-ASN-GLY-LYS-LYS-ALA-GLU-GLN-TRP-ALA-THR-GLY-LEU-LYS-TYR-ASP-ALA-ASN-ASN-ILE-TYR-LEU-ALA-ALA-ASN-TYR-GLY-GLU-THR-ARG-ASN-ALA-THR-PRO-ILE-THR-ASN-LYS-PHE-THR-ASN-THR-SER-GLY-PHE-ALA-ASN-LYS-THR-GLN-ASP-VAL-LEU-LEU-VAL-ALA-GLN-TYR-GLN-PHE-ASP-PHE-GLY-LEU-ARG-PRO-SER-ILE-ALA-TYR-THR-LYS-SER-LYS-ALA-LYS-ASP-VAL-GLU-GLY-ILE-GLY-ASP-VAL-ASP-LEU-VAL-ASN-TYR-PHE-GLU-VAL-GLY-ALA-THR-TYR-TYR-PHE-ASN-LYS-ASN-MET-SER-THR-TYR-VAL-ASP-TYR-ILE-ILE-ASN-GLN-ILE-ASP-SER-ASP-ASN-LYS-LEU-GLY-VAL-GLY-SER-ASP-ASP-THR-VAL-ALA-VAL-GLY-ILE-VAL-TYR-GLN-PHE,SER-GLY-GLY-ASP-GLY-ARG-GLY-HIS-ASN-THR-GLY-ALA-HIS-SER-THR-SER-GLY,340,17,OC[C@@H](C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)O)CC(=O)N)CCC[NH+]=C(N)N)[NH3+],Kd=1.8uM,5.744727,5.74,1,A,A,1,A,A,0,,L,A,,1,1,340,17,0,C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)O)C(=O)O)[C@@H](C)O,0.7849202752113342,0.7520779371261597,75.4903793334961,78.7782974243164,0.5937411189079285,0.9493022561073304,0.851128101348877,0.8414961099624634,0.7386063933372498,0.729723334312439,SGGDGRGHNTGAHSTSG,Low,"(5.699, 5.821]",train
3OB1,protein-peptide,O43597 P22681,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,IRNTNEYTEGPT,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,ILE-ARG-ASN-THR-ASN-GLU-PTR-TPO-GLU-GLY-PRO-THR,329,12,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)O)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(=O)N)CC(=O)N,Kd=3.83uM,5.416801,5.42,1,A,A,1,A,A,0,,A,B,,1,1,329,12,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O)C(=O)O)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)CC[C@H](NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C(NC(=O)CC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)OP(=O)(O)O)C(=O)O)[C@@H](C)O)C(=O)O,0.8661565780639648,0.8765450119972229,82.70586395263672,81.82161712646484,0.4144999980926513,0.6448380947113037,0.8867208957672119,0.87774658203125,0.7932001948356628,0.8420500755310059,IRNTNEYTEGPT,Low,"(5.31, 5.463]",train
3OB2,protein-peptide,P22681 P00533,GSLIGLMKDAFQPHHHHHHHLSPHPPGTVDKKMVEKCWKLMDKVVRLCQNPKLALKNSPPYILDLLPDTYQHLRTILSRYEGKMETLGENEYFRVFMENLMKKTKQTISLFKEGKERMYEENSQPRRNLTKLSLIFSHMLAELKGIFPSGLFQGDTFRITKADAAEFWRKAFGEKTIVPWKSFRQALHEVHPISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWSSLLRNWNSLAVTHPGYMAFLTYDEVKARLQKFIHKPGSYIFRLSCTRLGQWAIGYVTADGNILQTIPHNKPLFQALIDGFREGFYLFPDGRNQNPDLTG,DSFLQRYSSDPT,GLY-SER-LEU-ILE-GLY-LEU-MET-LYS-ASP-ALA-PHE-GLN-PRO-HIS-HIS-HIS-HIS-HIS-HIS-HIS-LEU-SER-PRO-HIS-PRO-PRO-GLY-THR-VAL-ASP-LYS-LYS-MET-VAL-GLU-LYS-CYS-TRP-LYS-LEU-MET-ASP-LYS-VAL-VAL-ARG-LEU-CYS-GLN-ASN-PRO-LYS-LEU-ALA-LEU-LYS-ASN-SER-PRO-PRO-TYR-ILE-LEU-ASP-LEU-LEU-PRO-ASP-THR-TYR-GLN-HIS-LEU-ARG-THR-ILE-LEU-SER-ARG-TYR-GLU-GLY-LYS-MET-GLU-THR-LEU-GLY-GLU-ASN-GLU-TYR-PHE-ARG-VAL-PHE-MET-GLU-ASN-LEU-MET-LYS-LYS-THR-LYS-GLN-THR-ILE-SER-LEU-PHE-LYS-GLU-GLY-LYS-GLU-ARG-MET-TYR-GLU-GLU-ASN-SER-GLN-PRO-ARG-ARG-ASN-LEU-THR-LYS-LEU-SER-LEU-ILE-PHE-SER-HIS-MET-LEU-ALA-GLU-LEU-LYS-GLY-ILE-PHE-PRO-SER-GLY-LEU-PHE-GLN-GLY-ASP-THR-PHE-ARG-ILE-THR-LYS-ALA-ASP-ALA-ALA-GLU-PHE-TRP-ARG-LYS-ALA-PHE-GLY-GLU-LYS-THR-ILE-VAL-PRO-TRP-LYS-SER-PHE-ARG-GLN-ALA-LEU-HIS-GLU-VAL-HIS-PRO-ILE-SER-SER-GLY-LEU-GLU-ALA-MET-ALA-LEU-LYS-SER-THR-ILE-ASP-LEU-THR-CYS-ASN-ASP-TYR-ILE-SER-VAL-PHE-GLU-PHE-ASP-ILE-PHE-THR-ARG-LEU-PHE-GLN-PRO-TRP-SER-SER-LEU-LEU-ARG-ASN-TRP-ASN-SER-LEU-ALA-VAL-THR-HIS-PRO-GLY-TYR-MET-ALA-PHE-LEU-THR-TYR-ASP-GLU-VAL-LYS-ALA-ARG-LEU-GLN-LYS-PHE-ILE-HIS-LYS-PRO-GLY-SER-TYR-ILE-PHE-ARG-LEU-SER-CYS-THR-ARG-LEU-GLY-GLN-TRP-ALA-ILE-GLY-TYR-VAL-THR-ALA-ASP-GLY-ASN-ILE-LEU-GLN-THR-ILE-PRO-HIS-ASN-LYS-PRO-LEU-PHE-GLN-ALA-LEU-ILE-ASP-GLY-PHE-ARG-GLU-GLY-PHE-TYR-LEU-PHE-PRO-ASP-GLY-ARG-ASN-GLN-ASN-PRO-ASP-LEU-THR-GLY,ASP-SER-PHE-LEU-GLN-ARG-PTR-SEP-SER-ASP-PRO-THR,329,12,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1ccccc1)CC(C)C)CCC(=O)N)CCC[NH+]=C(N)N)Cc1ccc(cc1)OP(O)(O)O)COP(O)(O)O,Kd=25.8uM,4.58838,4.59,1,A,A,1,A,A,0,,A,B,,1,1,329,12,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.7975113987922668,0.8346508741378784,81.46513366699219,81.4249496459961,0.4698003232479095,0.7613004446029663,0.8690694570541382,0.8414750695228577,0.71180659532547,0.7854524254798889,DSFLQRYSSDPT,Low,"(4.456, 4.606]",train
3OBQ,protein-peptide,O14964 Q99816,GAMGSAVSESQLKKMVSKYKYRDLTVRETVNVITLYKDLKPVLDSYGTGSRELMNLTGTIPVPYRGNTYNIPICLWLLDTYPYNPPICFVKPTSSMTIKTGKHVDANGKIYLPYLHEWKHPQSDLLGLIQVMIVVFGDEPPVFSRP,PTPSAPVPL,GLY-ALA-MET-GLY-SER-ALA-VAL-SER-GLU-SER-GLN-LEU-LYS-LYS-MET-VAL-SER-LYS-TYR-LYS-TYR-ARG-ASP-LEU-THR-VAL-ARG-GLU-THR-VAL-ASN-VAL-ILE-THR-LEU-TYR-LYS-ASP-LEU-LYS-PRO-VAL-LEU-ASP-SER-TYR-GLY-THR-GLY-SER-ARG-GLU-LEU-MET-ASN-LEU-THR-GLY-THR-ILE-PRO-VAL-PRO-TYR-ARG-GLY-ASN-THR-TYR-ASN-ILE-PRO-ILE-CYS-LEU-TRP-LEU-LEU-ASP-THR-TYR-PRO-TYR-ASN-PRO-PRO-ILE-CYS-PHE-VAL-LYS-PRO-THR-SER-SER-MET-THR-ILE-LYS-THR-GLY-LYS-HIS-VAL-ASP-ALA-ASN-GLY-LYS-ILE-TYR-LEU-PRO-TYR-LEU-HIS-GLU-TRP-LYS-HIS-PRO-GLN-SER-ASP-LEU-LEU-GLY-LEU-ILE-GLN-VAL-MET-ILE-VAL-VAL-PHE-GLY-ASP-GLU-PRO-PRO-VAL-PHE-SER-ARG-PRO,PRO-THR-PRO-SER-ALA-PRO-VAL-PRO-LEU,146,9,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CC(C)C)C(C)C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCC[NH2+]1,Kd=290uM,3.537602,3.54,1,A,A,1,A,A,0,,B,A,,1,1,146,9,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)O,0.9254412651062012,0.874117374420166,96.60672760009766,90.89119720458984,0.3387000858783722,0.4441372156143188,0.9325876832008362,0.9150413274765016,0.8510739803314209,0.8638864159584045,PTPSAPVPL,Low,"(2.044, 3.548]",train
3OBU,protein-peptide,Q72497 Q99816,GAMGSAVSESQLKKMVSKYKYRDLTVRETVNVITLYKDLKPVLDSYGTGSRELMNLTGTIPVPYRGNTYNIPICLWLLDTYPYNPPICFVKPTSSMTIKTGKHVDANGKIYLPYLHEWKHPQSDLLGLIQVMIVVFGDEPPVFSRP,PEPTAPPEE,GLY-ALA-MET-GLY-SER-ALA-VAL-SER-GLU-SER-GLN-LEU-LYS-LYS-MET-VAL-SER-LYS-TYR-LYS-TYR-ARG-ASP-LEU-THR-VAL-ARG-GLU-THR-VAL-ASN-VAL-ILE-THR-LEU-TYR-LYS-ASP-LEU-LYS-PRO-VAL-LEU-ASP-SER-TYR-GLY-THR-GLY-SER-ARG-GLU-LEU-MET-ASN-LEU-THR-GLY-THR-ILE-PRO-VAL-PRO-TYR-ARG-GLY-ASN-THR-TYR-ASN-ILE-PRO-ILE-CYS-LEU-TRP-LEU-LEU-ASP-THR-TYR-PRO-TYR-ASN-PRO-PRO-ILE-CYS-PHE-VAL-LYS-PRO-THR-SER-SER-MET-THR-ILE-LYS-THR-GLY-LYS-HIS-VAL-ASP-ALA-ASN-GLY-LYS-ILE-TYR-LEU-PRO-TYR-LEU-HIS-GLU-TRP-LYS-HIS-PRO-GLN-SER-ASP-LEU-LEU-GLY-LEU-ILE-GLN-VAL-MET-ILE-VAL-VAL-PHE-GLY-ASP-GLU-PRO-PRO-VAL-PHE-SER-ARG-PRO,PRO-GLU-PRO-THR-ALA-PRO-PRO-GLU-GLU,146,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC(=O)O)C,Kd=50uM,4.30103,4.3,1,A,A,1,A,A,0,,B,A,,1,1,146,9,0,C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9765804409980774,0.8474453687667847,96.5918197631836,90.313232421875,0.3233703970909118,0.500899612903595,0.935389280319214,0.9001914262771606,0.9102652668952942,0.8342588543891907,PEPTAPPEE,Low,"(4.155, 4.319]",train
3OBX,protein-peptide,Q72497 Q99816,GAMGSAVSESQLKKMVSKYKYRDLTVRETVNVITLYKDLKPVLDSYGTGSRELMNLTGTIPVPYRGNTYNIPICLWLLDTYPYNPPICFVKPTSSMTIKTGKHVDANGKIYLPYLHEWKHPQSDLLGLIQVMIVVFGDEPPVFSRP,PEATAPPEE,GLY-ALA-MET-GLY-SER-ALA-VAL-SER-GLU-SER-GLN-LEU-LYS-LYS-MET-VAL-SER-LYS-TYR-LYS-TYR-ARG-ASP-LEU-THR-VAL-ARG-GLU-THR-VAL-ASN-VAL-ILE-THR-LEU-TYR-LYS-ASP-LEU-LYS-PRO-VAL-LEU-ASP-SER-TYR-GLY-THR-GLY-SER-ARG-GLU-LEU-MET-ASN-LEU-THR-GLY-THR-ILE-PRO-VAL-PRO-TYR-ARG-GLY-ASN-THR-TYR-ASN-ILE-PRO-ILE-CYS-LEU-TRP-LEU-LEU-ASP-THR-TYR-PRO-TYR-ASN-PRO-PRO-ILE-CYS-PHE-VAL-LYS-PRO-THR-SER-SER-MET-THR-ILE-LYS-THR-GLY-LYS-HIS-VAL-ASP-ALA-ASN-GLY-LYS-ILE-TYR-LEU-PRO-TYR-LEU-HIS-GLU-TRP-LYS-HIS-PRO-GLN-SER-ASP-LEU-LEU-GLY-LEU-ILE-GLN-VAL-MET-ILE-VAL-VAL-PHE-GLY-ASP-GLU-PRO-PRO-VAL-PHE-SER-ARG-PRO,PRO-GLU-ALA-THR-ALA-PRO-PRO-GLU-GLU,146,9,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CCC(=O)O)C)C,Kd=130uM,3.886057,3.89,1,A,A,1,A,A,0,,B,A,,1,1,146,9,0,C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.9712589383125304,0.9080709218978882,96.74141693115234,91.98991394042967,0.3275339007377624,0.4399302899837494,0.9336331486701964,0.9291167855262756,0.908084750175476,0.9028093814849854,PEATAPPEE,Low,"(3.548, 3.924]",train
3OE0,protein-peptide,P61073 P00720,DYKDDDDAGAPEGISIYTSDNYTEEMGSGDYDSMKEPCFREENANFNKIFLPTIYSIIFLTGIVGNGLVILVMGYQKKLRSMTDKYRLHLSVADLLFVITLPFWAVDAVANWYFGNFLCKAVHVIYTVNLYSSVWILAFISLDRYLAIVHATNSQRPRKLLAEKVVYVGVWIPALLLTIPDFIFANVSEADDRYICDRFYPNDLWVVVFQFQHIMVGLILPGIVILSCYCIIISKLSHNIFEMLRIDEGLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAIGRNTNGVITKDEAEKLFNQDVDAAVRGILRNAKLKPVYDSLDAVRRAALINMVFQMGETGVAGFTNSLRMLQQKRWDEAAVNLAKSRWYNQTPNRAKRVITTFRTGTWDAYSGSGHQKRKALKPTVILILAFFACWLPYYIGISIDSFILLEIIKQGCEFENTVHKWISITEALAFFHCCLNPILYAFLGAKFKTSAQHALTSGRPLEVLFQ,RRACYQKPPYRRCRGP,ASP-TYR-LYS-ASP-ASP-ASP-ASP-ALA-GLY-ALA-PRO-GLU-GLY-ILE-SER-ILE-TYR-THR-SER-ASP-ASN-TYR-THR-GLU-GLU-MET-GLY-SER-GLY-ASP-TYR-ASP-SER-MET-LYS-GLU-PRO-CYS-PHE-ARG-GLU-GLU-ASN-ALA-ASN-PHE-ASN-LYS-ILE-PHE-LEU-PRO-THR-ILE-TYR-SER-ILE-ILE-PHE-LEU-THR-GLY-ILE-VAL-GLY-ASN-GLY-LEU-VAL-ILE-LEU-VAL-MET-GLY-TYR-GLN-LYS-LYS-LEU-ARG-SER-MET-THR-ASP-LYS-TYR-ARG-LEU-HIS-LEU-SER-VAL-ALA-ASP-LEU-LEU-PHE-VAL-ILE-THR-LEU-PRO-PHE-TRP-ALA-VAL-ASP-ALA-VAL-ALA-ASN-TRP-TYR-PHE-GLY-ASN-PHE-LEU-CYS-LYS-ALA-VAL-HIS-VAL-ILE-TYR-THR-VAL-ASN-LEU-TYR-SER-SER-VAL-TRP-ILE-LEU-ALA-PHE-ILE-SER-LEU-ASP-ARG-TYR-LEU-ALA-ILE-VAL-HIS-ALA-THR-ASN-SER-GLN-ARG-PRO-ARG-LYS-LEU-LEU-ALA-GLU-LYS-VAL-VAL-TYR-VAL-GLY-VAL-TRP-ILE-PRO-ALA-LEU-LEU-LEU-THR-ILE-PRO-ASP-PHE-ILE-PHE-ALA-ASN-VAL-SER-GLU-ALA-ASP-ASP-ARG-TYR-ILE-CYS-ASP-ARG-PHE-TYR-PRO-ASN-ASP-LEU-TRP-VAL-VAL-VAL-PHE-GLN-PHE-GLN-HIS-ILE-MET-VAL-GLY-LEU-ILE-LEU-PRO-GLY-ILE-VAL-ILE-LEU-SER-CYS-TYR-CYS-ILE-ILE-ILE-SER-LYS-LEU-SER-HIS-ASN-ILE-PHE-GLU-MET-LEU-ARG-ILE-ASP-GLU-GLY-LEU-ARG-LEU-LYS-ILE-TYR-LYS-ASP-THR-GLU-GLY-TYR-TYR-THR-ILE-GLY-ILE-GLY-HIS-LEU-LEU-THR-LYS-SER-PRO-SER-LEU-ASN-ALA-ALA-LYS-SER-GLU-LEU-ASP-LYS-ALA-ILE-GLY-ARG-ASN-THR-ASN-GLY-VAL-ILE-THR-LYS-ASP-GLU-ALA-GLU-LYS-LEU-PHE-ASN-GLN-ASP-VAL-ASP-ALA-ALA-VAL-ARG-GLY-ILE-LEU-ARG-ASN-ALA-LYS-LEU-LYS-PRO-VAL-TYR-ASP-SER-LEU-ASP-ALA-VAL-ARG-ARG-ALA-ALA-LEU-ILE-ASN-MET-VAL-PHE-GLN-MET-GLY-GLU-THR-GLY-VAL-ALA-GLY-PHE-THR-ASN-SER-LEU-ARG-MET-LEU-GLN-GLN-LYS-ARG-TRP-ASP-GLU-ALA-ALA-VAL-ASN-LEU-ALA-LYS-SER-ARG-TRP-TYR-ASN-GLN-THR-PRO-ASN-ARG-ALA-LYS-ARG-VAL-ILE-THR-THR-PHE-ARG-THR-GLY-THR-TRP-ASP-ALA-TYR-SER-GLY-SER-GLY-HIS-GLN-LYS-ARG-LYS-ALA-LEU-LYS-PRO-THR-VAL-ILE-LEU-ILE-LEU-ALA-PHE-PHE-ALA-CYS-TRP-LEU-PRO-TYR-TYR-ILE-GLY-ILE-SER-ILE-ASP-SER-PHE-ILE-LEU-LEU-GLU-ILE-ILE-LYS-GLN-GLY-CYS-GLU-PHE-GLU-ASN-THR-VAL-HIS-LYS-TRP-ILE-SER-ILE-THR-GLU-ALA-LEU-ALA-PHE-PHE-HIS-CYS-CYS-LEU-ASN-PRO-ILE-LEU-TYR-ALA-PHE-LEU-GLY-ALA-LYS-PHE-LYS-THR-SER-ALA-GLN-HIS-ALA-LEU-THR-SER-GLY-ARG-PRO-LEU-GLU-VAL-LEU-PHE-GLN,ARG-ARG-ALN-CYS-TYR-GLN-LYS-DPR-PRO-TYR-ARG-CIR-CYS-ARG-GLY-DPR,499,16,[NH3+]CCCC[C@@H]1NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@@H]3N(C1=O)CCC3)CCC2)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)CCCNC(=O)N)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@@H]1C(=O)O)CCC[NH+]=C(N)N)NC(=O)[C@H](Cc1cccc2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N,Ki=2.5nM,8.60206,8.6,1,A,A,1,A,A,0,,I,A,,1,1,499,16,0,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)O,N=C(N)NCCC[C@H](NC(=O)C(Cc1cccc2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)C1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCNC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,N=C(N)NCCC[C@H](NC(=O)C(Cc1cccc2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)C1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCNC(N)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.7420581579208374,0.6027960777282715,50.31946563720703,52.59063720703125,0.7671177387237549,1.9838387966156008,0.6283861398696899,0.6253274083137512,0.6915926933288574,0.5320329666137695,RRACYQKPPYRRCRGP,Moderate,"(8.383, 8.824]",train
3OMC,protein-peptide,Q7KZF4,AKQKKEKVWAHYEEQPVEEVMPVLEEKERSASYKPVFVTEITDDLHFYVQDVETGTQLEKLMENMRNDIASHPPVEGSYAPRRGEFCIAKFVDGEWYRARVEKVESPAKIHVFYIDYGNREVLPSTRLGTLSPAFSTRVLPAQATEYAFAFIQVPQDDDARTDAVDSVVRDIQNTQCLLNVEHLSAGCPHVTLQFADSKGDVGLGLVKEGLVMVEVRKEKQFQKVITEYLNAQESAKSARLNLWRYGDFRADDADEFGYSR,TGRARARA,ALA-LYS-GLN-LYS-LYS-GLU-LYS-VAL-TRP-ALA-HIS-TYR-GLU-GLU-GLN-PRO-VAL-GLU-GLU-VAL-MET-PRO-VAL-LEU-GLU-GLU-LYS-GLU-ARG-SER-ALA-SER-TYR-LYS-PRO-VAL-PHE-VAL-THR-GLU-ILE-THR-ASP-ASP-LEU-HIS-PHE-TYR-VAL-GLN-ASP-VAL-GLU-THR-GLY-THR-GLN-LEU-GLU-LYS-LEU-MET-GLU-ASN-MET-ARG-ASN-ASP-ILE-ALA-SER-HIS-PRO-PRO-VAL-GLU-GLY-SER-TYR-ALA-PRO-ARG-ARG-GLY-GLU-PHE-CYS-ILE-ALA-LYS-PHE-VAL-ASP-GLY-GLU-TRP-TYR-ARG-ALA-ARG-VAL-GLU-LYS-VAL-GLU-SER-PRO-ALA-LYS-ILE-HIS-VAL-PHE-TYR-ILE-ASP-TYR-GLY-ASN-ARG-GLU-VAL-LEU-PRO-SER-THR-ARG-LEU-GLY-THR-LEU-SER-PRO-ALA-PHE-SER-THR-ARG-VAL-LEU-PRO-ALA-GLN-ALA-THR-GLU-TYR-ALA-PHE-ALA-PHE-ILE-GLN-VAL-PRO-GLN-ASP-ASP-ASP-ALA-ARG-THR-ASP-ALA-VAL-ASP-SER-VAL-VAL-ARG-ASP-ILE-GLN-ASN-THR-GLN-CYS-LEU-LEU-ASN-VAL-GLU-HIS-LEU-SER-ALA-GLY-CYS-PRO-HIS-VAL-THR-LEU-GLN-PHE-ALA-ASP-SER-LYS-GLY-ASP-VAL-GLY-LEU-GLY-LEU-VAL-LYS-GLU-GLY-LEU-VAL-MET-VAL-GLU-VAL-ARG-LYS-GLU-LYS-GLN-PHE-GLN-LYS-VAL-ILE-THR-GLU-TYR-LEU-ASN-ALA-GLN-GLU-SER-ALA-LYS-SER-ALA-ARG-LEU-ASN-LEU-TRP-ARG-TYR-GLY-ASP-PHE-ARG-ALA-ASP-ASP-ALA-ASP-GLU-PHE-GLY-TYR-SER-ARG,THR-GLY-2MR-ALA-ARG-ALA-ARG-ALA,261,8,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC[NH+]=C(N)N)C)CCC[NH+]=C(N)N)C)CCC[NH+]=C(NC)NC,Kd=10uM,5.0,5.0,1,A,A,1,A,A,0,,C,A,,1,1,261,8,0,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(=O)O,CN=C(NC)NCCCC(NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,CN=C(NC)NCCCC(NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)N)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8772997260093689,0.7940129637718201,81.26326751708984,79.23672485351562,0.464123398065567,0.8669840693473816,0.8270930647850037,0.7977394461631775,0.8015614151954651,0.7284261584281921,TGRARARA,Low,"(4.866, 5.014]",train
3OMG,protein-peptide,Q7KZF4,AKQKKEKVWAHYEEQPVEEVMPVLEEKERSASYKPVFVTEITDDLHFYVQDVETGTQLEKLMENMRNDIASHPPVEGSYAPRRGEFCIAKFVDGEWYRARVEKVESPAKIHVFYIDYGNREVLPSTRLGTLSPAFSTRVLPAQATEYAFAFIQVPQDDDARTDAVDSVVRDIQNTQCLLNVEHLSAGCPHVTLQFADSKGDVGLGLVKEGLVMVEVRKEKQFQKVITEYLNAQESAKSARLNLWRYGDFRADDADEFGYSR,RGRARGQE,ALA-LYS-GLN-LYS-LYS-GLU-LYS-VAL-TRP-ALA-HIS-TYR-GLU-GLU-GLN-PRO-VAL-GLU-GLU-VAL-MET-PRO-VAL-LEU-GLU-GLU-LYS-GLU-ARG-SER-ALA-SER-TYR-LYS-PRO-VAL-PHE-VAL-THR-GLU-ILE-THR-ASP-ASP-LEU-HIS-PHE-TYR-VAL-GLN-ASP-VAL-GLU-THR-GLY-THR-GLN-LEU-GLU-LYS-LEU-MET-GLU-ASN-MET-ARG-ASN-ASP-ILE-ALA-SER-HIS-PRO-PRO-VAL-GLU-GLY-SER-TYR-ALA-PRO-ARG-ARG-GLY-GLU-PHE-CYS-ILE-ALA-LYS-PHE-VAL-ASP-GLY-GLU-TRP-TYR-ARG-ALA-ARG-VAL-GLU-LYS-VAL-GLU-SER-PRO-ALA-LYS-ILE-HIS-VAL-PHE-TYR-ILE-ASP-TYR-GLY-ASN-ARG-GLU-VAL-LEU-PRO-SER-THR-ARG-LEU-GLY-THR-LEU-SER-PRO-ALA-PHE-SER-THR-ARG-VAL-LEU-PRO-ALA-GLN-ALA-THR-GLU-TYR-ALA-PHE-ALA-PHE-ILE-GLN-VAL-PRO-GLN-ASP-ASP-ASP-ALA-ARG-THR-ASP-ALA-VAL-ASP-SER-VAL-VAL-ARG-ASP-ILE-GLN-ASN-THR-GLN-CYS-LEU-LEU-ASN-VAL-GLU-HIS-LEU-SER-ALA-GLY-CYS-PRO-HIS-VAL-THR-LEU-GLN-PHE-ALA-ASP-SER-LYS-GLY-ASP-VAL-GLY-LEU-GLY-LEU-VAL-LYS-GLU-GLY-LEU-VAL-MET-VAL-GLU-VAL-ARG-LYS-GLU-LYS-GLN-PHE-GLN-LYS-VAL-ILE-THR-GLU-TYR-LEU-ASN-ALA-GLN-GLU-SER-ALA-LYS-SER-ALA-ARG-LEU-ASN-LEU-TRP-ARG-TYR-GLY-ASP-PHE-ARG-ALA-ASP-ASP-ALA-ASP-GLU-PHE-GLY-TYR-SER-ARG,ARG-GLY-ARG-ALA-2MR-GLY-GLN-GLU,261,8,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC(=O)N)CCC[NH+]=C(NC)NC)C)CCC[NH+]=C(N)N,Kd=19uM,4.721246,4.72,1,A,A,1,A,A,0,,C,A,,1,1,261,8,0,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.8639622926712036,0.7770184874534607,81.14634704589844,79.09701538085938,0.4957234859466553,0.9472801685333252,0.8214938640594482,0.7923725247383118,0.7630552053451538,0.7085248231887817,RGRARGQE,Low,"(4.606, 4.745]",train
3PKN,protein-peptide,Q71RC2 P11940,GPLGSPLTASMLASAPPQEQKQMLGERLFPLIQAMHPTLAGKITGMLLEIDNSELLHMLESPESLRSKVDEAVAVLQAHQAKEAAQKA,TGLNPNAKVWQEIA,GLY-PRO-LEU-GLY-SER-PRO-LEU-THR-ALA-SER-MET-LEU-ALA-SER-ALA-PRO-PRO-GLN-GLU-GLN-LYS-GLN-MET-LEU-GLY-GLU-ARG-LEU-PHE-PRO-LEU-ILE-GLN-ALA-MET-HIS-PRO-THR-LEU-ALA-GLY-LYS-ILE-THR-GLY-MET-LEU-LEU-GLU-ILE-ASP-ASN-SER-GLU-LEU-LEU-HIS-MET-LEU-GLU-SER-PRO-GLU-SER-LEU-ARG-SER-LYS-VAL-ASP-GLU-ALA-VAL-ALA-VAL-LEU-GLN-ALA-HIS-GLN-ALA-LYS-GLU-ALA-ALA-GLN-LYS-ALA,THR-GLY-LEU-ASN-PRO-ASN-ALA-LYS-VAL-TRP-GLN-GLU-ILE-ALA,88,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)CCC(=O)O)CCC(=O)N)Cc1c[nH]c2c1cccc2)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(=O)N)CC(=O)N)C,Kd=22uM,4.657577,4.66,1,A,A,1,A,A,0,,B,A,,1,1,88,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)O,0.9785717725753784,0.9188379049301147,94.70543670654295,90.96239471435548,0.3031822144985199,0.5208200216293335,0.920265257358551,0.9092828631401062,0.907364010810852,0.8857153058052063,TGLNPNAKVWQEIA,Low,"(4.606, 4.745]",train
3PLU,protein-peptide,Q12420 Q6Q546,MGSSHHHHHHSSGLVPRGSHMIEVVVNDRLGKKVRVKCLGEDSVGDFKKVLSLQIGTQPNKIVLQKGGSVLKDHISLEDYEVHDQTNLELYYL,NLSIEETNEIREKLGMKPI,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-ILE-GLU-VAL-VAL-VAL-ASN-ASP-ARG-LEU-GLY-LYS-LYS-VAL-ARG-VAL-LYS-CYS-LEU-GLY-GLU-ASP-SER-VAL-GLY-ASP-PHE-LYS-LYS-VAL-LEU-SER-LEU-GLN-ILE-GLY-THR-GLN-PRO-ASN-LYS-ILE-VAL-LEU-GLN-LYS-GLY-GLY-SER-VAL-LEU-LYS-ASP-HIS-ILE-SER-LEU-GLU-ASP-TYR-GLU-VAL-HIS-ASP-GLN-THR-ASN-LEU-GLU-LEU-TYR-TYR-LEU,ASN-LEU-SER-ILE-GLU-GLU-THR-ASN-GLU-ILE-ARG-GLU-LYS-LEU-GLY-MET-LYS-PRO-ILE,93,19,CSCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](CC)C)C(=O)O)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CO)CCC(=O)O)CCC(=O)O)CC(=O)N)CCC(=O)O)CCC[NH+]=C(N)N)C)C)CC(C)C,Kd=1.69uM,5.772113,5.77,1,A,A,1,A,A,0,,C,A,,1,1,93,19,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)O)C(=O)O)[C@@H](C)CC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)O,1.0075008869171145,0.7257928848266602,83.8716049194336,68.51311492919922,0.3436531722545624,0.9171492457389832,0.8621722459793091,0.7144456505775452,0.9099044799804688,0.6345436573028564,NLSIEETNEIREKLGMKPI,Low,"(5.699, 5.821]",train
3POA,protein-peptide,P71590,SAGTSVTLQLDDGSGRTYQLREGSNIIGRGQDAQFRLPDTGVSRRHLEIRWDGQVALLADLNSTNGTTVNNAPVQEWQLADGDVIRLGHSEIIVRMHPLT,DTAPTEKIAYKK,SER-ALA-GLY-THR-SER-VAL-THR-LEU-GLN-LEU-ASP-ASP-GLY-SER-GLY-ARG-THR-TYR-GLN-LEU-ARG-GLU-GLY-SER-ASN-ILE-ILE-GLY-ARG-GLY-GLN-ASP-ALA-GLN-PHE-ARG-LEU-PRO-ASP-THR-GLY-VAL-SER-ARG-ARG-HIS-LEU-GLU-ILE-ARG-TRP-ASP-GLY-GLN-VAL-ALA-LEU-LEU-ALA-ASP-LEU-ASN-SER-THR-ASN-GLY-THR-THR-VAL-ASN-ASN-ALA-PRO-VAL-GLN-GLU-TRP-GLN-LEU-ALA-ASP-GLY-ASP-VAL-ILE-ARG-LEU-GLY-HIS-SER-GLU-ILE-ILE-VAL-ARG-MET-HIS-PRO-LEU-THR,ASP-THR-ALA-PRO-TPO-GLU-LYS-ILE-ALA-TYR-LYS-LYS,100,12,[NH3+]CCCC[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@@H](NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])C)CCC(=O)O,Kd=0.1uM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,100,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(C(=O)N[C@@H](CCCCN)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NC(C(=O)N[C@@H](CCCCN)C(=O)O)C(C)OP(=O)(O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)O,0.8817945122718811,0.7557834982872009,95.01392364501952,93.8051986694336,0.3263059258460998,0.6536612510681152,0.9232410192489624,0.8424778580665588,0.80446857213974,0.7341098785400391,DTAPTEKIAYKK,Moderate,"(6.824, 7.049]",train
3PUJ,protein-peptide,P70452 P61765,MAPIGLKAVVGEKIMHDVIKKVKKKGEWKVLVVDQLSMRMLSSCCKMTDIMTEGITIVEDINKRREPLPSLEAVYLITPSEKSVHSLISDFKDPPTAKYRAAHVFFTDSCPDALFNELVKSRAAKVIKTLTEINIAFLPYESQVYSLDSADSFQSFYSPHKAQMKNPILERLAEQIATLCATLKEYPAVRYRGEYKDNALLAQLIQDKLDAYKADDPTMGEGPDKARSQLLILDRGFDPSSPVLHELTFQAMSYDLLPIENDVYKYETSGIGEARVKEVLLDEDDDLWIALRHKHIAEVSQEVTRSLKDFSSSKRMNTGEKTTMRDLSQMLKKMPQYQKELSKYSTHLHLAEDCMKHYQGTVDKLCRVEQDLAMGTDAEGEKIKDPMRAIVPILLDANVSTYDKIRIILLYIFLKNGITEENLNKLIQHAQIPPEDSEIITNMAHLGVPIVTDSTLRRRSKPERKERISEQTYQLSRWTPIIKDIMEDTIEDKLDTKHYPYISTRSSASFSTTAVSARYGHWHKNKAPGEYRSGPRLIIFILGGVSLNEMRCAYEVTQANGKWEVLIGSTHILTPQKLLDTLKKLNKTDEEISS,MRDRTHELRQ,MET-ALA-PRO-ILE-GLY-LEU-LYS-ALA-VAL-VAL-GLY-GLU-LYS-ILE-MET-HIS-ASP-VAL-ILE-LYS-LYS-VAL-LYS-LYS-LYS-GLY-GLU-TRP-LYS-VAL-LEU-VAL-VAL-ASP-GLN-LEU-SER-MET-ARG-MET-LEU-SER-SER-CYS-CYS-LYS-MET-THR-ASP-ILE-MET-THR-GLU-GLY-ILE-THR-ILE-VAL-GLU-ASP-ILE-ASN-LYS-ARG-ARG-GLU-PRO-LEU-PRO-SER-LEU-GLU-ALA-VAL-TYR-LEU-ILE-THR-PRO-SER-GLU-LYS-SER-VAL-HIS-SER-LEU-ILE-SER-ASP-PHE-LYS-ASP-PRO-PRO-THR-ALA-LYS-TYR-ARG-ALA-ALA-HIS-VAL-PHE-PHE-THR-ASP-SER-CYS-PRO-ASP-ALA-LEU-PHE-ASN-GLU-LEU-VAL-LYS-SER-ARG-ALA-ALA-LYS-VAL-ILE-LYS-THR-LEU-THR-GLU-ILE-ASN-ILE-ALA-PHE-LEU-PRO-TYR-GLU-SER-GLN-VAL-TYR-SER-LEU-ASP-SER-ALA-ASP-SER-PHE-GLN-SER-PHE-TYR-SER-PRO-HIS-LYS-ALA-GLN-MET-LYS-ASN-PRO-ILE-LEU-GLU-ARG-LEU-ALA-GLU-GLN-ILE-ALA-THR-LEU-CYS-ALA-THR-LEU-LYS-GLU-TYR-PRO-ALA-VAL-ARG-TYR-ARG-GLY-GLU-TYR-LYS-ASP-ASN-ALA-LEU-LEU-ALA-GLN-LEU-ILE-GLN-ASP-LYS-LEU-ASP-ALA-TYR-LYS-ALA-ASP-ASP-PRO-THR-MET-GLY-GLU-GLY-PRO-ASP-LYS-ALA-ARG-SER-GLN-LEU-LEU-ILE-LEU-ASP-ARG-GLY-PHE-ASP-PRO-SER-SER-PRO-VAL-LEU-HIS-GLU-LEU-THR-PHE-GLN-ALA-MET-SER-TYR-ASP-LEU-LEU-PRO-ILE-GLU-ASN-ASP-VAL-TYR-LYS-TYR-GLU-THR-SER-GLY-ILE-GLY-GLU-ALA-ARG-VAL-LYS-GLU-VAL-LEU-LEU-ASP-GLU-ASP-ASP-ASP-LEU-TRP-ILE-ALA-LEU-ARG-HIS-LYS-HIS-ILE-ALA-GLU-VAL-SER-GLN-GLU-VAL-THR-ARG-SER-LEU-LYS-ASP-PHE-SER-SER-SER-LYS-ARG-MET-ASN-THR-GLY-GLU-LYS-THR-THR-MET-ARG-ASP-LEU-SER-GLN-MET-LEU-LYS-LYS-MET-PRO-GLN-TYR-GLN-LYS-GLU-LEU-SER-LYS-TYR-SER-THR-HIS-LEU-HIS-LEU-ALA-GLU-ASP-CYS-MET-LYS-HIS-TYR-GLN-GLY-THR-VAL-ASP-LYS-LEU-CYS-ARG-VAL-GLU-GLN-ASP-LEU-ALA-MET-GLY-THR-ASP-ALA-GLU-GLY-GLU-LYS-ILE-LYS-ASP-PRO-MET-ARG-ALA-ILE-VAL-PRO-ILE-LEU-LEU-ASP-ALA-ASN-VAL-SER-THR-TYR-ASP-LYS-ILE-ARG-ILE-ILE-LEU-LEU-TYR-ILE-PHE-LEU-LYS-ASN-GLY-ILE-THR-GLU-GLU-ASN-LEU-ASN-LYS-LEU-ILE-GLN-HIS-ALA-GLN-ILE-PRO-PRO-GLU-ASP-SER-GLU-ILE-ILE-THR-ASN-MET-ALA-HIS-LEU-GLY-VAL-PRO-ILE-VAL-THR-ASP-SER-THR-LEU-ARG-ARG-ARG-SER-LYS-PRO-GLU-ARG-LYS-GLU-ARG-ILE-SER-GLU-GLN-THR-TYR-GLN-LEU-SER-ARG-TRP-THR-PRO-ILE-ILE-LYS-ASP-ILE-MET-GLU-ASP-THR-ILE-GLU-ASP-LYS-LEU-ASP-THR-LYS-HIS-TYR-PRO-TYR-ILE-SER-THR-ARG-SER-SER-ALA-SER-PHE-SER-THR-THR-ALA-VAL-SER-ALA-ARG-TYR-GLY-HIS-TRP-HIS-LYS-ASN-LYS-ALA-PRO-GLY-GLU-TYR-ARG-SER-GLY-PRO-ARG-LEU-ILE-ILE-PHE-ILE-LEU-GLY-GLY-VAL-SER-LEU-ASN-GLU-MET-ARG-CYS-ALA-TYR-GLU-VAL-THR-GLN-ALA-ASN-GLY-LYS-TRP-GLU-VAL-LEU-ILE-GLY-SER-THR-HIS-ILE-LEU-THR-PRO-GLN-LYS-LEU-LEU-ASP-THR-LEU-LYS-LYS-LEU-ASN-LYS-THR-ASP-GLU-GLU-ILE-SER-SER,MET-ARG-ASP-ARG-THR-HIS-GLU-LEU-ARG-GLN,594,10,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(=O)O)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CCC(=O)O)C,Kd=31uM,4.508638,4.51,1,A,A,1,A,A,0,,C,A,,1,1,594,10,0,CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.6907822489738464,0.7292665243148804,72.16223907470703,72.19090270996094,0.6696285605430603,1.0655958652496338,0.8282124996185303,0.8111318945884705,0.6139991879463196,0.6803911328315735,MRDRTHELRQ,Low,"(4.456, 4.606]",train
3PUK,protein-peptide,Q60770 P70452,MAPPVSERGLKSVVWRKIKTAVFDDCRKEGEWKIMLLDEFTTKLLSSCCKMTDLLEEGITVIENIYKNREPVRQMKALYFISPTPKSVDCFLRDFGSKSEKKYKAAYIYFTDFCPDSLFNKIKASCSKSIRRCKEINISFIPQESQVYTLDVPDAFYYCYSPDPSNASRKEVVMEAMAEQIVTVCATLDENPGVRYKSKPLDNASKLAQLVEKKLEDYYKIDEKGLIKGKTQSQLLIIDRGFDPVSTVLHELTFQAMAYDLLPIENDTYKYKTDGKEKEAVLEEDDDLWVRVRHRHIAVVLEEIPKLMKEISSTKKATEGKTSLSALTQLMKKMPHFRKQISKQVVHLNLAEDCMNKFKLNIEKLCKTEQDLALGTDAEGQRVKDSMLVLLPVLLNKNHDNCDKIRAVLLYIFGINGTTEENLDRLIHNVKIEDDSDMIRNWSHLGVPIVPPSQQAKPLRKDRSAEETFQLSRWTPFIKDIMEDAIDNRLDSKEWPYCSRCPAVWNGSGAVSARQKPRTNYLELDRKNGSRLIIFVIGGITYSEMRCAYEVSQAHKSCEVIIGSTHILTPRKLLDDIKMLNKSKDKVSFKDE,MRDRTHELRQ,MET-ALA-PRO-PRO-VAL-SER-GLU-ARG-GLY-LEU-LYS-SER-VAL-VAL-TRP-ARG-LYS-ILE-LYS-THR-ALA-VAL-PHE-ASP-ASP-CYS-ARG-LYS-GLU-GLY-GLU-TRP-LYS-ILE-MET-LEU-LEU-ASP-GLU-PHE-THR-THR-LYS-LEU-LEU-SER-SER-CYS-CYS-LYS-MET-THR-ASP-LEU-LEU-GLU-GLU-GLY-ILE-THR-VAL-ILE-GLU-ASN-ILE-TYR-LYS-ASN-ARG-GLU-PRO-VAL-ARG-GLN-MET-LYS-ALA-LEU-TYR-PHE-ILE-SER-PRO-THR-PRO-LYS-SER-VAL-ASP-CYS-PHE-LEU-ARG-ASP-PHE-GLY-SER-LYS-SER-GLU-LYS-LYS-TYR-LYS-ALA-ALA-TYR-ILE-TYR-PHE-THR-ASP-PHE-CYS-PRO-ASP-SER-LEU-PHE-ASN-LYS-ILE-LYS-ALA-SER-CYS-SER-LYS-SER-ILE-ARG-ARG-CYS-LYS-GLU-ILE-ASN-ILE-SER-PHE-ILE-PRO-GLN-GLU-SER-GLN-VAL-TYR-THR-LEU-ASP-VAL-PRO-ASP-ALA-PHE-TYR-TYR-CYS-TYR-SER-PRO-ASP-PRO-SER-ASN-ALA-SER-ARG-LYS-GLU-VAL-VAL-MET-GLU-ALA-MET-ALA-GLU-GLN-ILE-VAL-THR-VAL-CYS-ALA-THR-LEU-ASP-GLU-ASN-PRO-GLY-VAL-ARG-TYR-LYS-SER-LYS-PRO-LEU-ASP-ASN-ALA-SER-LYS-LEU-ALA-GLN-LEU-VAL-GLU-LYS-LYS-LEU-GLU-ASP-TYR-TYR-LYS-ILE-ASP-GLU-LYS-GLY-LEU-ILE-LYS-GLY-LYS-THR-GLN-SER-GLN-LEU-LEU-ILE-ILE-ASP-ARG-GLY-PHE-ASP-PRO-VAL-SER-THR-VAL-LEU-HIS-GLU-LEU-THR-PHE-GLN-ALA-MET-ALA-TYR-ASP-LEU-LEU-PRO-ILE-GLU-ASN-ASP-THR-TYR-LYS-TYR-LYS-THR-ASP-GLY-LYS-GLU-LYS-GLU-ALA-VAL-LEU-GLU-GLU-ASP-ASP-ASP-LEU-TRP-VAL-ARG-VAL-ARG-HIS-ARG-HIS-ILE-ALA-VAL-VAL-LEU-GLU-GLU-ILE-PRO-LYS-LEU-MET-LYS-GLU-ILE-SER-SER-THR-LYS-LYS-ALA-THR-GLU-GLY-LYS-THR-SER-LEU-SER-ALA-LEU-THR-GLN-LEU-MET-LYS-LYS-MET-PRO-HIS-PHE-ARG-LYS-GLN-ILE-SER-LYS-GLN-VAL-VAL-HIS-LEU-ASN-LEU-ALA-GLU-ASP-CYS-MET-ASN-LYS-PHE-LYS-LEU-ASN-ILE-GLU-LYS-LEU-CYS-LYS-THR-GLU-GLN-ASP-LEU-ALA-LEU-GLY-THR-ASP-ALA-GLU-GLY-GLN-ARG-VAL-LYS-ASP-SER-MET-LEU-VAL-LEU-LEU-PRO-VAL-LEU-LEU-ASN-LYS-ASN-HIS-ASP-ASN-CYS-ASP-LYS-ILE-ARG-ALA-VAL-LEU-LEU-TYR-ILE-PHE-GLY-ILE-ASN-GLY-THR-THR-GLU-GLU-ASN-LEU-ASP-ARG-LEU-ILE-HIS-ASN-VAL-LYS-ILE-GLU-ASP-ASP-SER-ASP-MET-ILE-ARG-ASN-TRP-SER-HIS-LEU-GLY-VAL-PRO-ILE-VAL-PRO-PRO-SER-GLN-GLN-ALA-LYS-PRO-LEU-ARG-LYS-ASP-ARG-SER-ALA-GLU-GLU-THR-PHE-GLN-LEU-SER-ARG-TRP-THR-PRO-PHE-ILE-LYS-ASP-ILE-MET-GLU-ASP-ALA-ILE-ASP-ASN-ARG-LEU-ASP-SER-LYS-GLU-TRP-PRO-TYR-CYS-SER-ARG-CYS-PRO-ALA-VAL-TRP-ASN-GLY-SER-GLY-ALA-VAL-SER-ALA-ARG-GLN-LYS-PRO-ARG-THR-ASN-TYR-LEU-GLU-LEU-ASP-ARG-LYS-ASN-GLY-SER-ARG-LEU-ILE-ILE-PHE-VAL-ILE-GLY-GLY-ILE-THR-TYR-SER-GLU-MET-ARG-CYS-ALA-TYR-GLU-VAL-SER-GLN-ALA-HIS-LYS-SER-CYS-GLU-VAL-ILE-ILE-GLY-SER-THR-HIS-ILE-LEU-THR-PRO-ARG-LYS-LEU-LEU-ASP-ASP-ILE-LYS-MET-LEU-ASN-LYS-SER-LYS-ASP-LYS-VAL-SER-PHE-LYS-ASP-GLU,MET-ARG-ASP-ARG-THR-HIS-GLU-LEU-ARG-GLN,592,10,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CC(=O)O)CCC[NH+]=C(N)N)Cc1c[nH]cn1,Kd=18uM,4.744727,4.74,1,A,A,1,A,A,0,,C,A,,1,1,592,10,0,CSCC[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O,0.6502973437309265,0.6778483986854553,71.93145751953125,72.03665924072266,0.7227350473403931,1.121395707130432,0.837119460105896,0.8095456957817078,0.5755602717399597,0.6206419467926025,MRDRTHELRQ,Low,"(4.606, 4.745]",train
3PXE,protein-peptide,P38398,VNKRMSMVVSGLTPEEFMLVYKFARKHHITLTNLITEETTHVVMKTDAEFVCERTLKYFLGIAGGKWVVSYFWVTQSIKERKMLNEHDFEVRGDVVNGRNHQGPKRARESQDRKIFRGLEICCYGPFTNMPTDQLEWMVQLCGASVVKELSSFTLGTGVHPIVVVQPDAWTEDNGFHAIGQMCEAPVVTRKWVLDSVALYQCQELDTYLIPQIP,SRSTSPTFNK,VAL-ASN-LYS-ARG-MET-SER-MET-VAL-VAL-SER-GLY-LEU-THR-PRO-GLU-GLU-PHE-MET-LEU-VAL-TYR-LYS-PHE-ALA-ARG-LYS-HIS-HIS-ILE-THR-LEU-THR-ASN-LEU-ILE-THR-GLU-GLU-THR-THR-HIS-VAL-VAL-MET-LYS-THR-ASP-ALA-GLU-PHE-VAL-CYS-GLU-ARG-THR-LEU-LYS-TYR-PHE-LEU-GLY-ILE-ALA-GLY-GLY-LYS-TRP-VAL-VAL-SER-TYR-PHE-TRP-VAL-THR-GLN-SER-ILE-LYS-GLU-ARG-LYS-MET-LEU-ASN-GLU-HIS-ASP-PHE-GLU-VAL-ARG-GLY-ASP-VAL-VAL-ASN-GLY-ARG-ASN-HIS-GLN-GLY-PRO-LYS-ARG-ALA-ARG-GLU-SER-GLN-ASP-ARG-LYS-ILE-PHE-ARG-GLY-LEU-GLU-ILE-CYS-CYS-TYR-GLY-PRO-PHE-THR-ASN-MET-PRO-THR-ASP-GLN-LEU-GLU-TRP-MET-VAL-GLN-LEU-CYS-GLY-ALA-SER-VAL-VAL-LYS-GLU-LEU-SER-SER-PHE-THR-LEU-GLY-THR-GLY-VAL-HIS-PRO-ILE-VAL-VAL-VAL-GLN-PRO-ASP-ALA-TRP-THR-GLU-ASP-ASN-GLY-PHE-HIS-ALA-ILE-GLY-GLN-MET-CYS-GLU-ALA-PRO-VAL-VAL-THR-ARG-LYS-TRP-VAL-LEU-ASP-SER-VAL-ALA-LEU-TYR-GLN-CYS-GLN-GLU-LEU-ASP-THR-TYR-LEU-ILE-PRO-GLN-ILE-PRO,SER-ARG-SER-THR-SEP-PRO-THR-PHE-ASN-LYS,214,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1ccccc1)[C@H](O)C)COP(O)(O)O)[C@H](O)C)[NH3+],Kd=2uM,5.69897,5.7,1,A,A,1,A,A,0,,E,A,,1,1,214,10,0,C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.8890069127082825,0.8444133996963501,91.48374938964844,92.81379699707033,0.3372511267662048,0.5623729825019836,0.9382490515708924,0.9135575294494628,0.8487945795059204,0.8271273970603943,SRSTSPTFNK,Low,"(5.6, 5.699]",train
3Q4L,protein-peptide,P0A988,AAMKFTVEREHLLKPLQQVSGPLGGRPTLPILGNLLLQVADGTLSLTGTDLEMEMVARVALVQPHEPGATTVPARKFFDICRGLPEGAEIAVQLEGERMLVRSGRSRFSLSTLPAADFPNLDDWQSEVEFTLPQATMKRLIEATQFSMAHQDVRYYLNGMLFETEGEELRTVATDGHRLAVCSMPIGQSLPSHSVIVPRKGVIELMRMLDGGDNPLRVQIGSNNIRAHVGDFIFTSKLVDGRFPDYRRVLPKNPDKHLEAGCDLLKQAFARAAILSNEKFRGVRLYVSENQLKITANNPEQEEAEEILDVTYSGAEMEIGFNVSYVLDVLNALKCENVRMMLTDSVSSVQIEDAASQSAAYVVMPMRL,QADLF,ALA-ALA-MET-LYS-PHE-THR-VAL-GLU-ARG-GLU-HIS-LEU-LEU-LYS-PRO-LEU-GLN-GLN-VAL-SER-GLY-PRO-LEU-GLY-GLY-ARG-PRO-THR-LEU-PRO-ILE-LEU-GLY-ASN-LEU-LEU-LEU-GLN-VAL-ALA-ASP-GLY-THR-LEU-SER-LEU-THR-GLY-THR-ASP-LEU-GLU-MET-GLU-MET-VAL-ALA-ARG-VAL-ALA-LEU-VAL-GLN-PRO-HIS-GLU-PRO-GLY-ALA-THR-THR-VAL-PRO-ALA-ARG-LYS-PHE-PHE-ASP-ILE-CYS-ARG-GLY-LEU-PRO-GLU-GLY-ALA-GLU-ILE-ALA-VAL-GLN-LEU-GLU-GLY-GLU-ARG-MET-LEU-VAL-ARG-SER-GLY-ARG-SER-ARG-PHE-SER-LEU-SER-THR-LEU-PRO-ALA-ALA-ASP-PHE-PRO-ASN-LEU-ASP-ASP-TRP-GLN-SER-GLU-VAL-GLU-PHE-THR-LEU-PRO-GLN-ALA-THR-MET-LYS-ARG-LEU-ILE-GLU-ALA-THR-GLN-PHE-SER-MET-ALA-HIS-GLN-ASP-VAL-ARG-TYR-TYR-LEU-ASN-GLY-MET-LEU-PHE-GLU-THR-GLU-GLY-GLU-GLU-LEU-ARG-THR-VAL-ALA-THR-ASP-GLY-HIS-ARG-LEU-ALA-VAL-CYS-SER-MET-PRO-ILE-GLY-GLN-SER-LEU-PRO-SER-HIS-SER-VAL-ILE-VAL-PRO-ARG-LYS-GLY-VAL-ILE-GLU-LEU-MET-ARG-MET-LEU-ASP-GLY-GLY-ASP-ASN-PRO-LEU-ARG-VAL-GLN-ILE-GLY-SER-ASN-ASN-ILE-ARG-ALA-HIS-VAL-GLY-ASP-PHE-ILE-PHE-THR-SER-LYS-LEU-VAL-ASP-GLY-ARG-PHE-PRO-ASP-TYR-ARG-ARG-VAL-LEU-PRO-LYS-ASN-PRO-ASP-LYS-HIS-LEU-GLU-ALA-GLY-CYS-ASP-LEU-LEU-LYS-GLN-ALA-PHE-ALA-ARG-ALA-ALA-ILE-LEU-SER-ASN-GLU-LYS-PHE-ARG-GLY-VAL-ARG-LEU-TYR-VAL-SER-GLU-ASN-GLN-LEU-LYS-ILE-THR-ALA-ASN-ASN-PRO-GLU-GLN-GLU-GLU-ALA-GLU-GLU-ILE-LEU-ASP-VAL-THR-TYR-SER-GLY-ALA-GLU-MET-GLU-ILE-GLY-PHE-ASN-VAL-SER-TYR-VAL-LEU-ASP-VAL-LEU-ASN-ALA-LEU-LYS-CYS-GLU-ASN-VAL-ARG-MET-MET-LEU-THR-ASP-SER-VAL-SER-SER-VAL-GLN-ILE-GLU-ASP-ALA-ALA-SER-GLN-SER-ALA-ALA-TYR-VAL-VAL-MET-PRO-MET-ARG-LEU,ACE-GLN-ALC-ASP-LEU-ZCL,368,6,CC(C[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCC(=O)N)CC1CCCCC1)CC(=O)O)C,Kd=55nM,7.259637,7.26,1,A,A,1,A,A,0,,C,A,,1,1,368,6,0,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.924913227558136,0.8968520164489746,90.74977111816406,88.59661865234375,0.3615381419658661,0.472882479429245,0.9167472124099731,0.90892094373703,0.918576717376709,0.8938347697257996,QADLF,Moderate,"(7.049, 7.268]",train
3Q5U,protein-peptide,Q9NRQ2 P52293,NQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,NIGSIIRKWNGLL,ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,ASN-ILE-GLY-SER-ILE-ILE-ARG-LYS-TRP-ASN-GLY-LEU-LEU,460,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)C[NH3+])CO)CCC[NH+]=C(N)N,Kd=48.7uM,4.312471,4.31,1,A,A,1,A,A,0,,B,A,,1,1,460,13,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)CC)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8786109685897827,0.7638649344444275,87.87039947509766,87.26734924316406,0.4253591299057007,0.931800663471222,0.8712644577026367,0.8377974033355713,0.8249507546424866,0.704620897769928,NIGSIIRKWNGLL,Low,"(4.155, 4.319]",train
3Q8D,protein-peptide,P0A7H3 P28044,MEGWQRAFVLHSRPWSETSLMLDVFTEESGRVRLVAKGARSKRSTLKGALQPFTPLLLRFGGRGEVKTLRSAEAVSLALPLSGITLYSGLYINELLSRVLEYETRFSELFFDYLHCIQSLAGVTGTPEPALRRFELALLGHLGYGVNFTHCAGSGEPVDDTMTYRYREEKGFIASVVIDNKTFTGRQLKALNAREFPDADTLRAAKRFTRMALKPYLGGKPLKSRELFRQFMPKRTVKTHYE,YMDFDDDIPF,MET-GLU-GLY-TRP-GLN-ARG-ALA-PHE-VAL-LEU-HIS-SER-ARG-PRO-TRP-SER-GLU-THR-SER-LEU-MET-LEU-ASP-VAL-PHE-THR-GLU-GLU-SER-GLY-ARG-VAL-ARG-LEU-VAL-ALA-LYS-GLY-ALA-ARG-SER-LYS-ARG-SER-THR-LEU-LYS-GLY-ALA-LEU-GLN-PRO-PHE-THR-PRO-LEU-LEU-LEU-ARG-PHE-GLY-GLY-ARG-GLY-GLU-VAL-LYS-THR-LEU-ARG-SER-ALA-GLU-ALA-VAL-SER-LEU-ALA-LEU-PRO-LEU-SER-GLY-ILE-THR-LEU-TYR-SER-GLY-LEU-TYR-ILE-ASN-GLU-LEU-LEU-SER-ARG-VAL-LEU-GLU-TYR-GLU-THR-ARG-PHE-SER-GLU-LEU-PHE-PHE-ASP-TYR-LEU-HIS-CYS-ILE-GLN-SER-LEU-ALA-GLY-VAL-THR-GLY-THR-PRO-GLU-PRO-ALA-LEU-ARG-ARG-PHE-GLU-LEU-ALA-LEU-LEU-GLY-HIS-LEU-GLY-TYR-GLY-VAL-ASN-PHE-THR-HIS-CYS-ALA-GLY-SER-GLY-GLU-PRO-VAL-ASP-ASP-THR-MET-THR-TYR-ARG-TYR-ARG-GLU-GLU-LYS-GLY-PHE-ILE-ALA-SER-VAL-VAL-ILE-ASP-ASN-LYS-THR-PHE-THR-GLY-ARG-GLN-LEU-LYS-ALA-LEU-ASN-ALA-ARG-GLU-PHE-PRO-ASP-ALA-ASP-THR-LEU-ARG-ALA-ALA-LYS-ARG-PHE-THR-ARG-MET-ALA-LEU-LYS-PRO-TYR-LEU-GLY-GLY-LYS-PRO-LEU-LYS-SER-ARG-GLU-LEU-PHE-ARG-GLN-PHE-MET-PRO-LYS-ARG-THR-VAL-LYS-THR-HIS-TYR-GLU,TYR-MET-ASP-PHE-ASP-ASP-ASP-ILE-PRO-PHE,242,10,CC[C@@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)[NH3+])C,Kd=0.06uM,7.221849,7.22,1,A,A,1,A,A,0,,E,A,,1,1,242,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.8613256216049194,0.8014494180679321,85.33715057373047,87.67105865478516,0.4510164558887481,0.7703140377998352,0.8773751854896545,0.8759234547615051,0.7903489470481873,0.7828308343887329,YMDFDDDIPF,Moderate,"(7.049, 7.268]",train
3QN7,protein-peptide,P00749,IIGGEFTTIENQPWFAAIYRRHRGGSVTYVCGGSLISPCWVISATHCFIDYPKKEDYIVYLGRSRLNSNTQGEMKFEVENLILHKDYSADTLAHHNDIALLKIRSKEGRCAQPSRTIQTIALPSMYNDPQFGTSCEITGFGKEQSTDYLYPEQLKMTVVKLISHRECQQPHYYGSEVTTKMLCAADPQWKTDSCQGDSGGPLVCSLQGRMTLTGIVSWGRGCALKDKPGVYTRVSHFLPWIRSHTKEENGLAL,ACSRYEVDCRGRGSACG,ILE-ILE-GLY-GLY-GLU-PHE-THR-THR-ILE-GLU-ASN-GLN-PRO-TRP-PHE-ALA-ALA-ILE-TYR-ARG-ARG-HIS-ARG-GLY-GLY-SER-VAL-THR-TYR-VAL-CYS-GLY-GLY-SER-LEU-ILE-SER-PRO-CYS-TRP-VAL-ILE-SER-ALA-THR-HIS-CYS-PHE-ILE-ASP-TYR-PRO-LYS-LYS-GLU-ASP-TYR-ILE-VAL-TYR-LEU-GLY-ARG-SER-ARG-LEU-ASN-SER-ASN-THR-GLN-GLY-GLU-MET-LYS-PHE-GLU-VAL-GLU-ASN-LEU-ILE-LEU-HIS-LYS-ASP-TYR-SER-ALA-ASP-THR-LEU-ALA-HIS-HIS-ASN-ASP-ILE-ALA-LEU-LEU-LYS-ILE-ARG-SER-LYS-GLU-GLY-ARG-CYS-ALA-GLN-PRO-SER-ARG-THR-ILE-GLN-THR-ILE-ALA-LEU-PRO-SER-MET-TYR-ASN-ASP-PRO-GLN-PHE-GLY-THR-SER-CYS-GLU-ILE-THR-GLY-PHE-GLY-LYS-GLU-GLN-SER-THR-ASP-TYR-LEU-TYR-PRO-GLU-GLN-LEU-LYS-MET-THR-VAL-VAL-LYS-LEU-ILE-SER-HIS-ARG-GLU-CYS-GLN-GLN-PRO-HIS-TYR-TYR-GLY-SER-GLU-VAL-THR-THR-LYS-MET-LEU-CYS-ALA-ALA-ASP-PRO-GLN-TRP-LYS-THR-ASP-SER-CYS-GLN-GLY-ASP-SER-GLY-GLY-PRO-LEU-VAL-CYS-SER-LEU-GLN-GLY-ARG-MET-THR-LEU-THR-GLY-ILE-VAL-SER-TRP-GLY-ARG-GLY-CYS-ALA-LEU-LYS-ASP-LYS-PRO-GLY-VAL-TYR-THR-ARG-VAL-SER-HIS-PHE-LEU-PRO-TRP-ILE-ARG-SER-HIS-THR-LYS-GLU-GLU-ASN-GLY-LEU-ALA-LEU,ALA-CYS-SER-ARG-TYR-GLU-VAL-ASP-CYS-ARG-GLY-ARG-GLY-SER-ALA-CYS-GLY,253,17,OC[C@@H]1NC(=O)[C@H](CSCc2cc3CSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)CCC(=O)O)C(C)C)CC(=O)O)C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)NCC(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSCc(c2)c3)C(=O)O)C)CO)NC(=O)[C@@H]([NH3+])C,Kd=157nM,6.8041,6.8,1,A,A,1,A,A,0,,B,A,,1,1,253,17,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)O)C(=O)O,0.8572853803634644,0.81866055727005,94.21282196044922,92.08893585205078,0.3761168122291565,0.6915683150291443,0.9441976547241212,0.8975843191146851,0.7962054014205933,0.784107506275177,ACSRYEVDCRGRGSACG,Low,"(6.696, 6.824]",train
3QNJ,protein-peptide,P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,VDKPPYLPRPRPPRAIYNA,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,VAL-ASP-LYS-PRO-PRO-TYR-LEU-PRO-ARG-PRO-ARG-PRO-PRO-ARG-ORN-ILE-TYR-ASN-ORN,219,19,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC[NH+]=C(N)N)CC(C)C)Cc1ccc(cc1)O)[NH3+],Kd=1.0uM,6.0,6.0,1,A,A,1,A,A,0,,C,A,dimer,1,1,219,19,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(CCCN)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NC(CCCN)C(=O)O)C(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.902356505393982,0.7722917199134827,90.0382080078125,82.6419448852539,0.3650173246860504,0.8356286883354187,0.8960170149803162,0.8434962034225464,0.8540464043617249,0.7544905543327332,VDKPPYLPRPRPPRAIYNA,Low,"(5.959, 6.097]",train
3QZT,protein-peptide,Q12830 P62805,GPLGSVLTPLTEKDYEGLKRVLRSLQAHKMAWPFLEPVDPNDAPDYYGVIKEPMDLATMEERVQRRYYEKLTEFVADMTKIFDNCRYYNPSDSPFYQCAEVLESFFVQKLKGFKA,KGGAKRHRKV,GLY-PRO-LEU-GLY-SER-VAL-LEU-THR-PRO-LEU-THR-GLU-LYS-ASP-TYR-GLU-GLY-LEU-LYS-ARG-VAL-LEU-ARG-SER-LEU-GLN-ALA-HIS-LYS-MET-ALA-TRP-PRO-PHE-LEU-GLU-PRO-VAL-ASP-PRO-ASN-ASP-ALA-PRO-ASP-TYR-TYR-GLY-VAL-ILE-LYS-GLU-PRO-MET-ASP-LEU-ALA-THR-MET-GLU-GLU-ARG-VAL-GLN-ARG-ARG-TYR-TYR-GLU-LYS-LEU-THR-GLU-PHE-VAL-ALA-ASP-MET-THR-LYS-ILE-PHE-ASP-ASN-CYS-ARG-TYR-TYR-ASN-PRO-SER-ASP-SER-PRO-PHE-TYR-GLN-CYS-ALA-GLU-VAL-LEU-GLU-SER-PHE-PHE-VAL-GLN-LYS-LEU-LYS-GLY-PHE-LYS-ALA,LYS-GLY-GLY-ALA-ALY-ARG-HIS-ARG-LYS-VAL,115,10,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N)CCCCNC(=O)C)C,Kd=99uM,4.004365,4.0,1,A,A,1,A,A,0,,B,A,,1,1,115,10,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,CC(=O)NCCCCC(NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O,0.9269181489944458,0.7729937434196472,90.08850860595705,93.8545150756836,0.332013338804245,0.7495848536491394,0.9211033582687378,0.8556511998176575,0.853371798992157,0.7468945980072021,KGGAKRHRKV,Low,"(3.924, 4.155]",train
3QZV,protein-peptide,Q12830 P62805,GPLGSDTKLYCICKTPYDESKFYIGCDRCQNWYHGRCVGILQSEAELIDEYVCPQCQSTEDAMTVLTPLTEKDYEGLKRVLRSLQAHKMAWPFLEPVDPNDAPDYYGVIKEPMDLATMEERVQRRYYEKLTEFVADMTKIFDNCRYYNPSDSPFYQCAEVLESFFVQKLKGFKA,GKGLGKGGAKR,GLY-PRO-LEU-GLY-SER-ASP-THR-LYS-LEU-TYR-CYS-ILE-CYS-LYS-THR-PRO-TYR-ASP-GLU-SER-LYS-PHE-TYR-ILE-GLY-CYS-ASP-ARG-CYS-GLN-ASN-TRP-TYR-HIS-GLY-ARG-CYS-VAL-GLY-ILE-LEU-GLN-SER-GLU-ALA-GLU-LEU-ILE-ASP-GLU-TYR-VAL-CYS-PRO-GLN-CYS-GLN-SER-THR-GLU-ASP-ALA-MET-THR-VAL-LEU-THR-PRO-LEU-THR-GLU-LYS-ASP-TYR-GLU-GLY-LEU-LYS-ARG-VAL-LEU-ARG-SER-LEU-GLN-ALA-HIS-LYS-MET-ALA-TRP-PRO-PHE-LEU-GLU-PRO-VAL-ASP-PRO-ASN-ASP-ALA-PRO-ASP-TYR-TYR-GLY-VAL-ILE-LYS-GLU-PRO-MET-ASP-LEU-ALA-THR-MET-GLU-GLU-ARG-VAL-GLN-ARG-ARG-TYR-TYR-GLU-LYS-LEU-THR-GLU-PHE-VAL-ALA-ASP-MET-THR-LYS-ILE-PHE-ASP-ASN-CYS-ARG-TYR-TYR-ASN-PRO-SER-ASP-SER-PRO-PHE-TYR-GLN-CYS-ALA-GLU-VAL-LEU-GLU-SER-PHE-PHE-VAL-GLN-LYS-LEU-LYS-GLY-PHE-LYS-ALA,GLY-LYS-GLY-LEU-GLY-ALY-GLY-GLY-ALA-LYS-ARG,174,11,[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCCCNC(=O)C)CC(C)C)NC(=O)C[NH3+],Kd=69uM,4.161151,4.16,1,A,A,1,A,A,0,,C,A,,1,1,174,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O,0.8186755776405334,0.6919723749160767,61.74407958984375,70.22665405273438,0.5917537808418274,1.5747517347335815,0.7203057408332825,0.6979324221611023,0.7588085532188416,0.6473788619041443,GKGLGKGGAKR,Low,"(4.155, 4.319]",val
3R42,protein-peptide,P25604 P40343,GAMSANGKISVPEAVVNWLFKVIQPIYNDGRTTFHDSLALLDNFHSLRPRTRVFTHSDGTPQLLLSIYGTISTGEDGSSPHSIPVIMWVPSMYPVKPPFISINLENFDMNTISSSLPIQEYIDSNGWIALPILHAWDPAAMNLIMVVQELMSLLHEPPQDQA,QVPSDPYNY,GLY-ALA-MET-SER-ALA-ASN-GLY-LYS-ILE-SER-VAL-PRO-GLU-ALA-VAL-VAL-ASN-TRP-LEU-PHE-LYS-VAL-ILE-GLN-PRO-ILE-TYR-ASN-ASP-GLY-ARG-THR-THR-PHE-HIS-ASP-SER-LEU-ALA-LEU-LEU-ASP-ASN-PHE-HIS-SER-LEU-ARG-PRO-ARG-THR-ARG-VAL-PHE-THR-HIS-SER-ASP-GLY-THR-PRO-GLN-LEU-LEU-LEU-SER-ILE-TYR-GLY-THR-ILE-SER-THR-GLY-GLU-ASP-GLY-SER-SER-PRO-HIS-SER-ILE-PRO-VAL-ILE-MET-TRP-VAL-PRO-SER-MET-TYR-PRO-VAL-LYS-PRO-PRO-PHE-ILE-SER-ILE-ASN-LEU-GLU-ASN-PHE-ASP-MET-ASN-THR-ILE-SER-SER-SER-LEU-PRO-ILE-GLN-GLU-TYR-ILE-ASP-SER-ASN-GLY-TRP-ILE-ALA-LEU-PRO-ILE-LEU-HIS-ALA-TRP-ASP-PRO-ALA-ALA-MET-ASN-LEU-ILE-MET-VAL-VAL-GLN-GLU-LEU-MET-SER-LEU-LEU-HIS-GLU-PRO-PRO-GLN-ASP-GLN-ALA,GLN-VAL-PRO-SER-ASP-PRO-TYR-ASN-TYR,162,9,OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1ccc(cc1)O)CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)N)[NH3+],Kd=84uM,4.075721,4.08,1,A,A,1,A,A,0,,B,A,,1,1,162,9,0,CC(C)[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9614022374153136,0.8016825914382935,94.7975845336914,91.08524322509766,0.3724532723426819,0.7311092019081116,0.9077284932136536,0.8417911529541016,0.9090312123298644,0.7569332122802734,QVPSDPYNY,Low,"(3.924, 4.155]",train
3RL8,protein-peptide,Q12959 P25054,MGHHHHHHMEKIMEIKLIKGPKGLGFSIAGGVGNQHIPGDNSIYVTKIIEGGAAHKDGKLQIGDKLLAVNNVCLEEVTHEEAVTALKNTSDFVYLKVAKPTSMYM,RHSGSYLVTSV,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-GLU-LYS-ILE-MET-GLU-ILE-LYS-LEU-ILE-LYS-GLY-PRO-LYS-GLY-LEU-GLY-PHE-SER-ILE-ALA-GLY-GLY-VAL-GLY-ASN-GLN-HIS-ILE-PRO-GLY-ASP-ASN-SER-ILE-TYR-VAL-THR-LYS-ILE-ILE-GLU-GLY-GLY-ALA-ALA-HIS-LYS-ASP-GLY-LYS-LEU-GLN-ILE-GLY-ASP-LYS-LEU-LEU-ALA-VAL-ASN-ASN-VAL-CYS-LEU-GLU-GLU-VAL-THR-HIS-GLU-GLU-ALA-VAL-THR-ALA-LEU-LYS-ASN-THR-SER-ASP-PHE-VAL-TYR-LEU-LYS-VAL-ALA-LYS-PRO-THR-SER-MET-TYR-MET,ARG-HIS-SER-GLY-SER-TYR-LEU-VAL-THR-SER-VAL,105,11,OC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(C)C,Kd=1.05uM,5.978811,5.98,1,A,A,1,A,A,0,,F,A,,0,1,105,11,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9931902289390564,0.9207561612129213,90.3613510131836,88.3157958984375,0.3329073190689087,0.4734916985034942,0.9071103930473328,0.9103938937187196,0.896175742149353,0.8816800117492676,RHSGSYLVTSV,Low,"(5.959, 6.097]",train
3RQE,protein-peptide,Q9BUL8 P49023,GHMRMTMEEMKNEAETTSMVSMPLYAVMYPVFNELERVNLSAAQTLRAAFIKAEKENPGLTQDIIMKILEKKSVEVNFTESLLRMAADDVEEYMIERPEPEFQDLNEKARALKQILSKIPDEINDRVRFLQTIKDIASAIKELLDTVNNVFKKYQYQNRRALEHQKKEFVKYSKSFSDTLKTYFKDGKAINVFVSANRLIHQTNLILQTFKTVA,DDLDALLADLESTT,GLY-HIS-MET-ARG-MET-THR-MET-GLU-GLU-MET-LYS-ASN-GLU-ALA-GLU-THR-THR-SER-MET-VAL-SER-MET-PRO-LEU-TYR-ALA-VAL-MET-TYR-PRO-VAL-PHE-ASN-GLU-LEU-GLU-ARG-VAL-ASN-LEU-SER-ALA-ALA-GLN-THR-LEU-ARG-ALA-ALA-PHE-ILE-LYS-ALA-GLU-LYS-GLU-ASN-PRO-GLY-LEU-THR-GLN-ASP-ILE-ILE-MET-LYS-ILE-LEU-GLU-LYS-LYS-SER-VAL-GLU-VAL-ASN-PHE-THR-GLU-SER-LEU-LEU-ARG-MET-ALA-ALA-ASP-ASP-VAL-GLU-GLU-TYR-MET-ILE-GLU-ARG-PRO-GLU-PRO-GLU-PHE-GLN-ASP-LEU-ASN-GLU-LYS-ALA-ARG-ALA-LEU-LYS-GLN-ILE-LEU-SER-LYS-ILE-PRO-ASP-GLU-ILE-ASN-ASP-ARG-VAL-ARG-PHE-LEU-GLN-THR-ILE-LYS-ASP-ILE-ALA-SER-ALA-ILE-LYS-GLU-LEU-LEU-ASP-THR-VAL-ASN-ASN-VAL-PHE-LYS-LYS-TYR-GLN-TYR-GLN-ASN-ARG-ARG-ALA-LEU-GLU-HIS-GLN-LYS-LYS-GLU-PHE-VAL-LYS-TYR-SER-LYS-SER-PHE-SER-ASP-THR-LEU-LYS-THR-TYR-PHE-LYS-ASP-GLY-LYS-ALA-ILE-ASN-VAL-PHE-VAL-SER-ALA-ASN-ARG-LEU-ILE-HIS-GLN-THR-ASN-LEU-ILE-LEU-GLN-THR-PHE-LYS-THR-VAL-ALA,ASP-ASP-LEU-ASP-ALA-LEU-LEU-ALA-ASP-LEU-GLU-SER-THR-THR,214,14,OC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])C)CC(C)C)CC(C)C)C)CC(=O)O)CC(C)C)CCC(=O)O,Kd=17uM,4.769551,4.77,1,A,A,1,A,A,0,,E,A,,0,1,214,14,0,CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.8741531372070312,0.8441094756126404,73.96717071533203,71.0275650024414,0.4691602885723114,0.7233011722564697,0.8472516536712646,0.8344525098800659,0.8425012826919556,0.8231592178344727,DDLDALLADLESTT,Low,"(4.745, 4.866]",train
3RQF,protein-peptide,Q9BUL8 P49023,GHMRMTMEEMKNEAETTSMVSMPLYAVMYPVFNELERVNLSAAQTLRAAFIKAEKENPGLTQDIIMKILEKKSVEVNFTESLLRMAADDVEEYMIERPEPEFQDLNEKARALKQILSKIPDEINDRVRFLQTIKDIASAIKELLDTVNNVFKKYQYQNRRALEHQKKEFVKYSKSFSDTLKTYFKDGKAINVFVSANRLIHQTNLILQTFKTVA,NLSELDRLLLELN,GLY-HIS-MET-ARG-MET-THR-MET-GLU-GLU-MET-LYS-ASN-GLU-ALA-GLU-THR-THR-SER-MET-VAL-SER-MET-PRO-LEU-TYR-ALA-VAL-MET-TYR-PRO-VAL-PHE-ASN-GLU-LEU-GLU-ARG-VAL-ASN-LEU-SER-ALA-ALA-GLN-THR-LEU-ARG-ALA-ALA-PHE-ILE-LYS-ALA-GLU-LYS-GLU-ASN-PRO-GLY-LEU-THR-GLN-ASP-ILE-ILE-MET-LYS-ILE-LEU-GLU-LYS-LYS-SER-VAL-GLU-VAL-ASN-PHE-THR-GLU-SER-LEU-LEU-ARG-MET-ALA-ALA-ASP-ASP-VAL-GLU-GLU-TYR-MET-ILE-GLU-ARG-PRO-GLU-PRO-GLU-PHE-GLN-ASP-LEU-ASN-GLU-LYS-ALA-ARG-ALA-LEU-LYS-GLN-ILE-LEU-SER-LYS-ILE-PRO-ASP-GLU-ILE-ASN-ASP-ARG-VAL-ARG-PHE-LEU-GLN-THR-ILE-LYS-ASP-ILE-ALA-SER-ALA-ILE-LYS-GLU-LEU-LEU-ASP-THR-VAL-ASN-ASN-VAL-PHE-LYS-LYS-TYR-GLN-TYR-GLN-ASN-ARG-ARG-ALA-LEU-GLU-HIS-GLN-LYS-LYS-GLU-PHE-VAL-LYS-TYR-SER-LYS-SER-PHE-SER-ASP-THR-LEU-LYS-THR-TYR-PHE-LYS-ASP-GLY-LYS-ALA-ILE-ASN-VAL-PHE-VAL-SER-ALA-ASN-ARG-LEU-ILE-HIS-GLN-THR-ASN-LEU-ILE-LEU-GLN-THR-PHE-LYS-THR-VAL-ALA,ASN-LEU-SER-GLU-LEU-ASP-ARG-LEU-LEU-LEU-GLU-LEU-ASN,214,13,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(C)C)CCC(=O)O)CC(C)C)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CC(=O)O)CC(C)C)CCC(=O)O)[NH3+],Kd=39uM,4.408935,4.41,1,A,A,1,A,A,0,,E,A,,1,1,214,13,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.8263689279556274,0.843005895614624,74.73005676269531,71.0267562866211,0.4680576026439667,0.6763712167739868,0.8519702553749084,0.8750874996185303,0.7841755747795105,0.8349854350090027,NLSELDRLLLELN,Low,"(4.319, 4.456]",train
3RQG,protein-peptide,Q9BUL8 P49023,GHMRMTMEEMKNEAETTSMVSMPLYAVMYPVFNELERVNLSAAQTLRAAFIKAEKENPGLTQDIIMKILEKKSVEVNFTESLLRMAADDVEEYMIERPEPEFQDLNEKARALKQILSKIPDEINDRVRFLQTIKDIASAIKELLDTVNNVFKKYQYQNRRALEHQKKEFVKYSKSFSDTLKTYFKDGKAINVFVSANRLIHQTNLILQTFKTVA,ATRELDELMASLS,GLY-HIS-MET-ARG-MET-THR-MET-GLU-GLU-MET-LYS-ASN-GLU-ALA-GLU-THR-THR-SER-MET-VAL-SER-MET-PRO-LEU-TYR-ALA-VAL-MET-TYR-PRO-VAL-PHE-ASN-GLU-LEU-GLU-ARG-VAL-ASN-LEU-SER-ALA-ALA-GLN-THR-LEU-ARG-ALA-ALA-PHE-ILE-LYS-ALA-GLU-LYS-GLU-ASN-PRO-GLY-LEU-THR-GLN-ASP-ILE-ILE-MET-LYS-ILE-LEU-GLU-LYS-LYS-SER-VAL-GLU-VAL-ASN-PHE-THR-GLU-SER-LEU-LEU-ARG-MET-ALA-ALA-ASP-ASP-VAL-GLU-GLU-TYR-MET-ILE-GLU-ARG-PRO-GLU-PRO-GLU-PHE-GLN-ASP-LEU-ASN-GLU-LYS-ALA-ARG-ALA-LEU-LYS-GLN-ILE-LEU-SER-LYS-ILE-PRO-ASP-GLU-ILE-ASN-ASP-ARG-VAL-ARG-PHE-LEU-GLN-THR-ILE-LYS-ASP-ILE-ALA-SER-ALA-ILE-LYS-GLU-LEU-LEU-ASP-THR-VAL-ASN-ASN-VAL-PHE-LYS-LYS-TYR-GLN-TYR-GLN-ASN-ARG-ARG-ALA-LEU-GLU-HIS-GLN-LYS-LYS-GLU-PHE-VAL-LYS-TYR-SER-LYS-SER-PHE-SER-ASP-THR-LEU-LYS-THR-TYR-PHE-LYS-ASP-GLY-LYS-ALA-ILE-ASN-VAL-PHE-VAL-SER-ALA-ASN-ARG-LEU-ILE-HIS-GLN-THR-ASN-LEU-ILE-LEU-GLN-THR-PHE-LYS-THR-VAL-ALA,ALA-THR-ARG-GLU-LEU-ASP-GLU-LEU-MET-ALA-SER-LEU-SER,214,13,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCC(=O)O)CC(C)C)CC(=O)O)CCC(=O)O)CC(C)C,Kd=23uM,4.638272,4.64,1,A,A,1,A,A,0,,E,A,,0,1,214,13,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(=O)O,0.8662813901901245,0.8289737105369568,73.12982177734375,70.73055267333984,0.4590969383716583,0.7306127548217773,0.8573840856552124,0.8204092979431152,0.832712709903717,0.8311147689819336,ATRELDELMASLS,Low,"(4.606, 4.745]",val
3RTX,protein-peptide,O55236,SLKLGAIFLEGITVKGVTQVTTQPKLGEVQQKCHQFCGWEGSGFPGAQPVSMDKQNIRLLEQKPYKVSWKADGTRYMMLIDGTNEVFMIDRDNSVFHVSNLEFPFRKDLRMHLSNTLLDGEMIIDKVNGQAVPRYLIYDIIKFNAQPVGDCDFNIRLQCIEREIISPRHEKMKTGLIDKTQEPFSVRPKQFFDINISRKLLEGNFAKEVSHEMDGLIFQPIGKYKPGRCDDILKWKPPSLNSVDFRLKITRMGGEGLLPQNVGLLYVGGYERPFAQIKVTKELKQYDNKIIECKFENNSWVFMRQRIDKSFPNAYNTAMAVCNSISNPVTKEMLFEFIDRCAA,TSPSYSPTSPSYSPTSPS,SER-LEU-LYS-LEU-GLY-ALA-ILE-PHE-LEU-GLU-GLY-ILE-THR-VAL-LYS-GLY-VAL-THR-GLN-VAL-THR-THR-GLN-PRO-LYS-LEU-GLY-GLU-VAL-GLN-GLN-LYS-CYS-HIS-GLN-PHE-CYS-GLY-TRP-GLU-GLY-SER-GLY-PHE-PRO-GLY-ALA-GLN-PRO-VAL-SER-MET-ASP-LYS-GLN-ASN-ILE-ARG-LEU-LEU-GLU-GLN-LYS-PRO-TYR-LYS-VAL-SER-TRP-LYS-ALA-ASP-GLY-THR-ARG-TYR-MET-MET-LEU-ILE-ASP-GLY-THR-ASN-GLU-VAL-PHE-MET-ILE-ASP-ARG-ASP-ASN-SER-VAL-PHE-HIS-VAL-SER-ASN-LEU-GLU-PHE-PRO-PHE-ARG-LYS-ASP-LEU-ARG-MET-HIS-LEU-SER-ASN-THR-LEU-LEU-ASP-GLY-GLU-MET-ILE-ILE-ASP-LYS-VAL-ASN-GLY-GLN-ALA-VAL-PRO-ARG-TYR-LEU-ILE-TYR-ASP-ILE-ILE-LYS-PHE-ASN-ALA-GLN-PRO-VAL-GLY-ASP-CYS-ASP-PHE-ASN-ILE-ARG-LEU-GLN-CYS-ILE-GLU-ARG-GLU-ILE-ILE-SER-PRO-ARG-HIS-GLU-LYS-MET-LYS-THR-GLY-LEU-ILE-ASP-LYS-THR-GLN-GLU-PRO-PHE-SER-VAL-ARG-PRO-LYS-GLN-PHE-PHE-ASP-ILE-ASN-ILE-SER-ARG-LYS-LEU-LEU-GLU-GLY-ASN-PHE-ALA-LYS-GLU-VAL-SER-HIS-GLU-MET-ASP-GLY-LEU-ILE-PHE-GLN-PRO-ILE-GLY-LYS-TYR-LYS-PRO-GLY-ARG-CYS-ASP-ASP-ILE-LEU-LYS-TRP-LYS-PRO-PRO-SER-LEU-ASN-SER-VAL-ASP-PHE-ARG-LEU-LYS-ILE-THR-ARG-MET-GLY-GLY-GLU-GLY-LEU-LEU-PRO-GLN-ASN-VAL-GLY-LEU-LEU-TYR-VAL-GLY-GLY-TYR-GLU-ARG-PRO-PHE-ALA-GLN-ILE-LYS-VAL-THR-LYS-GLU-LEU-LYS-GLN-TYR-ASP-ASN-LYS-ILE-ILE-GLU-CYS-LYS-PHE-GLU-ASN-ASN-SER-TRP-VAL-PHE-MET-ARG-GLN-ARG-ILE-ASP-LYS-SER-PHE-PRO-ASN-ALA-TYR-ASN-THR-ALA-MET-ALA-VAL-CYS-ASN-SER-ILE-SER-ASN-PRO-VAL-THR-LYS-GLU-MET-LEU-PHE-GLU-PHE-ILE-ASP-ARG-CYS-ALA-ALA,THR-SEP-PRO-SER-TYR-SEP-PRO-THR-SEP-PRO-SER-TYR-SEP-PRO-THR-SEP-PRO-SER,343,18,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)COP(O)(O)O)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](COP(O)(O)O)[NH3+])CO)COP(O)(O)O)COP(O)(O)O,Kd=139uM,3.856985,3.86,1,A,A,1,A,A,0,,C,A,dimer,1,1,343,18,0,C[C@@H](O)[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,C[C@@H](O)[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CO)C(=O)O,0.5856766700744629,0.6167272329330444,70.91568756103516,73.95185089111328,0.656803548336029,1.2886983156204224,0.8105708956718445,0.7649415731430054,0.4982896447181701,0.5796735882759094,TSPSYSPTSPSYSPTSPS,Low,"(3.548, 3.924]",train
3RZ9,protein-peptide,P52293 P13010,MHHHHHHSSGLVPRGSGMKETAAAKFERQHMDSPDLGTDDDDKAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,EDGPTAKKLKTEQ,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LYS-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,GLU-ASP-GLY-PRO-THR-ALA-LYS-LYS-LEU-LYS-THR-GLU-GLN,510,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)O)[C@H](O)C)CCCC[NH3+])CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1C=CCN1C(=O)CNC(=O)[C@@H]([NH3+])C)C)CCCC[NH3+],Kd=120nM,6.920819,6.92,1,A,A,1,A,A,0,,B,A,,1,1,510,13,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.966212809085846,0.7925658822059631,81.13240814208984,81.572265625,0.4944444000720978,1.0596578121185305,0.8254337310791016,0.7974052429199219,0.8938549757003784,0.6982187628746033,EDGPTAKKLKTEQ,Low,"(6.824, 7.049]",train
3S7F,protein-peptide,Q9NRG4,MRAEGLGGLERFCSPGKGRGLRALQPFQVGDLLFSCPAYAYVLTVNERGNHCEYCFTRKEGLSKCGRCKQAFYCNVECQKEDWPMHKLECSPMVVFGENWNPSETVRLTARILAKQKIHPERTPSEKLLAVKEFESHLDKLDNEKKDLIQSDIAALHHFYSKHLEFPDNDSLVVLFAQVNCNGFTIEDEELSHLGSAIFPDVALMNHSCCPNVIVTYKGTLAEVRAVQEIKPGEEVFTSYIDLLYPTEDRNDRLRDSYFFTCECQECTTKDKDKAKVEIRKLSDPPKAEAIRDMVRYARNVIEEFRRAKHYKSPSELLEICELSQEKMSSVFEDSNVYMLHMMYQAMGVCLYMQDWEGALQYGQKIIKPYSKHYPLYSLNVASMWLKLGRLYMGLEHKAAGEKALKKAIAIMEVAHGKDHPYISEIKQEIESH,SSHLKSKKGQSTS,MET-ARG-ALA-GLU-GLY-LEU-GLY-GLY-LEU-GLU-ARG-PHE-CYS-SER-PRO-GLY-LYS-GLY-ARG-GLY-LEU-ARG-ALA-LEU-GLN-PRO-PHE-GLN-VAL-GLY-ASP-LEU-LEU-PHE-SER-CYS-PRO-ALA-TYR-ALA-TYR-VAL-LEU-THR-VAL-ASN-GLU-ARG-GLY-ASN-HIS-CYS-GLU-TYR-CYS-PHE-THR-ARG-LYS-GLU-GLY-LEU-SER-LYS-CYS-GLY-ARG-CYS-LYS-GLN-ALA-PHE-TYR-CYS-ASN-VAL-GLU-CYS-GLN-LYS-GLU-ASP-TRP-PRO-MET-HIS-LYS-LEU-GLU-CYS-SER-PRO-MET-VAL-VAL-PHE-GLY-GLU-ASN-TRP-ASN-PRO-SER-GLU-THR-VAL-ARG-LEU-THR-ALA-ARG-ILE-LEU-ALA-LYS-GLN-LYS-ILE-HIS-PRO-GLU-ARG-THR-PRO-SER-GLU-LYS-LEU-LEU-ALA-VAL-LYS-GLU-PHE-GLU-SER-HIS-LEU-ASP-LYS-LEU-ASP-ASN-GLU-LYS-LYS-ASP-LEU-ILE-GLN-SER-ASP-ILE-ALA-ALA-LEU-HIS-HIS-PHE-TYR-SER-LYS-HIS-LEU-GLU-PHE-PRO-ASP-ASN-ASP-SER-LEU-VAL-VAL-LEU-PHE-ALA-GLN-VAL-ASN-CYS-ASN-GLY-PHE-THR-ILE-GLU-ASP-GLU-GLU-LEU-SER-HIS-LEU-GLY-SER-ALA-ILE-PHE-PRO-ASP-VAL-ALA-LEU-MET-ASN-HIS-SER-CYS-CYS-PRO-ASN-VAL-ILE-VAL-THR-TYR-LYS-GLY-THR-LEU-ALA-GLU-VAL-ARG-ALA-VAL-GLN-GLU-ILE-LYS-PRO-GLY-GLU-GLU-VAL-PHE-THR-SER-TYR-ILE-ASP-LEU-LEU-TYR-PRO-THR-GLU-ASP-ARG-ASN-ASP-ARG-LEU-ARG-ASP-SER-TYR-PHE-PHE-THR-CYS-GLU-CYS-GLN-GLU-CYS-THR-THR-LYS-ASP-LYS-ASP-LYS-ALA-LYS-VAL-GLU-ILE-ARG-LYS-LEU-SER-ASP-PRO-PRO-LYS-ALA-GLU-ALA-ILE-ARG-ASP-MET-VAL-ARG-TYR-ALA-ARG-ASN-VAL-ILE-GLU-GLU-PHE-ARG-ARG-ALA-LYS-HIS-TYR-LYS-SER-PRO-SER-GLU-LEU-LEU-GLU-ILE-CYS-GLU-LEU-SER-GLN-GLU-LYS-MET-SER-SER-VAL-PHE-GLU-ASP-SER-ASN-VAL-TYR-MET-LEU-HIS-MET-MET-TYR-GLN-ALA-MET-GLY-VAL-CYS-LEU-TYR-MET-GLN-ASP-TRP-GLU-GLY-ALA-LEU-GLN-TYR-GLY-GLN-LYS-ILE-ILE-LYS-PRO-TYR-SER-LYS-HIS-TYR-PRO-LEU-TYR-SER-LEU-ASN-VAL-ALA-SER-MET-TRP-LEU-LYS-LEU-GLY-ARG-LEU-TYR-MET-GLY-LEU-GLU-HIS-LYS-ALA-ALA-GLY-GLU-LYS-ALA-LEU-LYS-LYS-ALA-ILE-ALA-ILE-MET-GLU-VAL-ALA-HIS-GLY-LYS-ASP-HIS-PRO-TYR-ILE-SER-GLU-ILE-LYS-GLN-GLU-ILE-GLU-SER-HIS,SER-SER-HIS-LEU-LYS-SER-LYS-LYS-GLY-GLN-SER-THR-SER,433,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CCCC[NH3+])CO,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,I,A,,0,1,433,13,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,0.8787717819213867,0.7348253726959229,89.68147277832031,85.81026458740234,0.395779401063919,0.9563743472099304,0.9161844849586488,0.8609201312065125,0.8512011170387268,0.7033016085624695,SSHLKSKKGQSTS,Low,"(5.31, 5.463]",train
3SHB,protein-peptide,Q96T88,GPLGSPEFSGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRND,ARTKQTARKSTG,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY,77,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=0.93uM,6.031517,6.03,1,A,A,1,A,A,0,,B,A,,1,1,77,12,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.951850414276123,0.8401702046394348,84.0623779296875,84.9465103149414,0.4414899051189422,0.7692408561706543,0.7763654589653015,0.7832976579666138,0.8061148524284363,0.7245181798934937,ARTKQTARKSTG,Low,"(5.959, 6.097]",train
3SHV,protein-peptide,P16104 Q8NEM0,MGHHHHHHMKSGRGKKPTRTLVMTSMPSEKQNVVIQVVDKLKGFSIAPDVCETTTHVLSGKPLRTLNVLLGIARGCWVLSYDWVLWSLELGHWISEEPFELSHHFPAAPLCRSECHLSAGPYRGTLFADQPAMFVSPASSPPVAKLCELVHLCGGRVSQVPRQASIVIGPYSGKKKATVKYLSEKWVLDSITQHKVCAPENYLLSQ,KKATQASQEY,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-MET-LYS-SER-GLY-ARG-GLY-LYS-LYS-PRO-THR-ARG-THR-LEU-VAL-MET-THR-SER-MET-PRO-SER-GLU-LYS-GLN-ASN-VAL-VAL-ILE-GLN-VAL-VAL-ASP-LYS-LEU-LYS-GLY-PHE-SER-ILE-ALA-PRO-ASP-VAL-CYS-GLU-THR-THR-THR-HIS-VAL-LEU-SER-GLY-LYS-PRO-LEU-ARG-THR-LEU-ASN-VAL-LEU-LEU-GLY-ILE-ALA-ARG-GLY-CYS-TRP-VAL-LEU-SER-TYR-ASP-TRP-VAL-LEU-TRP-SER-LEU-GLU-LEU-GLY-HIS-TRP-ILE-SER-GLU-GLU-PRO-PHE-GLU-LEU-SER-HIS-HIS-PHE-PRO-ALA-ALA-PRO-LEU-CYS-ARG-SER-GLU-CYS-HIS-LEU-SER-ALA-GLY-PRO-TYR-ARG-GLY-THR-LEU-PHE-ALA-ASP-GLN-PRO-ALA-MET-PHE-VAL-SER-PRO-ALA-SER-SER-PRO-PRO-VAL-ALA-LYS-LEU-CYS-GLU-LEU-VAL-HIS-LEU-CYS-GLY-GLY-ARG-VAL-SER-GLN-VAL-PRO-ARG-GLN-ALA-SER-ILE-VAL-ILE-GLY-PRO-TYR-SER-GLY-LYS-LYS-LYS-ALA-THR-VAL-LYS-TYR-LEU-SER-GLU-LYS-TRP-VAL-LEU-ASP-SER-ILE-THR-GLN-HIS-LYS-VAL-CYS-ALA-PRO-GLU-ASN-TYR-LEU-LEU-SER-GLN,LYS-LYS-ALA-THR-GLN-ALA-SEP-GLN-GLU-TYR,206,10,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])C)COP(O)(O)O,Kd=0.22uM,6.657577,6.66,1,A,A,1,A,A,0,,C,A,,1,1,206,10,0,C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.930860161781311,0.884163498878479,86.84417724609375,84.50141143798828,0.3653786778450012,0.6211352348327637,0.8909423351287842,0.8748026490211487,0.8627146482467651,0.8349260091781616,KKATQASQEY,Low,"(6.523, 6.696]",train
3SO6,protein-peptide,D3ZAR1 P01130,MEGMVFSLKYLGMTLVERPKGEELSAAAVKRIVATAKASGKKLQKVTLKVSPRGIILTDSLTSQLIENVSIYRISYCTADKMHDKVFAYIAQSQQNESLECHAFLCTKRKVAQAVTLTVAQAFKVAFEFWQVSLVPR,NSINFDNPVYQKTT,MET-GLU-GLY-MET-VAL-PHE-SER-LEU-LYS-TYR-LEU-GLY-MET-THR-LEU-VAL-GLU-ARG-PRO-LYS-GLY-GLU-GLU-LEU-SER-ALA-ALA-ALA-VAL-LYS-ARG-ILE-VAL-ALA-THR-ALA-LYS-ALA-SER-GLY-LYS-LYS-LEU-GLN-LYS-VAL-THR-LEU-LYS-VAL-SER-PRO-ARG-GLY-ILE-ILE-LEU-THR-ASP-SER-LEU-THR-SER-GLN-LEU-ILE-GLU-ASN-VAL-SER-ILE-TYR-ARG-ILE-SER-TYR-CYS-THR-ALA-ASP-LYS-MET-HIS-ASP-LYS-VAL-PHE-ALA-TYR-ILE-ALA-GLN-SER-GLN-GLN-ASN-GLU-SER-LEU-GLU-CYS-HIS-ALA-PHE-LEU-CYS-THR-LYS-ARG-LYS-VAL-ALA-GLN-ALA-VAL-THR-LEU-THR-VAL-ALA-GLN-ALA-PHE-LYS-VAL-ALA-PHE-GLU-PHE-TRP-GLN-VAL-SER-LEU-VAL-PRO-ARG,ASN-SER-ILE-ASN-PHE-ASP-ASN-PRO-VAL-TYR-GLN-LYS-THR-THR,137,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(=C)C)NC(=O)[C@@H]1C=CCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CO)[NH3+])CC(=O)N)Cc1ccccc1)CC(=O)O)CC(=O)N)Cc1ccc(cc1)O)CCC(=O)N,Kd=4.1uM,5.387216,5.39,1,A,A,1,A,A,0,,Q,A,,1,1,137,14,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.977944314479828,0.8351154923439026,97.20963287353516,93.96934509277344,0.3078293204307556,0.6823874115943909,0.9425782561302184,0.8753340840339661,0.9288387298583984,0.7976885437965393,NSINFDNPVYQKTT,Low,"(5.31, 5.463]",train
3SW9,protein-peptide,O88508 Q9H9B1,NSQVWSALQMSKALQDSAPDRPSPVERIVSRDIARGYERIPIPCVNAVDSEPCPSNYKYVSQNCVTSPMNIDRNITHLQYCVCIDDCSSSNCMCGQLSMRCWYDKDGRLLPEFNMAEPPLIFECNHACSCWRNCRNRVVQNGLRARLQLYRTRDMGWGVRSLQDIPPGTFVCEYVGELISDSEADVREEDSYLFDLDNKDGEVYCIDARFYGNVSRFINHHCEPNLVPVRVFMAHQDLRFPRIAFFSTRLIEAGEQLGFDYGERFWDIKGKLFSCRCGSPKCRHS,SATARKVGRPGR,ASN-SER-GLN-VAL-TRP-SER-ALA-LEU-GLN-MET-SER-LYS-ALA-LEU-GLN-ASP-SER-ALA-PRO-ASP-ARG-PRO-SER-PRO-VAL-GLU-ARG-ILE-VAL-SER-ARG-ASP-ILE-ALA-ARG-GLY-TYR-GLU-ARG-ILE-PRO-ILE-PRO-CYS-VAL-ASN-ALA-VAL-ASP-SER-GLU-PRO-CYS-PRO-SER-ASN-TYR-LYS-TYR-VAL-SER-GLN-ASN-CYS-VAL-THR-SER-PRO-MET-ASN-ILE-ASP-ARG-ASN-ILE-THR-HIS-LEU-GLN-TYR-CYS-VAL-CYS-ILE-ASP-ASP-CYS-SER-SER-SER-ASN-CYS-MET-CYS-GLY-GLN-LEU-SER-MET-ARG-CYS-TRP-TYR-ASP-LYS-ASP-GLY-ARG-LEU-LEU-PRO-GLU-PHE-ASN-MET-ALA-GLU-PRO-PRO-LEU-ILE-PHE-GLU-CYS-ASN-HIS-ALA-CYS-SER-CYS-TRP-ARG-ASN-CYS-ARG-ASN-ARG-VAL-VAL-GLN-ASN-GLY-LEU-ARG-ALA-ARG-LEU-GLN-LEU-TYR-ARG-THR-ARG-ASP-MET-GLY-TRP-GLY-VAL-ARG-SER-LEU-GLN-ASP-ILE-PRO-PRO-GLY-THR-PHE-VAL-CYS-GLU-TYR-VAL-GLY-GLU-LEU-ILE-SER-ASP-SER-GLU-ALA-ASP-VAL-ARG-GLU-GLU-ASP-SER-TYR-LEU-PHE-ASP-LEU-ASP-ASN-LYS-ASP-GLY-GLU-VAL-TYR-CYS-ILE-ASP-ALA-ARG-PHE-TYR-GLY-ASN-VAL-SER-ARG-PHE-ILE-ASN-HIS-HIS-CYS-GLU-PRO-ASN-LEU-VAL-PRO-VAL-ARG-VAL-PHE-MET-ALA-HIS-GLN-ASP-LEU-ARG-PHE-PRO-ARG-ILE-ALA-PHE-PHE-SER-THR-ARG-LEU-ILE-GLU-ALA-GLY-GLU-GLN-LEU-GLY-PHE-ASP-TYR-GLY-GLU-ARG-PHE-TRP-ASP-ILE-LYS-GLY-LYS-LEU-PHE-SER-CYS-ARG-CYS-GLY-SER-PRO-LYS-CYS-ARG-HIS-SER,SER-ALA-THR-ALA-ARG-LYS-VAL-GLY-ARG-PRO-GLY-ARG,285,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])C)CCC[NH+]=C(N)N,Kd=4.2uM,5.376751,5.38,1,A,A,1,A,A,0,,P,A,,1,1,285,12,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O,0.8745198845863342,0.8354403376579285,86.08419799804688,82.5991439819336,0.5065038800239563,0.7714396715164185,0.8616175055503845,0.8482816815376282,0.8083009719848633,0.7817914485931396,SATARKVGRPGR,Low,"(5.31, 5.463]",train
3SZM,protein-peptide,P16104 Q8NEM0,GHMSGRGKKPTRTLVMTSMPSEKQNVVIQVVDKLKGFSIAPDVCETTTHVLSGKPLRTLNVLLGIARGCWVLSYDWVLWSLELGHWISEEPFELSHHFPAAPLCRSECHLSAGPYRGTLFADQPVMFVSPASSPPVAKLCELVHLCGGRVSQVPRQASIVIGPYSGKKKATVKYLSEKWVLDSITQHKVCAPENYLLSQ,KKATQASQEY,GLY-HIS-MET-SER-GLY-ARG-GLY-LYS-LYS-PRO-THR-ARG-THR-LEU-VAL-MET-THR-SER-MET-PRO-SER-GLU-LYS-GLN-ASN-VAL-VAL-ILE-GLN-VAL-VAL-ASP-LYS-LEU-LYS-GLY-PHE-SER-ILE-ALA-PRO-ASP-VAL-CYS-GLU-THR-THR-THR-HIS-VAL-LEU-SER-GLY-LYS-PRO-LEU-ARG-THR-LEU-ASN-VAL-LEU-LEU-GLY-ILE-ALA-ARG-GLY-CYS-TRP-VAL-LEU-SER-TYR-ASP-TRP-VAL-LEU-TRP-SER-LEU-GLU-LEU-GLY-HIS-TRP-ILE-SER-GLU-GLU-PRO-PHE-GLU-LEU-SER-HIS-HIS-PHE-PRO-ALA-ALA-PRO-LEU-CYS-ARG-SER-GLU-CYS-HIS-LEU-SER-ALA-GLY-PRO-TYR-ARG-GLY-THR-LEU-PHE-ALA-ASP-GLN-PRO-VAL-MET-PHE-VAL-SER-PRO-ALA-SER-SER-PRO-PRO-VAL-ALA-LYS-LEU-CYS-GLU-LEU-VAL-HIS-LEU-CYS-GLY-GLY-ARG-VAL-SER-GLN-VAL-PRO-ARG-GLN-ALA-SER-ILE-VAL-ILE-GLY-PRO-TYR-SER-GLY-LYS-LYS-LYS-ALA-THR-VAL-LYS-TYR-LEU-SER-GLU-LYS-TRP-VAL-LEU-ASP-SER-ILE-THR-GLN-HIS-LYS-VAL-CYS-ALA-PRO-GLU-ASN-TYR-LEU-LEU-SER-GLN,LYS-LYS-ALA-THR-GLN-ALA-SEP-GLN-GLU-TYR,199,10,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])C)COP(O)(O)O,Kd=0.4uM,6.39794,6.4,1,A,A,1,A,A,0,,I,A,,1,1,199,10,0,C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9592769145965576,0.8582821488380432,91.05744171142578,89.34700775146484,0.3188723027706146,0.6245062351226807,0.9375653862953186,0.8925782442092896,0.9048961400985718,0.8245825171470642,KKATQASQEY,Low,"(6.26, 6.398]",train
3T6R,protein-peptide,Q96T88 Q16695,GSAPEFGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECR,ARTKQTA,GLY-SER-ALA-PRO-GLU-PHE-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG,ALA-ARG-THR-LYS-GLN-THR-ALA,72,7,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=2.20uM,5.657577,5.66,1,A,A,1,A,A,0,,D,A,,0,1,72,7,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O,0.9720427393913268,0.9281635284423828,89.34591674804688,91.35821533203124,0.4161258637905121,0.5466241836547852,0.7932472825050354,0.8600506782531738,0.8585137724876404,0.8323444724082947,ARTKQTA,Low,"(5.6, 5.699]",val
3T7G,protein-peptide,P38862 P40344,GSMSSERVLSYAPAFKSFLDTSFFQELSRLKLDVLKLDSTCQPLTVNLDLHNIPKSADQVPLFLTNRSFEKHNNKRTNEVPLQGSIFNFNVLDEFKNLDKQLFLHQRALECWEDGIKDINKCVSFVIISFADLKKYRFYYWLGVPCFQRPSSTVLHVRPEPSLKGLFSKCQKWFDVNYSKWVCILDADDEIVNYDKCIIRKTKVLAIRDTSTMENVPSALTKNFLSVLQYDVPDLIDFKLLIIRQNEGSFALNATFASIDPQSSSSNPDMKVSGWERNVQGKLAPRVVDLS,SIDDIDELIQDMEIKEE,GLY-SER-MET-SER-SER-GLU-ARG-VAL-LEU-SER-TYR-ALA-PRO-ALA-PHE-LYS-SER-PHE-LEU-ASP-THR-SER-PHE-PHE-GLN-GLU-LEU-SER-ARG-LEU-LYS-LEU-ASP-VAL-LEU-LYS-LEU-ASP-SER-THR-CYS-GLN-PRO-LEU-THR-VAL-ASN-LEU-ASP-LEU-HIS-ASN-ILE-PRO-LYS-SER-ALA-ASP-GLN-VAL-PRO-LEU-PHE-LEU-THR-ASN-ARG-SER-PHE-GLU-LYS-HIS-ASN-ASN-LYS-ARG-THR-ASN-GLU-VAL-PRO-LEU-GLN-GLY-SER-ILE-PHE-ASN-PHE-ASN-VAL-LEU-ASP-GLU-PHE-LYS-ASN-LEU-ASP-LYS-GLN-LEU-PHE-LEU-HIS-GLN-ARG-ALA-LEU-GLU-CYS-TRP-GLU-ASP-GLY-ILE-LYS-ASP-ILE-ASN-LYS-CYS-VAL-SER-PHE-VAL-ILE-ILE-SER-PHE-ALA-ASP-LEU-LYS-LYS-TYR-ARG-PHE-TYR-TYR-TRP-LEU-GLY-VAL-PRO-CYS-PHE-GLN-ARG-PRO-SER-SER-THR-VAL-LEU-HIS-VAL-ARG-PRO-GLU-PRO-SER-LEU-LYS-GLY-LEU-PHE-SER-LYS-CYS-GLN-LYS-TRP-PHE-ASP-VAL-ASN-TYR-SER-LYS-TRP-VAL-CYS-ILE-LEU-ASP-ALA-ASP-ASP-GLU-ILE-VAL-ASN-TYR-ASP-LYS-CYS-ILE-ILE-ARG-LYS-THR-LYS-VAL-LEU-ALA-ILE-ARG-ASP-THR-SER-THR-MET-GLU-ASN-VAL-PRO-SER-ALA-LEU-THR-LYS-ASN-PHE-LEU-SER-VAL-LEU-GLN-TYR-ASP-VAL-PRO-ASP-LEU-ILE-ASP-PHE-LYS-LEU-LEU-ILE-ILE-ARG-GLN-ASN-GLU-GLY-SER-PHE-ALA-LEU-ASN-ALA-THR-PHE-ALA-SER-ILE-ASP-PRO-GLN-SER-SER-SER-SER-ASN-PRO-ASP-MET-LYS-VAL-SER-GLY-TRP-GLU-ARG-ASN-VAL-GLN-GLY-LYS-LEU-ALA-PRO-ARG-VAL-VAL-ASP-LEU-SER,SER-ILE-ASP-ASP-ILE-ASP-GLU-LEU-ILE-GLN-ASP-MET-GLU-ILE-LYS-GLU-GLU,291,17,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](CC)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H]([NH3+])C)C)C)CC(C)C)C)CC(=O)O,Kd=6.32uM,5.199283,5.2,1,A,A,1,A,A,0,,C,A,,0,1,291,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)[C@@H](C)CC)C(=O)O)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.8455546498298645,0.6666984558105469,84.06657409667969,82.46565246582031,0.5059012174606323,1.089667558670044,0.8778105974197388,0.8009270429611206,0.8029938340187073,0.633141279220581,SIDDIDELIQDMEIKEE,Low,"(5.105, 5.222]",train
3TG5,protein-peptide,Q9NRG4 P04637,MRAEGLGGLERFCSPGKGRGLRALQPFQVGDLLFSCPAYAYVLTVNERGNHCEYCFTRKEGLSKCGRCKQAFYCNVECQKEDWPMHKLECSPMVVFGENWNPSETVRLTARILAKQKIHPERTPSEKLLAVKEFESHLDKLDNEKKDLIQSDIAALHHFYSKHLGFPDNDSLVVLFAQVNCNGFTIEDEELSHLGSAIFPDVALMNHSCCPNVIVTYKGTLAEVRAVQEIKPGEEVFTSYIDLLYPTEDRNDRLRDSYFFTCECQECTTKDKDKAKVEIRKLSDPPKAEAIRDMVRYARNVIEEFRRAKHYKSPSELLEICELSQEKMSSVFEDSNVYMLHMMYQAMGVCLYMQDWEGALQYGQKIIKPYSKHYPLYSLNVASMWLKLGRLYMGLEHKAAGEKALKKAIAIMEVAHGKDHPYISEIKQEIESH,HSSHLKSKKGQ,MET-ARG-ALA-GLU-GLY-LEU-GLY-GLY-LEU-GLU-ARG-PHE-CYS-SER-PRO-GLY-LYS-GLY-ARG-GLY-LEU-ARG-ALA-LEU-GLN-PRO-PHE-GLN-VAL-GLY-ASP-LEU-LEU-PHE-SER-CYS-PRO-ALA-TYR-ALA-TYR-VAL-LEU-THR-VAL-ASN-GLU-ARG-GLY-ASN-HIS-CYS-GLU-TYR-CYS-PHE-THR-ARG-LYS-GLU-GLY-LEU-SER-LYS-CYS-GLY-ARG-CYS-LYS-GLN-ALA-PHE-TYR-CYS-ASN-VAL-GLU-CYS-GLN-LYS-GLU-ASP-TRP-PRO-MET-HIS-LYS-LEU-GLU-CYS-SER-PRO-MET-VAL-VAL-PHE-GLY-GLU-ASN-TRP-ASN-PRO-SER-GLU-THR-VAL-ARG-LEU-THR-ALA-ARG-ILE-LEU-ALA-LYS-GLN-LYS-ILE-HIS-PRO-GLU-ARG-THR-PRO-SER-GLU-LYS-LEU-LEU-ALA-VAL-LYS-GLU-PHE-GLU-SER-HIS-LEU-ASP-LYS-LEU-ASP-ASN-GLU-LYS-LYS-ASP-LEU-ILE-GLN-SER-ASP-ILE-ALA-ALA-LEU-HIS-HIS-PHE-TYR-SER-LYS-HIS-LEU-GLY-PHE-PRO-ASP-ASN-ASP-SER-LEU-VAL-VAL-LEU-PHE-ALA-GLN-VAL-ASN-CYS-ASN-GLY-PHE-THR-ILE-GLU-ASP-GLU-GLU-LEU-SER-HIS-LEU-GLY-SER-ALA-ILE-PHE-PRO-ASP-VAL-ALA-LEU-MET-ASN-HIS-SER-CYS-CYS-PRO-ASN-VAL-ILE-VAL-THR-TYR-LYS-GLY-THR-LEU-ALA-GLU-VAL-ARG-ALA-VAL-GLN-GLU-ILE-LYS-PRO-GLY-GLU-GLU-VAL-PHE-THR-SER-TYR-ILE-ASP-LEU-LEU-TYR-PRO-THR-GLU-ASP-ARG-ASN-ASP-ARG-LEU-ARG-ASP-SER-TYR-PHE-PHE-THR-CYS-GLU-CYS-GLN-GLU-CYS-THR-THR-LYS-ASP-LYS-ASP-LYS-ALA-LYS-VAL-GLU-ILE-ARG-LYS-LEU-SER-ASP-PRO-PRO-LYS-ALA-GLU-ALA-ILE-ARG-ASP-MET-VAL-ARG-TYR-ALA-ARG-ASN-VAL-ILE-GLU-GLU-PHE-ARG-ARG-ALA-LYS-HIS-TYR-LYS-SER-PRO-SER-GLU-LEU-LEU-GLU-ILE-CYS-GLU-LEU-SER-GLN-GLU-LYS-MET-SER-SER-VAL-PHE-GLU-ASP-SER-ASN-VAL-TYR-MET-LEU-HIS-MET-MET-TYR-GLN-ALA-MET-GLY-VAL-CYS-LEU-TYR-MET-GLN-ASP-TRP-GLU-GLY-ALA-LEU-GLN-TYR-GLY-GLN-LYS-ILE-ILE-LYS-PRO-TYR-SER-LYS-HIS-TYR-PRO-LEU-TYR-SER-LEU-ASN-VAL-ALA-SER-MET-TRP-LEU-LYS-LEU-GLY-ARG-LEU-TYR-MET-GLY-LEU-GLU-HIS-LYS-ALA-ALA-GLY-GLU-LYS-ALA-LEU-LYS-LYS-ALA-ILE-ALA-ILE-MET-GLU-VAL-ALA-HIS-GLY-LYS-ASP-HIS-PRO-TYR-ILE-SER-GLU-ILE-LYS-GLN-GLU-ILE-GLU-SER-HIS,HIS-SER-SER-HIS-LEU-LYS-SER-LYS-LYS-GLY-GLN,433,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CCC(=O)N)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)[NH3+])CC(C)C)CCCC[NH3+])CO,Kd=20uM,4.69897,4.7,1,A,A,1,A,A,0,,B,A,,1,1,433,11,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.8907075524330139,0.7559287548065186,90.29615783691406,86.02903747558594,0.3776479959487915,0.85713791847229,0.9234550595283508,0.8768744468688965,0.8670364022254944,0.7256922721862793,HSSHLKSKKGQ,Low,"(4.606, 4.745]",val
3TL0,protein-peptide,Q06124,GSHMTSRRWFHPNITGVEAENLLLTRGVDGSFLARPSKSNPGDFTLSVRRNGAVTHIKIQNTGDYYDLYGGEKFATLAELVQYYMEHHGQLKEKNGDVIELKYPLNCAD,RLNYAQLWHR,GLY-SER-HIS-MET-THR-SER-ARG-ARG-TRP-PHE-HIS-PRO-ASN-ILE-THR-GLY-VAL-GLU-ALA-GLU-ASN-LEU-LEU-LEU-THR-ARG-GLY-VAL-ASP-GLY-SER-PHE-LEU-ALA-ARG-PRO-SER-LYS-SER-ASN-PRO-GLY-ASP-PHE-THR-LEU-SER-VAL-ARG-ARG-ASN-GLY-ALA-VAL-THR-HIS-ILE-LYS-ILE-GLN-ASN-THR-GLY-ASP-TYR-TYR-ASP-LEU-TYR-GLY-GLY-GLU-LYS-PHE-ALA-THR-LEU-ALA-GLU-LEU-VAL-GLN-TYR-TYR-MET-GLU-HIS-HIS-GLY-GLN-LEU-LYS-GLU-LYS-ASN-GLY-ASP-VAL-ILE-GLU-LEU-LYS-TYR-PRO-LEU-ASN-CYS-ALA-ASP,ARG-LEU-ASN-PTR-ALA-GLN-LEU-TRP-HIS-ARG,109,10,CC(C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(=O)N)Cc1ccc(cc1)OP(O)(O)O)C)C)C,Kd=0.26uM,6.585027,6.59,1,A,A,1,A,A,0,,B,A,,1,1,109,10,0,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)C(Cc1ccc(OP(=O)(O)O)cc1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9398616552352904,0.8151136636734009,95.54420471191406,91.7254867553711,0.3286764323711395,0.7187387943267822,0.9246608018875122,0.86627596616745,0.8911408185958862,0.7908552289009094,RLNYAQLWHR,Low,"(6.523, 6.696]",train
3TSZ,protein-peptide,Q07157 Q9Y624,GSHMILRPSMKLVKFRKGDSVGLRLAGGNDVGIFVAGVLEDSPAAKEGLEEGDQILRVNNVDFTNIIREEAVLFLLDLPKGEEVTILAQKKKDVYRRIVESDVGDSFYIRTHFEYEKESPYGLSFNKGEVFRVVDTLYNGKLGSWLAIRIGKNHKEVERGIIPNKNRAEQLASVQYTLPKTAGGDRADFWRFRGLRSSKRNLRKSREDLSAQPVQTKFPAYERVVLREAGFLRPVTIFGPIADVAREKLAREEPDIYQIAKSEPRDAGTDQRSSGIIRLHTIKQIIDQDKHALLDVTPNAVDRLNYAQWYPIVVFLNPDSKQGVKTMRMRLCPESRKSARKLYERSHKLRKNNHHLFTTTINLNSMNDGWYGALKEAIQQQQNQLVWVSEG,EGEFKQTSSFLV,GLY-SER-HIS-MET-ILE-LEU-ARG-PRO-SER-MET-LYS-LEU-VAL-LYS-PHE-ARG-LYS-GLY-ASP-SER-VAL-GLY-LEU-ARG-LEU-ALA-GLY-GLY-ASN-ASP-VAL-GLY-ILE-PHE-VAL-ALA-GLY-VAL-LEU-GLU-ASP-SER-PRO-ALA-ALA-LYS-GLU-GLY-LEU-GLU-GLU-GLY-ASP-GLN-ILE-LEU-ARG-VAL-ASN-ASN-VAL-ASP-PHE-THR-ASN-ILE-ILE-ARG-GLU-GLU-ALA-VAL-LEU-PHE-LEU-LEU-ASP-LEU-PRO-LYS-GLY-GLU-GLU-VAL-THR-ILE-LEU-ALA-GLN-LYS-LYS-LYS-ASP-VAL-TYR-ARG-ARG-ILE-VAL-GLU-SER-ASP-VAL-GLY-ASP-SER-PHE-TYR-ILE-ARG-THR-HIS-PHE-GLU-TYR-GLU-LYS-GLU-SER-PRO-TYR-GLY-LEU-SER-PHE-ASN-LYS-GLY-GLU-VAL-PHE-ARG-VAL-VAL-ASP-THR-LEU-TYR-ASN-GLY-LYS-LEU-GLY-SER-TRP-LEU-ALA-ILE-ARG-ILE-GLY-LYS-ASN-HIS-LYS-GLU-VAL-GLU-ARG-GLY-ILE-ILE-PRO-ASN-LYS-ASN-ARG-ALA-GLU-GLN-LEU-ALA-SER-VAL-GLN-TYR-THR-LEU-PRO-LYS-THR-ALA-GLY-GLY-ASP-ARG-ALA-ASP-PHE-TRP-ARG-PHE-ARG-GLY-LEU-ARG-SER-SER-LYS-ARG-ASN-LEU-ARG-LYS-SER-ARG-GLU-ASP-LEU-SER-ALA-GLN-PRO-VAL-GLN-THR-LYS-PHE-PRO-ALA-TYR-GLU-ARG-VAL-VAL-LEU-ARG-GLU-ALA-GLY-PHE-LEU-ARG-PRO-VAL-THR-ILE-PHE-GLY-PRO-ILE-ALA-ASP-VAL-ALA-ARG-GLU-LYS-LEU-ALA-ARG-GLU-GLU-PRO-ASP-ILE-TYR-GLN-ILE-ALA-LYS-SER-GLU-PRO-ARG-ASP-ALA-GLY-THR-ASP-GLN-ARG-SER-SER-GLY-ILE-ILE-ARG-LEU-HIS-THR-ILE-LYS-GLN-ILE-ILE-ASP-GLN-ASP-LYS-HIS-ALA-LEU-LEU-ASP-VAL-THR-PRO-ASN-ALA-VAL-ASP-ARG-LEU-ASN-TYR-ALA-GLN-TRP-TYR-PRO-ILE-VAL-VAL-PHE-LEU-ASN-PRO-ASP-SER-LYS-GLN-GLY-VAL-LYS-THR-MET-ARG-MET-ARG-LEU-CYS-PRO-GLU-SER-ARG-LYS-SER-ALA-ARG-LYS-LEU-TYR-GLU-ARG-SER-HIS-LYS-LEU-ARG-LYS-ASN-ASN-HIS-HIS-LEU-PHE-THR-THR-THR-ILE-ASN-LEU-ASN-SER-MET-ASN-ASP-GLY-TRP-TYR-GLY-ALA-LEU-LYS-GLU-ALA-ILE-GLN-GLN-GLN-GLN-ASN-GLN-LEU-VAL-TRP-VAL-SER-GLU-GLY,GLU-GLY-GLU-PHE-LYS-GLN-THR-SER-SER-PHE-LEU-VAL,391,12,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(C)C)Cc1ccccc1)CO)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccccc1)C)CCC(=O)N,Kd=35uM,4.455932,4.46,1,A,A,1,A,A,0,,B,A,,1,1,391,12,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)[C@@H](C)O,0.8548405170440674,0.7140679955482483,68.79834747314453,66.94819641113281,0.646143913269043,1.4440770149230957,0.7655448913574219,0.7239609956741333,0.7949684262275696,0.6428607702255249,EGEFKQTSSFLV,Low,"(4.319, 4.456]",train
3TWU,protein-peptide,Q9H2K2 Q07820,GAMGSGNSEADRQLLEAAKAGDVETVKKLCTVQSVNCRDIEGRQSTPLHFAAGYNRVSVVEYLLQHGADVHAKDKGGLVPLHNACSYGHYEVAELLVKHGAVVNVADLWKFTPLHEAAAKGKYEICKLLLQHGADPTKKNRDGNTPLDLVKDGDTDIQDLLRGDAAL,SRRVARPPPIGAEVPN,GLY-ALA-MET-GLY-SER-GLY-ASN-SER-GLU-ALA-ASP-ARG-GLN-LEU-LEU-GLU-ALA-ALA-LYS-ALA-GLY-ASP-VAL-GLU-THR-VAL-LYS-LYS-LEU-CYS-THR-VAL-GLN-SER-VAL-ASN-CYS-ARG-ASP-ILE-GLU-GLY-ARG-GLN-SER-THR-PRO-LEU-HIS-PHE-ALA-ALA-GLY-TYR-ASN-ARG-VAL-SER-VAL-VAL-GLU-TYR-LEU-LEU-GLN-HIS-GLY-ALA-ASP-VAL-HIS-ALA-LYS-ASP-LYS-GLY-GLY-LEU-VAL-PRO-LEU-HIS-ASN-ALA-CYS-SER-TYR-GLY-HIS-TYR-GLU-VAL-ALA-GLU-LEU-LEU-VAL-LYS-HIS-GLY-ALA-VAL-VAL-ASN-VAL-ALA-ASP-LEU-TRP-LYS-PHE-THR-PRO-LEU-HIS-GLU-ALA-ALA-ALA-LYS-GLY-LYS-TYR-GLU-ILE-CYS-LYS-LEU-LEU-LEU-GLN-HIS-GLY-ALA-ASP-PRO-THR-LYS-LYS-ASN-ARG-ASP-GLY-ASN-THR-PRO-LEU-ASP-LEU-VAL-LYS-ASP-GLY-ASP-THR-ASP-ILE-GLN-ASP-LEU-LEU-ARG-GLY-ASP-ALA-ALA-LEU,SER-ARG-ARG-VAL-ALA-ARG-PRO-PRO-PRO-ILE-GLY-ALA-GLU-VAL-PRO-XSN,167,16,CC[C@@H]([C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N)CC(=O)O)C(C)C)CCC(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])C)CCC[NH+]=C(N)N)C,Kd=2.4uM,5.619789,5.62,1,A,A,1,A,A,0,,B,A,,1,1,167,16,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NC(CC(=O)O)C(N)=O)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)NC(CC(=O)O)C(N)=O)C(=O)N[C@H](C(=O)O)C(C)C,0.9457497596740724,0.7733314633369446,93.5493392944336,92.80397033691406,0.3064410984516144,0.6803913712501526,0.9421293139457704,0.856764554977417,0.8920100927352905,0.7524731755256653,SRRVARPPPIGAEVPN,Low,"(5.6, 5.699]",val
3TWX,protein-peptide,Q9H2K2,GAMGNSEADRQLLEAAKAGDVETVKKLCTVQSVNCRDIEGRQSTPLHFAAGYNRVSVVEYLLQHGADVHAKDKGGLVPLHNACSYGHYEVAELLVKHGAVVNVADLWKFTPLHEAAAKGKYEICKLLLQHGADPTKKNRDGNTPLDLVKDGDTDIQDLLRGDAAL,LPHLQRESPDGQSFRS,GLY-ALA-MET-GLY-ASN-SER-GLU-ALA-ASP-ARG-GLN-LEU-LEU-GLU-ALA-ALA-LYS-ALA-GLY-ASP-VAL-GLU-THR-VAL-LYS-LYS-LEU-CYS-THR-VAL-GLN-SER-VAL-ASN-CYS-ARG-ASP-ILE-GLU-GLY-ARG-GLN-SER-THR-PRO-LEU-HIS-PHE-ALA-ALA-GLY-TYR-ASN-ARG-VAL-SER-VAL-VAL-GLU-TYR-LEU-LEU-GLN-HIS-GLY-ALA-ASP-VAL-HIS-ALA-LYS-ASP-LYS-GLY-GLY-LEU-VAL-PRO-LEU-HIS-ASN-ALA-CYS-SER-TYR-GLY-HIS-TYR-GLU-VAL-ALA-GLU-LEU-LEU-VAL-LYS-HIS-GLY-ALA-VAL-VAL-ASN-VAL-ALA-ASP-LEU-TRP-LYS-PHE-THR-PRO-LEU-HIS-GLU-ALA-ALA-ALA-LYS-GLY-LYS-TYR-GLU-ILE-CYS-LYS-LEU-LEU-LEU-GLN-HIS-GLY-ALA-ASP-PRO-THR-LYS-LYS-ASN-ARG-ASP-GLY-ASN-THR-PRO-LEU-ASP-LEU-VAL-LYS-ASP-GLY-ASP-THR-ASP-ILE-GLN-ASP-LEU-LEU-ARG-GLY-ASP-ALA-ALA-LEU,LEU-PRO-HIS-LEU-GLN-ARG-GLU-SER-PRO-ASP-GLY-GLN-SER-PHE-ARG-SET,165,16,OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CO)CCC[NH+]=C(N)N)Cc1ccccc1)CO)CCC(=O)N)CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC[NH+]=C(N)N)CCC(=O)O,Kd=5.5uM,5.259637,5.26,1,A,A,1,A,A,0,,C,A,dimer,1,1,165,16,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CO)C(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(CO)C(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)O,0.8860406875610352,0.7582277655601501,94.93269348144533,93.89165496826172,0.3494589030742645,0.7685648202896118,0.9295689463615416,0.853242814540863,0.8199099898338318,0.7344740033149719,LPHLQRESPDGQSFRS,Low,"(5.222, 5.31]",val
3TZD,protein-peptide,P10412 Q13185,LYFQGEFVVEKVLDRRVVNGKVEYFLKWKGFTDADNTWEPEENLDCPELIEAFLNSQK,YPVKKKARKSAGAAKRKAS,LEU-TYR-PHE-GLN-GLY-GLU-PHE-VAL-VAL-GLU-LYS-VAL-LEU-ASP-ARG-ARG-VAL-VAL-ASN-GLY-LYS-VAL-GLU-TYR-PHE-LEU-LYS-TRP-LYS-GLY-PHE-THR-ASP-ALA-ASP-ASN-THR-TRP-GLU-PRO-GLU-GLU-ASN-LEU-ASP-CYS-PRO-GLU-LEU-ILE-GLU-ALA-PHE-LEU-ASN-SER-GLN-LYS,TYR-PRO-VAL-LYS-LYS-LYS-ALA-ARG-MLY-SER-ALA-GLY-ALA-ALA-LYS-ARG-LYS-ALA-SER,58,19,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)C)CO)CCCC[NH+](C)C)CCC[NH+]=C(N)N)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CCCC[NH3+])CCCC[NH3+],Kd=52uM,4.283997,4.28,1,A,A,1,A,A,0,,T,A,,1,1,58,19,0,CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O,0.9896625876426696,0.6335339546203613,88.69812774658203,84.1822280883789,0.3674000203609466,0.878699779510498,0.8508384227752686,0.7082238793373108,0.7808620929718018,0.6148614883422852,YPVKKKARKSAGAAKRKAS,Low,"(4.155, 4.319]",train
3UAL,protein-peptide,P58340 P62258,MDDREDLVYQAKLAEQAERYDEMVESMKKVAGMDVELTVEERNLLSVAYKNVIGARRASWRIISSIEQKEENKGGEDKLKMIREYRQMVETELKLICCDILDVLDKHLIPAANTGESKVFYYKMKGDYHRYLAEFATGNDRKEAAENSLVAYKAASDIAMTELPPTHPIRLGLALNFSVFYYEILNSPDRACRLAKAAFDDAIAELDTLSEESYKDSTLIMQLLRDNLTLWT,MIRSFSEPFGRDLL,MET-ASP-ASP-ARG-GLU-ASP-LEU-VAL-TYR-GLN-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-GLU-MET-VAL-GLU-SER-MET-LYS-LYS-VAL-ALA-GLY-MET-ASP-VAL-GLU-LEU-THR-VAL-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-ILE-GLY-ALA-ARG-ARG-ALA-SER-TRP-ARG-ILE-ILE-SER-SER-ILE-GLU-GLN-LYS-GLU-GLU-ASN-LYS-GLY-GLY-GLU-ASP-LYS-LEU-LYS-MET-ILE-ARG-GLU-TYR-ARG-GLN-MET-VAL-GLU-THR-GLU-LEU-LYS-LEU-ILE-CYS-CYS-ASP-ILE-LEU-ASP-VAL-LEU-ASP-LYS-HIS-LEU-ILE-PRO-ALA-ALA-ASN-THR-GLY-GLU-SER-LYS-VAL-PHE-TYR-TYR-LYS-MET-LYS-GLY-ASP-TYR-HIS-ARG-TYR-LEU-ALA-GLU-PHE-ALA-THR-GLY-ASN-ASP-ARG-LYS-GLU-ALA-ALA-GLU-ASN-SER-LEU-VAL-ALA-TYR-LYS-ALA-ALA-SER-ASP-ILE-ALA-MET-THR-GLU-LEU-PRO-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-ASP-ARG-ALA-CYS-ARG-LEU-ALA-LYS-ALA-ALA-PHE-ASP-ASP-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,MET-ILE-ARG-SER-PHE-SEP-GLU-PRO-PHE-GLY-ARG-ASP-LEU-LEU,232,14,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)O)Cc1ccccc1)CCC(=O)O)COP(O)(O)O)Cc1ccccc1)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Kd=1.55uM,5.809668,5.81,1,A,A,1,A,A,0,,P,A,,1,1,232,14,0,CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(COP(=O)(O)O)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9294082522392272,0.749299168586731,92.5189208984375,89.03834533691406,0.3376347720623016,0.8335283994674683,0.9351574182510376,0.8662126660346985,0.8924018740653992,0.7200707197189331,MIRSFSEPFGRDLL,Low,"(5.699, 5.821]",train
3UAT,protein-peptide,Q62696 D3ZCE5,GPGSEFSQKRSLYVRALFDYDKTKDSGLPSQGLNFKFGDILHVINASDDEWWQARQVTPDGESDEVGVIPSKRRVEKKERARLKTVKFNSKVLSYEPVNQQEVNYTRPVIILGPMKDRVNDDLISEFPDKFGSCVPHTTRPKRDYEVDGRDYHFVTSREQMEKDIQEHKFIEAGQYNNHLYGTSVQSVRAVAEKGKHCILDVSGNAIKRLQIAQLYPISIFIKPKSMENIMEMNKRLTDEQARKTFERAVRLEQEFTEHFTAIVQGDTLEDIYNQVKQIIEEQSGPYIWVPAKEKL,GRRHSMENLELMKLTPEK,GLY-PRO-GLY-SER-GLU-PHE-SER-GLN-LYS-ARG-SER-LEU-TYR-VAL-ARG-ALA-LEU-PHE-ASP-TYR-ASP-LYS-THR-LYS-ASP-SER-GLY-LEU-PRO-SER-GLN-GLY-LEU-ASN-PHE-LYS-PHE-GLY-ASP-ILE-LEU-HIS-VAL-ILE-ASN-ALA-SER-ASP-ASP-GLU-TRP-TRP-GLN-ALA-ARG-GLN-VAL-THR-PRO-ASP-GLY-GLU-SER-ASP-GLU-VAL-GLY-VAL-ILE-PRO-SER-LYS-ARG-ARG-VAL-GLU-LYS-LYS-GLU-ARG-ALA-ARG-LEU-LYS-THR-VAL-LYS-PHE-ASN-SER-LYS-VAL-LEU-SER-TYR-GLU-PRO-VAL-ASN-GLN-GLN-GLU-VAL-ASN-TYR-THR-ARG-PRO-VAL-ILE-ILE-LEU-GLY-PRO-MET-LYS-ASP-ARG-VAL-ASN-ASP-ASP-LEU-ILE-SER-GLU-PHE-PRO-ASP-LYS-PHE-GLY-SER-CYS-VAL-PRO-HIS-THR-THR-ARG-PRO-LYS-ARG-ASP-TYR-GLU-VAL-ASP-GLY-ARG-ASP-TYR-HIS-PHE-VAL-THR-SER-ARG-GLU-GLN-MET-GLU-LYS-ASP-ILE-GLN-GLU-HIS-LYS-PHE-ILE-GLU-ALA-GLY-GLN-TYR-ASN-ASN-HIS-LEU-TYR-GLY-THR-SER-VAL-GLN-SER-VAL-ARG-ALA-VAL-ALA-GLU-LYS-GLY-LYS-HIS-CYS-ILE-LEU-ASP-VAL-SER-GLY-ASN-ALA-ILE-LYS-ARG-LEU-GLN-ILE-ALA-GLN-LEU-TYR-PRO-ILE-SER-ILE-PHE-ILE-LYS-PRO-LYS-SER-MET-GLU-ASN-ILE-MET-GLU-MET-ASN-LYS-ARG-LEU-THR-ASP-GLU-GLN-ALA-ARG-LYS-THR-PHE-GLU-ARG-ALA-VAL-ARG-LEU-GLU-GLN-GLU-PHE-THR-GLU-HIS-PHE-THR-ALA-ILE-VAL-GLN-GLY-ASP-THR-LEU-GLU-ASP-ILE-TYR-ASN-GLN-VAL-LYS-GLN-ILE-ILE-GLU-GLU-GLN-SER-GLY-PRO-TYR-ILE-TRP-VAL-PRO-ALA-LYS-GLU-LYS-LEU,GLY-ARG-ARG-HIS-SEP-MET-GLU-ASN-LEU-GLU-LEU-MET-LYS-LEU-THR-PRO-GLU-LYS,296,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCC[NH+]=C(N)N)Cc1nc[nH]c1)COP(O)(O)O)CCSC)C)CC(=O)N)CC(C)C)CCC(=O)O)CC(C)C)CCSC,Kd=0.22uM,6.657577,6.66,1,A,A,1,A,A,0,,B,A,,1,1,296,18,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O,0.6902463436126709,0.717244565486908,80.50829315185547,81.06417083740234,0.5684632658958435,1.0064150094985962,0.8337501287460327,0.8045516610145569,0.6046091914176941,0.6806374192237854,GRRHSMENLELMKLTPEK,Low,"(6.523, 6.696]",train
3UEO,protein-peptide,Q14676 Q92547,GPLGSEEGLFSQKSFLVLGFSNENESNIANIIKENAGKIMSLLSRTVADYAVVPLLGCEVEATVGEVVTNTWLVTCIDYQTLFDPKSNPLFTPVPVMTGMTPLEDCVISFSQCAGAEKESLTFLANLLGASVQEYFVRKSNAKKGMFASTHLILKERGGSKYEAAKKWNLPAVTIAWLLETARTGKRADESHFLIENSTKEER,GFIDSDTDVEEE,GLY-PRO-LEU-GLY-SER-GLU-GLU-GLY-LEU-PHE-SER-GLN-LYS-SER-PHE-LEU-VAL-LEU-GLY-PHE-SER-ASN-GLU-ASN-GLU-SER-ASN-ILE-ALA-ASN-ILE-ILE-LYS-GLU-ASN-ALA-GLY-LYS-ILE-MET-SER-LEU-LEU-SER-ARG-THR-VAL-ALA-ASP-TYR-ALA-VAL-VAL-PRO-LEU-LEU-GLY-CYS-GLU-VAL-GLU-ALA-THR-VAL-GLY-GLU-VAL-VAL-THR-ASN-THR-TRP-LEU-VAL-THR-CYS-ILE-ASP-TYR-GLN-THR-LEU-PHE-ASP-PRO-LYS-SER-ASN-PRO-LEU-PHE-THR-PRO-VAL-PRO-VAL-MET-THR-GLY-MET-THR-PRO-LEU-GLU-ASP-CYS-VAL-ILE-SER-PHE-SER-GLN-CYS-ALA-GLY-ALA-GLU-LYS-GLU-SER-LEU-THR-PHE-LEU-ALA-ASN-LEU-LEU-GLY-ALA-SER-VAL-GLN-GLU-TYR-PHE-VAL-ARG-LYS-SER-ASN-ALA-LYS-LYS-GLY-MET-PHE-ALA-SER-THR-HIS-LEU-ILE-LEU-LYS-GLU-ARG-GLY-GLY-SER-LYS-TYR-GLU-ALA-ALA-LYS-LYS-TRP-ASN-LEU-PRO-ALA-VAL-THR-ILE-ALA-TRP-LEU-LEU-GLU-THR-ALA-ARG-THR-GLY-LYS-ARG-ALA-ASP-GLU-SER-HIS-PHE-LEU-ILE-GLU-ASN-SER-THR-LYS-GLU-GLU-ARG,GLY-PHE-ILE-ASP-SEP-ASP-TPO-ASP-VAL-GLU-GLU-GLU,203,12,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])COP(O)(O)O)CC(=O)O)CC(=O)O,Kd=94uM,4.026872,4.03,1,A,A,1,A,A,0,,E,A,dimer,0,1,203,12,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](NC(=O)C(COP(=O)(O)O)NC(=O)C[C@H](NC(=O)C(NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)C(C)OP(=O)(O)O)C(=O)O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O,0.8298295140266418,0.7710028886795044,89.0285873413086,87.39962005615234,0.427766740322113,0.758712112903595,0.8724361658096313,0.8520953059196472,0.7842941284179688,0.7507297992706299,GFIDSDTDVEEE,Low,"(3.924, 4.155]",train
3UI2,protein-peptide,P37107 O22265,GEVNKIIGSRTAGEGAMEYLIEWKDGHSPSWVPSSYIAADVVSEYETPWWTAARKADEQALSQLLEDRDVDAVDENGRTALLFVAGLGSDKCVRLLAEAGADLDHRDMRGGLTALHMAAGYVRPEVVEALVELGADIEVEDERGLTALELAREILKTTPKGNPMQFGRRIGLEKVINVLEGQVFEYAEVDEIVEKRGKGKDVEYLVRWKDGGDCEWVKGVHVAEDVAKDYEDGLEYAVAESVIG,QKAPPGTARRKRK,GLY-GLU-VAL-ASN-LYS-ILE-ILE-GLY-SER-ARG-THR-ALA-GLY-GLU-GLY-ALA-MET-GLU-TYR-LEU-ILE-GLU-TRP-LYS-ASP-GLY-HIS-SER-PRO-SER-TRP-VAL-PRO-SER-SER-TYR-ILE-ALA-ALA-ASP-VAL-VAL-SER-GLU-TYR-GLU-THR-PRO-TRP-TRP-THR-ALA-ALA-ARG-LYS-ALA-ASP-GLU-GLN-ALA-LEU-SER-GLN-LEU-LEU-GLU-ASP-ARG-ASP-VAL-ASP-ALA-VAL-ASP-GLU-ASN-GLY-ARG-THR-ALA-LEU-LEU-PHE-VAL-ALA-GLY-LEU-GLY-SER-ASP-LYS-CYS-VAL-ARG-LEU-LEU-ALA-GLU-ALA-GLY-ALA-ASP-LEU-ASP-HIS-ARG-ASP-MET-ARG-GLY-GLY-LEU-THR-ALA-LEU-HIS-MET-ALA-ALA-GLY-TYR-VAL-ARG-PRO-GLU-VAL-VAL-GLU-ALA-LEU-VAL-GLU-LEU-GLY-ALA-ASP-ILE-GLU-VAL-GLU-ASP-GLU-ARG-GLY-LEU-THR-ALA-LEU-GLU-LEU-ALA-ARG-GLU-ILE-LEU-LYS-THR-THR-PRO-LYS-GLY-ASN-PRO-MET-GLN-PHE-GLY-ARG-ARG-ILE-GLY-LEU-GLU-LYS-VAL-ILE-ASN-VAL-LEU-GLU-GLY-GLN-VAL-PHE-GLU-TYR-ALA-GLU-VAL-ASP-GLU-ILE-VAL-GLU-LYS-ARG-GLY-LYS-GLY-LYS-ASP-VAL-GLU-TYR-LEU-VAL-ARG-TRP-LYS-ASP-GLY-GLY-ASP-CYS-GLU-TRP-VAL-LYS-GLY-VAL-HIS-VAL-ALA-GLU-ASP-VAL-ALA-LYS-ASP-TYR-GLU-ASP-GLY-LEU-GLU-TYR-ALA-VAL-ALA-GLU-SER-VAL-ILE-GLY,GLN-LYS-ALA-PRO-PRO-GLY-THR-ALA-ARG-ARG-LYS-ARG-LYS,244,13,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCCC[NH3+])C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=0.43uM,6.366532,6.37,1,A,A,1,A,A,0,,B,A,,1,1,244,13,0,C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O,0.9256327748298644,0.7083501219749451,81.3216552734375,70.88676452636719,0.3971539139747619,0.9019562005996704,0.8440320491790771,0.7669582366943359,0.902258574962616,0.675767719745636,QKAPPGTARRKRK,Low,"(6.26, 6.398]",train
3UIG,protein-peptide,O15392 P68431,GMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFKELEGWEPDDDPIEEHKKHSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,ARTKQTARKSTGGKA,GLY-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-LYS-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-HIS-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-ARG-TPO-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,143,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=4.8uM,5.318759,5.32,1,A,A,1,A,A,0,,P,A,,1,1,143,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.8386085033416748,0.7282349467277527,84.34557342529297,85.98712158203125,0.4030214250087738,0.8409051299095154,0.8355333209037781,0.7906842231750488,0.6930164694786072,0.6558043956756592,ARTKQTARKSTGGKA,Low,"(5.31, 5.463]",train
3UIH,protein-peptide,Q9NR28 O15392,GMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFKELEGWEPDDDPIEEHKKHSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,AVPIAQKSEPHSLSS,GLY-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-LYS-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-HIS-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-VAL-PRO-ILE-ALA-GLN-LYS-SER-GLU-PRO-HIS-SER-LEU-SER-SER,143,15,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)C,Kd=121uM,3.917215,3.92,1,A,A,1,A,A,0,,P,A,,1,1,143,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8213142156600952,0.7433464527130127,82.183837890625,85.33541107177734,0.4041407406330108,0.8296113610267639,0.831844687461853,0.7750202417373657,0.7079220414161682,0.6436447501182556,AVPIAQKSEPHSLSS,Low,"(3.548, 3.924]",val
3UII,protein-peptide,O15392 P68431,GMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFKELEGWEPDDDPIEEHKKHSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,ARTKQTARKS,GLY-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-LYS-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-HIS-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER,143,10,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=10.0uM,5.0,5.0,1,A,A,1,A,A,0,,P,A,,1,1,143,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.908888041973114,0.8772593140602112,83.9541244506836,86.99292755126953,0.3622176945209503,0.6681028604507446,0.8752888441085815,0.8506771326065063,0.8233335614204407,0.7877510190010071,ARTKQTARKS,Low,"(4.866, 5.014]",train
3UIJ,protein-peptide,Q9NR28 O15392,GMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFYELEGWEPDDDPIEEHKKWSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,AVPIAQKSEPHSLSS,GLY-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-TYR-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-TRP-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-VAL-PRO-ILE-ALA-GLN-LYS-SER-GLU-PRO-HIS-SER-LEU-SER-SER,143,15,CC[C@@H]([C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)[C@@H]([NH3+])C)C,Kd=19.8uM,4.703335,4.7,1,A,A,1,A,A,0,,P,A,,1,1,143,15,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O,0.8273913264274597,0.7678645849227905,82.5278091430664,83.90020751953125,0.3949946761131286,0.8205651640892029,0.8396359086036682,0.7860116362571716,0.7096149921417236,0.67154461145401,AVPIAQKSEPHSLSS,Low,"(4.606, 4.745]",train
3UIK,protein-peptide,O15392 P68431,GMGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFYELEGWEPDDDPIEEHKKWSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,ARTKQTARKS,GLY-MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-TYR-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-TRP-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER,143,10,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=10.6uM,4.974694,4.97,1,A,A,1,A,A,0,,P,A,,1,1,143,10,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.935482144355774,0.8358983397483826,86.0987777709961,86.3650894165039,0.3706608116626739,0.6720149517059326,0.8576890826225281,0.8463905453681946,0.8282963633537292,0.7764571309089661,ARTKQTARKS,Low,"(4.866, 5.014]",train
3UNN,protein-peptide,Q14676,SNVEPVGRLHIFSGAHGPEKDFPLHLGKNVVGRMPDCSVALPFPSISKQHAEIEILAWDKAPILRDCGSLNGTQILRPPKVLSPGVSHRLRDQELILFADLLCQYHRLDVSLP,MEDTQAID,SER-ASN-VAL-GLU-PRO-VAL-GLY-ARG-LEU-HIS-ILE-PHE-SER-GLY-ALA-HIS-GLY-PRO-GLU-LYS-ASP-PHE-PRO-LEU-HIS-LEU-GLY-LYS-ASN-VAL-VAL-GLY-ARG-MET-PRO-ASP-CYS-SER-VAL-ALA-LEU-PRO-PHE-PRO-SER-ILE-SER-LYS-GLN-HIS-ALA-GLU-ILE-GLU-ILE-LEU-ALA-TRP-ASP-LYS-ALA-PRO-ILE-LEU-ARG-ASP-CYS-GLY-SER-LEU-ASN-GLY-THR-GLN-ILE-LEU-ARG-PRO-PRO-LYS-VAL-LEU-SER-PRO-GLY-VAL-SER-HIS-ARG-LEU-ARG-ASP-GLN-GLU-LEU-ILE-LEU-PHE-ALA-ASP-LEU-LEU-CYS-GLN-TYR-HIS-ARG-LEU-ASP-VAL-SER-LEU-PRO,MET-GLU-ASP-TPO-GLN-ALA-ILE-ASP,113,8,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)[C@H](CC)C)C)CCC(=O)N)CC(=O)O)CCC(=O)O)[NH3+],Kd=40uM,4.39794,4.4,1,A,A,1,A,A,0,,B,A,,1,1,113,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O,CC[C@H](C)[C@H](NC(=O)C[C@H](N)C(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)NC(C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCSC)C(=O)O)C(=O)O)C(=O)O)C(C)OP(=O)(O)O,0.8909891843795776,0.7866628170013428,94.80257415771484,92.92528533935548,0.3175727725028991,0.6228268146514893,0.9349167346954346,0.8703041076660156,0.8386849164962769,0.7657524943351746,MEDTQAID,Low,"(4.319, 4.456]",train
3UPV,protein-peptide,P15705 P22202,SMKAEEARLEGKEYFTKSDWPNAVKAYTEMIKRAPEDARGYSNRAAALAKLMSFPEAIADCNKAIEKDPNFVRAYIRKATAQIAVKEYASALETLDAARTKDAEVNNGSSAREIDQLYYKASQQRF,PTVEEVD,SER-MET-LYS-ALA-GLU-GLU-ALA-ARG-LEU-GLU-GLY-LYS-GLU-TYR-PHE-THR-LYS-SER-ASP-TRP-PRO-ASN-ALA-VAL-LYS-ALA-TYR-THR-GLU-MET-ILE-LYS-ARG-ALA-PRO-GLU-ASP-ALA-ARG-GLY-TYR-SER-ASN-ARG-ALA-ALA-ALA-LEU-ALA-LYS-LEU-MET-SER-PHE-PRO-GLU-ALA-ILE-ALA-ASP-CYS-ASN-LYS-ALA-ILE-GLU-LYS-ASP-PRO-ASN-PHE-VAL-ARG-ALA-TYR-ILE-ARG-LYS-ALA-THR-ALA-GLN-ILE-ALA-VAL-LYS-GLU-TYR-ALA-SER-ALA-LEU-GLU-THR-LEU-ASP-ALA-ALA-ARG-THR-LYS-ASP-ALA-GLU-VAL-ASN-ASN-GLY-SER-SER-ALA-ARG-GLU-ILE-ASP-GLN-LEU-TYR-TYR-LYS-ALA-SER-GLN-GLN-ARG-PHE,PRO-THR-VAL-GLU-GLU-VAL-ASP,126,7,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]1[NH2+]CCC1,Kd=5uM,5.30103,5.3,1,A,A,1,A,A,0,,B,A,,1,1,126,7,0,CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O,0.9549851417541504,0.8810043931007385,98.23356628417967,97.29801940917967,0.278164267539978,0.481321781873703,0.9489729404449464,0.926743745803833,0.9235934019088744,0.8695695400238037,PTVEEVD,Low,"(5.222, 5.31]",val
3UVK,protein-peptide,O14686 P61964,GAMGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GCARSEPKILT,GLY-ALA-MET-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLY-CYS-ALA-ARG-SER-GLU-PRO-LYS-ILE-LEU-THR,318,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(C)C)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CS)C)CCC[NH+]=C(N)N)CO)CCC(=O)O,Kd=0.16uM,6.79588,6.8,1,A,A,1,A,A,0,,B,A,,1,1,318,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@H](C(=O)O)[C@@H](C)O,0.8675183057785034,0.8109400868415833,94.1322250366211,92.17459869384766,0.365503191947937,0.6458112001419067,0.9154629707336426,0.8891795873641968,0.8061400055885315,0.7599336504936218,GCARSEPKILT,Low,"(6.696, 6.824]",val
3UVL,protein-peptide,P61964 Q8NEZ4,GAMGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GSARAEPKMSA,GLY-ALA-MET-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLY-SER-ALA-ARG-ALA-GLU-PRO-LYS-MET-SER-ALA,318,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[NH3+])CO)C)CCC[NH+]=C(N)N)C)CCC(=O)O,Kd=2.03uM,5.692504,5.69,1,A,A,1,A,A,0,,B,A,,1,1,318,11,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)O,CSCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](C)C(=O)O,0.8923641443252563,0.8224337697029114,93.59380340576172,92.57696533203124,0.3506567180156708,0.6177911162376404,0.9223082065582277,0.8952858448028564,0.8354859948158264,0.7747396230697632,GSARAEPKMSA,Low,"(5.6, 5.699]",train
3UVM,protein-peptide,Q9UMN6 P61964,GAMGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GAARAEVYLR,GLY-ALA-MET-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLY-ALA-ALA-ARG-ALA-GLU-VAL-TYR-LEU-ARG,318,10,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)CC(C)C)Cc1ccc(cc1)O)C(C)C)CCC(=O)O)C)CCC[NH+]=C(N)N)C)C,Kd=0.03uM,7.522879,7.52,1,A,A,1,A,A,0,,B,A,,1,1,318,10,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)O)C(C)C,0.9224241375923156,0.7860089540481567,94.50425720214844,91.9945068359375,0.3400027155876159,0.7186725735664368,0.9247786402702332,0.8814224004745483,0.8741982579231262,0.7307090759277344,GAARAEVYLR,Moderate,"(7.268, 7.523]",train
3UVN,protein-peptide,O15047 P61964,GAMGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GSARSEGYYPI,GLY-ALA-MET-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLY-SER-ALA-ARG-SER-GLU-GLY-TYR-TYR-PRO-ILE,318,11,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C)CO)CCC[NH+]=C(N)N)C)CO,Kd=0.26uM,6.585027,6.59,1,A,A,1,A,A,0,,B,A,,1,1,318,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O,0.9228503704071044,0.8098040223121643,93.93464660644533,92.32930755615234,0.3440405428409576,0.6465123295783997,0.9238914847373962,0.8899902701377869,0.8731979727745056,0.7583109140396118,GSARSEGYYPI,Low,"(6.523, 6.696]",val
3UVO,protein-peptide,Q9UPS6 P61964,GAMGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,GCARSEGFYTI,GLY-ALA-MET-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLY-CYS-ALA-ARG-SER-GLU-GLY-PHE-TYR-THR-ILE,318,11,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)C)C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)[NH3+])C)CCC[NH+]=C(N)N,Kd=0.10uM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,318,11,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CN)[C@@H](C)O)C(=O)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(=O)NCC(=O)O)C(=O)O)[C@@H](C)O,0.9247661232948304,0.7995894551277161,94.1695327758789,92.1916275024414,0.3464021384716034,0.7085416316986084,0.9219614267349244,0.8870725035667419,0.874175488948822,0.7482374906539917,GCARSEGFYTI,Moderate,"(6.824, 7.049]",train
3UVU,protein-peptide,P39748 P52293,MHHHHHHSSGLVPRGSGMKETAAAKFERQHMDSPDLGTDDDDKAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,SAKRKEPEPKGSTKKKAKT,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-GLY-MET-LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LYS-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,SER-ALA-LYS-ARG-LYS-GLU-PRO-GLU-PRO-LYS-GLY-SER-THR-LYS-LYS-LYS-ALA-LYS-THR,510,19,[NH3+]CCCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CCCC[NH3+])C)CCCC[NH3+])CCCC[NH3+])CCCC[NH3+])[C@H](O)C)CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])C)CCCC[NH3+])CCC[NH+]=C(N)N)CCCC[NH3+])CCC(=O)O)CCC(=O)O,Kd=42nM,7.376751,7.38,1,A,A,1,A,A,0,,B,A,,1,1,510,19,0,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O,0.9135775566101074,0.824309229850769,79.92463684082031,80.2919921875,0.4597440063953399,0.9470821619033812,0.8249607086181641,0.8006142377853394,0.8211287260055542,0.7346446514129639,SAKRKEPEPKGSTKKKAKT,Moderate,"(7.268, 7.523]",train
3UVW,protein-peptide,O60885 P62805,SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,SGRGKGGKGLGY,SER-MET-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,SER-GLY-ARG-GLY-ALY-GLY-GLY-ALY-GLY-LEU-GLY-TYR,127,12,OC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)C)CC(C)C)CCCCNC(=O)C)CCCCNC(=O)C)CCC[NH+]=C(N)N)[NH3+],Kd=6.8uM,5.167491,5.17,1,A,A,1,A,A,0,,B,A,,1,1,127,12,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)C(CCCCNC(C)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,0.8202321529388428,0.7027662396430969,92.7047348022461,93.16048431396484,0.3623050451278686,0.7848486304283142,0.9287675619125366,0.8307107090950012,0.7391414642333984,0.6707800626754761,SGRGKGGKGLGY,Low,"(5.105, 5.222]",val
3UVX,protein-peptide,O60885 P62805,SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,GKGGAKRHRKV,SER-MET-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,GLY-ALY-GLY-GLY-ALA-ALY-ARG-HIS-ARG-LYS-VAL,127,11,[NH3+]CC(=O)N[C@H]([C@H]([NH2+]CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC)CCCCNC(=O)C)C)O)CCCCNC(=O)C,Kd=46.1uM,4.336299,4.34,1,A,A,1,A,A,0,,B,A,,1,1,127,11,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)C(CCCCNC(C)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)C(C)C)C(=O)NCC(=O)O,0.8607224225997925,0.737903892993927,93.29235076904295,93.58758544921876,0.3435522317886352,0.7293123602867126,0.9322589635849,0.8506249785423279,0.7930194735527039,0.7097235918045044,GKGGAKRHRKV,Low,"(4.319, 4.456]",train
3UW9,protein-peptide,O60885 P62805,SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKPGDDIVLMAEALEKLFLQKINELPTEE,GKGLGKGGAKR,SER-MET-ASN-PRO-PRO-PRO-PRO-GLU-THR-SER-ASN-PRO-ASN-LYS-PRO-LYS-ARG-GLN-THR-ASN-GLN-LEU-GLN-TYR-LEU-LEU-ARG-VAL-VAL-LEU-LYS-THR-LEU-TRP-LYS-HIS-GLN-PHE-ALA-TRP-PRO-PHE-GLN-GLN-PRO-VAL-ASP-ALA-VAL-LYS-LEU-ASN-LEU-PRO-ASP-TYR-TYR-LYS-ILE-ILE-LYS-THR-PRO-MET-ASP-MET-GLY-THR-ILE-LYS-LYS-ARG-LEU-GLU-ASN-ASN-TYR-TYR-TRP-ASN-ALA-GLN-GLU-CYS-ILE-GLN-ASP-PHE-ASN-THR-MET-PHE-THR-ASN-CYS-TYR-ILE-TYR-ASN-LYS-PRO-GLY-ASP-ASP-ILE-VAL-LEU-MET-ALA-GLU-ALA-LEU-GLU-LYS-LEU-PHE-LEU-GLN-LYS-ILE-ASN-GLU-LEU-PRO-THR-GLU-GLU,GLY-ALY-GLY-LEU-GLY-ALY-GLY-GLY-ALA-LYS-ARG,127,11,CC(=O)NCCCC[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(=O)O)CCCCNC(=O)C)CC(C)C)[NH3+],Kd=27.4uM,4.562249,4.56,1,A,A,1,A,A,0,,E,A,dimer,1,1,127,11,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NC(CCCCNC(C)=O)C(=O)NCC(=O)O,CC(=O)NCCCCC(NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NC(CCCCNC(C)=O)C(=O)NCC(=O)O,0.8657003045082092,0.6648458242416382,94.20989990234376,93.13928985595705,0.350400298833847,0.8145977854728699,0.9329451322555542,0.8237645626068115,0.7990701794624329,0.6251161694526672,GKGLGKGGAKR,Low,"(4.456, 4.606]",train
3UX0,protein-peptide,Q9NPC2 P31947,AMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKGPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,KRRKSV,ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CSO-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-GLY-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,LYS-ARG-ARG-LYS-SEP-VAL,235,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=0.55uM,6.259637,6.26,1,A,A,1,A,A,0,,P,A,,0,1,235,6,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)O,CC(C)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9400675296783448,0.8792594075202942,92.1573715209961,92.66738891601562,0.3112681210041046,0.5179182291030884,0.9479247331619264,0.9291199445724488,0.9225430488586426,0.8667942881584167,KRRKSV,Low,"(6.097, 6.26]",val
3UXG,protein-peptide,O14593 P56524,GDSLSIHQLAAQGELDQLKEHLRKGDNLVNKPDERGFTPLIWASAFGEIETVRFLLEWGADPHILAKERESALSLASTGGYTDIVGLLLERDVDINIYDWNGGTPLLYAVHGNHVKCVEALLARGADLTTEADSGYTPMDLAVALGYRKVQQVIENHILKLFQSNLVPADPE,LPLYTSPSLPNITLGLP,GLY-ASP-SER-LEU-SER-ILE-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-LEU-ASP-GLN-LEU-LYS-GLU-HIS-LEU-ARG-LYS-GLY-ASP-ASN-LEU-VAL-ASN-LYS-PRO-ASP-GLU-ARG-GLY-PHE-THR-PRO-LEU-ILE-TRP-ALA-SER-ALA-PHE-GLY-GLU-ILE-GLU-THR-VAL-ARG-PHE-LEU-LEU-GLU-TRP-GLY-ALA-ASP-PRO-HIS-ILE-LEU-ALA-LYS-GLU-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-SER-THR-GLY-GLY-TYR-THR-ASP-ILE-VAL-GLY-LEU-LEU-LEU-GLU-ARG-ASP-VAL-ASP-ILE-ASN-ILE-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-GLU-ALA-LEU-LEU-ALA-ARG-GLY-ALA-ASP-LEU-THR-THR-GLU-ALA-ASP-SER-GLY-TYR-THR-PRO-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-LYS-VAL-GLN-GLN-VAL-ILE-GLU-ASN-HIS-ILE-LEU-LYS-LEU-PHE-GLN-SER-ASN-LEU-VAL-PRO-ALA-ASP-PRO-GLU,LEU-PRO-LEU-TYR-THR-SER-PRO-SER-LEU-PRO-ASN-ILE-THR-LEU-GLY-LEU-PRO,172,17,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CC(C)C)Cc1ccc(cc1)O)CO)CO)CC(C)C)CC(=O)N)C,Kd=109uM,3.962574,3.96,1,A,A,1,A,A,0,,B,A,,1,1,172,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.9312663078308104,0.8744312524795532,91.41657257080078,87.60498809814453,0.3573798537254333,0.5593066811561584,0.9139797687530518,0.8926805853843689,0.8429953455924988,0.8335316777229309,LPLYTSPSLPNITLGLP,Low,"(3.924, 4.155]",train
3UZD,protein-peptide,P61981 P56524,MVDREQLVQKARLAEQAERYDDMAAAMKNVTELNEPLSNEERNLLSVAYKNVVGARRSSWRVISSIEQKTSADGNEKKIEMVRAYREKIEKELEAVCQDVLSLLDNYLIKNCSETQYESKVFYLKMKGDYYRYLAEVATGEKRATVVESSEKAYSEAHEISKEHMQPTHPIRLGLALNYSVFYYEIQNAPEQACHLAKTAFDDAIAELDTLNEDSYKDSTLIMQLLRDNLTLWTSDQQDDDGGEGNNS,LPLYTSPSLPNITLGLP,MET-VAL-ASP-ARG-GLU-GLN-LEU-VAL-GLN-LYS-ALA-ARG-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-ALA-MET-LYS-ASN-VAL-THR-GLU-LEU-ASN-GLU-PRO-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-ILE-SER-SER-ILE-GLU-GLN-LYS-THR-SER-ALA-ASP-GLY-ASN-GLU-LYS-LYS-ILE-GLU-MET-VAL-ARG-ALA-TYR-ARG-GLU-LYS-ILE-GLU-LYS-GLU-LEU-GLU-ALA-VAL-CYS-GLN-ASP-VAL-LEU-SER-LEU-LEU-ASP-ASN-TYR-LEU-ILE-LYS-ASN-CYS-SER-GLU-THR-GLN-TYR-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-GLU-LYS-ARG-ALA-THR-VAL-VAL-GLU-SER-SER-GLU-LYS-ALA-TYR-SER-GLU-ALA-HIS-GLU-ILE-SER-LYS-GLU-HIS-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-TYR-SER-VAL-PHE-TYR-TYR-GLU-ILE-GLN-ASN-ALA-PRO-GLU-GLN-ALA-CYS-HIS-LEU-ALA-LYS-THR-ALA-PHE-ASP-ASP-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-ASN-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-GLN-GLN-ASP-ASP-ASP-GLY-GLY-GLU-GLY-ASN-ASN-SER,LEU-PRO-LEU-TYR-THR-SER-PRO-SEP-LEU-PRO-ASN-ILE-THR-LEU-GLY-LEU-PRO,248,17,CCC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)[NH3+])COP(O)(O)O)CC(C)C)CC(=O)N,Kd=9uM,5.045757,5.05,1,A,A,1,A,A,0,,B,A,,1,1,248,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,0.8855249285697937,0.7663446068763733,84.99986267089844,83.7690200805664,0.3984951674938202,0.8202557563781738,0.8991624712944031,0.8478710651397705,0.8184362649917603,0.7207614183425903,LPLYTSPSLPNITLGLP,Low,"(5.014, 5.105]",train
3V2O,protein-peptide,P98158 Q9H9E1,MHHHHHHSSRENLYFQGANSLSVHQLAAQGEMLYLATRIEQENVINHTDEEGFTPLMWAAAHGQIAVVEFLLQNGADPQLLGKGRESALSLACSKGYTDIVKMLLDCGVDVNEYDWNGGTPLLYAVHGNHVKCVKMLLESGADPTIETDSGYNSMDLAVALGYRSVQQVIESHLLKLLQNIKE,HYRKTGSLLPTLPKLPSLS,MET-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-ARG-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ALA-ASN-SER-LEU-SER-VAL-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-MET-LEU-TYR-LEU-ALA-THR-ARG-ILE-GLU-GLN-GLU-ASN-VAL-ILE-ASN-HIS-THR-ASP-GLU-GLU-GLY-PHE-THR-PRO-LEU-MET-TRP-ALA-ALA-ALA-HIS-GLY-GLN-ILE-ALA-VAL-VAL-GLU-PHE-LEU-LEU-GLN-ASN-GLY-ALA-ASP-PRO-GLN-LEU-LEU-GLY-LYS-GLY-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-CYS-SER-LYS-GLY-TYR-THR-ASP-ILE-VAL-LYS-MET-LEU-LEU-ASP-CYS-GLY-VAL-ASP-VAL-ASN-GLU-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-LYS-MET-LEU-LEU-GLU-SER-GLY-ALA-ASP-PRO-THR-ILE-GLU-THR-ASP-SER-GLY-TYR-ASN-SER-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-SER-VAL-GLN-GLN-VAL-ILE-GLU-SER-HIS-LEU-LEU-LYS-LEU-LEU-GLN-ASN-ILE-LYS-GLU,HIS-TYR-ARG-LYS-THR-GLY-SER-LEU-LEU-PRO-THR-LEU-PRO-LYS-LEU-PRO-SER-LEU-SER,183,19,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])C)CC(C)C)CCCC[NH3+])CC(C)C,Kd=4.9uM,5.309804,5.31,1,A,A,1,A,A,0,,B,A,,1,1,183,19,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,0.8976768255233765,0.7993635535240173,86.31684112548828,81.84332275390625,0.4124060869216919,0.7174349427223206,0.8729607462882996,0.8376188278198242,0.8110340237617493,0.7522314786911011,HYRKTGSLLPTLPKLPSLS,Low,"(5.222, 5.31]",train
3V2X,protein-peptide,P98158 Q9H9E1,GANSLSVHQLAAQGEMLYLATRIEQENVINHTDEEGFTPLMWAAAHGQIAVVEFLLQNGADPQLLGKGRESALSLACSKGYTDIVKMLLDCGVDVNEYDWNGGTPLLYAVHGNHVKCVKMLLESGADPTIETDSGYNSMDLAVALGYRSVQQVIESHLLKLLQNIKE,LLPTLPKLPSL,GLY-ALA-ASN-SER-LEU-SER-VAL-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-MET-LEU-TYR-LEU-ALA-THR-ARG-ILE-GLU-GLN-GLU-ASN-VAL-ILE-ASN-HIS-THR-ASP-GLU-GLU-GLY-PHE-THR-PRO-LEU-MET-TRP-ALA-ALA-ALA-HIS-GLY-GLN-ILE-ALA-VAL-VAL-GLU-PHE-LEU-LEU-GLN-ASN-GLY-ALA-ASP-PRO-GLN-LEU-LEU-GLY-LYS-GLY-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-CYS-SER-LYS-GLY-TYR-THR-ASP-ILE-VAL-LYS-MET-LEU-LEU-ASP-CYS-GLY-VAL-ASP-VAL-ASN-GLU-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-LYS-MET-LEU-LEU-GLU-SER-GLY-ALA-ASP-PRO-THR-ILE-GLU-THR-ASP-SER-GLY-TYR-ASN-SER-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-SER-VAL-GLN-GLN-VAL-ILE-GLU-SER-HIS-LEU-LEU-LYS-LEU-LEU-GLN-ASN-ILE-LYS-GLU,LEU-LEU-PRO-THR-LEU-PRO-LYS-LEU-PRO-SER-LEU,167,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CO)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CC(C)C,Kd=4.5uM,5.346787,5.35,1,A,A,1,A,A,0,,B,A,,1,1,167,11,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)O,0.9208922386169434,0.8466858267784119,95.31231689453124,92.20149230957033,0.3241673111915588,0.5488673448562622,0.9427476525306702,0.9044577479362488,0.876804769039154,0.8322427868843079,LLPTLPKLPSL,Low,"(5.31, 5.463]",train
3V30,protein-peptide,O14593 P48382,GDSLSIHQLAAQGELDQLKEHLRKGDNLVNKPDERGFTPLIWASAFGEIETVRFLLEWGADPHILAKERESALSLASTGGYTDIVGLLLERDVDINIYDWNGGTPLLYAVRGNHVKCVEALLARGADLTTEADSGYTPMDLAVALGYRKVQQVIENHILKLFQSNLVPADPE,KTLVSMPPLPGLDLKGS,GLY-ASP-SER-LEU-SER-ILE-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-LEU-ASP-GLN-LEU-LYS-GLU-HIS-LEU-ARG-LYS-GLY-ASP-ASN-LEU-VAL-ASN-LYS-PRO-ASP-GLU-ARG-GLY-PHE-THR-PRO-LEU-ILE-TRP-ALA-SER-ALA-PHE-GLY-GLU-ILE-GLU-THR-VAL-ARG-PHE-LEU-LEU-GLU-TRP-GLY-ALA-ASP-PRO-HIS-ILE-LEU-ALA-LYS-GLU-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-SER-THR-GLY-GLY-TYR-THR-ASP-ILE-VAL-GLY-LEU-LEU-LEU-GLU-ARG-ASP-VAL-ASP-ILE-ASN-ILE-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-ARG-GLY-ASN-HIS-VAL-LYS-CYS-VAL-GLU-ALA-LEU-LEU-ALA-ARG-GLY-ALA-ASP-LEU-THR-THR-GLU-ALA-ASP-SER-GLY-TYR-THR-PRO-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-LYS-VAL-GLN-GLN-VAL-ILE-GLU-ASN-HIS-ILE-LEU-LYS-LEU-PHE-GLN-SER-ASN-LEU-VAL-PRO-ALA-ASP-PRO-GLU,LYS-THR-LEU-VAL-SER-MET-PRO-PRO-LEU-PRO-GLY-LEU-ASP-LEU-LYS-GLY-SER,172,17,CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CO)C)CC(C)C)CC(=O)O)CC(C)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CC(C)C)CO,Kd=184uM,3.735182,3.74,1,A,A,1,A,A,0,,B,A,,1,1,172,17,0,CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C,CSCC[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)[C@@H](C)O)C(C)C,0.963837742805481,0.883249819278717,92.9408187866211,89.03823852539062,0.3300607800483703,0.5633949637413025,0.9300571084022522,0.895382821559906,0.8763834238052368,0.8402456045150757,KTLVSMPPLPGLDLKGS,Low,"(3.548, 3.924]",train
3V31,protein-peptide,Q9H9E1 P56524,GANSLSVHQLAAQGEMLYLATRIEQENVINHTDEEGFTPLMWAAAHGQIAVVEFLLQNGADPQLLGKGRESALSLACSKGYTDIVKMLLDCGVDVNEYDWNGGTPLLYAVHGNHVKCVKMLLESGADPTIETDSGYNSMDLAVALGYRSVQQVIESHLLKLLQNIKE,LPLYTSPSLPNITLGLP,GLY-ALA-ASN-SER-LEU-SER-VAL-HIS-GLN-LEU-ALA-ALA-GLN-GLY-GLU-MET-LEU-TYR-LEU-ALA-THR-ARG-ILE-GLU-GLN-GLU-ASN-VAL-ILE-ASN-HIS-THR-ASP-GLU-GLU-GLY-PHE-THR-PRO-LEU-MET-TRP-ALA-ALA-ALA-HIS-GLY-GLN-ILE-ALA-VAL-VAL-GLU-PHE-LEU-LEU-GLN-ASN-GLY-ALA-ASP-PRO-GLN-LEU-LEU-GLY-LYS-GLY-ARG-GLU-SER-ALA-LEU-SER-LEU-ALA-CYS-SER-LYS-GLY-TYR-THR-ASP-ILE-VAL-LYS-MET-LEU-LEU-ASP-CYS-GLY-VAL-ASP-VAL-ASN-GLU-TYR-ASP-TRP-ASN-GLY-GLY-THR-PRO-LEU-LEU-TYR-ALA-VAL-HIS-GLY-ASN-HIS-VAL-LYS-CYS-VAL-LYS-MET-LEU-LEU-GLU-SER-GLY-ALA-ASP-PRO-THR-ILE-GLU-THR-ASP-SER-GLY-TYR-ASN-SER-MET-ASP-LEU-ALA-VAL-ALA-LEU-GLY-TYR-ARG-SER-VAL-GLN-GLN-VAL-ILE-GLU-SER-HIS-LEU-LEU-LYS-LEU-LEU-GLN-ASN-ILE-LYS-GLU,ACE-LEU-PRO-LEU-TYR-THR-SER-PRO-SER-LEU-PRO-ASN-ILE-THR-LEU-GLY-LEU-PRO,167,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CC(C)C)CC(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)C)CC(C)C)CC(C)C)Cc1ccc(cc1)O)CO)CO)CC(C)C)CC(=O)N)C,Kd=1.6uM,5.79588,5.8,1,A,A,1,A,A,0,,B,A,,1,1,167,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,0.9352225065231324,0.77663254737854,93.16471099853516,89.70433044433594,0.34456267952919,0.6605591177940369,0.9343142509460448,0.8581946492195129,0.8641179800033569,0.756242036819458,LPLYTSPSLPNITLGLP,Low,"(5.699, 5.821]",train
3V43,protein-peptide,Q92794 P68431,HMEPIPICSFCLGTKEQNREKKPEELISCADCGNSGHPSCLKFSPELTVRVKALRWQCIECKTCSSCRDQGKNADNMLFCDSCDRGFHMECCDPPLTRMPKGMWICQICRPR,ARTKQTARKSTGGKAPRK,HIS-MET-GLU-PRO-ILE-PRO-ILE-CYS-SER-PHE-CYS-LEU-GLY-THR-LYS-GLU-GLN-ASN-ARG-GLU-LYS-LYS-PRO-GLU-GLU-LEU-ILE-SER-CYS-ALA-ASP-CYS-GLY-ASN-SER-GLY-HIS-PRO-SER-CYS-LEU-LYS-PHE-SER-PRO-GLU-LEU-THR-VAL-ARG-VAL-LYS-ALA-LEU-ARG-TRP-GLN-CYS-ILE-GLU-CYS-LYS-THR-CYS-SER-SER-CYS-ARG-ASP-GLN-GLY-LYS-ASN-ALA-ASP-ASN-MET-LEU-PHE-CYS-ASP-SER-CYS-ASP-ARG-GLY-PHE-HIS-MET-GLU-CYS-CYS-ASP-PRO-PRO-LEU-THR-ARG-MET-PRO-LYS-GLY-MET-TRP-ILE-CYS-GLN-ILE-CYS-ARG-PRO-ARG,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-ALY-ALA-PRO-ARG-LYS,112,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=23.3uM,4.632644,4.63,1,A,A,1,A,A,0,,Q,A,,1,1,112,18,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CC(=O)NCCCCC(NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.959808588027954,0.6973952054977417,87.67924499511719,88.90026092529297,0.3280580639839172,0.8636586666107178,0.9109681248664856,0.7844430208206177,0.8854801654815674,0.6756332516670227,ARTKQTARKSTGGKAPRK,Low,"(4.606, 4.745]",train
3VA4,protein-peptide,Q5PSV9 O96017,MGSSHHHHHHSSGLVPRGSHMEPIGQLRLFSGTHGPERDFPLYLGKNVVGRSPDCSVALPFPSISKQHAVIEISAWNKAPILQDCGSLNGTQIVKPPRVLPPGVSHRLRDQELILFADFPCQYHRLDVPPPL,LETVSTQELYS,MET-GLY-SER-SER-HIS-HIS-HIS-HIS-HIS-HIS-SER-SER-GLY-LEU-VAL-PRO-ARG-GLY-SER-HIS-MET-GLU-PRO-ILE-GLY-GLN-LEU-ARG-LEU-PHE-SER-GLY-THR-HIS-GLY-PRO-GLU-ARG-ASP-PHE-PRO-LEU-TYR-LEU-GLY-LYS-ASN-VAL-VAL-GLY-ARG-SER-PRO-ASP-CYS-SER-VAL-ALA-LEU-PRO-PHE-PRO-SER-ILE-SER-LYS-GLN-HIS-ALA-VAL-ILE-GLU-ILE-SER-ALA-TRP-ASN-LYS-ALA-PRO-ILE-LEU-GLN-ASP-CYS-GLY-SER-LEU-ASN-GLY-THR-GLN-ILE-VAL-LYS-PRO-PRO-ARG-VAL-LEU-PRO-PRO-GLY-VAL-SER-HIS-ARG-LEU-ARG-ASP-GLN-GLU-LEU-ILE-LEU-PHE-ALA-ASP-PHE-PRO-CYS-GLN-TYR-HIS-ARG-LEU-ASP-VAL-PRO-PRO-PRO-LEU,LEU-GLU-THR-VAL-SER-TPO-GLN-GLU-LEU-TYR-SER,132,11,OC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)Cc1ccc(cc1)O)CC(C)C)CCC(=O)O)CCC(=O)N)NC(=O)[C@H](C(C)C)[NH3+],Kd=40uM,4.39794,4.4,1,A,A,1,A,A,0,,C,A,,0,1,132,11,0,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)O)C(C)OP(=O)(O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C(NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)O)C(C)OP(=O)(O)O)C(C)C)[C@@H](C)O)C(=O)O)C(=O)O,0.8639086484909058,0.7621892690658569,81.06090545654297,78.22608947753906,0.4572112262248993,0.7882617712020874,0.8089950084686279,0.7533882856369019,0.7465181350708008,0.683897078037262,LETVSTQELYS,Low,"(4.319, 4.456]",train
3WDC,protein-peptide,P9WPC9,MFERFTDRARRVVVLAQEEARMLNHNYIGTEHILLGLIHEGEGVAAKSLESLGISLEGVRSQVEEIIGQGQQAPSGHIPFTPRAKKVLELSLREALQLGHNYIGTEHILLGLIREGEGVAAQVLVKLGAELTRVRQQVIQLLSGYLEHHHHHH,WLAFVLV,MET-PHE-GLU-ARG-PHE-THR-ASP-ARG-ALA-ARG-ARG-VAL-VAL-VAL-LEU-ALA-GLN-GLU-GLU-ALA-ARG-MET-LEU-ASN-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-HIS-GLU-GLY-GLU-GLY-VAL-ALA-ALA-LYS-SER-LEU-GLU-SER-LEU-GLY-ILE-SER-LEU-GLU-GLY-VAL-ARG-SER-GLN-VAL-GLU-GLU-ILE-ILE-GLY-GLN-GLY-GLN-GLN-ALA-PRO-SER-GLY-HIS-ILE-PRO-PHE-THR-PRO-ARG-ALA-LYS-LYS-VAL-LEU-GLU-LEU-SER-LEU-ARG-GLU-ALA-LEU-GLN-LEU-GLY-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-ARG-GLU-GLY-GLU-GLY-VAL-ALA-ALA-GLN-VAL-LEU-VAL-LYS-LEU-GLY-ALA-GLU-LEU-THR-ARG-VAL-ARG-GLN-GLN-VAL-ILE-GLN-LEU-LEU-SER-GLY-TYR-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,WRP-WLU-ALA-WPA-VAL-MLE-WVL,153,7,OC[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C(C)C)C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C)[C@@H](c1cn(c2c1cccc2)C([C@H](O)C)(C)C)O)[C@@H](C=C(C)C)C)CC(C)C)C)[C@@H](c1ccccc1)OC)C,Kd=12nM,7.920819,7.92,1,A,A,1,A,A,0,,B,A,,1,1,153,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,0.891363799571991,0.8424039483070374,93.10584259033205,93.2409210205078,0.3377623558044433,0.5692764520645142,0.9323519468307496,0.8928203582763672,0.8537729978561401,0.8134599328041077,WLAFVLV,Moderate,"(7.523, 7.921]",val
3WDD,protein-peptide,P9WPC9,MYERFTDRARRVVVLAQEEARMLNHNYIGTEHILLGLIHEGEGVAAKSLESLGISLEGVRSQVEEIIGQGQQAPSGHIPFTPRAKKVLELSLREALQLGHNYIGTEHILLGLIREGEGVAAQVLVKLGAELTRVRQQVIQLLSGYLEHHHHHH,WLAFVLV,MET-TYR-GLU-ARG-PHE-THR-ASP-ARG-ALA-ARG-ARG-VAL-VAL-VAL-LEU-ALA-GLN-GLU-GLU-ALA-ARG-MET-LEU-ASN-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-HIS-GLU-GLY-GLU-GLY-VAL-ALA-ALA-LYS-SER-LEU-GLU-SER-LEU-GLY-ILE-SER-LEU-GLU-GLY-VAL-ARG-SER-GLN-VAL-GLU-GLU-ILE-ILE-GLY-GLN-GLY-GLN-GLN-ALA-PRO-SER-GLY-HIS-ILE-PRO-PHE-THR-PRO-ARG-ALA-LYS-LYS-VAL-LEU-GLU-LEU-SER-LEU-ARG-GLU-ALA-LEU-GLN-LEU-GLY-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-ARG-GLU-GLY-GLU-GLY-VAL-ALA-ALA-GLN-VAL-LEU-VAL-LYS-LEU-GLY-ALA-GLU-LEU-THR-ARG-VAL-ARG-GLN-GLN-VAL-ILE-GLN-LEU-LEU-SER-GLY-TYR-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,WRP-WLU-ALA-WPA-VAL-MLE-WVL,153,7,OC[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C(C)C)C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C)[C@@H](c1cn(c2c1cccc2)C([C@H](O)C)(C)C)O)[C@@H](C=C(C)C)C)CC(C)C)C)[C@@H](c1ccccc1)OC)C,Kd=780nM,6.107905,6.11,1,A,A,1,A,A,0,,B,A,,1,1,153,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,0.8758106231689453,0.8640130758285522,92.92950439453124,93.48902130126952,0.3427101373672485,0.5266017913818359,0.9278411865234376,0.9080146551132202,0.8354591727256775,0.8407576680183411,WLAFVLV,Low,"(6.097, 6.26]",train
3WDE,protein-peptide,P9WPC9,MFERFTDRARRVVVLAQEEARMLNHNYIGTEHILLGLIHEGEGVAAKSLESLGISLEGVRSQVEEIIGQGQQAPSGHIPYTPRAKKVLELSLREALQLGHNYIGTEHILLGLIREGEGVAAQVLVKLGAELTRVRQQVIQLLSGYLEHHHHHH,WLAFVLV,MET-PHE-GLU-ARG-PHE-THR-ASP-ARG-ALA-ARG-ARG-VAL-VAL-VAL-LEU-ALA-GLN-GLU-GLU-ALA-ARG-MET-LEU-ASN-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-HIS-GLU-GLY-GLU-GLY-VAL-ALA-ALA-LYS-SER-LEU-GLU-SER-LEU-GLY-ILE-SER-LEU-GLU-GLY-VAL-ARG-SER-GLN-VAL-GLU-GLU-ILE-ILE-GLY-GLN-GLY-GLN-GLN-ALA-PRO-SER-GLY-HIS-ILE-PRO-TYR-THR-PRO-ARG-ALA-LYS-LYS-VAL-LEU-GLU-LEU-SER-LEU-ARG-GLU-ALA-LEU-GLN-LEU-GLY-HIS-ASN-TYR-ILE-GLY-THR-GLU-HIS-ILE-LEU-LEU-GLY-LEU-ILE-ARG-GLU-GLY-GLU-GLY-VAL-ALA-ALA-GLN-VAL-LEU-VAL-LYS-LEU-GLY-ALA-GLU-LEU-THR-ARG-VAL-ARG-GLN-GLN-VAL-ILE-GLN-LEU-LEU-SER-GLY-TYR-LEU-GLU-HIS-HIS-HIS-HIS-HIS-HIS,WRP-WLU-ALA-WPA-VAL-MLE-WVL,153,7,OC[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](C(C)C)C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C)[C@@H](c1cn(c2c1cccc2)C([C@H](O)C)(C)C)O)[C@@H](C=C(C)C)C)CC(C)C)C)[C@@H](c1ccccc1)OC)C,Kd=124nM,6.906578,6.91,1,A,A,1,A,A,0,,B,A,,1,1,153,7,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(C)C)C(=O)N[C@H](C(=O)O)C(C)C,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,CNC(CC(C)CO)C(=O)NC(C(=O)N[C@@H](C)C(=O)NC(C(=O)N[C@H](C(=O)NC(C(=O)O)C(C)C=C(C)C)C(C)C)C(OC)c1ccccc1)C(O)c1cn(C(C)(C)C(C)O)c2ccccc12,0.8892182111740112,0.8272932767868042,92.84066009521484,93.41764068603516,0.3469593822956085,0.554867684841156,0.9231586456298828,0.8994582891464233,0.8494831323623657,0.8092520236968994,WLAFVLV,Low,"(6.824, 7.049]",train
3WDZ,protein-peptide,Q64337 Q9Z2X8,MGHHHHHHDYDIPTTENLYFQGAPKVGRLIYTAGGYFRQSLSYLEAYNPSNGSWLRLADLQVPRSGLAGCVVGGLLYAVGGRNNSPDGNTDSSALDCYNPMTNQWSPCASMSVPRNRIGVGVIDGHIYAVGGSHGCIHHSSVERYEPERDEWHLVAPMLTRRIGVGVAVLNRLLYAVGGFDGTNRLNSAECYYPERNEWRMITPMNTIRSGAGVCVLHNCIYAAGGYDGQDQLNSVERYDVETETWTFVAPMRHHRSALGITVHQGKIYVLGGYDGHTFLDSVECYDPDSDTWSEVTRMTSGRSGVGVAVT,KEVDPSTGELQSLQ,MET-GLY-HIS-HIS-HIS-HIS-HIS-HIS-ASP-TYR-ASP-ILE-PRO-THR-THR-GLU-ASN-LEU-TYR-PHE-GLN-GLY-ALA-PRO-LYS-VAL-GLY-ARG-LEU-ILE-TYR-THR-ALA-GLY-GLY-TYR-PHE-ARG-GLN-SER-LEU-SER-TYR-LEU-GLU-ALA-TYR-ASN-PRO-SER-ASN-GLY-SER-TRP-LEU-ARG-LEU-ALA-ASP-LEU-GLN-VAL-PRO-ARG-SER-GLY-LEU-ALA-GLY-CYS-VAL-VAL-GLY-GLY-LEU-LEU-TYR-ALA-VAL-GLY-GLY-ARG-ASN-ASN-SER-PRO-ASP-GLY-ASN-THR-ASP-SER-SER-ALA-LEU-ASP-CYS-TYR-ASN-PRO-MET-THR-ASN-GLN-TRP-SER-PRO-CYS-ALA-SER-MET-SER-VAL-PRO-ARG-ASN-ARG-ILE-GLY-VAL-GLY-VAL-ILE-ASP-GLY-HIS-ILE-TYR-ALA-VAL-GLY-GLY-SER-HIS-GLY-CYS-ILE-HIS-HIS-SER-SER-VAL-GLU-ARG-TYR-GLU-PRO-GLU-ARG-ASP-GLU-TRP-HIS-LEU-VAL-ALA-PRO-MET-LEU-THR-ARG-ARG-ILE-GLY-VAL-GLY-VAL-ALA-VAL-LEU-ASN-ARG-LEU-LEU-TYR-ALA-VAL-GLY-GLY-PHE-ASP-GLY-THR-ASN-ARG-LEU-ASN-SER-ALA-GLU-CYS-TYR-TYR-PRO-GLU-ARG-ASN-GLU-TRP-ARG-MET-ILE-THR-PRO-MET-ASN-THR-ILE-ARG-SER-GLY-ALA-GLY-VAL-CYS-VAL-LEU-HIS-ASN-CYS-ILE-TYR-ALA-ALA-GLY-GLY-TYR-ASP-GLY-GLN-ASP-GLN-LEU-ASN-SER-VAL-GLU-ARG-TYR-ASP-VAL-GLU-THR-GLU-THR-TRP-THR-PHE-VAL-ALA-PRO-MET-ARG-HIS-HIS-ARG-SER-ALA-LEU-GLY-ILE-THR-VAL-HIS-GLN-GLY-LYS-ILE-TYR-VAL-LEU-GLY-GLY-TYR-ASP-GLY-HIS-THR-PHE-LEU-ASP-SER-VAL-GLU-CYS-TYR-ASP-PRO-ASP-SER-ASP-THR-TRP-SER-GLU-VAL-THR-ARG-MET-THR-SER-GLY-ARG-SER-GLY-VAL-GLY-VAL-ALA-VAL-THR,LYS-GLU-VAL-ASP-PRO-SEP-THR-GLY-GLU-LEU-GLN-SER-LEU-GLN,311,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CC(C)C)CCC(=O)O)[C@H](O)C)COP(O)(O)O)CC(=O)O)C(C)C)CCC(=O)O)[NH3+],Kd=0.12uM,6.920819,6.92,1,A,A,1,A,A,0,,B,A,,1,1,311,14,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)NC(COP(=O)(O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)O,0.938548505306244,0.7198487520217896,87.80430603027344,88.1874008178711,0.3911154270172119,0.9670265316963196,0.883735716342926,0.8256361484527588,0.8810978531837463,0.6511993408203125,KEVDPSTGELQSLQ,Low,"(6.824, 7.049]",train
3WP0,protein-peptide,Q6P1M3 P31016,GPGSVHYARPIIILGPTKDRANDDLLSEFPDKFGSCVPHTTRPKREYEIDGRDYHFVSSREKMEKDIQAHKFIEAGQYNSHLYGTSVQSVREVAEQGKHCILDVSANAVRRLQAAHLHPIAIFIRPRSLENVLEINKRITEEQARKAFDRATKLEQEFTECFSAIVEGDSFEEIYHKVKRVIEDLSG,LSRVKSLKKSLRQSF,GLY-PRO-GLY-SER-VAL-HIS-TYR-ALA-ARG-PRO-ILE-ILE-ILE-LEU-GLY-PRO-THR-LYS-ASP-ARG-ALA-ASN-ASP-ASP-LEU-LEU-SER-GLU-PHE-PRO-ASP-LYS-PHE-GLY-SER-CYS-VAL-PRO-HIS-THR-THR-ARG-PRO-LYS-ARG-GLU-TYR-GLU-ILE-ASP-GLY-ARG-ASP-TYR-HIS-PHE-VAL-SER-SER-ARG-GLU-LYS-MET-GLU-LYS-ASP-ILE-GLN-ALA-HIS-LYS-PHE-ILE-GLU-ALA-GLY-GLN-TYR-ASN-SER-HIS-LEU-TYR-GLY-THR-SER-VAL-GLN-SER-VAL-ARG-GLU-VAL-ALA-GLU-GLN-GLY-LYS-HIS-CYS-ILE-LEU-ASP-VAL-SER-ALA-ASN-ALA-VAL-ARG-ARG-LEU-GLN-ALA-ALA-HIS-LEU-HIS-PRO-ILE-ALA-ILE-PHE-ILE-ARG-PRO-ARG-SER-LEU-GLU-ASN-VAL-LEU-GLU-ILE-ASN-LYS-ARG-ILE-THR-GLU-GLU-GLN-ALA-ARG-LYS-ALA-PHE-ASP-ARG-ALA-THR-LYS-LEU-GLU-GLN-GLU-PHE-THR-GLU-CYS-PHE-SER-ALA-ILE-VAL-GLU-GLY-ASP-SER-PHE-GLU-GLU-ILE-TYR-HIS-LYS-VAL-LYS-ARG-VAL-ILE-GLU-ASP-LEU-SER-GLY,LEU-SER-ARG-VAL-LYS-SEP-LEU-LYS-LYS-SER-LEU-ARG-GLN-SER-PHE,187,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CO)CCC(=O)N)CCC[NH+]=C(N)N)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)CCC[NH+]=C(N)N)CCCC[NH3+])COP(O)(O)O)CC(C)C)CCCC[NH3+],Kd=10.2uM,4.9914,4.99,1,A,A,1,A,A,0,,B,A,,1,1,187,15,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(=O)O,0.8360012769699097,0.7526849508285522,89.49942779541016,88.86566162109375,0.3901581466197967,0.8817510008811951,0.899761438369751,0.8292297720909119,0.7736504077911377,0.7335487008094788,LSRVKSLKKSLRQSF,Low,"(4.866, 5.014]",train
3WP1,protein-peptide,Q6P1M3 P31016,GPGSVHYARPIIILGPTKDRANDDLLSEFPDKFGSCVPHTTRPKREYEIDGRDYHFVSSREKMEKDIQAHKFIEAGQYNSHLYGTSVQSVREVAEQGKHCILDVSANAVRRLQAAHLHPIAIFIRPRSLENVLEINKRITEEQARKAFDRATKLEQEFTECFSAIVEGDSFEEIYHKVKRVIEDLSG,LKKSLRQSFRRMRRSRV,GLY-PRO-GLY-SER-VAL-HIS-TYR-ALA-ARG-PRO-ILE-ILE-ILE-LEU-GLY-PRO-THR-LYS-ASP-ARG-ALA-ASN-ASP-ASP-LEU-LEU-SER-GLU-PHE-PRO-ASP-LYS-PHE-GLY-SER-CYS-VAL-PRO-HIS-THR-THR-ARG-PRO-LYS-ARG-GLU-TYR-GLU-ILE-ASP-GLY-ARG-ASP-TYR-HIS-PHE-VAL-SER-SER-ARG-GLU-LYS-MET-GLU-LYS-ASP-ILE-GLN-ALA-HIS-LYS-PHE-ILE-GLU-ALA-GLY-GLN-TYR-ASN-SER-HIS-LEU-TYR-GLY-THR-SER-VAL-GLN-SER-VAL-ARG-GLU-VAL-ALA-GLU-GLN-GLY-LYS-HIS-CYS-ILE-LEU-ASP-VAL-SER-ALA-ASN-ALA-VAL-ARG-ARG-LEU-GLN-ALA-ALA-HIS-LEU-HIS-PRO-ILE-ALA-ILE-PHE-ILE-ARG-PRO-ARG-SER-LEU-GLU-ASN-VAL-LEU-GLU-ILE-ASN-LYS-ARG-ILE-THR-GLU-GLU-GLN-ALA-ARG-LYS-ALA-PHE-ASP-ARG-ALA-THR-LYS-LEU-GLU-GLN-GLU-PHE-THR-GLU-CYS-PHE-SER-ALA-ILE-VAL-GLU-GLY-ASP-SER-PHE-GLU-GLU-ILE-TYR-HIS-LYS-VAL-LYS-ARG-VAL-ILE-GLU-ASP-LEU-SER-GLY,LEU-LYS-LYS-SER-LEU-ARG-GLN-SEP-PHE-ARG-ARG-MET-ARG-ARG-SER-ARG-VAL,187,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCSC)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)Cc1ccccc1)COP(O)(O)O)CCC(=O)N)CCC[NH+]=C(N)N)CC(C)C)CO)NC(=O)[C@H](CCCC[NH3+])[NH3+],Kd=14.1uM,4.850781,4.85,1,A,A,1,A,A,0,,A,B,,1,1,187,17,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8864173889160156,0.7123404741287231,91.84730529785156,87.32178497314453,0.3666082918643951,0.9752304553985596,0.9067625403404236,0.8054702877998352,0.8323115110397339,0.6890580058097839,LKKSLRQSFRRMRRSRV,Low,"(4.745, 4.866]",train
3WSY,protein-peptide,Q92673,EQPEPIKVYGQVSLNDSHNQMVVHWAGEKSNVIVALARDSLALARPKSSDVYVSYDYGKSFKKISDKLNFGLGNRSEAVIAQFYHSPADNKRYIFADAYAQYLWITFDFCNTLQGFSIPFRAADLLLHSKASNLLLGFDRSHPNKQLWKSDDFGQTWIMIQEHVKSFSWGIDPYDKPNTIYIERHEPSGYSTVFRSTDFFQSRENQEVILEEVRDFQLRDKYMFATKVVHLLGSEQQSSVQLWVSFGRKPMRAAQFVTRHPINEYYIADASEDQVFVCVSHSNNRTNLYISEAEGLKFSLSLENVLYYSPGGAGSDTLVRYFANEPFADFHRVEGLQGVYIATLINGSMNEENMRSVITFDKGGTWEFLQAPAFTGYGEKINCELSQGCSLHLAQRLSQLLNLQLRRMPILSKESAPGLIIATGSVGKNLASKTNVYISSSAGARWREALPGPHYYTWGDHGGIITAIAQGMETNELKYSTNEGETWKTFIFSEKPVFVYGLLTEPGEKSTVFTIFGSNKENVHSWLILQVNATDALGVPCTENDYKLWSPSDERGNECLLGHKTVFKRRTPHATCFNGEDFDRPVVVSNCSCTREDYECDFGFKMSEDLSLEVCVPDPEFSGKSYSPPVPCPVGSTYRRTRGYRKISGDTCSGGDVEARLEGELVPCPSRLENLYFQ,LPQDRGFLVVQGDPR,GLU-GLN-PRO-GLU-PRO-ILE-LYS-VAL-TYR-GLY-GLN-VAL-SER-LEU-ASN-ASP-SER-HIS-ASN-GLN-MET-VAL-VAL-HIS-TRP-ALA-GLY-GLU-LYS-SER-ASN-VAL-ILE-VAL-ALA-LEU-ALA-ARG-ASP-SER-LEU-ALA-LEU-ALA-ARG-PRO-LYS-SER-SER-ASP-VAL-TYR-VAL-SER-TYR-ASP-TYR-GLY-LYS-SER-PHE-LYS-LYS-ILE-SER-ASP-LYS-LEU-ASN-PHE-GLY-LEU-GLY-ASN-ARG-SER-GLU-ALA-VAL-ILE-ALA-GLN-PHE-TYR-HIS-SER-PRO-ALA-ASP-ASN-LYS-ARG-TYR-ILE-PHE-ALA-ASP-ALA-TYR-ALA-GLN-TYR-LEU-TRP-ILE-THR-PHE-ASP-PHE-CYS-ASN-THR-LEU-GLN-GLY-PHE-SER-ILE-PRO-PHE-ARG-ALA-ALA-ASP-LEU-LEU-LEU-HIS-SER-LYS-ALA-SER-ASN-LEU-LEU-LEU-GLY-PHE-ASP-ARG-SER-HIS-PRO-ASN-LYS-GLN-LEU-TRP-LYS-SER-ASP-ASP-PHE-GLY-GLN-THR-TRP-ILE-MET-ILE-GLN-GLU-HIS-VAL-LYS-SER-PHE-SER-TRP-GLY-ILE-ASP-PRO-TYR-ASP-LYS-PRO-ASN-THR-ILE-TYR-ILE-GLU-ARG-HIS-GLU-PRO-SER-GLY-TYR-SER-THR-VAL-PHE-ARG-SER-THR-ASP-PHE-PHE-GLN-SER-ARG-GLU-ASN-GLN-GLU-VAL-ILE-LEU-GLU-GLU-VAL-ARG-ASP-PHE-GLN-LEU-ARG-ASP-LYS-TYR-MET-PHE-ALA-THR-LYS-VAL-VAL-HIS-LEU-LEU-GLY-SER-GLU-GLN-GLN-SER-SER-VAL-GLN-LEU-TRP-VAL-SER-PHE-GLY-ARG-LYS-PRO-MET-ARG-ALA-ALA-GLN-PHE-VAL-THR-ARG-HIS-PRO-ILE-ASN-GLU-TYR-TYR-ILE-ALA-ASP-ALA-SER-GLU-ASP-GLN-VAL-PHE-VAL-CYS-VAL-SER-HIS-SER-ASN-ASN-ARG-THR-ASN-LEU-TYR-ILE-SER-GLU-ALA-GLU-GLY-LEU-LYS-PHE-SER-LEU-SER-LEU-GLU-ASN-VAL-LEU-TYR-TYR-SER-PRO-GLY-GLY-ALA-GLY-SER-ASP-THR-LEU-VAL-ARG-TYR-PHE-ALA-ASN-GLU-PRO-PHE-ALA-ASP-PHE-HIS-ARG-VAL-GLU-GLY-LEU-GLN-GLY-VAL-TYR-ILE-ALA-THR-LEU-ILE-ASN-GLY-SER-MET-ASN-GLU-GLU-ASN-MET-ARG-SER-VAL-ILE-THR-PHE-ASP-LYS-GLY-GLY-THR-TRP-GLU-PHE-LEU-GLN-ALA-PRO-ALA-PHE-THR-GLY-TYR-GLY-GLU-LYS-ILE-ASN-CYS-GLU-LEU-SER-GLN-GLY-CYS-SER-LEU-HIS-LEU-ALA-GLN-ARG-LEU-SER-GLN-LEU-LEU-ASN-LEU-GLN-LEU-ARG-ARG-MET-PRO-ILE-LEU-SER-LYS-GLU-SER-ALA-PRO-GLY-LEU-ILE-ILE-ALA-THR-GLY-SER-VAL-GLY-LYS-ASN-LEU-ALA-SER-LYS-THR-ASN-VAL-TYR-ILE-SER-SER-SER-ALA-GLY-ALA-ARG-TRP-ARG-GLU-ALA-LEU-PRO-GLY-PRO-HIS-TYR-TYR-THR-TRP-GLY-ASP-HIS-GLY-GLY-ILE-ILE-THR-ALA-ILE-ALA-GLN-GLY-MET-GLU-THR-ASN-GLU-LEU-LYS-TYR-SER-THR-ASN-GLU-GLY-GLU-THR-TRP-LYS-THR-PHE-ILE-PHE-SER-GLU-LYS-PRO-VAL-PHE-VAL-TYR-GLY-LEU-LEU-THR-GLU-PRO-GLY-GLU-LYS-SER-THR-VAL-PHE-THR-ILE-PHE-GLY-SER-ASN-LYS-GLU-ASN-VAL-HIS-SER-TRP-LEU-ILE-LEU-GLN-VAL-ASN-ALA-THR-ASP-ALA-LEU-GLY-VAL-PRO-CYS-THR-GLU-ASN-ASP-TYR-LYS-LEU-TRP-SER-PRO-SER-ASP-GLU-ARG-GLY-ASN-GLU-CYS-LEU-LEU-GLY-HIS-LYS-THR-VAL-PHE-LYS-ARG-ARG-THR-PRO-HIS-ALA-THR-CYS-PHE-ASN-GLY-GLU-ASP-PHE-ASP-ARG-PRO-VAL-VAL-VAL-SER-ASN-CYS-SER-CYS-THR-ARG-GLU-ASP-TYR-GLU-CYS-ASP-PHE-GLY-PHE-LYS-MET-SER-GLU-ASP-LEU-SER-LEU-GLU-VAL-CYS-VAL-PRO-ASP-PRO-GLU-PHE-SER-GLY-LYS-SER-TYR-SER-PRO-PRO-VAL-PRO-CYS-PRO-VAL-GLY-SER-THR-TYR-ARG-ARG-THR-ARG-GLY-TYR-ARG-LYS-ILE-SER-GLY-ASP-THR-CYS-SER-GLY-GLY-ASP-VAL-GLU-ALA-ARG-LEU-GLU-GLY-GLU-LEU-VAL-PRO-CYS-PRO-SER-ARG-LEU-GLU-ASN-LEU-TYR-PHE-GLN,LEU-PRO-GLN-ASP-ARG-GLY-PHE-LEU-VAL-VAL-GLN-GLY-ASP-PRO-ARG,678,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)C(C)C)C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)[NH3+])CCC(=O)N)CC(=O)O)CCC[NH+]=C(N)N)C,Kd=441nM,6.355561,6.36,1,A,A,1,A,A,0,,C,A,,1,1,678,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.7666163444519043,0.7123296856880188,67.92640686035156,66.00884246826172,0.6349367499351501,1.025338888168335,0.8269692659378052,0.819889485836029,0.7379998564720154,0.6854397058486938,LPQDRGFLVVQGDPR,Low,"(6.26, 6.398]",train
3ZEV,protein-peptide,P20068 P20789,GPGSGPNSDLDVNTDIYSKVLVTAIYLALFVVGTVGNSVTLFTLARKKSLQSLQSTVDYYLGSLALSDLLILLLAMPVELYNFIWVHHPWAFGDAGCRGYYFLRDACTYATALNVVSLSVELYLAICHPFKAKTLMSRSRTKKFISAIWLASALLAIPMLFTMGLQNLSGDGTHPGGLVCTPIVDTATLKVVIQVNTFMSFLFPMLVASILNTVIANKLTVMVHQAAEQGRVCTEPGRVQALRRGVLVLRAVVIAFVVCWLPYHVRRLMFCYISDEQWTTFLFDFYHYFYMLTNALVYVSAAINPILYNLVSANFRQVFLSTLACLCPGTRELEVLFQ,GGRRPYIL,GLY-PRO-GLY-SER-GLY-PRO-ASN-SER-ASP-LEU-ASP-VAL-ASN-THR-ASP-ILE-TYR-SER-LYS-VAL-LEU-VAL-THR-ALA-ILE-TYR-LEU-ALA-LEU-PHE-VAL-VAL-GLY-THR-VAL-GLY-ASN-SER-VAL-THR-LEU-PHE-THR-LEU-ALA-ARG-LYS-LYS-SER-LEU-GLN-SER-LEU-GLN-SER-THR-VAL-ASP-TYR-TYR-LEU-GLY-SER-LEU-ALA-LEU-SER-ASP-LEU-LEU-ILE-LEU-LEU-LEU-ALA-MET-PRO-VAL-GLU-LEU-TYR-ASN-PHE-ILE-TRP-VAL-HIS-HIS-PRO-TRP-ALA-PHE-GLY-ASP-ALA-GLY-CYS-ARG-GLY-TYR-TYR-PHE-LEU-ARG-ASP-ALA-CYS-THR-TYR-ALA-THR-ALA-LEU-ASN-VAL-VAL-SER-LEU-SER-VAL-GLU-LEU-TYR-LEU-ALA-ILE-CYS-HIS-PRO-PHE-LYS-ALA-LYS-THR-LEU-MET-SER-ARG-SER-ARG-THR-LYS-LYS-PHE-ILE-SER-ALA-ILE-TRP-LEU-ALA-SER-ALA-LEU-LEU-ALA-ILE-PRO-MET-LEU-PHE-THR-MET-GLY-LEU-GLN-ASN-LEU-SER-GLY-ASP-GLY-THR-HIS-PRO-GLY-GLY-LEU-VAL-CYS-THR-PRO-ILE-VAL-ASP-THR-ALA-THR-LEU-LYS-VAL-VAL-ILE-GLN-VAL-ASN-THR-PHE-MET-SER-PHE-LEU-PHE-PRO-MET-LEU-VAL-ALA-SER-ILE-LEU-ASN-THR-VAL-ILE-ALA-ASN-LYS-LEU-THR-VAL-MET-VAL-HIS-GLN-ALA-ALA-GLU-GLN-GLY-ARG-VAL-CYS-THR-GLU-PRO-GLY-ARG-VAL-GLN-ALA-LEU-ARG-ARG-GLY-VAL-LEU-VAL-LEU-ARG-ALA-VAL-VAL-ILE-ALA-PHE-VAL-VAL-CYS-TRP-LEU-PRO-TYR-HIS-VAL-ARG-ARG-LEU-MET-PHE-CYS-TYR-ILE-SER-ASP-GLU-GLN-TRP-THR-THR-PHE-LEU-PHE-ASP-PHE-TYR-HIS-TYR-PHE-TYR-MET-LEU-THR-ASN-ALA-LEU-VAL-TYR-VAL-SER-ALA-ALA-ILE-ASN-PRO-ILE-LEU-TYR-ASN-LEU-VAL-SER-ALA-ASN-PHE-ARG-GLN-VAL-PHE-LEU-SER-THR-LEU-ALA-CYS-LEU-CYS-PRO-GLY-THR-ARG-GLU-LEU-GLU-VAL-LEU-PHE-GLN,GLY-GLY-ARG-ARG-PRO-TYR-ILE-LEU,338,8,[NH3+]CC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](CC)C)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=2.3nM,8.638272,8.64,1,A,A,1,A,A,0,,C,A,,1,1,338,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O,0.8930323123931885,0.8585333824157715,76.8317642211914,75.35124969482422,0.5427546501159668,0.7161215543746948,0.8427122235298157,0.82805997133255,0.8893550634384155,0.8587552905082703,GGRRPYIL,Moderate,"(8.383, 8.824]",val
3ZMQ,protein-peptide,P12931 P18031,MHHHHHHHMEMEKEFEQIDKSGSWAAIYQDIRHEASDFPCRVAKLPKNKNRNRYRDVSPFDHSRIKLHQEDNDYINASLIKMEEAQRSYILTQGPLPNTCGHFWEMVWEQKSRGVVMLNRVMEKGSLKCAQYWPQKEEKEMIFEDTNLKLTLISEDIKSYYTVRQLELENLTTQETREILHFHYTTWPDFGVPESPASFLNFLFKVRESGSLSPEHGPVVVHSSAGIGRSGTFCLADTCLLLMDKRKDPSSVDIKKVLLEMRKFRMGLIQTADQLRFSYLAVIEGAKFIMGDSSVQDQWKELSHEDLEPPPEHIPPPPRPPKRILEPHN,EAQYQPGENL,MET-HIS-HIS-HIS-HIS-HIS-HIS-HIS-MET-GLU-MET-GLU-LYS-GLU-PHE-GLU-GLN-ILE-ASP-LYS-SER-GLY-SER-TRP-ALA-ALA-ILE-TYR-GLN-ASP-ILE-ARG-HIS-GLU-ALA-SER-ASP-PHE-PRO-CYS-ARG-VAL-ALA-LYS-LEU-PRO-LYS-ASN-LYS-ASN-ARG-ASN-ARG-TYR-ARG-ASP-VAL-SER-PRO-PHE-ASP-HIS-SER-ARG-ILE-LYS-LEU-HIS-GLN-GLU-ASP-ASN-ASP-TYR-ILE-ASN-ALA-SER-LEU-ILE-LYS-MET-GLU-GLU-ALA-GLN-ARG-SER-TYR-ILE-LEU-THR-GLN-GLY-PRO-LEU-PRO-ASN-THR-CYS-GLY-HIS-PHE-TRP-GLU-MET-VAL-TRP-GLU-GLN-LYS-SER-ARG-GLY-VAL-VAL-MET-LEU-ASN-ARG-VAL-MET-GLU-LYS-GLY-SER-LEU-LYS-CYS-ALA-GLN-TYR-TRP-PRO-GLN-LYS-GLU-GLU-LYS-GLU-MET-ILE-PHE-GLU-ASP-THR-ASN-LEU-LYS-LEU-THR-LEU-ILE-SER-GLU-ASP-ILE-LYS-SER-TYR-TYR-THR-VAL-ARG-GLN-LEU-GLU-LEU-GLU-ASN-LEU-THR-THR-GLN-GLU-THR-ARG-GLU-ILE-LEU-HIS-PHE-HIS-TYR-THR-THR-TRP-PRO-ASP-PHE-GLY-VAL-PRO-GLU-SER-PRO-ALA-SER-PHE-LEU-ASN-PHE-LEU-PHE-LYS-VAL-ARG-GLU-SER-GLY-SER-LEU-SER-PRO-GLU-HIS-GLY-PRO-VAL-VAL-VAL-HIS-SER-SER-ALA-GLY-ILE-GLY-ARG-SER-GLY-THR-PHE-CYS-LEU-ALA-ASP-THR-CYS-LEU-LEU-LEU-MET-ASP-LYS-ARG-LYS-ASP-PRO-SER-SER-VAL-ASP-ILE-LYS-LYS-VAL-LEU-LEU-GLU-MET-ARG-LYS-PHE-ARG-MET-GLY-LEU-ILE-GLN-THR-ALA-ASP-GLN-LEU-ARG-PHE-SER-TYR-LEU-ALA-VAL-ILE-GLU-GLY-ALA-LYS-PHE-ILE-MET-GLY-ASP-SER-SER-VAL-GLN-ASP-GLN-TRP-LYS-GLU-LEU-SER-HIS-GLU-ASP-LEU-GLU-PRO-PRO-PRO-GLU-HIS-ILE-PRO-PRO-PRO-PRO-ARG-PRO-PRO-LYS-ARG-ILE-LEU-GLU-PRO-HIS-ASN,GLU-ALA-GLN-FTY-GLN-PRO-GLY-GLU-ASN-LEU,329,10,NC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)CCC(=O)N)Cc1ccc(cc1)C(P(O)(O)O)(F)F)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])C,IC50=0.36uM,6.443697,6.44,1,A,A,1,A,A,0,,C,A,,1,1,329,10,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(Cc1ccc(C(F)(F)P(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)C(Cc1ccc(C(F)(F)P(=O)(O)O)cc1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,0.8889403939247131,0.9117760062217712,84.53866577148438,85.91011810302734,0.4553988873958587,0.6475485563278198,0.8831473588943481,0.880030632019043,0.8147986531257629,0.8551226258277893,EAQYQPGENL,Low,"(6.398, 6.523]",train
3ZQI,protein-peptide,P04483 P0ACT4,MSRLDKSKVINSALELLNEVGIEGLTTRKLAQKLGVEQPTLYWHVKNKRALLDALAIEMLDRHHTHFSPLEGESWQDFLRNNAKSFRNALLSHRDGAKVHLGTRPTEKQYETLENQLAFLTQQGFSLENALYALSAVGHFTLGSVLEDQEHQVAKEERETPTTDSMPPLLRQAIELFDHQGAEPAFLHGLESLIRGFEVQLTALLQIV,DDSVLAARARMWMWHW,MET-SER-ARG-LEU-ASP-LYS-SER-LYS-VAL-ILE-ASN-SER-ALA-LEU-GLU-LEU-LEU-ASN-GLU-VAL-GLY-ILE-GLU-GLY-LEU-THR-THR-ARG-LYS-LEU-ALA-GLN-LYS-LEU-GLY-VAL-GLU-GLN-PRO-THR-LEU-TYR-TRP-HIS-VAL-LYS-ASN-LYS-ARG-ALA-LEU-LEU-ASP-ALA-LEU-ALA-ILE-GLU-MET-LEU-ASP-ARG-HIS-HIS-THR-HIS-PHE-SER-PRO-LEU-GLU-GLY-GLU-SER-TRP-GLN-ASP-PHE-LEU-ARG-ASN-ASN-ALA-LYS-SER-PHE-ARG-ASN-ALA-LEU-LEU-SER-HIS-ARG-ASP-GLY-ALA-LYS-VAL-HIS-LEU-GLY-THR-ARG-PRO-THR-GLU-LYS-GLN-TYR-GLU-THR-LEU-GLU-ASN-GLN-LEU-ALA-PHE-LEU-THR-GLN-GLN-GLY-PHE-SER-LEU-GLU-ASN-ALA-LEU-TYR-ALA-LEU-SER-ALA-VAL-GLY-HIS-PHE-THR-LEU-GLY-SER-VAL-LEU-GLU-ASP-GLN-GLU-HIS-GLN-VAL-ALA-LYS-GLU-GLU-ARG-GLU-THR-PRO-THR-THR-ASP-SER-MET-PRO-PRO-LEU-LEU-ARG-GLN-ALA-ILE-GLU-LEU-PHE-ASP-HIS-GLN-GLY-ALA-GLU-PRO-ALA-PHE-LEU-HIS-GLY-LEU-GLU-SER-LEU-ILE-ARG-GLY-PHE-GLU-VAL-GLN-LEU-THR-ALA-LEU-LEU-GLN-ILE-VAL,ASP-ASP-SER-VAL-LEU-ALA-ALA-ARG-ALA-ARG-MET-TRP-MET-TRP-HIS-TRP,208,16,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)Cc1cnc[nH]1)Cc1c[nH]c2c1cccc2)CCSC)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)[NH3+])CC(C)C)C)C)CCC[NH+]=C(N)N)C)CCC[NH+]=C(N)N,Kd=64nM,7.19382,7.19,1,A,A,1,A,A,0,,C,A,dimer,1,1,208,16,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)O)C(=O)O)C(=O)O)C(C)C,0.7317211031913757,0.7645666599273682,79.76199340820312,86.26435089111328,0.5165256857872009,0.8957454562187195,0.8408439755439758,0.8327572345733643,0.6486368179321289,0.7294901609420776,DDSVLAARARMWMWHW,Moderate,"(7.049, 7.268]",val
3ZVY,protein-peptide,Q96T88 P68431,RKSGPSCKHCKDDVNRLCRVCACHLCGGRQDPDKQLMCDECDMAFHIYCLDPPLSSVPSEDEWYCPECRNDA,ARTKQTAR,ARG-LYS-SER-GLY-PRO-SER-CYS-LYS-HIS-CYS-LYS-ASP-ASP-VAL-ASN-ARG-LEU-CYS-ARG-VAL-CYS-ALA-CYS-HIS-LEU-CYS-GLY-GLY-ARG-GLN-ASP-PRO-ASP-LYS-GLN-LEU-MET-CYS-ASP-GLU-CYS-ASP-MET-ALA-PHE-HIS-ILE-TYR-CYS-LEU-ASP-PRO-PRO-LEU-SER-SER-VAL-PRO-SER-GLU-ASP-GLU-TRP-TYR-CYS-PRO-GLU-CYS-ARG-ASN-ASP-ALA,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG,72,8,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=7.9uM,5.102373,5.1,1,A,A,1,A,A,0,,C,A,,1,1,72,8,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=N)N)[C@@H](C)O)[C@@H](C)O)C(=O)O,0.84090656042099,0.8353984951972961,90.82036590576172,79.56780242919922,0.5324790477752686,0.6008366346359253,0.7155219316482544,0.8575551509857178,0.7238152623176575,0.812498152256012,ARTKQTAR,Low,"(5.014, 5.105]",train
4A0J,protein-peptide,O15392 P68431,MGAPTLPPAWQPFLKDHRISTFKNWPFLEGCACTPERMAEAGFIHCPTENEPDLAQCFFCFKELEGWEPDDDPIEEHKKHSSGCAFLSVKKQFEELTLGEFLKLDRERAKNKIAKETNNKKKEFEETAKKVRRAIEQLAAMD,ARTKQT,MET-GLY-ALA-PRO-THR-LEU-PRO-PRO-ALA-TRP-GLN-PRO-PHE-LEU-LYS-ASP-HIS-ARG-ILE-SER-THR-PHE-LYS-ASN-TRP-PRO-PHE-LEU-GLU-GLY-CYS-ALA-CYS-THR-PRO-GLU-ARG-MET-ALA-GLU-ALA-GLY-PHE-ILE-HIS-CYS-PRO-THR-GLU-ASN-GLU-PRO-ASP-LEU-ALA-GLN-CYS-PHE-PHE-CYS-PHE-LYS-GLU-LEU-GLU-GLY-TRP-GLU-PRO-ASP-ASP-ASP-PRO-ILE-GLU-GLU-HIS-LYS-LYS-HIS-SER-SER-GLY-CYS-ALA-PHE-LEU-SER-VAL-LYS-LYS-GLN-PHE-GLU-GLU-LEU-THR-LEU-GLY-GLU-PHE-LEU-LYS-LEU-ASP-ARG-GLU-ARG-ALA-LYS-ASN-LYS-ILE-ALA-LYS-GLU-THR-ASN-ASN-LYS-LYS-LYS-GLU-PHE-GLU-GLU-THR-ALA-LYS-LYS-VAL-ARG-ARG-ALA-ILE-GLU-GLN-LEU-ALA-ALA-MET-ASP,ALA-ARG-TPO-LYS-GLN-THR,142,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N,Kd=1.0uM,6.0,6.0,1,A,A,1,A,A,0,,C,A,,1,1,142,6,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,CC(OP(=O)(O)O)C(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O,0.9736406803131104,0.9502000212669371,86.4805908203125,87.08351135253906,0.3691417872905731,0.454167753458023,0.8532165288925171,0.8821923732757568,0.9108412861824036,0.9011806845664978,ARTKQT,Low,"(5.959, 6.097]",train
4A2A,protein-peptide,O08398 Q9WZU0,MIDLSKTVFYTSIDIGSRYIKGLVLGKRDQEWEALAFSSVKSRGLDEGEIKDAIAFKESVNTLLKELEEQLQKSLRSDFVISFSSVSFEREDTVIERDFGEEKRSITLDILSEMQSEALEKLKENGKTPLHIFSKRYLLDDERIVFNPLDMKASKIAIEYTSIVVPLKVYEMFYNFLQDTVKSPFQLKSSLVSTAEGVLTTPEKDRGVVVVNLGYNFTGLIAYKNGVPIKISYVPVGMKHVIKDVSAVLDTSFEESERLIITHGNAVYNDLKEEEIQYRGLDGNTIKTTTAKKLSVIIHARLREIMSKSKKFFREVEAKIVEEGEIGIPGGVVLTGGGAKIPRINELATEVFKSPVRTGCYANSDRPSIINADEVANDPSFAAAFGNVFAVSENPYEETPVKSENPLKKIFRLFKELME,EGDIPAIYRYGLEGLL,MET-ILE-ASP-LEU-SER-LYS-THR-VAL-PHE-TYR-THR-SER-ILE-ASP-ILE-GLY-SER-ARG-TYR-ILE-LYS-GLY-LEU-VAL-LEU-GLY-LYS-ARG-ASP-GLN-GLU-TRP-GLU-ALA-LEU-ALA-PHE-SER-SER-VAL-LYS-SER-ARG-GLY-LEU-ASP-GLU-GLY-GLU-ILE-LYS-ASP-ALA-ILE-ALA-PHE-LYS-GLU-SER-VAL-ASN-THR-LEU-LEU-LYS-GLU-LEU-GLU-GLU-GLN-LEU-GLN-LYS-SER-LEU-ARG-SER-ASP-PHE-VAL-ILE-SER-PHE-SER-SER-VAL-SER-PHE-GLU-ARG-GLU-ASP-THR-VAL-ILE-GLU-ARG-ASP-PHE-GLY-GLU-GLU-LYS-ARG-SER-ILE-THR-LEU-ASP-ILE-LEU-SER-GLU-MET-GLN-SER-GLU-ALA-LEU-GLU-LYS-LEU-LYS-GLU-ASN-GLY-LYS-THR-PRO-LEU-HIS-ILE-PHE-SER-LYS-ARG-TYR-LEU-LEU-ASP-ASP-GLU-ARG-ILE-VAL-PHE-ASN-PRO-LEU-ASP-MET-LYS-ALA-SER-LYS-ILE-ALA-ILE-GLU-TYR-THR-SER-ILE-VAL-VAL-PRO-LEU-LYS-VAL-TYR-GLU-MET-PHE-TYR-ASN-PHE-LEU-GLN-ASP-THR-VAL-LYS-SER-PRO-PHE-GLN-LEU-LYS-SER-SER-LEU-VAL-SER-THR-ALA-GLU-GLY-VAL-LEU-THR-THR-PRO-GLU-LYS-ASP-ARG-GLY-VAL-VAL-VAL-VAL-ASN-LEU-GLY-TYR-ASN-PHE-THR-GLY-LEU-ILE-ALA-TYR-LYS-ASN-GLY-VAL-PRO-ILE-LYS-ILE-SER-TYR-VAL-PRO-VAL-GLY-MET-LYS-HIS-VAL-ILE-LYS-ASP-VAL-SER-ALA-VAL-LEU-ASP-THR-SER-PHE-GLU-GLU-SER-GLU-ARG-LEU-ILE-ILE-THR-HIS-GLY-ASN-ALA-VAL-TYR-ASN-ASP-LEU-LYS-GLU-GLU-GLU-ILE-GLN-TYR-ARG-GLY-LEU-ASP-GLY-ASN-THR-ILE-LYS-THR-THR-THR-ALA-LYS-LYS-LEU-SER-VAL-ILE-ILE-HIS-ALA-ARG-LEU-ARG-GLU-ILE-MET-SER-LYS-SER-LYS-LYS-PHE-PHE-ARG-GLU-VAL-GLU-ALA-LYS-ILE-VAL-GLU-GLU-GLY-GLU-ILE-GLY-ILE-PRO-GLY-GLY-VAL-VAL-LEU-THR-GLY-GLY-GLY-ALA-LYS-ILE-PRO-ARG-ILE-ASN-GLU-LEU-ALA-THR-GLU-VAL-PHE-LYS-SER-PRO-VAL-ARG-THR-GLY-CYS-TYR-ALA-ASN-SER-ASP-ARG-PRO-SER-ILE-ILE-ASN-ALA-ASP-GLU-VAL-ALA-ASN-ASP-PRO-SER-PHE-ALA-ALA-ALA-PHE-GLY-ASN-VAL-PHE-ALA-VAL-SER-GLU-ASN-PRO-TYR-GLU-GLU-THR-PRO-VAL-LYS-SER-GLU-ASN-PRO-LEU-LYS-LYS-ILE-PHE-ARG-LEU-PHE-LYS-GLU-LEU-MET-GLU,GLU-GLY-ASP-ILE-PRO-ALA-ILE-TYR-ARG-TYR-GLY-LEU-GLU-GLY-LEU-LEU,419,16,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(C)C)CCC(=O)O)CC(C)C)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](CC(=O)O)[NH3+])C)C,Kd=45uM,4.346787,4.35,1,A,A,1,A,A,0,,C,A,,1,1,419,16,0,CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.5529314875602722,0.7028533816337585,75.20645141601562,73.79292297363281,0.7374531626701355,1.1318761110305786,0.8269264698028564,0.7922543883323669,0.4413293004035949,0.6611117124557495,EGDIPAIYRYGLEGLL,Low,"(4.319, 4.456]",val
4A7J,protein-peptide,P61964 P68431,GPLGSSATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,MARTKQTARKSTGGKA,GLY-PRO-LEU-GLY-SER-SER-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,MET-ALA-2MR-THR-LYS-GLN-THR-ALA-ARG-LYS-SER-THR-GLY-GLY-LYS-ALA,318,16,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)[C@H](O)C)CCC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(NC)NC,Kd=0.1uM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,318,16,0,CSCC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,CN=C(NC)NCCCC(NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O,CN=C(NC)NCCCC(NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](C)N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)O,0.8358616232872009,0.6883378028869629,93.2004852294922,92.29525756835938,0.3735593855381012,0.9844582676887512,0.914151668548584,0.8373257517814636,0.7582801580429077,0.6196443438529968,MARTKQTARKSTGGKA,Moderate,"(6.824, 7.049]",train
4AA1,protein-peptide,Q10714 P01019,ALVKEEIQAKEYLENLNKELAKRTNVETEAAWAYGSNITDENEKKKNEISAELAKFMKEVASDTTKFQWRSYQSEDLKRQFKALTKLGYAALPEDDYAELLDTLSAMESNFAKVKVCDYKDSTKCDLALDPEIEEVISKSRDHEELAYYWREFYDKAGTAVRSQFERYVELNTKAAKLNNFTSGAEAWLDEYEDDTFEQQLEDIFADIRPLYQQIHGYVRFRLRKHYGDAVVSETGPIPMHLLGNMWAQQWSEIADIVSPFPEKPLVDVSAEMEKQGYTPLKMFQMGDDFFTSMNLTKLPQDFWDKSIIEKPTDGRDLVCHASAWDFYLTDDVRIKQCTRVTQDQLFTVHHELGHIQYFLQYQHQPFVYRTGANPGFHEAVGDVLSLSVSTPKHLEKIGLLKDYVRDDEARINQLFLTALDKIVFLPFAFTMDKYRWSLFRGEVDKANWNCAFWKLRDEYSGIEPPVVRSEKDFDAPAKYHISADVEYLRYLVSFIIQFQFYKSACIKAGQYDPDNVELPLDNCDIYGSAAAGAAFHNMLSMGASKPWPDALEAFNGERIMSGKAIAEYFEPLRVWLEAENIKNNVHIGWTTSNKCVS,DRVYIHPF,ALA-LEU-VAL-LYS-GLU-GLU-ILE-GLN-ALA-LYS-GLU-TYR-LEU-GLU-ASN-LEU-ASN-LYS-GLU-LEU-ALA-LYS-ARG-THR-ASN-VAL-GLU-THR-GLU-ALA-ALA-TRP-ALA-TYR-GLY-SER-ASN-ILE-THR-ASP-GLU-ASN-GLU-LYS-LYS-LYS-ASN-GLU-ILE-SER-ALA-GLU-LEU-ALA-LYS-PHE-MET-LYS-GLU-VAL-ALA-SER-ASP-THR-THR-LYS-PHE-GLN-TRP-ARG-SER-TYR-GLN-SER-GLU-ASP-LEU-LYS-ARG-GLN-PHE-LYS-ALA-LEU-THR-LYS-LEU-GLY-TYR-ALA-ALA-LEU-PRO-GLU-ASP-ASP-TYR-ALA-GLU-LEU-LEU-ASP-THR-LEU-SER-ALA-MET-GLU-SER-ASN-PHE-ALA-LYS-VAL-LYS-VAL-CYS-ASP-TYR-LYS-ASP-SER-THR-LYS-CYS-ASP-LEU-ALA-LEU-ASP-PRO-GLU-ILE-GLU-GLU-VAL-ILE-SER-LYS-SER-ARG-ASP-HIS-GLU-GLU-LEU-ALA-TYR-TYR-TRP-ARG-GLU-PHE-TYR-ASP-LYS-ALA-GLY-THR-ALA-VAL-ARG-SER-GLN-PHE-GLU-ARG-TYR-VAL-GLU-LEU-ASN-THR-LYS-ALA-ALA-LYS-LEU-ASN-ASN-PHE-THR-SER-GLY-ALA-GLU-ALA-TRP-LEU-ASP-GLU-TYR-GLU-ASP-ASP-THR-PHE-GLU-GLN-GLN-LEU-GLU-ASP-ILE-PHE-ALA-ASP-ILE-ARG-PRO-LEU-TYR-GLN-GLN-ILE-HIS-GLY-TYR-VAL-ARG-PHE-ARG-LEU-ARG-LYS-HIS-TYR-GLY-ASP-ALA-VAL-VAL-SER-GLU-THR-GLY-PRO-ILE-PRO-MET-HIS-LEU-LEU-GLY-ASN-MET-TRP-ALA-GLN-GLN-TRP-SER-GLU-ILE-ALA-ASP-ILE-VAL-SER-PRO-PHE-PRO-GLU-LYS-PRO-LEU-VAL-ASP-VAL-SER-ALA-GLU-MET-GLU-LYS-GLN-GLY-TYR-THR-PRO-LEU-LYS-MET-PHE-GLN-MET-GLY-ASP-ASP-PHE-PHE-THR-SER-MET-ASN-LEU-THR-LYS-LEU-PRO-GLN-ASP-PHE-TRP-ASP-LYS-SER-ILE-ILE-GLU-LYS-PRO-THR-ASP-GLY-ARG-ASP-LEU-VAL-CYS-HIS-ALA-SER-ALA-TRP-ASP-PHE-TYR-LEU-THR-ASP-ASP-VAL-ARG-ILE-LYS-GLN-CYS-THR-ARG-VAL-THR-GLN-ASP-GLN-LEU-PHE-THR-VAL-HIS-HIS-GLU-LEU-GLY-HIS-ILE-GLN-TYR-PHE-LEU-GLN-TYR-GLN-HIS-GLN-PRO-PHE-VAL-TYR-ARG-THR-GLY-ALA-ASN-PRO-GLY-PHE-HIS-GLU-ALA-VAL-GLY-ASP-VAL-LEU-SER-LEU-SER-VAL-SER-THR-PRO-LYS-HIS-LEU-GLU-LYS-ILE-GLY-LEU-LEU-LYS-ASP-TYR-VAL-ARG-ASP-ASP-GLU-ALA-ARG-ILE-ASN-GLN-LEU-PHE-LEU-THR-ALA-LEU-ASP-LYS-ILE-VAL-PHE-LEU-PRO-PHE-ALA-PHE-THR-MET-ASP-LYS-TYR-ARG-TRP-SER-LEU-PHE-ARG-GLY-GLU-VAL-ASP-LYS-ALA-ASN-TRP-ASN-CYS-ALA-PHE-TRP-LYS-LEU-ARG-ASP-GLU-TYR-SER-GLY-ILE-GLU-PRO-PRO-VAL-VAL-ARG-SER-GLU-LYS-ASP-PHE-ASP-ALA-PRO-ALA-LYS-TYR-HIS-ILE-SER-ALA-ASP-VAL-GLU-TYR-LEU-ARG-TYR-LEU-VAL-SER-PHE-ILE-ILE-GLN-PHE-GLN-PHE-TYR-LYS-SER-ALA-CYS-ILE-LYS-ALA-GLY-GLN-TYR-ASP-PRO-ASP-ASN-VAL-GLU-LEU-PRO-LEU-ASP-ASN-CYS-ASP-ILE-TYR-GLY-SER-ALA-ALA-ALA-GLY-ALA-ALA-PHE-HIS-ASN-MET-LEU-SER-MET-GLY-ALA-SER-LYS-PRO-TRP-PRO-ASP-ALA-LEU-GLU-ALA-PHE-ASN-GLY-GLU-ARG-ILE-MET-SER-GLY-LYS-ALA-ILE-ALA-GLU-TYR-PHE-GLU-PRO-LEU-ARG-VAL-TRP-LEU-GLU-ALA-GLU-ASN-ILE-LYS-ASN-ASN-VAL-HIS-ILE-GLY-TRP-THR-THR-SER-ASN-LYS-CYS-VAL-SER,ASP-ARG-VAL-TYR-ILE-HIS-PRO-PHE,598,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N)Cc1nc[nH]c1)NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])C,Ki=76uM,4.119186,4.12,1,A,A,1,A,A,0,,P,A,,1,1,598,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.9448958039283752,0.9326761960983276,94.0240707397461,94.52938079833984,0.332816869020462,0.4311493039131164,0.94264954328537,0.945184290409088,0.937206506729126,0.9295491576194764,DRVYIHPF,Low,"(3.924, 4.155]",train
4AA2,protein-peptide,P01021 Q10714,ALVKEEIQAKEYLENLNKELAKRTNVETEAAWAYGSNITDENEKKKNEISAELAKFMKEVASDTTKFQWRSYQSEDLKRQFKALTKLGYAALPEDDYAELLDTLSAMESNFAKVKVCDYKDSTKCDLALDPEIEEVISKSRDHEELAYYWREFYDKAGTAVRSQFERYVELNTKAAKLNNFTSGAEAWLDEYEDDTFEQQLEDIFADIRPLYQQIHGYVRFRLRKHYGDAVVSETGPIPMHLLGNMWAQQWSEIADIVSPFPEKPLVDVSAEMEKQGYTPLKMFQMGDDFFTSMNLTKLPQDFWDKSIIEKPTDGRDLVCHASAWDFYLTDDVRIKQCTRVTQDQLFTVHHELGHIQYFLQYQHQPFVYRTGANPGFHEAVGDVLSLSVSTPKHLEKIGLLKDYVRDDEARINQLFLTALDKIVFLPFAFTMDKYRWSLFRGEVDKANWNCAFWKLRDEYSGIEPPVVRSEKDFDAPAKYHISADVEYLRYLVSFIIQFQFYKSACIKAGQYDPDNVELPLDNCDIYGSAAAGAAFHNMLSMGASKPWPDALEAFNGERIMSGKAIAEYFEPLRVWLEAENIKNNVHIGWTTSNKCVS,EGLPPRPKIPP,ALA-LEU-VAL-LYS-GLU-GLU-ILE-GLN-ALA-LYS-GLU-TYR-LEU-GLU-ASN-LEU-ASN-LYS-GLU-LEU-ALA-LYS-ARG-THR-ASN-VAL-GLU-THR-GLU-ALA-ALA-TRP-ALA-TYR-GLY-SER-ASN-ILE-THR-ASP-GLU-ASN-GLU-LYS-LYS-LYS-ASN-GLU-ILE-SER-ALA-GLU-LEU-ALA-LYS-PHE-MET-LYS-GLU-VAL-ALA-SER-ASP-THR-THR-LYS-PHE-GLN-TRP-ARG-SER-TYR-GLN-SER-GLU-ASP-LEU-LYS-ARG-GLN-PHE-LYS-ALA-LEU-THR-LYS-LEU-GLY-TYR-ALA-ALA-LEU-PRO-GLU-ASP-ASP-TYR-ALA-GLU-LEU-LEU-ASP-THR-LEU-SER-ALA-MET-GLU-SER-ASN-PHE-ALA-LYS-VAL-LYS-VAL-CYS-ASP-TYR-LYS-ASP-SER-THR-LYS-CYS-ASP-LEU-ALA-LEU-ASP-PRO-GLU-ILE-GLU-GLU-VAL-ILE-SER-LYS-SER-ARG-ASP-HIS-GLU-GLU-LEU-ALA-TYR-TYR-TRP-ARG-GLU-PHE-TYR-ASP-LYS-ALA-GLY-THR-ALA-VAL-ARG-SER-GLN-PHE-GLU-ARG-TYR-VAL-GLU-LEU-ASN-THR-LYS-ALA-ALA-LYS-LEU-ASN-ASN-PHE-THR-SER-GLY-ALA-GLU-ALA-TRP-LEU-ASP-GLU-TYR-GLU-ASP-ASP-THR-PHE-GLU-GLN-GLN-LEU-GLU-ASP-ILE-PHE-ALA-ASP-ILE-ARG-PRO-LEU-TYR-GLN-GLN-ILE-HIS-GLY-TYR-VAL-ARG-PHE-ARG-LEU-ARG-LYS-HIS-TYR-GLY-ASP-ALA-VAL-VAL-SER-GLU-THR-GLY-PRO-ILE-PRO-MET-HIS-LEU-LEU-GLY-ASN-MET-TRP-ALA-GLN-GLN-TRP-SER-GLU-ILE-ALA-ASP-ILE-VAL-SER-PRO-PHE-PRO-GLU-LYS-PRO-LEU-VAL-ASP-VAL-SER-ALA-GLU-MET-GLU-LYS-GLN-GLY-TYR-THR-PRO-LEU-LYS-MET-PHE-GLN-MET-GLY-ASP-ASP-PHE-PHE-THR-SER-MET-ASN-LEU-THR-LYS-LEU-PRO-GLN-ASP-PHE-TRP-ASP-LYS-SER-ILE-ILE-GLU-LYS-PRO-THR-ASP-GLY-ARG-ASP-LEU-VAL-CYS-HIS-ALA-SER-ALA-TRP-ASP-PHE-TYR-LEU-THR-ASP-ASP-VAL-ARG-ILE-LYS-GLN-CYS-THR-ARG-VAL-THR-GLN-ASP-GLN-LEU-PHE-THR-VAL-HIS-HIS-GLU-LEU-GLY-HIS-ILE-GLN-TYR-PHE-LEU-GLN-TYR-GLN-HIS-GLN-PRO-PHE-VAL-TYR-ARG-THR-GLY-ALA-ASN-PRO-GLY-PHE-HIS-GLU-ALA-VAL-GLY-ASP-VAL-LEU-SER-LEU-SER-VAL-SER-THR-PRO-LYS-HIS-LEU-GLU-LYS-ILE-GLY-LEU-LEU-LYS-ASP-TYR-VAL-ARG-ASP-ASP-GLU-ALA-ARG-ILE-ASN-GLN-LEU-PHE-LEU-THR-ALA-LEU-ASP-LYS-ILE-VAL-PHE-LEU-PRO-PHE-ALA-PHE-THR-MET-ASP-LYS-TYR-ARG-TRP-SER-LEU-PHE-ARG-GLY-GLU-VAL-ASP-LYS-ALA-ASN-TRP-ASN-CYS-ALA-PHE-TRP-LYS-LEU-ARG-ASP-GLU-TYR-SER-GLY-ILE-GLU-PRO-PRO-VAL-VAL-ARG-SER-GLU-LYS-ASP-PHE-ASP-ALA-PRO-ALA-LYS-TYR-HIS-ILE-SER-ALA-ASP-VAL-GLU-TYR-LEU-ARG-TYR-LEU-VAL-SER-PHE-ILE-ILE-GLN-PHE-GLN-PHE-TYR-LYS-SER-ALA-CYS-ILE-LYS-ALA-GLY-GLN-TYR-ASP-PRO-ASP-ASN-VAL-GLU-LEU-PRO-LEU-ASP-ASN-CYS-ASP-ILE-TYR-GLY-SER-ALA-ALA-ALA-GLY-ALA-ALA-PHE-HIS-ASN-MET-LEU-SER-MET-GLY-ALA-SER-LYS-PRO-TRP-PRO-ASP-ALA-LEU-GLU-ALA-PHE-ASN-GLY-GLU-ARG-ILE-MET-SER-GLY-LYS-ALA-ILE-ALA-GLU-TYR-PHE-GLU-PRO-LEU-ARG-VAL-TRP-LEU-GLU-ALA-GLU-ASN-ILE-LYS-ASN-ASN-VAL-HIS-ILE-GLY-TRP-THR-THR-SER-ASN-LYS-CYS-VAL-SER,GLU-GLY-LEU-PRO-PRO-ARG-PRO-LYS-ILE-PRO-PRO,598,11,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O)[C@H](CC)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC[NH+]=C(N)N)[NH3+],Ki=107uM,3.970616,3.97,1,A,A,1,A,A,0,,P,A,,1,1,598,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](N)CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)O,0.8682392835617065,0.911097764968872,93.34759521484376,94.21110534667967,0.3593123853206634,0.4623520076274872,0.9336484670639038,0.9388871192932128,0.840597927570343,0.904150366783142,EGLPPRPKIPP,Low,"(3.924, 4.155]",val
4AIF,protein-peptide,O00170 P07900,AEEKAKAVPLIHQEGNRLYREGHVKEAAAKYYDAIACLKNLQMKEQPGSPEWIQLDQQITPLLLNYCQCKLVVEEYYEVLDHCSSILNKYDDNVKAYFKRGKAHAAVWNAQEAQADFAKVLELDPALAPVVSRELQALEARIRQ,SRMEEVD,ALA-GLU-GLU-LYS-ALA-LYS-ALA-VAL-PRO-LEU-ILE-HIS-GLN-GLU-GLY-ASN-ARG-LEU-TYR-ARG-GLU-GLY-HIS-VAL-LYS-GLU-ALA-ALA-ALA-LYS-TYR-TYR-ASP-ALA-ILE-ALA-CYS-LEU-LYS-ASN-LEU-GLN-MET-LYS-GLU-GLN-PRO-GLY-SER-PRO-GLU-TRP-ILE-GLN-LEU-ASP-GLN-GLN-ILE-THR-PRO-LEU-LEU-LEU-ASN-TYR-CYS-GLN-CYS-LYS-LEU-VAL-VAL-GLU-GLU-TYR-TYR-GLU-VAL-LEU-ASP-HIS-CYS-SER-SER-ILE-LEU-ASN-LYS-TYR-ASP-ASP-ASN-VAL-LYS-ALA-TYR-PHE-LYS-ARG-GLY-LYS-ALA-HIS-ALA-ALA-VAL-TRP-ASN-ALA-GLN-GLU-ALA-GLN-ALA-ASP-PHE-ALA-LYS-VAL-LEU-GLU-LEU-ASP-PRO-ALA-LEU-ALA-PRO-VAL-VAL-SER-ARG-GLU-LEU-GLN-ALA-LEU-GLU-ALA-ARG-ILE-ARG-GLN,SER-ARG-MET-GLU-GLU-VAL-ASP,144,7,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)CCC(=O)O)C)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC,Kd=14.4uM,4.841638,4.84,1,A,A,1,A,A,0,,D,A,,1,1,144,7,0,CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)C(C)C,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)[C@@H](NC(=O)C[C@H](N)C(=O)O)C(C)C)C(=O)O)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,0.9592174887657166,0.8795508742332458,96.55409240722656,95.63958740234376,0.2828111350536346,0.5290142297744751,0.9482585787773132,0.9200870990753174,0.932983696460724,0.8694168329238892,SRMEEVD,Low,"(4.745, 4.866]",val
4AOM,protein-peptide,Q8IDR3 Q8I4W8,MESVADIQQLEEKVDESDVRIYFNEKSSGGKISIDNASYNARKLGLAPSSIDEKKIKELYGDNLTYEQYLEYLSICVHDKDNVEELIKMFAHFDNNCTGYLTKSQMKNILTTWGDALTDQEAIDALNAFSSEDNIDYKLFCEDILQ,KNIPSLLRVQAHIRKKMV,MET-GLU-SER-VAL-ALA-ASP-ILE-GLN-GLN-LEU-GLU-GLU-LYS-VAL-ASP-GLU-SER-ASP-VAL-ARG-ILE-TYR-PHE-ASN-GLU-LYS-SER-SER-GLY-GLY-LYS-ILE-SER-ILE-ASP-ASN-ALA-SER-TYR-ASN-ALA-ARG-LYS-LEU-GLY-LEU-ALA-PRO-SER-SER-ILE-ASP-GLU-LYS-LYS-ILE-LYS-GLU-LEU-TYR-GLY-ASP-ASN-LEU-THR-TYR-GLU-GLN-TYR-LEU-GLU-TYR-LEU-SER-ILE-CYS-VAL-HIS-ASP-LYS-ASP-ASN-VAL-GLU-GLU-LEU-ILE-LYS-MET-PHE-ALA-HIS-PHE-ASP-ASN-ASN-CYS-THR-GLY-TYR-LEU-THR-LYS-SER-GLN-MET-LYS-ASN-ILE-LEU-THR-THR-TRP-GLY-ASP-ALA-LEU-THR-ASP-GLN-GLU-ALA-ILE-ASP-ALA-LEU-ASN-ALA-PHE-SER-SER-GLU-ASP-ASN-ILE-ASP-TYR-LYS-LEU-PHE-CYS-GLU-ASP-ILE-LEU-GLN,LYS-ASN-ILE-PRO-SER-LEU-LEU-ARG-VAL-GLN-ALA-HIS-ILE-ARG-LYS-LYS-MET-VAL,146,18,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCSC)CCCC[NH3+])NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(=O)N)CO)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)CCC(=O)N)C)Cc1nc[nH]c1)CCC[NH+]=C(N)N,Kd=85nM,7.070581,7.07,1,A,A,1,A,A,0,,T,A,,1,1,146,18,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)CC)C(C)C,0.9072290658950806,0.7832077145576477,91.52042388916016,80.33393859863281,0.3987227380275726,0.7627689838409424,0.8112245798110962,0.8161037564277649,0.8740655183792114,0.7749836444854736,KNIPSLLRVQAHIRKKMV,Moderate,"(7.049, 7.268]",train
4APH,protein-peptide,P12821 P01019,LVTDEAEASKFVEEYDRTSQVVWNEYAEANWNYNTNITTETSKILLQKNMQIANHTLKYGTQARKFDVNQLQNTTIKRIIKKVQDLERAALPAQELEEYNKILLDMETTYSVATVCHPNGSCLQLEPDLTNVMATSRKYEDLLWAWEGWRDKAGRAILQFYPKYVELINQAARLNGYVDAGDSWRSMYETPSLEQDLERLFQELQPLYLNLHAYVRRALHRHYGAQHINLEGPIPAHLLGNMWAQTWSNIYDLVVPFPSAPSMDTTEAMLKQGWTPRRMFKEADDFFTSLGLLPVPPEFWNKSMLEKPTDGREVVCHASAWDFYNGKDFRIKQCTTVNLEDLVVAHHEMGHIQYFMQYKDLPVALREGANPGFHEAIGDVLALSVSTPKHLHSLNLLSSEGGSDEHDINFLMKMALDKIAFIPFSYLVDQWRWRVFDGSITKENYNQEWWSLRLKYQGLCPPVPRTQGDFDPGAKFHIPSSVPYIRYFVSFIIQFQFHEALCQAAGHTGPLHKCDIYQSKEAGQRLATAMKLGFSRPWPEAMQLITGQPNMSASAMLSYFKPLLDWLRTENELHGEKLGWPQYNWTPNS,DRVYIHPF,LEU-VAL-THR-ASP-GLU-ALA-GLU-ALA-SER-LYS-PHE-VAL-GLU-GLU-TYR-ASP-ARG-THR-SER-GLN-VAL-VAL-TRP-ASN-GLU-TYR-ALA-GLU-ALA-ASN-TRP-ASN-TYR-ASN-THR-ASN-ILE-THR-THR-GLU-THR-SER-LYS-ILE-LEU-LEU-GLN-LYS-ASN-MET-GLN-ILE-ALA-ASN-HIS-THR-LEU-LYS-TYR-GLY-THR-GLN-ALA-ARG-LYS-PHE-ASP-VAL-ASN-GLN-LEU-GLN-ASN-THR-THR-ILE-LYS-ARG-ILE-ILE-LYS-LYS-VAL-GLN-ASP-LEU-GLU-ARG-ALA-ALA-LEU-PRO-ALA-GLN-GLU-LEU-GLU-GLU-TYR-ASN-LYS-ILE-LEU-LEU-ASP-MET-GLU-THR-THR-TYR-SER-VAL-ALA-THR-VAL-CYS-HIS-PRO-ASN-GLY-SER-CYS-LEU-GLN-LEU-GLU-PRO-ASP-LEU-THR-ASN-VAL-MET-ALA-THR-SER-ARG-LYS-TYR-GLU-ASP-LEU-LEU-TRP-ALA-TRP-GLU-GLY-TRP-ARG-ASP-LYS-ALA-GLY-ARG-ALA-ILE-LEU-GLN-PHE-TYR-PRO-LYS-TYR-VAL-GLU-LEU-ILE-ASN-GLN-ALA-ALA-ARG-LEU-ASN-GLY-TYR-VAL-ASP-ALA-GLY-ASP-SER-TRP-ARG-SER-MET-TYR-GLU-THR-PRO-SER-LEU-GLU-GLN-ASP-LEU-GLU-ARG-LEU-PHE-GLN-GLU-LEU-GLN-PRO-LEU-TYR-LEU-ASN-LEU-HIS-ALA-TYR-VAL-ARG-ARG-ALA-LEU-HIS-ARG-HIS-TYR-GLY-ALA-GLN-HIS-ILE-ASN-LEU-GLU-GLY-PRO-ILE-PRO-ALA-HIS-LEU-LEU-GLY-ASN-MET-TRP-ALA-GLN-THR-TRP-SER-ASN-ILE-TYR-ASP-LEU-VAL-VAL-PRO-PHE-PRO-SER-ALA-PRO-SER-MET-ASP-THR-THR-GLU-ALA-MET-LEU-LYS-GLN-GLY-TRP-THR-PRO-ARG-ARG-MET-PHE-LYS-GLU-ALA-ASP-ASP-PHE-PHE-THR-SER-LEU-GLY-LEU-LEU-PRO-VAL-PRO-PRO-GLU-PHE-TRP-ASN-LYS-SER-MET-LEU-GLU-LYS-PRO-THR-ASP-GLY-ARG-GLU-VAL-VAL-CYS-HIS-ALA-SER-ALA-TRP-ASP-PHE-TYR-ASN-GLY-LYS-ASP-PHE-ARG-ILE-LYS-GLN-CYS-THR-THR-VAL-ASN-LEU-GLU-ASP-LEU-VAL-VAL-ALA-HIS-HIS-GLU-MET-GLY-HIS-ILE-GLN-TYR-PHE-MET-GLN-TYR-LYS-ASP-LEU-PRO-VAL-ALA-LEU-ARG-GLU-GLY-ALA-ASN-PRO-GLY-PHE-HIS-GLU-ALA-ILE-GLY-ASP-VAL-LEU-ALA-LEU-SER-VAL-SER-THR-PRO-LYS-HIS-LEU-HIS-SER-LEU-ASN-LEU-LEU-SER-SER-GLU-GLY-GLY-SER-ASP-GLU-HIS-ASP-ILE-ASN-PHE-LEU-MET-LYS-MET-ALA-LEU-ASP-LYS-ILE-ALA-PHE-ILE-PRO-PHE-SER-TYR-LEU-VAL-ASP-GLN-TRP-ARG-TRP-ARG-VAL-PHE-ASP-GLY-SER-ILE-THR-LYS-GLU-ASN-TYR-ASN-GLN-GLU-TRP-TRP-SER-LEU-ARG-LEU-LYS-TYR-GLN-GLY-LEU-CYS-PRO-PRO-VAL-PRO-ARG-THR-GLN-GLY-ASP-PHE-ASP-PRO-GLY-ALA-LYS-PHE-HIS-ILE-PRO-SER-SER-VAL-PRO-TYR-ILE-ARG-TYR-PHE-VAL-SER-PHE-ILE-ILE-GLN-PHE-GLN-PHE-HIS-GLU-ALA-LEU-CYS-GLN-ALA-ALA-GLY-HIS-THR-GLY-PRO-LEU-HIS-LYS-CYS-ASP-ILE-TYR-GLN-SER-LYS-GLU-ALA-GLY-GLN-ARG-LEU-ALA-THR-ALA-MET-LYS-LEU-GLY-PHE-SER-ARG-PRO-TRP-PRO-GLU-ALA-MET-GLN-LEU-ILE-THR-GLY-GLN-PRO-ASN-MET-SER-ALA-SER-ALA-MET-LEU-SER-TYR-PHE-LYS-PRO-LEU-LEU-ASP-TRP-LEU-ARG-THR-GLU-ASN-GLU-LEU-HIS-GLY-GLU-LYS-LEU-GLY-TRP-PRO-GLN-TYR-ASN-TRP-THR-PRO-ASN-SER,ASP-ARG-VAL-TYR-ILE-HIS-PRO-PHE,589,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N)C,Ki=4.0uM,5.39794,5.4,1,A,A,1,A,A,0,,P,A,,1,1,589,8,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.9497228860855104,0.914110004901886,93.35224151611328,92.4299087524414,0.3298191726207733,0.4510020315647125,0.9492037296295166,0.9460026621818542,0.9414774775505066,0.9061368703842164,DRVYIHPF,Low,"(5.31, 5.463]",val
4APO,protein-peptide,Q15388 O00170,DPWAMTAEEKAKAVPLIHQEGNRLYREGHVKEAAAKYYDAIACLKNLQMKEQPGSPEWIQLDQQITPLLLNYCQCKLVVEEYYEVLDHCSSILNKYDDNVKAYFKRGKAHAAVWNAQEAQADFAKVLELDPALAPVVSRELQALEARIRQKDEEDKARFRGIFSH,AEDDVE,ASP-PRO-TRP-ALA-MET-THR-ALA-GLU-GLU-LYS-ALA-LYS-ALA-VAL-PRO-LEU-ILE-HIS-GLN-GLU-GLY-ASN-ARG-LEU-TYR-ARG-GLU-GLY-HIS-VAL-LYS-GLU-ALA-ALA-ALA-LYS-TYR-TYR-ASP-ALA-ILE-ALA-CYS-LEU-LYS-ASN-LEU-GLN-MET-LYS-GLU-GLN-PRO-GLY-SER-PRO-GLU-TRP-ILE-GLN-LEU-ASP-GLN-GLN-ILE-THR-PRO-LEU-LEU-LEU-ASN-TYR-CYS-GLN-CYS-LYS-LEU-VAL-VAL-GLU-GLU-TYR-TYR-GLU-VAL-LEU-ASP-HIS-CYS-SER-SER-ILE-LEU-ASN-LYS-TYR-ASP-ASP-ASN-VAL-LYS-ALA-TYR-PHE-LYS-ARG-GLY-LYS-ALA-HIS-ALA-ALA-VAL-TRP-ASN-ALA-GLN-GLU-ALA-GLN-ALA-ASP-PHE-ALA-LYS-VAL-LEU-GLU-LEU-ASP-PRO-ALA-LEU-ALA-PRO-VAL-VAL-SER-ARG-GLU-LEU-GLN-ALA-LEU-GLU-ALA-ARG-ILE-ARG-GLN-LYS-ASP-GLU-GLU-ASP-LYS-ALA-ARG-PHE-ARG-GLY-ILE-PHE-SER-HIS,ALA-GLU-ASP-ASP-VAL-GLU,165,6,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)C(C)C)CC(=O)O)CC(=O)O)NC(=O)[C@@H]([NH3+])C,Kd=12.3uM,4.910095,4.91,1,A,A,1,A,A,0,,D,A,,0,1,165,6,0,CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O,CC(C)[C@H](NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.9527277946472168,0.8898995518684387,92.5102767944336,90.18157196044922,0.308573842048645,0.4945736825466156,0.91713148355484,0.9031286239624025,0.9323870539665222,0.8865922689437866,AEDDVE,Low,"(4.866, 5.014]",train
4AZA,protein-peptide,P06730 Q04637,MATVEPETTPTPNPPTTEEEKTESNQEVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV,KKRYSREFLLGF,MET-ALA-THR-VAL-GLU-PRO-GLU-THR-THR-PRO-THR-PRO-ASN-PRO-PRO-THR-THR-GLU-GLU-GLU-LYS-THR-GLU-SER-ASN-GLN-GLU-VAL-ALA-ASN-PRO-GLU-HIS-TYR-ILE-LYS-HIS-PRO-LEU-GLN-ASN-ARG-TRP-ALA-LEU-TRP-PHE-PHE-LYS-ASN-ASP-LYS-SER-LYS-THR-TRP-GLN-ALA-ASN-LEU-ARG-LEU-ILE-SER-LYS-PHE-ASP-THR-VAL-GLU-ASP-PHE-TRP-ALA-LEU-TYR-ASN-HIS-ILE-GLN-LEU-SER-SER-ASN-LEU-MET-PRO-GLY-CYS-ASP-TYR-SER-LEU-PHE-LYS-ASP-GLY-ILE-GLU-PRO-MET-TRP-GLU-ASP-GLU-LYS-ASN-LYS-ARG-GLY-GLY-ARG-TRP-LEU-ILE-THR-LEU-ASN-LYS-GLN-GLN-ARG-ARG-SER-ASP-LEU-ASP-ARG-PHE-TRP-LEU-GLU-THR-LEU-LEU-CYS-LEU-ILE-GLY-GLU-SER-PHE-ASP-ASP-TYR-SER-ASP-ASP-VAL-CYS-GLY-ALA-VAL-VAL-ASN-VAL-ARG-ALA-LYS-GLY-ASP-LYS-ILE-ALA-ILE-TRP-THR-THR-GLU-CYS-GLU-ASN-ARG-GLU-ALA-VAL-THR-HIS-ILE-GLY-ARG-VAL-TYR-LYS-GLU-ARG-LEU-GLY-LEU-PRO-PRO-LYS-ILE-VAL-ILE-GLY-TYR-GLN-SER-HIS-ALA-ASP-THR-ALA-THR-LYS-SER-GLY-SER-THR-THR-LYS-ASN-ARG-PHE-VAL-VAL,ACE-LYS-LYS-ARG-TYR-SER-ARG-GLU-PHE-LEU-LEU-GLY-PHE-NH2,217,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N)Cc1ccccc1)CC(C)C)CC(C)C)Cc1ccccc1)CCC(=O)O)CCC[NH+]=C(N)N)CO)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)C)CCCC[NH3+],Kd=103.0nM,6.987163,6.99,1,A,A,1,A,A,0,,B,A,,1,1,217,14,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)O,1.00799560546875,0.7789044380187988,82.32483673095703,81.40853118896484,0.4114645421504974,0.9348483681678772,0.8179510235786438,0.7778401970863342,0.935419499874115,0.6870045065879822,KKRYSREFLLGF,Low,"(6.824, 7.049]",val
4B4N,protein-peptide,A9PKC6 Q16630,PIVQNLQGQMVHQAISPRTLNAWVKVVEEKAFSPEVIPMFSALSEGATPQDLNTMLNTVGGHQAAMQMLKETINEEAAEWDRLHPVHAGPIAPGQMREPRGSDIAGTTSTLQEQIGWMTHNPPIPVGEIYKRWIILGLNKIVRMYS,PVLFPGQPFGQPPLG,PRO-ILE-VAL-GLN-ASN-LEU-GLN-GLY-GLN-MET-VAL-HIS-GLN-ALA-ILE-SER-PRO-ARG-THR-LEU-ASN-ALA-TRP-VAL-LYS-VAL-VAL-GLU-GLU-LYS-ALA-PHE-SER-PRO-GLU-VAL-ILE-PRO-MET-PHE-SER-ALA-LEU-SER-GLU-GLY-ALA-THR-PRO-GLN-ASP-LEU-ASN-THR-MET-LEU-ASN-THR-VAL-GLY-GLY-HIS-GLN-ALA-ALA-MET-GLN-MET-LEU-LYS-GLU-THR-ILE-ASN-GLU-GLU-ALA-ALA-GLU-TRP-ASP-ARG-LEU-HIS-PRO-VAL-HIS-ALA-GLY-PRO-ILE-ALA-PRO-GLY-GLN-MET-ARG-GLU-PRO-ARG-GLY-SER-ASP-ILE-ALA-GLY-THR-THR-SER-THR-LEU-GLN-GLU-GLN-ILE-GLY-TRP-MET-THR-HIS-ASN-PRO-PRO-ILE-PRO-VAL-GLY-GLU-ILE-TYR-LYS-ARG-TRP-ILE-ILE-LEU-GLY-LEU-ASN-LYS-ILE-VAL-ARG-MET-TYR-SER,PRO-VAL-LEU-PHE-PRO-GLY-GLN-PRO-PHE-GLY-GLN-PRO-PRO-LEU-GLY,146,15,CC(C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)CCC(=O)N)Cc1ccccc1)CCC(=O)N)Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCC[NH2+]1)C,Kd=362uM,3.441291,3.44,1,A,A,1,A,A,0,,B,A,,1,1,146,15,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)NCC(=O)O,0.7385114431381226,0.3905500173568725,53.06981658935547,56.53474807739258,0.8510059714317322,1.6965553760528564,0.6876276731491089,0.5445680022239685,0.6930025815963745,0.3306414186954498,PVLFPGQPFGQPPLG,Low,"(2.044, 3.548]",train
4B60,protein-peptide,P02679 P14738,GPAMAKVETGTDVTSKVTVEIGSIEGHNNTNKVEPHAGQRAVLKYKLKFENGLHQGDYFDFTLSNNVNTHGVSTARKVPEIKNGSVVMATGEVLEGGKIRYTFTNDIEDKVDVTAELEINLFIDPKTVQTNGNQTITSTLNEEQTSKELDVKYKDGIGNYYANLNGSIETFNKANNRFSHVAFIKPNNGKTTSVTVTGTLMKGSNQNGNQPKVRIFEYLGNNEDIAKSVYANTTDTSKFKEVTSNMSGNLNLQNNGSYSLNIENLDKTYVVHYDGEYLNGTDEVDFRTQMVGHPEQLYKYYYDRGYTLTWDNGLVLYSNKA,GEGQQHHLGGAKQAGDV,GLY-PRO-ALA-MET-ALA-LYS-VAL-GLU-THR-GLY-THR-ASP-VAL-THR-SER-LYS-VAL-THR-VAL-GLU-ILE-GLY-SER-ILE-GLU-GLY-HIS-ASN-ASN-THR-ASN-LYS-VAL-GLU-PRO-HIS-ALA-GLY-GLN-ARG-ALA-VAL-LEU-LYS-TYR-LYS-LEU-LYS-PHE-GLU-ASN-GLY-LEU-HIS-GLN-GLY-ASP-TYR-PHE-ASP-PHE-THR-LEU-SER-ASN-ASN-VAL-ASN-THR-HIS-GLY-VAL-SER-THR-ALA-ARG-LYS-VAL-PRO-GLU-ILE-LYS-ASN-GLY-SER-VAL-VAL-MET-ALA-THR-GLY-GLU-VAL-LEU-GLU-GLY-GLY-LYS-ILE-ARG-TYR-THR-PHE-THR-ASN-ASP-ILE-GLU-ASP-LYS-VAL-ASP-VAL-THR-ALA-GLU-LEU-GLU-ILE-ASN-LEU-PHE-ILE-ASP-PRO-LYS-THR-VAL-GLN-THR-ASN-GLY-ASN-GLN-THR-ILE-THR-SER-THR-LEU-ASN-GLU-GLU-GLN-THR-SER-LYS-GLU-LEU-ASP-VAL-LYS-TYR-LYS-ASP-GLY-ILE-GLY-ASN-TYR-TYR-ALA-ASN-LEU-ASN-GLY-SER-ILE-GLU-THR-PHE-ASN-LYS-ALA-ASN-ASN-ARG-PHE-SER-HIS-VAL-ALA-PHE-ILE-LYS-PRO-ASN-ASN-GLY-LYS-THR-THR-SER-VAL-THR-VAL-THR-GLY-THR-LEU-MET-LYS-GLY-SER-ASN-GLN-ASN-GLY-ASN-GLN-PRO-LYS-VAL-ARG-ILE-PHE-GLU-TYR-LEU-GLY-ASN-ASN-GLU-ASP-ILE-ALA-LYS-SER-VAL-TYR-ALA-ASN-THR-THR-ASP-THR-SER-LYS-PHE-LYS-GLU-VAL-THR-SER-ASN-MET-SER-GLY-ASN-LEU-ASN-LEU-GLN-ASN-ASN-GLY-SER-TYR-SER-LEU-ASN-ILE-GLU-ASN-LEU-ASP-LYS-THR-TYR-VAL-VAL-HIS-TYR-ASP-GLY-GLU-TYR-LEU-ASN-GLY-THR-ASP-GLU-VAL-ASP-PHE-ARG-THR-GLN-MET-VAL-GLY-HIS-PRO-GLU-GLN-LEU-TYR-LYS-TYR-TYR-TYR-ASP-ARG-GLY-TYR-THR-LEU-THR-TRP-ASP-ASN-GLY-LEU-VAL-LEU-TYR-SER-ASN-LYS-ALA,GLY-GLU-GLY-GLN-GLN-HIS-HIS-LEU-GLY-GLY-ALA-LYS-GLN-ALA-GLY-ASP-VAL,321,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(=O)O)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N)[NH3+])CCC(=O)N)Cc1nc[nH]c1)Cc1nc[nH]c1)CC(C)C)C,Kd=3.7uM,5.431798,5.43,1,A,A,1,A,A,0,,C,A,,1,1,321,17,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)NCC(=O)N[C@@H](CCC(=O)NCC(=O)O)C(=O)O,0.888380229473114,0.8599281311035156,86.06421661376953,82.88961791992188,0.4375459253787994,0.633013129234314,0.8998029232025146,0.8926993012428284,0.8337493538856506,0.8517352938652039,GEGQQHHLGGAKQAGDV,Low,"(5.31, 5.463]",train
4B8P,protein-peptide,Q71VM4,GSGMKETAAAKFERQHMDSPDLGTDDDDKAMADIGSSLPAMIGGVYSDDNNLQLEATTQFRKLLSIERSPPIEEVIQSGVVPRFVQFLTREDFPQLQFEAAWALTNIASGTSENTKVVIDHGAVPIFVKLLGSSSDDVREQAVWALGNVAGDSPKCRDLVLANGALLPLLAQLNEHTKLSMLRNATWTLSNFCRGKPQPSFEQTRPALPALARLIHSNDEEVLTDACWALSYLSDGTNDKIQAVIEAGVCPRLVELLLHPSPSVLIPALRTVGNIVTGDDAQTQCIIDHQALPCLLSLLTQNLKKSIKKEACWTISNITAGNKDQIQAVINAGIIGPLVNLLQTAEFDIKKEAAWAISNATSGGSHDQIKYLVSEGCIKPLCDLLICPDIRIVTVCLEGLENILKVGETDKTLAAGDVNVFSQMIDEAEGLEKIENLQSHDNNEIYEKAVKILEAYWMDEEDDTMGATTVAAPQGATFDFGQGGGAAQFK,VHKTVLGKRKYW,GLY-SER-GLY-MET-LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LYS-ALA-MET-ALA-ASP-ILE-GLY-SER-SER-LEU-PRO-ALA-MET-ILE-GLY-GLY-VAL-TYR-SER-ASP-ASP-ASN-ASN-LEU-GLN-LEU-GLU-ALA-THR-THR-GLN-PHE-ARG-LYS-LEU-LEU-SER-ILE-GLU-ARG-SER-PRO-PRO-ILE-GLU-GLU-VAL-ILE-GLN-SER-GLY-VAL-VAL-PRO-ARG-PHE-VAL-GLN-PHE-LEU-THR-ARG-GLU-ASP-PHE-PRO-GLN-LEU-GLN-PHE-GLU-ALA-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-ASN-THR-LYS-VAL-VAL-ILE-ASP-HIS-GLY-ALA-VAL-PRO-ILE-PHE-VAL-LYS-LEU-LEU-GLY-SER-SER-SER-ASP-ASP-VAL-ARG-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-VAL-ALA-GLY-ASP-SER-PRO-LYS-CYS-ARG-ASP-LEU-VAL-LEU-ALA-ASN-GLY-ALA-LEU-LEU-PRO-LEU-LEU-ALA-GLN-LEU-ASN-GLU-HIS-THR-LYS-LEU-SER-MET-LEU-ARG-ASN-ALA-THR-TRP-THR-LEU-SER-ASN-PHE-CYS-ARG-GLY-LYS-PRO-GLN-PRO-SER-PHE-GLU-GLN-THR-ARG-PRO-ALA-LEU-PRO-ALA-LEU-ALA-ARG-LEU-ILE-HIS-SER-ASN-ASP-GLU-GLU-VAL-LEU-THR-ASP-ALA-CYS-TRP-ALA-LEU-SER-TYR-LEU-SER-ASP-GLY-THR-ASN-ASP-LYS-ILE-GLN-ALA-VAL-ILE-GLU-ALA-GLY-VAL-CYS-PRO-ARG-LEU-VAL-GLU-LEU-LEU-LEU-HIS-PRO-SER-PRO-SER-VAL-LEU-ILE-PRO-ALA-LEU-ARG-THR-VAL-GLY-ASN-ILE-VAL-THR-GLY-ASP-ASP-ALA-GLN-THR-GLN-CYS-ILE-ILE-ASP-HIS-GLN-ALA-LEU-PRO-CYS-LEU-LEU-SER-LEU-LEU-THR-GLN-ASN-LEU-LYS-LYS-SER-ILE-LYS-LYS-GLU-ALA-CYS-TRP-THR-ILE-SER-ASN-ILE-THR-ALA-GLY-ASN-LYS-ASP-GLN-ILE-GLN-ALA-VAL-ILE-ASN-ALA-GLY-ILE-ILE-GLY-PRO-LEU-VAL-ASN-LEU-LEU-GLN-THR-ALA-GLU-PHE-ASP-ILE-LYS-LYS-GLU-ALA-ALA-TRP-ALA-ILE-SER-ASN-ALA-THR-SER-GLY-GLY-SER-HIS-ASP-GLN-ILE-LYS-TYR-LEU-VAL-SER-GLU-GLY-CYS-ILE-LYS-PRO-LEU-CYS-ASP-LEU-LEU-ILE-CYS-PRO-ASP-ILE-ARG-ILE-VAL-THR-VAL-CYS-LEU-GLU-GLY-LEU-GLU-ASN-ILE-LEU-LYS-VAL-GLY-GLU-THR-ASP-LYS-THR-LEU-ALA-ALA-GLY-ASP-VAL-ASN-VAL-PHE-SER-GLN-MET-ILE-ASP-GLU-ALA-GLU-GLY-LEU-GLU-LYS-ILE-GLU-ASN-LEU-GLN-SER-HIS-ASP-ASN-ASN-GLU-ILE-TYR-GLU-LYS-ALA-VAL-LYS-ILE-LEU-GLU-ALA-TYR-TRP-MET-ASP-GLU-GLU-ASP-ASP-THR-MET-GLY-ALA-THR-THR-VAL-ALA-ALA-PRO-GLN-GLY-ALA-THR-PHE-ASP-PHE-GLY-GLN-GLY-GLY-GLY-ALA-ALA-GLN-PHE-LYS,VAL-HIS-LYS-THR-VAL-LEU-GLY-LYS-ARG-LYS-TYR-TRP,490,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@H](O)C)[NH3+])CC(C)C,Kd=0.14uM,6.853872,6.85,1,A,A,1,A,A,0,,C,A,,1,1,490,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,0.8193036317825317,0.7284130454063416,79.12887573242188,78.75308990478516,0.4945558905601501,1.0300636291503906,0.8487177491188049,0.8081733584403992,0.7534341216087341,0.670207679271698,VHKTVLGKRKYW,Low,"(6.824, 7.049]",val
4B9W,protein-peptide,Q8CDG1 Q99MV1,GPAEALEWTWVEFTVDETVDVVVCMMYSPGEFYCHFLKDDALEKLDDLNQSLADYCAQKPPNGFKAEIGRPCCAFFSGDGNWYRALVKEILPSGNVKVHFVDYGNVEEVTTDQLQAILPQFLLLPFQGMQCWLVDIQPPNKHWTKEATARFQACVVGLKLQARVVEITANGVGVELTDLSTPYPKIISDVLIREQLVLRCG,GRAGPAGRGLVFR,GLY-PRO-ALA-GLU-ALA-LEU-GLU-TRP-THR-TRP-VAL-GLU-PHE-THR-VAL-ASP-GLU-THR-VAL-ASP-VAL-VAL-VAL-CYS-MET-MET-TYR-SER-PRO-GLY-GLU-PHE-TYR-CYS-HIS-PHE-LEU-LYS-ASP-ASP-ALA-LEU-GLU-LYS-LEU-ASP-ASP-LEU-ASN-GLN-SER-LEU-ALA-ASP-TYR-CYS-ALA-GLN-LYS-PRO-PRO-ASN-GLY-PHE-LYS-ALA-GLU-ILE-GLY-ARG-PRO-CYS-CYS-ALA-PHE-PHE-SER-GLY-ASP-GLY-ASN-TRP-TYR-ARG-ALA-LEU-VAL-LYS-GLU-ILE-LEU-PRO-SER-GLY-ASN-VAL-LYS-VAL-HIS-PHE-VAL-ASP-TYR-GLY-ASN-VAL-GLU-GLU-VAL-THR-THR-ASP-GLN-LEU-GLN-ALA-ILE-LEU-PRO-GLN-PHE-LEU-LEU-LEU-PRO-PHE-GLN-GLY-MET-GLN-CYS-TRP-LEU-VAL-ASP-ILE-GLN-PRO-PRO-ASN-LYS-HIS-TRP-THR-LYS-GLU-ALA-THR-ALA-ARG-PHE-GLN-ALA-CYS-VAL-VAL-GLY-LEU-LYS-LEU-GLN-ALA-ARG-VAL-VAL-GLU-ILE-THR-ALA-ASN-GLY-VAL-GLY-VAL-GLU-LEU-THR-ASP-LEU-SER-THR-PRO-TYR-PRO-LYS-ILE-ILE-SER-ASP-VAL-LEU-ILE-ARG-GLU-GLN-LEU-VAL-LEU-ARG-CYS-GLY,GLY-ARG-ALA-GLY-PRO-ALA-GLY-2MR-GLY-LEU-VAL-PHE-ARG,201,13,CNC(=[NH+]CCC[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC[NH+]=C(N)N)Cc1ccccc1)C(C)C)CC(C)C)NC(=O)CNC(=O)[C@@H]([NH3+])C)NC,Kd=68.0uM,4.167491,4.17,1,A,A,1,A,A,0,,P,A,dimer,1,1,201,13,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CN=C(NC)NCCCC(NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.9395523071289062,0.8858452439308167,93.28082275390624,90.1764144897461,0.3430946767330169,0.5576099157333374,0.9315178394317628,0.9121409058570862,0.8860702514648438,0.8606145977973938,GRAGPAGRGLVFR,Low,"(4.155, 4.319]",train
4BA3,protein-peptide,P52293,GSGMKETAAAKFERQHMDSPDLGTDDDDKAMADIGSNQGTVNWSVEDIVKGINSNNLESQLQATQAARKLLSREKQPPIDNIIRAGLIPKFVSFLGKTDCSPIQFESAWALTNIASGTSEQTKAVVDGGAIPAFISLLASPHAHISEQAVWALGNIAGDGSAFRDLVIKHGAIDPLLALLAVPDLSTLACGYLRNLTWTLSNLCRNKNPAPPLDAVEQILPTLVRLLHHNDPEVLADSCWAISYLTDGPNERIEMVVKKGVVPQLVKLLGATELPIVTPALRAIGNIVTGTDEQTQKVIDAGALAVFPSLLTNPKTNIQKEATWTMSNITAGRQDQIQQVVNHGLVPFLVGVLSKADFKTQKEAAWAITNYTSGGTVEQIVYLVHCGIIEPLMNLLSAKDTKIIQVILDAISNIFQAAEKLGETEKLSIMIEECGGLDKIEALQRHENESVYKASLNLIEKYFSVEEEEDQNVVPETTSEGFAFQVQDGAPGTFNF,VHKTVLGKRKYW,GLY-SER-GLY-MET-LYS-GLU-THR-ALA-ALA-ALA-LYS-PHE-GLU-ARG-GLN-HIS-MET-ASP-SER-PRO-ASP-LEU-GLY-THR-ASP-ASP-ASP-ASP-LYS-ALA-MET-ALA-ASP-ILE-GLY-SER-ASN-GLN-GLY-THR-VAL-ASN-TRP-SER-VAL-GLU-ASP-ILE-VAL-LYS-GLY-ILE-ASN-SER-ASN-ASN-LEU-GLU-SER-GLN-LEU-GLN-ALA-THR-GLN-ALA-ALA-ARG-LYS-LEU-LEU-SER-ARG-GLU-LYS-GLN-PRO-PRO-ILE-ASP-ASN-ILE-ILE-ARG-ALA-GLY-LEU-ILE-PRO-LYS-PHE-VAL-SER-PHE-LEU-GLY-LYS-THR-ASP-CYS-SER-PRO-ILE-GLN-PHE-GLU-SER-ALA-TRP-ALA-LEU-THR-ASN-ILE-ALA-SER-GLY-THR-SER-GLU-GLN-THR-LYS-ALA-VAL-VAL-ASP-GLY-GLY-ALA-ILE-PRO-ALA-PHE-ILE-SER-LEU-LEU-ALA-SER-PRO-HIS-ALA-HIS-ILE-SER-GLU-GLN-ALA-VAL-TRP-ALA-LEU-GLY-ASN-ILE-ALA-GLY-ASP-GLY-SER-ALA-PHE-ARG-ASP-LEU-VAL-ILE-LYS-HIS-GLY-ALA-ILE-ASP-PRO-LEU-LEU-ALA-LEU-LEU-ALA-VAL-PRO-ASP-LEU-SER-THR-LEU-ALA-CYS-GLY-TYR-LEU-ARG-ASN-LEU-THR-TRP-THR-LEU-SER-ASN-LEU-CYS-ARG-ASN-LYS-ASN-PRO-ALA-PRO-PRO-LEU-ASP-ALA-VAL-GLU-GLN-ILE-LEU-PRO-THR-LEU-VAL-ARG-LEU-LEU-HIS-HIS-ASN-ASP-PRO-GLU-VAL-LEU-ALA-ASP-SER-CYS-TRP-ALA-ILE-SER-TYR-LEU-THR-ASP-GLY-PRO-ASN-GLU-ARG-ILE-GLU-MET-VAL-VAL-LYS-LYS-GLY-VAL-VAL-PRO-GLN-LEU-VAL-LYS-LEU-LEU-GLY-ALA-THR-GLU-LEU-PRO-ILE-VAL-THR-PRO-ALA-LEU-ARG-ALA-ILE-GLY-ASN-ILE-VAL-THR-GLY-THR-ASP-GLU-GLN-THR-GLN-LYS-VAL-ILE-ASP-ALA-GLY-ALA-LEU-ALA-VAL-PHE-PRO-SER-LEU-LEU-THR-ASN-PRO-LYS-THR-ASN-ILE-GLN-LYS-GLU-ALA-THR-TRP-THR-MET-SER-ASN-ILE-THR-ALA-GLY-ARG-GLN-ASP-GLN-ILE-GLN-GLN-VAL-VAL-ASN-HIS-GLY-LEU-VAL-PRO-PHE-LEU-VAL-GLY-VAL-LEU-SER-LYS-ALA-ASP-PHE-LYS-THR-GLN-LYS-GLU-ALA-ALA-TRP-ALA-ILE-THR-ASN-TYR-THR-SER-GLY-GLY-THR-VAL-GLU-GLN-ILE-VAL-TYR-LEU-VAL-HIS-CYS-GLY-ILE-ILE-GLU-PRO-LEU-MET-ASN-LEU-LEU-SER-ALA-LYS-ASP-THR-LYS-ILE-ILE-GLN-VAL-ILE-LEU-ASP-ALA-ILE-SER-ASN-ILE-PHE-GLN-ALA-ALA-GLU-LYS-LEU-GLY-GLU-THR-GLU-LYS-LEU-SER-ILE-MET-ILE-GLU-GLU-CYS-GLY-GLY-LEU-ASP-LYS-ILE-GLU-ALA-LEU-GLN-ARG-HIS-GLU-ASN-GLU-SER-VAL-TYR-LYS-ALA-SER-LEU-ASN-LEU-ILE-GLU-LYS-TYR-PHE-SER-VAL-GLU-GLU-GLU-GLU-ASP-GLN-ASN-VAL-VAL-PRO-GLU-THR-THR-SER-GLU-GLY-PHE-ALA-PHE-GLN-VAL-GLN-ASP-GLY-ALA-PRO-GLY-THR-PHE-ASN-PHE,VAL-HIS-LYS-THR-VAL-LEU-GLY-LYS-ARG-LYS-TYR-TRP,496,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCCC[NH3+])CCC[NH+]=C(N)N)NC(=O)CNC(=O)[C@H](CC(C)C)[NH3+],Kd=2.9uM,5.537602,5.54,1,A,A,1,A,A,0,,B,A,,1,1,496,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,0.9377591609954834,0.8012412786483765,82.64922332763672,83.1443862915039,0.521238386631012,1.0082865953445437,0.8432864546775818,0.8148255944252014,0.8678733706474304,0.719720184803009,VHKTVLGKRKYW,Low,"(5.463, 5.6]",train
4BD3,protein-peptide,Q5T6S3 P68431,SKLTEGQYVLCRWTDGLYYLGKIKRVSSSKQSCLVTFEDNSKYWVLWKDIQHAGVPGE,ATGGVKKPHRY,SER-LYS-LEU-THR-GLU-GLY-GLN-TYR-VAL-LEU-CYS-ARG-TRP-THR-ASP-GLY-LEU-TYR-TYR-LEU-GLY-LYS-ILE-LYS-ARG-VAL-SER-SER-SER-LYS-GLN-SER-CYS-LEU-VAL-THR-PHE-GLU-ASP-ASN-SER-LYS-TYR-TRP-VAL-LEU-TRP-LYS-ASP-ILE-GLN-HIS-ALA-GLY-VAL-PRO-GLY-GLU,ALA-THR-GLY-GLY-VAL-M3L-LYS-PRO-HIS-ARG-TYR,58,11,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)Cc1nc[nH]c1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CCCC[N+](C)(C)C,Kd=29uM,4.537602,4.54,1,A,A,1,A,A,0,,B,A,,1,1,58,11,0,CC(C)[C@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C(CCCC[N+](C)(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O,0.8759943246841431,0.7853837013244629,93.67157745361328,91.61005401611328,0.3459329605102539,0.64228355884552,0.8739104866981506,0.8316341042518616,0.7768775820732117,0.7738211154937744,ATGGVKKPHRY,Low,"(4.456, 4.606]",val
4BG6,protein-peptide,P61587 P63104,MDKNELVQKAKLAEQAERYDDMAACMKSVTEQGAELSNEERNLLSVAYKNVVGARRSSWRVVSSIEQKTEGAEKKQQMAREYREKIETELRDICNDVLSLLEKFLIPNASQAESKVFYLKMKGDYYRYLAEVAAGDDKKGIVDQSQQAYQEAFEISKKEMQPTHPIRLGLALNFSVFYYEILNSPEKACSLAKTAFDEAIAELDTLSEESYKDSTLIMQLLRDNLTLWTSDTQGDEAEAGEGGEN,DLRKDKAKSC,MET-ASP-LYS-ASN-GLU-LEU-VAL-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-ASP-ASP-MET-ALA-ALA-CYS-MET-LYS-SER-VAL-THR-GLU-GLN-GLY-ALA-GLU-LEU-SER-ASN-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-ALA-ARG-ARG-SER-SER-TRP-ARG-VAL-VAL-SER-SER-ILE-GLU-GLN-LYS-THR-GLU-GLY-ALA-GLU-LYS-LYS-GLN-GLN-MET-ALA-ARG-GLU-TYR-ARG-GLU-LYS-ILE-GLU-THR-GLU-LEU-ARG-ASP-ILE-CYS-ASN-ASP-VAL-LEU-SER-LEU-LEU-GLU-LYS-PHE-LEU-ILE-PRO-ASN-ALA-SER-GLN-ALA-GLU-SER-LYS-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-ALA-GLY-ASP-ASP-LYS-LYS-GLY-ILE-VAL-ASP-GLN-SER-GLN-GLN-ALA-TYR-GLN-GLU-ALA-PHE-GLU-ILE-SER-LYS-LYS-GLU-MET-GLN-PRO-THR-HIS-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-TYR-TYR-GLU-ILE-LEU-ASN-SER-PRO-GLU-LYS-ALA-CYS-SER-LEU-ALA-LYS-THR-ALA-PHE-ASP-GLU-ALA-ILE-ALA-GLU-LEU-ASP-THR-LEU-SER-GLU-GLU-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR-SER-ASP-THR-GLN-GLY-ASP-GLU-ALA-GLU-ALA-GLY-GLU-GLY-GLY-GLU-ASN,ASP-LEU-ARG-LYS-ASP-LYS-ALA-LYS-SEP-CYS,245,10,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CS)COP(O)(O)O)CCCC[NH3+])C)NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(=O)O,Kd=0.069uM,7.161151,7.16,1,A,A,1,A,A,0,,Q,A,,1,1,245,10,0,CC(C)C[C@H](NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)C(COP(=O)(O)O)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.8910393714904785,0.8358905911445618,84.67882537841797,86.22513580322266,0.3513489961624145,0.6827306151390076,0.9198452234268188,0.8853155970573425,0.8348182439804077,0.7980241179466248,DLRKDKAKSC,Moderate,"(7.049, 7.268]",train
4BLB,protein-peptide,P08151 Q9UMX1 P0AEX9,MKTEEGKLVIWINGDKGYNGLAEVGKKFEKDTGIKVTVEHPDKLEEKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDAVRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDKELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKNKHMNADTDYSIAEHAFNHGETAMTINGPWAWSNIDTSKVNYGVTVLPTFKGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEGLEAVNKDKPLGAVALKSYEEELAKDPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASGRQTVDAALAAAQTNAAAPGLHAIYGECRRLYPDQPNPLQVTAIVKYDSFGPDPLDYVSMYRNVGSPSANIPEHWHYISFGLSDLYGDNRVHEFTGTDGPSGFGFELTFRLKRETGESAPPTWPAELMQGLARYVFQSENTFCSGDHVSWHSPLDNSESRIQHMLLTEDPQMQPVQTPFGVVTFLQIVGVCTEELHSAQQWNGQGILELLRTVPIAGGPWLITDMRRGETIFEIDPHLQERVDKGIETDGSNLSGVSAKCAWDDLPSRGEDPIRTRQLESVHLKFNQESGALIPLCLRGRLLHGRHFTYKSITGDMAITFVSTGVEGAFATEEHPYAAHGPWLQILLTEEFVEKMLEDLEDLTSAALPKEYSWPEKKLKVSILPDVVFDSPLVEHHHHHH,TSPGGSYGHLSIGTMSP,MET-LYS-THR-GLU-GLU-GLY-LYS-LEU-VAL-ILE-TRP-ILE-ASN-GLY-ASP-LYS-GLY-TYR-ASN-GLY-LEU-ALA-GLU-VAL-GLY-LYS-LYS-PHE-GLU-LYS-ASP-THR-GLY-ILE-LYS-VAL-THR-VAL-GLU-HIS-PRO-ASP-LYS-LEU-GLU-GLU-LYS-PHE-PRO-GLN-VAL-ALA-ALA-THR-GLY-ASP-GLY-PRO-ASP-ILE-ILE-PHE-TRP-ALA-HIS-ASP-ARG-PHE-GLY-GLY-TYR-ALA-GLN-SER-GLY-LEU-LEU-ALA-GLU-ILE-THR-PRO-ASP-LYS-ALA-PHE-GLN-ASP-LYS-LEU-TYR-PRO-PHE-THR-TRP-ASP-ALA-VAL-ARG-TYR-ASN-GLY-LYS-LEU-ILE-ALA-TYR-PRO-ILE-ALA-VAL-GLU-ALA-LEU-SER-LEU-ILE-TYR-ASN-LYS-ASP-LEU-LEU-PRO-ASN-PRO-PRO-LYS-THR-TRP-GLU-GLU-ILE-PRO-ALA-LEU-ASP-LYS-GLU-LEU-LYS-ALA-LYS-GLY-LYS-SER-ALA-LEU-MET-PHE-ASN-LEU-GLN-GLU-PRO-TYR-PHE-THR-TRP-PRO-LEU-ILE-ALA-ALA-ASP-GLY-GLY-TYR-ALA-PHE-LYS-TYR-GLU-ASN-GLY-LYS-TYR-ASP-ILE-LYS-ASP-VAL-GLY-VAL-ASP-ASN-ALA-GLY-ALA-LYS-ALA-GLY-LEU-THR-PHE-LEU-VAL-ASP-LEU-ILE-LYS-ASN-LYS-HIS-MET-ASN-ALA-ASP-THR-ASP-TYR-SER-ILE-ALA-GLU-HIS-ALA-PHE-ASN-HIS-GLY-GLU-THR-ALA-MET-THR-ILE-ASN-GLY-PRO-TRP-ALA-TRP-SER-ASN-ILE-ASP-THR-SER-LYS-VAL-ASN-TYR-GLY-VAL-THR-VAL-LEU-PRO-THR-PHE-LYS-GLY-GLN-PRO-SER-LYS-PRO-PHE-VAL-GLY-VAL-LEU-SER-ALA-GLY-ILE-ASN-ALA-ALA-SER-PRO-ASN-LYS-GLU-LEU-ALA-LYS-GLU-PHE-LEU-GLU-ASN-TYR-LEU-LEU-THR-ASP-GLU-GLY-LEU-GLU-ALA-VAL-ASN-LYS-ASP-LYS-PRO-LEU-GLY-ALA-VAL-ALA-LEU-LYS-SER-TYR-GLU-GLU-GLU-LEU-ALA-LYS-ASP-PRO-ARG-ILE-ALA-ALA-THR-MET-GLU-ASN-ALA-GLN-LYS-GLY-GLU-ILE-MET-PRO-ASN-ILE-PRO-GLN-MET-SER-ALA-PHE-TRP-TYR-ALA-VAL-ARG-THR-ALA-VAL-ILE-ASN-ALA-ALA-SER-GLY-ARG-GLN-THR-VAL-ASP-ALA-ALA-LEU-ALA-ALA-ALA-GLN-THR-ASN-ALA-ALA-ALA-PRO-GLY-LEU-HIS-ALA-ILE-TYR-GLY-GLU-CYS-ARG-ARG-LEU-TYR-PRO-ASP-GLN-PRO-ASN-PRO-LEU-GLN-VAL-THR-ALA-ILE-VAL-LYS-TYR-ASP-SER-PHE-GLY-PRO-ASP-PRO-LEU-ASP-TYR-VAL-SER-MET-TYR-ARG-ASN-VAL-GLY-SER-PRO-SER-ALA-ASN-ILE-PRO-GLU-HIS-TRP-HIS-TYR-ILE-SER-PHE-GLY-LEU-SER-ASP-LEU-TYR-GLY-ASP-ASN-ARG-VAL-HIS-GLU-PHE-THR-GLY-THR-ASP-GLY-PRO-SER-GLY-PHE-GLY-PHE-GLU-LEU-THR-PHE-ARG-LEU-LYS-ARG-GLU-THR-GLY-GLU-SER-ALA-PRO-PRO-THR-TRP-PRO-ALA-GLU-LEU-MET-GLN-GLY-LEU-ALA-ARG-TYR-VAL-PHE-GLN-SER-GLU-ASN-THR-PHE-CYS-SER-GLY-ASP-HIS-VAL-SER-TRP-HIS-SER-PRO-LEU-ASP-ASN-SER-GLU-SER-ARG-ILE-GLN-HIS-MET-LEU-LEU-THR-GLU-ASP-PRO-GLN-MET-GLN-PRO-VAL-GLN-THR-PRO-PHE-GLY-VAL-VAL-THR-PHE-LEU-GLN-ILE-VAL-GLY-VAL-CYS-THR-GLU-GLU-LEU-HIS-SER-ALA-GLN-GLN-TRP-ASN-GLY-GLN-GLY-ILE-LEU-GLU-LEU-LEU-ARG-THR-VAL-PRO-ILE-ALA-GLY-GLY-PRO-TRP-LEU-ILE-THR-ASP-MET-ARG-ARG-GLY-GLU-THR-ILE-PHE-GLU-ILE-ASP-PRO-HIS-LEU-GLN-GLU-ARG-VAL-ASP-LYS-GLY-ILE-GLU-THR-ASP-GLY-SER-ASN-LEU-SER-GLY-VAL-SER-ALA-LYS-CYS-ALA-TRP-ASP-ASP-LEU-PRO-SER-ARG-GLY-GLU-ASP-PRO-ILE-ARG-THR-ARG-GLN-LEU-GLU-SER-VAL-HIS-LEU-LYS-PHE-ASN-GLN-GLU-SER-GLY-ALA-LEU-ILE-PRO-LEU-CYS-LEU-ARG-GLY-ARG-LEU-LEU-HIS-GLY-ARG-HIS-PHE-THR-TYR-LYS-SER-ILE-THR-GLY-ASP-MET-ALA-ILE-THR-PHE-VAL-SER-THR-GLY-VAL-GLU-GLY-ALA-PHE-ALA-THR-GLU-GLU-HIS-PRO-TYR-ALA-ALA-HIS-GLY-PRO-TRP-LEU-GLN-ILE-LEU-LEU-THR-GLU-GLU-PHE-VAL-GLU-LYS-MET-LEU-GLU-ASP-LEU-GLU-ASP-LEU-THR-SER-ALA-ALA-LEU-PRO-LYS-GLU-TYR-SER-TRP-PRO-GLU-LYS-LYS-LEU-LYS-VAL-SER-ILE-LEU-PRO-ASP-VAL-VAL-PHE-ASP-SER-PRO-LEU-VAL-GLU-HIS-HIS-HIS-HIS-HIS-HIS,THR-SER-PRO-GLY-GLY-SER-TYR-GLY-HIS-LEU-SER-ILE-GLY-THR-MET-SER-PRO,753,17,CC[C@@H]([C@@H](C(=O)NCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])Cc1ccc(cc1)O)CC(C)C)CO)C,Kd=4.47uM,5.349692,5.35,1,A,A,1,A,A,0,,E,A,,1,1,753,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.772469162940979,0.5430318713188171,67.43698120117188,60.19590759277344,0.5844714045524597,1.661447286605835,0.801196277141571,0.7002953290939331,0.7433717250823975,0.4962459206581116,TSPGGSYGHLSIGTMSP,Low,"(5.31, 5.463]",train
4BV2,protein-peptide,Q9WYW0 P04637,MKMKEFLDLLNESRLTVTLTGAGISTPSGIPDFRGPNGIYKKYSQNVFDIDFFYSHPEEFYRFAKEGIFPMLQAKPNLAHVLLAKLEEKGLIEAVITQNIDRLHQRAGSKKVIELHGNVEEYYCVRCEKKYTVEDVIKKLESSDVPLCDDCNSLIRPNIVFFGENLPQDALREAIGLSSRASLMIVLGSSLVVYPAAELPLITVRSGGKLVIVNLGETPFDDIATLKYNMDVVEFARRVMEEGGIS,STSRHKKLMFKTE,MET-LYS-MET-LYS-GLU-PHE-LEU-ASP-LEU-LEU-ASN-GLU-SER-ARG-LEU-THR-VAL-THR-LEU-THR-GLY-ALA-GLY-ILE-SER-THR-PRO-SER-GLY-ILE-PRO-ASP-PHE-ARG-GLY-PRO-ASN-GLY-ILE-TYR-LYS-LYS-TYR-SER-GLN-ASN-VAL-PHE-ASP-ILE-ASP-PHE-PHE-TYR-SER-HIS-PRO-GLU-GLU-PHE-TYR-ARG-PHE-ALA-LYS-GLU-GLY-ILE-PHE-PRO-MET-LEU-GLN-ALA-LYS-PRO-ASN-LEU-ALA-HIS-VAL-LEU-LEU-ALA-LYS-LEU-GLU-GLU-LYS-GLY-LEU-ILE-GLU-ALA-VAL-ILE-THR-GLN-ASN-ILE-ASP-ARG-LEU-HIS-GLN-ARG-ALA-GLY-SER-LYS-LYS-VAL-ILE-GLU-LEU-HIS-GLY-ASN-VAL-GLU-GLU-TYR-TYR-CYS-VAL-ARG-CYS-GLU-LYS-LYS-TYR-THR-VAL-GLU-ASP-VAL-ILE-LYS-LYS-LEU-GLU-SER-SER-ASP-VAL-PRO-LEU-CYS-ASP-ASP-CYS-ASN-SER-LEU-ILE-ARG-PRO-ASN-ILE-VAL-PHE-PHE-GLY-GLU-ASN-LEU-PRO-GLN-ASP-ALA-LEU-ARG-GLU-ALA-ILE-GLY-LEU-SER-SER-ARG-ALA-SER-LEU-MET-ILE-VAL-LEU-GLY-SER-SER-LEU-VAL-VAL-TYR-PRO-ALA-ALA-GLU-LEU-PRO-LEU-ILE-THR-VAL-ARG-SER-GLY-GLY-LYS-LEU-VAL-ILE-VAL-ASN-LEU-GLY-GLU-THR-PRO-PHE-ASP-ASP-ILE-ALA-THR-LEU-LYS-TYR-ASN-MET-ASP-VAL-VAL-GLU-PHE-ALA-ARG-ARG-VAL-MET-GLU-GLU-GLY-GLY-ILE-SER,SER-THR-SER-ARG-HIS-LYS-LYS-LEU-MET-PHE-LYS-THR-GLU,246,13,CSCC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)[NH3+])CCCC[NH3+])CCCC[NH3+])CC(C)C,Kd>180uM,3.74,3.74,1,A,A,1,A,A,0,,E,A,dimer,1,1,246,13,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)CC[C@H](N)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O,0.8419077396392822,0.7744306921958923,91.12393188476562,89.29336547851562,0.4052139520645141,0.79170823097229,0.912508487701416,0.8726403117179871,0.7928867936134338,0.7498782873153687,STSRHKKLMFKTE,Low,"(3.548, 3.924]",val
4BXU,protein-peptide,O75381 P50542,GAMATPGSENVLPREPLIATAVKFLQNSRVRQSPLATRRAFLKKKGLTDEEIDMAFQQSGTAADEPSSL,ASEDELVAEFLQDQN,GLY-ALA-MET-ALA-THR-PRO-GLY-SER-GLU-ASN-VAL-LEU-PRO-ARG-GLU-PRO-LEU-ILE-ALA-THR-ALA-VAL-LYS-PHE-LEU-GLN-ASN-SER-ARG-VAL-ARG-GLN-SER-PRO-LEU-ALA-THR-ARG-ARG-ALA-PHE-LEU-LYS-LYS-LYS-GLY-LEU-THR-ASP-GLU-GLU-ILE-ASP-MET-ALA-PHE-GLN-GLN-SER-GLY-THR-ALA-ALA-ASP-GLU-PRO-SER-SER-LEU,ALA-SER-GLU-ASP-GLU-LEU-VAL-ALA-GLU-PHE-LEU-GLN-ASP-GLN-ASN,69,15,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CCC(=O)N)CC(=O)O)CCC(=O)N)CC(C)C)Cc1ccccc1)CCC(=O)O)C)C(C)C)CC(C)C)CCC(=O)O)CC(=O)O)CCC(=O)O)NC(=O)[C@@H]([NH3+])C,Kd=100nM,7.0,7.0,1,A,A,1,A,A,0,,B,A,,1,1,69,15,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(C)C)C(=O)O,1.0369462966918943,0.883787214756012,88.90898132324219,83.85888671875,0.374425321817398,0.7227446436882019,0.8241844177246094,0.8098863363265991,0.8594820499420166,0.7754508256912231,ASEDELVAEFLQDQN,Moderate,"(6.824, 7.049]",train
4CY1,protein-peptide,Q7Z3B3 P61964,MGATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDCGA,DGTCVAARTRPVLSY,MET-GLY-ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS-GLY-ALA,ASP-GLY-THR-CYS-VAL-ALA-ALA-ARG-THR-ARG-PRO-VAL-LEU-SER-TYR,316,15,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CO)CC(C)C)C(C)C)CCC[NH+]=C(N)N)[C@H](O)C)CCC[NH+]=C(N)N)C)C)C(C)C)CS)[C@H](O)C,Kd=181nM,6.742321,6.74,1,A,A,1,A,A,0,,C,A,,0,1,316,15,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,0.9076777696609496,0.7194108366966248,94.37799835205078,93.4489288330078,0.3584238290786743,0.8264017105102539,0.923353672027588,0.8723711371421814,0.8508886694908142,0.6811707615852356,DGTCVAARTRPVLSY,Low,"(6.696, 6.824]",train
4DGB,protein-peptide,P04590 P62940,MVNPTVFFDIAVDGEPLGRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGNFTHHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAGPNTNGSQFFICTAKTEWLDGKHVVFGKVKEGMNIVEAMERFGSRNGKTSKKITIADCGQLE,PGPLPA,MET-VAL-ASN-PRO-THR-VAL-PHE-PHE-ASP-ILE-ALA-VAL-ASP-GLY-GLU-PRO-LEU-GLY-ARG-VAL-SER-PHE-GLU-LEU-PHE-ALA-ASP-LYS-VAL-PRO-LYS-THR-ALA-GLU-ASN-PHE-ARG-ALA-LEU-SER-THR-GLY-GLU-LYS-GLY-PHE-GLY-TYR-LYS-GLY-SER-CYS-PHE-HIS-ARG-ILE-ILE-PRO-GLY-PHE-MET-CYS-GLN-GLY-GLY-ASN-PHE-THR-HIS-HIS-ASN-GLY-THR-GLY-GLY-LYS-SER-ILE-TYR-GLY-GLU-LYS-PHE-GLU-ASP-GLU-ASN-PHE-ILE-LEU-LYS-HIS-THR-GLY-PRO-GLY-ILE-LEU-SER-MET-ALA-ASN-ALA-GLY-PRO-ASN-THR-ASN-GLY-SER-GLN-PHE-PHE-ILE-CYS-THR-ALA-LYS-THR-GLU-TRP-LEU-ASP-GLY-LYS-HIS-VAL-VAL-PHE-GLY-LYS-VAL-LYS-GLU-GLY-MET-ASN-ILE-VAL-GLU-ALA-MET-GLU-ARG-PHE-GLY-SER-ARG-ASN-GLY-LYS-THR-SER-LYS-LYS-ILE-THR-ILE-ALA-ASP-CYS-GLY-GLN-LEU-GLU,PRO-GLY-PRO-LEU-PRO-ALA,165,6,CC(C[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCC[NH2+]1)C,Kd=130uM,3.886057,3.89,1,A,A,1,A,A,0,,B,A,,1,1,165,6,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](C)C(=O)O,0.8223208785057068,0.9020336270332336,96.15239715576172,96.42698669433594,0.3704276382923126,0.4336641728878021,0.9315512180328368,0.9319496750831604,0.7730834484100342,0.894554615020752,PGPLPA,Low,"(3.548, 3.924]",train
4DJS,protein-peptide,P35222,LATRAIPELTKLLNDEDQVVVNKAAVMVHQLSKKEASRHAIMRSPQMVSAIVRTMQNTNDVETARCTAGTLHNLSHHREGLLAIFKSGGIPALVKMLGSPVDSVLFYAITTLHNLLLHQEGAKMAVRLAGGLQKMVALLNKTNVKFLAITTDCLQILAYGNQESKLIILASGGPQALVNIMRTYTYEKLLWTTSRVLKVLSVCSSNKPAIVEAGGMQALGLHLTDPSQRLVQNCLWTLRNLSDAATKQEGMEGLLGTLVQLLGSDDINVVTCAAGILSNLTCNNYKNKMMVCQVGGIEALVRTVLRAGDREDITEPAICALRHLTSRHQEAEMAQNAVRLHYGLPVVVKLLHPPSHWPLIKATVGLIRNLALCPANHAPLREQGAIPRLVQLLVRAHQDTQRRTSMGGTQQQFVEGVRMEEIVEGCTGALHILARDVHNRIVIRGLNTIPLFVQLLYSPIENIQRVAAGVLCELAQDKEAAEAIEAEGATAPLTELLHSRNEGVATYAAAVLFRMSED,RRWPQLILDLHVRRVWR,LEU-ALA-THR-ARG-ALA-ILE-PRO-GLU-LEU-THR-LYS-LEU-LEU-ASN-ASP-GLU-ASP-GLN-VAL-VAL-VAL-ASN-LYS-ALA-ALA-VAL-MET-VAL-HIS-GLN-LEU-SER-LYS-LYS-GLU-ALA-SER-ARG-HIS-ALA-ILE-MET-ARG-SER-PRO-GLN-MET-VAL-SER-ALA-ILE-VAL-ARG-THR-MET-GLN-ASN-THR-ASN-ASP-VAL-GLU-THR-ALA-ARG-CYS-THR-ALA-GLY-THR-LEU-HIS-ASN-LEU-SER-HIS-HIS-ARG-GLU-GLY-LEU-LEU-ALA-ILE-PHE-LYS-SER-GLY-GLY-ILE-PRO-ALA-LEU-VAL-LYS-MET-LEU-GLY-SER-PRO-VAL-ASP-SER-VAL-LEU-PHE-TYR-ALA-ILE-THR-THR-LEU-HIS-ASN-LEU-LEU-LEU-HIS-GLN-GLU-GLY-ALA-LYS-MET-ALA-VAL-ARG-LEU-ALA-GLY-GLY-LEU-GLN-LYS-MET-VAL-ALA-LEU-LEU-ASN-LYS-THR-ASN-VAL-LYS-PHE-LEU-ALA-ILE-THR-THR-ASP-CYS-LEU-GLN-ILE-LEU-ALA-TYR-GLY-ASN-GLN-GLU-SER-LYS-LEU-ILE-ILE-LEU-ALA-SER-GLY-GLY-PRO-GLN-ALA-LEU-VAL-ASN-ILE-MET-ARG-THR-TYR-THR-TYR-GLU-LYS-LEU-LEU-TRP-THR-THR-SER-ARG-VAL-LEU-LYS-VAL-LEU-SER-VAL-CYS-SER-SER-ASN-LYS-PRO-ALA-ILE-VAL-GLU-ALA-GLY-GLY-MET-GLN-ALA-LEU-GLY-LEU-HIS-LEU-THR-ASP-PRO-SER-GLN-ARG-LEU-VAL-GLN-ASN-CYS-LEU-TRP-THR-LEU-ARG-ASN-LEU-SER-ASP-ALA-ALA-THR-LYS-GLN-GLU-GLY-MET-GLU-GLY-LEU-LEU-GLY-THR-LEU-VAL-GLN-LEU-LEU-GLY-SER-ASP-ASP-ILE-ASN-VAL-VAL-THR-CYS-ALA-ALA-GLY-ILE-LEU-SER-ASN-LEU-THR-CYS-ASN-ASN-TYR-LYS-ASN-LYS-MET-MET-VAL-CYS-GLN-VAL-GLY-GLY-ILE-GLU-ALA-LEU-VAL-ARG-THR-VAL-LEU-ARG-ALA-GLY-ASP-ARG-GLU-ASP-ILE-THR-GLU-PRO-ALA-ILE-CYS-ALA-LEU-ARG-HIS-LEU-THR-SER-ARG-HIS-GLN-GLU-ALA-GLU-MET-ALA-GLN-ASN-ALA-VAL-ARG-LEU-HIS-TYR-GLY-LEU-PRO-VAL-VAL-VAL-LYS-LEU-LEU-HIS-PRO-PRO-SER-HIS-TRP-PRO-LEU-ILE-LYS-ALA-THR-VAL-GLY-LEU-ILE-ARG-ASN-LEU-ALA-LEU-CYS-PRO-ALA-ASN-HIS-ALA-PRO-LEU-ARG-GLU-GLN-GLY-ALA-ILE-PRO-ARG-LEU-VAL-GLN-LEU-LEU-VAL-ARG-ALA-HIS-GLN-ASP-THR-GLN-ARG-ARG-THR-SER-MET-GLY-GLY-THR-GLN-GLN-GLN-PHE-VAL-GLU-GLY-VAL-ARG-MET-GLU-GLU-ILE-VAL-GLU-GLY-CYS-THR-GLY-ALA-LEU-HIS-ILE-LEU-ALA-ARG-ASP-VAL-HIS-ASN-ARG-ILE-VAL-ILE-ARG-GLY-LEU-ASN-THR-ILE-PRO-LEU-PHE-VAL-GLN-LEU-LEU-TYR-SER-PRO-ILE-GLU-ASN-ILE-GLN-ARG-VAL-ALA-ALA-GLY-VAL-LEU-CYS-GLU-LEU-ALA-GLN-ASP-LYS-GLU-ALA-ALA-GLU-ALA-ILE-GLU-ALA-GLU-GLY-ALA-THR-ALA-PRO-LEU-THR-GLU-LEU-LEU-HIS-SER-ARG-ASN-GLU-GLY-VAL-ALA-THR-TYR-ALA-ALA-ALA-VAL-LEU-PHE-ARG-MET-SER-GLU-ASP,ARG-ARG-TRP-PRO-GLN-MK8-ILE-LEU-ASP-MK8-HIS-VAL-ARG-ARG-VAL-TRP-ARG,518,17,CC[C@@H]([C@@H]1NC(=O)[C@](C)(CCC/C=C\C/C=C/[C@@](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(C)C)CC(=O)O)(C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)C(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C(C)C)Cc1nc[nH]c1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])Cc1c[nH]c2c1cccc2)CCC(=O)N)C,Kd=13nM,7.886057,7.89,1,A,A,1,A,A,0,,B,A,,1,1,518,17,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C,0.7543387413024902,0.8260471224784851,83.2724838256836,84.92020416259766,0.4267898201942444,0.6996600031852722,0.8836556673049927,0.8944146633148193,0.7021496891975403,0.808955192565918,RRWPQLILDLHVRRVWR,Moderate,"(7.523, 7.921]",train
4DMA,protein-peptide,P70365 P03372,KNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKAKNVVPLYDLLLEMLDAHRL,RHKILHRLLQEGSPS,LYS-ASN-SER-LEU-ALA-LEU-SER-LEU-THR-ALA-ASP-GLN-MET-VAL-SER-ALA-LEU-LEU-ASP-ALA-GLU-PRO-PRO-ILE-LEU-TYR-SER-GLU-TYR-ASP-PRO-THR-ARG-PRO-PHE-SER-GLU-ALA-SER-MET-MET-GLY-LEU-LEU-THR-ASN-LEU-ALA-ASP-ARG-GLU-LEU-VAL-HIS-MET-ILE-ASN-TRP-ALA-LYS-ARG-VAL-PRO-GLY-PHE-VAL-ASP-LEU-THR-LEU-HIS-ASP-GLN-VAL-HIS-LEU-LEU-GLU-CYS-ALA-TRP-LEU-GLU-ILE-LEU-MET-ILE-GLY-LEU-VAL-TRP-ARG-SER-MET-GLU-HIS-PRO-GLY-LYS-LEU-LEU-PHE-ALA-PRO-ASN-LEU-LEU-LEU-ASP-ARG-ASN-GLN-GLY-LYS-CYS-VAL-GLU-GLY-MET-VAL-GLU-ILE-PHE-ASP-MET-LEU-LEU-ALA-THR-SER-SER-ARG-PHE-ARG-MET-MET-ASN-LEU-GLN-GLY-GLU-GLU-PHE-VAL-CYS-LEU-LYS-SER-ILE-ILE-LEU-LEU-ASN-SER-GLY-VAL-TYR-THR-PHE-LEU-SER-SER-THR-LEU-LYS-SER-LEU-GLU-GLU-LYS-ASP-HIS-ILE-HIS-ARG-VAL-LEU-ASP-LYS-ILE-THR-ASP-THR-LEU-ILE-HIS-LEU-MET-ALA-LYS-ALA-GLY-LEU-THR-LEU-GLN-GLN-GLN-HIS-GLN-ARG-LEU-ALA-GLN-LEU-LEU-LEU-ILE-LEU-SER-HIS-ILE-ARG-HIS-MET-SER-ASN-LYS-GLY-MET-GLU-HIS-LEU-TYR-SER-MET-LYS-ALA-LYS-ASN-VAL-VAL-PRO-LEU-TYR-ASP-LEU-LEU-LEU-GLU-MET-LEU-ASP-ALA-HIS-ARG-LEU,ARG-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-GLU-GLY-SER-PRO-SER,247,15,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCC(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CC(C)C)[C@H](CC)C)NC(=O)[C@H](Cc1nc[nH]c1)[NH3+],Kd=0.65uM,6.187087,6.19,1,A,A,1,A,A,0,,E,A,,1,1,247,15,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.908990740776062,0.7660985589027405,89.31951141357422,84.24148559570312,0.4043923616409302,0.7982968091964722,0.9228418469429016,0.8609483242034912,0.8697454929351807,0.7423861026763916,RHKILHRLLQEGSPS,Low,"(6.097, 6.26]",train
4DOW,protein-peptide,Q9Z1N2 P62806,SKTRQTFSWVGRPLPNRKQFQQMYREICMKINDGSEIHIKVGQFVLIQGEDNKKPYVAKLIELFQNGAEVPPKKCARVQWFVRFLEIPVSKRHLLGRSPPAQEIFWYDCSDWDNKINVETIIGPVQVVALAPEEVIPVDQKSEETLFVKLSWNKKDFAPLPPE,GAKRHRKVLRDN,SER-LYS-THR-ARG-GLN-THR-PHE-SER-TRP-VAL-GLY-ARG-PRO-LEU-PRO-ASN-ARG-LYS-GLN-PHE-GLN-GLN-MET-TYR-ARG-GLU-ILE-CYS-MET-LYS-ILE-ASN-ASP-GLY-SER-GLU-ILE-HIS-ILE-LYS-VAL-GLY-GLN-PHE-VAL-LEU-ILE-GLN-GLY-GLU-ASP-ASN-LYS-LYS-PRO-TYR-VAL-ALA-LYS-LEU-ILE-GLU-LEU-PHE-GLN-ASN-GLY-ALA-GLU-VAL-PRO-PRO-LYS-LYS-CYS-ALA-ARG-VAL-GLN-TRP-PHE-VAL-ARG-PHE-LEU-GLU-ILE-PRO-VAL-SER-LYS-ARG-HIS-LEU-LEU-GLY-ARG-SER-PRO-PRO-ALA-GLN-GLU-ILE-PHE-TRP-TYR-ASP-CYS-SER-ASP-TRP-ASP-ASN-LYS-ILE-ASN-VAL-GLU-THR-ILE-ILE-GLY-PRO-VAL-GLN-VAL-VAL-ALA-LEU-ALA-PRO-GLU-GLU-VAL-ILE-PRO-VAL-ASP-GLN-LYS-SER-GLU-GLU-THR-LEU-PHE-VAL-LYS-LEU-SER-TRP-ASN-LYS-LYS-ASP-PHE-ALA-PRO-LEU-PRO-PRO-GLU,GLY-ALA-LYS-ARG-HIS-ARG-MLY-VAL-LEU-ARG-ASP-ASN,163,12,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(=O)O)CCC[NH+]=C(N)N)CC(C)C)C(C)C)CCCC[NH+](C)C)CCC[NH+]=C(N)N)Cc1nc[nH]c1)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)C[NH3+])C,Kd=9.6uM,5.017729,5.02,1,A,A,1,A,A,0,,C,A,,1,1,163,12,0,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(C)C,CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)O)C(=O)N[C@H](C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)O)C(C)C,0.8668209910392761,0.8551133871078491,86.40943908691406,83.67513275146484,0.3790777921676636,0.64363694190979,0.9073902368545532,0.8924444317817688,0.8138214945793152,0.8457805514335632,GAKRHRKVLRDN,Low,"(5.014, 5.105]",train
4DS1,protein-peptide,Q02647 P40477,GPLGSMSDENKSTPIVKASDITDKLKEDILTISKDALDKYQLERDIAGTVKKQLDVKYGNTWHVIVGKNFGSYVTHEKGHFVYFYIGPLAFLVFKTA,NYAESGIQTDL,GLY-PRO-LEU-GLY-SER-MET-SER-ASP-GLU-ASN-LYS-SER-THR-PRO-ILE-VAL-LYS-ALA-SER-ASP-ILE-THR-ASP-LYS-LEU-LYS-GLU-ASP-ILE-LEU-THR-ILE-SER-LYS-ASP-ALA-LEU-ASP-LYS-TYR-GLN-LEU-GLU-ARG-ASP-ILE-ALA-GLY-THR-VAL-LYS-LYS-GLN-LEU-ASP-VAL-LYS-TYR-GLY-ASN-THR-TRP-HIS-VAL-ILE-VAL-GLY-LYS-ASN-PHE-GLY-SER-TYR-VAL-THR-HIS-GLU-LYS-GLY-HIS-PHE-VAL-TYR-PHE-TYR-ILE-GLY-PRO-LEU-ALA-PHE-LEU-VAL-PHE-LYS-THR-ALA,ASN-TYR-ALA-GLU-SER-GLY-ILE-GLN-THR-ASP-LEU,97,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)O)[C@H](O)C)CCC(=O)N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])C)CCC(=O)O)CO)C,Kd=17.9uM,4.747147,4.75,1,A,A,1,A,A,0,,B,A,dimer,1,1,97,11,0,CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)O,1.012287974357605,0.8205873966217041,93.1468505859375,88.78752136230469,0.3374211490154266,0.5852766633033752,0.9001757502555847,0.8753139972686768,0.9014270305633544,0.8069056868553162,NYAESGIQTDL,Low,"(4.745, 4.866]",val
4E3B,protein-peptide,O14907,AVVQRVEIHKLRQGENLILGFSIGGGIDQDPSQNPFSEDKTDKGIYVTRVSEGGPAEIAGLQIGDKIMQVNGWDMTMVTHDQARKRLTKRSEEVVRLLVTRQ,ANSRWPTSIL,ALA-VAL-VAL-GLN-ARG-VAL-GLU-ILE-HIS-LYS-LEU-ARG-GLN-GLY-GLU-ASN-LEU-ILE-LEU-GLY-PHE-SER-ILE-GLY-GLY-GLY-ILE-ASP-GLN-ASP-PRO-SER-GLN-ASN-PRO-PHE-SER-GLU-ASP-LYS-THR-ASP-LYS-GLY-ILE-TYR-VAL-THR-ARG-VAL-SER-GLU-GLY-GLY-PRO-ALA-GLU-ILE-ALA-GLY-LEU-GLN-ILE-GLY-ASP-LYS-ILE-MET-GLN-VAL-ASN-GLY-TRP-ASP-MET-THR-MET-VAL-THR-HIS-ASP-GLN-ALA-ARG-LYS-ARG-LEU-THR-LYS-ARG-SER-GLU-GLU-VAL-VAL-ARG-LEU-LEU-VAL-THR-ARG-GLN,ALA-ASN-SER-ARG-TRP-PRO-THR-SER-ILE-LEU,102,10,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)[C@H](CC)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CCC[NH+]=C(N)N,Ki=0.9uM,6.045757,6.05,1,A,A,1,A,A,0,,C,A,,1,1,102,10,0,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)O,0.9468080401420592,0.8623141646385193,97.28411865234376,94.73300170898438,0.3056861460208893,0.5281095504760742,0.934753715991974,0.9019702076911926,0.8940179944038391,0.8524001240730286,ANSRWPTSIL,Low,"(5.959, 6.097]",train
4E9C,protein-peptide,P53350,GPLGSPEFDCHLSDMLQQLHSVNASKPSERGLVRQEEAEDPACIPIFWVSKWVDYSDKYGLGYQLCDNSVGVLFNDSTRLILYNDGDSLQYIERDGTESYLTVSSHPNSLMKKITLLKYFRNYMSEHLLKAGANITPREGDELARLPYLRTWFRTRSAIILHLSNGSVQINFFQDHTKLILCPLMAAVTYIDEKRDFRTYRLSLLEEYGCCKELASRLRYARTMVDKLLSSR,LDPPLHSTA,GLY-PRO-LEU-GLY-SER-PRO-GLU-PHE-ASP-CYS-HIS-LEU-SER-ASP-MET-LEU-GLN-GLN-LEU-HIS-SER-VAL-ASN-ALA-SER-LYS-PRO-SER-GLU-ARG-GLY-LEU-VAL-ARG-GLN-GLU-GLU-ALA-GLU-ASP-PRO-ALA-CYS-ILE-PRO-ILE-PHE-TRP-VAL-SER-LYS-TRP-VAL-ASP-TYR-SER-ASP-LYS-TYR-GLY-LEU-GLY-TYR-GLN-LEU-CYS-ASP-ASN-SER-VAL-GLY-VAL-LEU-PHE-ASN-ASP-SER-THR-ARG-LEU-ILE-LEU-TYR-ASN-ASP-GLY-ASP-SER-LEU-GLN-TYR-ILE-GLU-ARG-ASP-GLY-THR-GLU-SER-TYR-LEU-THR-VAL-SER-SER-HIS-PRO-ASN-SER-LEU-MET-LYS-LYS-ILE-THR-LEU-LEU-LYS-TYR-PHE-ARG-ASN-TYR-MET-SER-GLU-HIS-LEU-LEU-LYS-ALA-GLY-ALA-ASN-ILE-THR-PRO-ARG-GLU-GLY-ASP-GLU-LEU-ALA-ARG-LEU-PRO-TYR-LEU-ARG-THR-TRP-PHE-ARG-THR-ARG-SER-ALA-ILE-ILE-LEU-HIS-LEU-SER-ASN-GLY-SER-VAL-GLN-ILE-ASN-PHE-PHE-GLN-ASP-HIS-THR-LYS-LEU-ILE-LEU-CYS-PRO-LEU-MET-ALA-ALA-VAL-THR-TYR-ILE-ASP-GLU-LYS-ARG-ASP-PHE-ARG-THR-TYR-ARG-LEU-SER-LEU-LEU-GLU-GLU-TYR-GLY-CYS-CYS-LYS-GLU-LEU-ALA-SER-ARG-LEU-ARG-TYR-ALA-ARG-THR-MET-VAL-ASP-LYS-LEU-LEU-SER-SER-ARG,ACE-LEU-ASP-PRO-PRO-LEU-HIS-SER-TPO-ALA-NH2,232,11,OC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)N)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CC(C)C,Kd=1100nM,5.958607,5.96,1,A,A,1,A,A,0,,B,A,,1,1,232,11,0,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O,0.8403765559196472,0.8406723737716675,85.01323699951172,87.8245849609375,0.4189733862876892,0.5898699760437012,0.913009524345398,0.8956390619277954,0.798878014087677,0.8269307017326355,LDPPLHSTA,Low,"(5.821, 5.959]",train
4EDU,protein-peptide,Q9BTM1 Q9UQR0,QRDDFHWEEYLKETGSISAPSECFRQSQIPPVNDFKVGMKLEARDPRNATSVCIATVIGITGARLRLRLDGSDNRNDFWRLVDSPDIQPVGTCEKEGDLLQPPLGYQMNTSSWPMFLLETLNGSEMASATLFKKEPPKPPLNNFKVGMKLEAIDKKNPYLICPATIGDVKGDEVHITFDGWSGAFDYWCKYDSRDIFPAGWCRLTGDVLQPPGTS,VHRLLRKGNYAERVGA,GLN-ARG-ASP-ASP-PHE-HIS-TRP-GLU-GLU-TYR-LEU-LYS-GLU-THR-GLY-SER-ILE-SER-ALA-PRO-SER-GLU-CYS-PHE-ARG-GLN-SER-GLN-ILE-PRO-PRO-VAL-ASN-ASP-PHE-LYS-VAL-GLY-MET-LYS-LEU-GLU-ALA-ARG-ASP-PRO-ARG-ASN-ALA-THR-SER-VAL-CYS-ILE-ALA-THR-VAL-ILE-GLY-ILE-THR-GLY-ALA-ARG-LEU-ARG-LEU-ARG-LEU-ASP-GLY-SER-ASP-ASN-ARG-ASN-ASP-PHE-TRP-ARG-LEU-VAL-ASP-SER-PRO-ASP-ILE-GLN-PRO-VAL-GLY-THR-CYS-GLU-LYS-GLU-GLY-ASP-LEU-LEU-GLN-PRO-PRO-LEU-GLY-TYR-GLN-MET-ASN-THR-SER-SER-TRP-PRO-MET-PHE-LEU-LEU-GLU-THR-LEU-ASN-GLY-SER-GLU-MET-ALA-SER-ALA-THR-LEU-PHE-LYS-LYS-GLU-PRO-PRO-LYS-PRO-PRO-LEU-ASN-ASN-PHE-LYS-VAL-GLY-MET-LYS-LEU-GLU-ALA-ILE-ASP-LYS-LYS-ASN-PRO-TYR-LEU-ILE-CYS-PRO-ALA-THR-ILE-GLY-ASP-VAL-LYS-GLY-ASP-GLU-VAL-HIS-ILE-THR-PHE-ASP-GLY-TRP-SER-GLY-ALA-PHE-ASP-TYR-TRP-CYS-LYS-TYR-ASP-SER-ARG-ASP-ILE-PHE-PRO-ALA-GLY-TRP-CYS-ARG-LEU-THR-GLY-ASP-VAL-LEU-GLN-PRO-PRO-GLY-THR-SER,VAL-HIS-ARG-LEU-LEU-ARG-MLZ-GLY-ASN-TYR-ALA-GLU-ARG-VAL-GLY-ALA,215,16,CCC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCCC[NH2+]C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)Cc1nc[nH]c1)CCC[NH+]=C(N)N)CC(C)C)CC(C)C,Kd~102uM,3.99,3.99,1,A,A,1,A,A,0,,T,A,,1,1,215,16,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C)C(=O)O)C(C)C,CNCCCCC(NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)N)C(C)C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C,CNCCCCC(NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)N)C(C)C)C(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)O)C(C)C,0.8504140973091125,0.713798463344574,88.6961898803711,86.45879364013672,0.3821589648723602,0.9642282128334044,0.910674512386322,0.8322679400444031,0.7920589447021484,0.6841810345649719,VHRLLRKGNYAERVGA,Low,"(3.924, 4.155]",train
4EJF,protein-peptide,P55212,MGSAFYKREMFDPAEKYKMDHRRRGIALIFNHERFFWHLTLPERRGTCADRDNLTRRFSDLGFEVKCFNDLKAEELLLKIHEVSTVSHADADCFVCVFLSHGEGNHIYAYDAKIEIQTLTGLFKGDKCHSLVGKPKIFIIQAARGNQHDVPVIPLDVVDNQTEKLDTNITEVDAASVYTLPAGADFLMCYSVAEGYYSHRETVNGSWYIQDLCEMLGKYGSSLEFTELLTLVNRKVSQRRVDFCKDPSAIGKKQVPCFASMLTKKLHFFPKSNHHHHHH,TEKEKGRLHCVEWTILER,MET-GLY-SER-ALA-PHE-TYR-LYS-ARG-GLU-MET-PHE-ASP-PRO-ALA-GLU-LYS-TYR-LYS-MET-ASP-HIS-ARG-ARG-ARG-GLY-ILE-ALA-LEU-ILE-PHE-ASN-HIS-GLU-ARG-PHE-PHE-TRP-HIS-LEU-THR-LEU-PRO-GLU-ARG-ARG-GLY-THR-CYS-ALA-ASP-ARG-ASP-ASN-LEU-THR-ARG-ARG-PHE-SER-ASP-LEU-GLY-PHE-GLU-VAL-LYS-CYS-PHE-ASN-ASP-LEU-LYS-ALA-GLU-GLU-LEU-LEU-LEU-LYS-ILE-HIS-GLU-VAL-SER-THR-VAL-SER-HIS-ALA-ASP-ALA-ASP-CYS-PHE-VAL-CYS-VAL-PHE-LEU-SER-HIS-GLY-GLU-GLY-ASN-HIS-ILE-TYR-ALA-TYR-ASP-ALA-LYS-ILE-GLU-ILE-GLN-THR-LEU-THR-GLY-LEU-PHE-LYS-GLY-ASP-LYS-CYS-HIS-SER-LEU-VAL-GLY-LYS-PRO-LYS-ILE-PHE-ILE-ILE-GLN-ALA-ALA-ARG-GLY-ASN-GLN-HIS-ASP-VAL-PRO-VAL-ILE-PRO-LEU-ASP-VAL-VAL-ASP-ASN-GLN-THR-GLU-LYS-LEU-ASP-THR-ASN-ILE-THR-GLU-VAL-ASP-ALA-ALA-SER-VAL-TYR-THR-LEU-PRO-ALA-GLY-ALA-ASP-PHE-LEU-MET-CYS-TYR-SER-VAL-ALA-GLU-GLY-TYR-TYR-SER-HIS-ARG-GLU-THR-VAL-ASN-GLY-SER-TRP-TYR-ILE-GLN-ASP-LEU-CYS-GLU-MET-LEU-GLY-LYS-TYR-GLY-SER-SER-LEU-GLU-PHE-THR-GLU-LEU-LEU-THR-LEU-VAL-ASN-ARG-LYS-VAL-SER-GLN-ARG-ARG-VAL-ASP-PHE-CYS-LYS-ASP-PRO-SER-ALA-ILE-GLY-LYS-LYS-GLN-VAL-PRO-CYS-PHE-ALA-SER-MET-LEU-THR-LYS-LYS-LEU-HIS-PHE-PHE-PRO-LYS-SER-ASN-HIS-HIS-HIS-HIS-HIS-HIS,THR-GLU-LYS-GLU-LYS-GLY-ARG-LEU-HIS-CYS-VAL-GLU-TRP-THR-ILE-LEU-GLU-ARG,279,18,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CCC(=O)O)CC(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(C)C)Cc1nc[nH]c1)CS)CCC(=O)O)C,IC50=8uM,5.09691,5.1,1,A,A,1,A,A,0,,E,A,3mer,1,1,279,18,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CC[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N[C@H](C(=O)O)[C@@H](C)O)C(=O)O)C(=O)O)C(C)C)C(=O)O)[C@@H](C)O,0.8035672903060913,0.74797123670578,80.38323974609375,75.85896301269531,0.6595363020896912,1.0580737590789795,0.8219374418258667,0.7753981351852417,0.6663988828659058,0.6425480842590332,TEKEKGRLHCVEWTILER,Low,"(5.014, 5.105]",train
4EOY,protein-peptide,C0H519 Q8IJK2,GAMGMPSLKDEVSFENRVAETHKIRSKYPNRIPVVIERANRSNLPIIEKKKFLVPMNMLVGEFKFILHQHINQSAYGSNMKLFRERTIYLFVNNIVPKTGLLMQDLYEMYKDEDGYLYMEYSSESSLG,NDWLLPSY,GLY-ALA-MET-GLY-MET-PRO-SER-LEU-LYS-ASP-GLU-VAL-SER-PHE-GLU-ASN-ARG-VAL-ALA-GLU-THR-HIS-LYS-ILE-ARG-SER-LYS-TYR-PRO-ASN-ARG-ILE-PRO-VAL-VAL-ILE-GLU-ARG-ALA-ASN-ARG-SER-ASN-LEU-PRO-ILE-ILE-GLU-LYS-LYS-LYS-PHE-LEU-VAL-PRO-MET-ASN-MET-LEU-VAL-GLY-GLU-PHE-LYS-PHE-ILE-LEU-HIS-GLN-HIS-ILE-ASN-GLN-SER-ALA-TYR-GLY-SER-ASN-MET-LYS-LEU-PHE-ARG-GLU-ARG-THR-ILE-TYR-LEU-PHE-VAL-ASN-ASN-ILE-VAL-PRO-LYS-THR-GLY-LEU-LEU-MET-GLN-ASP-LEU-TYR-GLU-MET-TYR-LYS-ASP-GLU-ASP-GLY-TYR-LEU-TYR-MET-GLU-TYR-SER-SER-GLU-SER-SER-LEU-GLY,ASN-ASP-TRP-LEU-LEU-PRO-SER-TYR,128,8,OC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CC(=O)O)CC(C)C)CC(C)C,Kd=326nM,6.486782,6.49,1,A,A,1,A,A,0,,D,A,,1,1,128,8,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](CO)C(=O)O,0.9563153982162476,0.8932291865348816,88.44319152832031,85.50340270996094,0.3320549428462982,0.5048600435256958,0.9229393005371094,0.9024631381034852,0.9278945922851562,0.8909206390380859,NDWLLPSY,Low,"(6.398, 6.523]",train
4EP2,protein-peptide,P03369 Q9YV20,PQITLWKRPLVTIRIGGQLKEALLNTGADDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPVEILGHKAIGTVLVGPTPVNIIGRNLLTQIGMTLNFGGSSGPQITLWKRPLVTIRIGGQLKEALLNTGADDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPVEILGHKAIGTVLVGPTPVNIIGRNLLTQIGMTLNF,AETFYVDG,PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-ALA-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-VAL-GLU-ILE-LEU-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-MET-THR-LEU-ASN-PHE-GLY-GLY-SER-SER-GLY-PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-ALA-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-VAL-GLU-ILE-LEU-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-MET-THR-LEU-ASN-PHE,ALA-GLU-THR-PHE-TYR-VAL-ASP-GLY,203,8,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)C(C)C)Cc1ccc(cc1)O)Cc1ccccc1)[C@H](O)C)NC(=O)[C@@H]([NH3+])C,Kd=4.43uM,5.353596,5.35,1,A,A,1,A,A,0,,B,A,,1,1,203,8,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,0.9100569486618042,0.8886823654174805,93.34107208251952,93.94970703125,0.3477058112621307,0.4970746636390686,0.935941219329834,0.9275893568992616,0.879889190196991,0.8789556622505188,AETFYVDG,Low,"(5.31, 5.463]",val
4EQF,protein-peptide,Q8C437 O88703,GAMEFERAKAAVESDTEFWDKMQAEWEEMARRNWISENQEAQNQVTVSASEKGYYFHTENPFKDWPGAFEEGLKRLKEGDLPVTILFMEAAILQDPGDAEAWQFLGITQAENENEQAAIVALQRCLELQPNNLKALMALAVSYTNTSHQQDACEALKNWIKQNPKYKYLVKNKKGSPGLTRRMSKSPVDSSVLEGVKELYLEAAHQNGDMIDPDLQTGLGVLFHLSGEFNRAIDAFNAALTVRPEDYSLWNRLGATLANGDRSEEAVEAYTRALEIQPGFIRSRYNLGISCINLGAYREAVSNFLTALSLQRKSRNQQQVPHPAISGNIWAALRIALSLMDQPELFQAANLGDLDVLLRAFNLDP,SRLSSNL,GLY-ALA-MET-GLU-PHE-GLU-ARG-ALA-LYS-ALA-ALA-VAL-GLU-SER-ASP-THR-GLU-PHE-TRP-ASP-LYS-MET-GLN-ALA-GLU-TRP-GLU-GLU-MET-ALA-ARG-ARG-ASN-TRP-ILE-SER-GLU-ASN-GLN-GLU-ALA-GLN-ASN-GLN-VAL-THR-VAL-SER-ALA-SER-GLU-LYS-GLY-TYR-TYR-PHE-HIS-THR-GLU-ASN-PRO-PHE-LYS-ASP-TRP-PRO-GLY-ALA-PHE-GLU-GLU-GLY-LEU-LYS-ARG-LEU-LYS-GLU-GLY-ASP-LEU-PRO-VAL-THR-ILE-LEU-PHE-MET-GLU-ALA-ALA-ILE-LEU-GLN-ASP-PRO-GLY-ASP-ALA-GLU-ALA-TRP-GLN-PHE-LEU-GLY-ILE-THR-GLN-ALA-GLU-ASN-GLU-ASN-GLU-GLN-ALA-ALA-ILE-VAL-ALA-LEU-GLN-ARG-CYS-LEU-GLU-LEU-GLN-PRO-ASN-ASN-LEU-LYS-ALA-LEU-MET-ALA-LEU-ALA-VAL-SER-TYR-THR-ASN-THR-SER-HIS-GLN-GLN-ASP-ALA-CYS-GLU-ALA-LEU-LYS-ASN-TRP-ILE-LYS-GLN-ASN-PRO-LYS-TYR-LYS-TYR-LEU-VAL-LYS-ASN-LYS-LYS-GLY-SER-PRO-GLY-LEU-THR-ARG-ARG-MET-SER-LYS-SER-PRO-VAL-ASP-SER-SER-VAL-LEU-GLU-GLY-VAL-LYS-GLU-LEU-TYR-LEU-GLU-ALA-ALA-HIS-GLN-ASN-GLY-ASP-MET-ILE-ASP-PRO-ASP-LEU-GLN-THR-GLY-LEU-GLY-VAL-LEU-PHE-HIS-LEU-SER-GLY-GLU-PHE-ASN-ARG-ALA-ILE-ASP-ALA-PHE-ASN-ALA-ALA-LEU-THR-VAL-ARG-PRO-GLU-ASP-TYR-SER-LEU-TRP-ASN-ARG-LEU-GLY-ALA-THR-LEU-ALA-ASN-GLY-ASP-ARG-SER-GLU-GLU-ALA-VAL-GLU-ALA-TYR-THR-ARG-ALA-LEU-GLU-ILE-GLN-PRO-GLY-PHE-ILE-ARG-SER-ARG-TYR-ASN-LEU-GLY-ILE-SER-CYS-ILE-ASN-LEU-GLY-ALA-TYR-ARG-GLU-ALA-VAL-SER-ASN-PHE-LEU-THR-ALA-LEU-SER-LEU-GLN-ARG-LYS-SER-ARG-ASN-GLN-GLN-GLN-VAL-PRO-HIS-PRO-ALA-ILE-SER-GLY-ASN-ILE-TRP-ALA-ALA-LEU-ARG-ILE-ALA-LEU-SER-LEU-MET-ASP-GLN-PRO-GLU-LEU-PHE-GLN-ALA-ALA-ASN-LEU-GLY-ASP-LEU-ASP-VAL-LEU-LEU-ARG-ALA-PHE-ASN-LEU-ASP-PRO,SER-ARG-LEU-SER-SER-ASN-LEU,365,7,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC(=O)N)CO)NC(=O)[C@@H](NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CC(C)C,Kd=155nM,6.809668,6.81,1,A,A,1,A,A,0,,B,A,,1,1,365,7,0,CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)O,0.9326590299606324,0.9086381196975708,76.440673828125,75.25049591064453,0.5627827048301697,0.6619367003440857,0.8384966254234314,0.8350604176521301,0.9175570607185364,0.897922933101654,SRLSSNL,Low,"(6.696, 6.824]",train
4EQJ,protein-peptide,P03369 Q9YV20,PQITLWKRPLVTIRIGGQLKEALLNTGSDFTVLEEMNLPGKWKPKMIRGIGGFIKVRQYDQIPVEILGHKAIGTVLVGPTPVNIIGRNLLTQIGMTLNFGGSSGPQITLWKRPLVTIRIGGQLKEALLNTGSDDTVLEEMNLPGKWKPKMIGGIGGFIKVRQYDQIPVEILGHKAIGTVLVGPTPVNIIGRNLLTQIGMTLNF,AETFYVDG,PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-SER-ASP-PHE-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-ARG-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-VAL-GLU-ILE-LEU-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-MET-THR-LEU-ASN-PHE-GLY-GLY-SER-SER-GLY-PRO-GLN-ILE-THR-LEU-TRP-LYS-ARG-PRO-LEU-VAL-THR-ILE-ARG-ILE-GLY-GLY-GLN-LEU-LYS-GLU-ALA-LEU-LEU-ASN-THR-GLY-SER-ASP-ASP-THR-VAL-LEU-GLU-GLU-MET-ASN-LEU-PRO-GLY-LYS-TRP-LYS-PRO-LYS-MET-ILE-GLY-GLY-ILE-GLY-GLY-PHE-ILE-LYS-VAL-ARG-GLN-TYR-ASP-GLN-ILE-PRO-VAL-GLU-ILE-LEU-GLY-HIS-LYS-ALA-ILE-GLY-THR-VAL-LEU-VAL-GLY-PRO-THR-PRO-VAL-ASN-ILE-ILE-GLY-ARG-ASN-LEU-LEU-THR-GLN-ILE-GLY-MET-THR-LEU-ASN-PHE,ALA-GLU-THR-PHE-TYR-VAL-ASP-GLY,203,8,O=C([C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)N[C@H](C(=O)N[C@H](C(=O)O)C)C(C)C,Kd=2.52uM,5.598599,5.6,1,A,A,1,A,A,0,,G,A,,1,1,203,8,0,CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,CC(C)[C@H](NC(=O)C[C@H](NC(=O)CN)C(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)N[C@@H](C)C(=O)O)C(=O)O)[C@@H](C)O,0.897841215133667,0.8889613747596741,92.42741394042967,93.00797271728516,0.358946144580841,0.4933885931968689,0.9295322895050048,0.9254329800605774,0.8662217855453491,0.8798434138298035,AETFYVDG,Low,"(5.463, 5.6]",train
4ERQ,protein-peptide,O14686 P61964,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,INPTGCARSEPKIL,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,ILE-ASN-PRO-THR-GLY-CYS-ALA-ARG-SER-GLU-PRO-LYS-ILE-LEU,312,14,[NH3+]CCCC[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)[NH3+])CC(=O)N)CS)C)CCC[NH+]=C(N)N)CO)CCC(=O)O,Kd=75nM,7.124939,7.12,1,A,A,1,A,A,0,,D,A,,1,1,312,14,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)CC)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)O,0.9207776784896852,0.6792489886283875,95.40985870361328,92.697998046875,0.3304073810577392,0.9908812642097472,0.9433270692825316,0.8603143095970154,0.8672109246253967,0.6119474172592163,INPTGCARSEPKIL,Moderate,"(7.049, 7.268]",train
4ERY,protein-peptide,P61964 Q8NEZ4,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,VNPTGCARSEPKMS,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,VAL-ASN-PRO-THR-GLY-CYS-ALA-ARG-SER-GLU-PRO-LYS-MET-SER,312,14,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])CC(=O)N)CS)C)CCC[NH+]=C(N)N)CO)CCC(=O)O,Kd=54nM,7.267606,7.27,1,A,A,1,A,A,0,,D,A,,1,1,312,14,0,CSCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,CSCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O)C(=O)O,0.891129195690155,0.7465618848800659,94.9796371459961,93.5529556274414,0.3520369231700897,0.7911032438278198,0.9342247247695924,0.8782771229743958,0.8324258923530579,0.6915978193283081,VNPTGCARSEPKMS,Moderate,"(7.049, 7.268]",train
4ERZ,protein-peptide,Q9UMN6 P61964,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,LNPHGAARAEVYLR,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,LEU-ASN-PRO-HIS-GLY-ALA-ALA-ARG-ALA-GLU-VAL-TYR-LEU-ARG,312,14,O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)C(C)C)CCC(=O)O)C)CCC[NH+]=C(N)N)C)C)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CC(=O)N)Cc1nc[nH]c1,Kd=88nM,7.055517,7.06,1,A,A,1,A,A,0,,D,A,,0,1,312,14,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)O,0.9041110277175904,0.696855902671814,95.65662384033205,92.55945587158205,0.3414801061153412,0.909676432609558,0.9393664598464966,0.8561215996742249,0.8473677039146423,0.6350042819976807,LNPHGAARAEVYLR,Moderate,"(7.049, 7.268]",val
4ES0,protein-peptide,Q9UPS6 P61964,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,EHVTGCARSEGFYT,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLU-HIS-VAL-THR-GLY-CYS-ALA-ARG-SER-GLU-GLY-PHE-TYR-THR,312,14,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CCC(=O)O)CO)CCC[NH+]=C(N)N)C)CS,Kd=103nM,6.987163,6.99,1,A,A,1,A,A,0,,C,A,,1,1,312,14,0,CC(C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC(C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O,0.8956138491630554,0.7046375870704651,95.43098449707033,93.2129364013672,0.3482863903045654,0.8944582939147949,0.936028242111206,0.8645328283309937,0.8414151072502136,0.6466349363327026,EHVTGCARSEGFYT,Low,"(6.824, 7.049]",val
4ESG,protein-peptide,P61964 Q03164,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,EPPLNPHGSARAEVHLR,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLU-PRO-PRO-LEU-ASN-PRO-HIS-GLY-SER-ALA-ARG-ALA-GLU-VAL-HIS-LEU-ARG,312,17,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1nc[nH]c1)C(C)C)CCC(=O)O)C)CCC[NH+]=C(N)N)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)[NH3+])CC(C)C)CC(=O)N)Cc1nc[nH]c1,Kd=2762nM,5.558776,5.56,1,A,A,1,A,A,0,,C,A,,0,1,312,17,0,CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(=O)O,0.8549264073371887,0.6768060326576233,95.4320831298828,91.70663452148438,0.3704336285591125,0.9425619840621948,0.932930052280426,0.8424941897392273,0.7822340130805969,0.6133487224578857,EPPLNPHGSARAEVHLR,Low,"(5.463, 5.6]",val
4EWR,protein-peptide,O15047 P61964,ATQSKPTPVKPNYALKFTLAGHTKAVSSVKFSPNGEWLASSSADKLIKIWGAYDGKFEKTISGHKLGISDVAWSSDSNLLVSASDDKTLKIWDVSSGKCLKTLKGHSNYVFCCNFNPQSNLIVSGSFDESVRIWDVKTGKCLKTLPAHSDPVSAVHFNRDGSLIVSSSYDGLCRIWDTASGQCLKTLIDDDNPPVSFVKFSPNGKYILAATLDNTLKLWDYSKGKCLKTYTGHKNEKYCIFANFSVTGGKWIVSGSEDNLVYIWNLQTKEIVQKLQGHTDVVISTACHPTENIIASAALENDKTIKLWKSDC,EHQTGSARSEGYYP,ALA-THR-GLN-SER-LYS-PRO-THR-PRO-VAL-LYS-PRO-ASN-TYR-ALA-LEU-LYS-PHE-THR-LEU-ALA-GLY-HIS-THR-LYS-ALA-VAL-SER-SER-VAL-LYS-PHE-SER-PRO-ASN-GLY-GLU-TRP-LEU-ALA-SER-SER-SER-ALA-ASP-LYS-LEU-ILE-LYS-ILE-TRP-GLY-ALA-TYR-ASP-GLY-LYS-PHE-GLU-LYS-THR-ILE-SER-GLY-HIS-LYS-LEU-GLY-ILE-SER-ASP-VAL-ALA-TRP-SER-SER-ASP-SER-ASN-LEU-LEU-VAL-SER-ALA-SER-ASP-ASP-LYS-THR-LEU-LYS-ILE-TRP-ASP-VAL-SER-SER-GLY-LYS-CYS-LEU-LYS-THR-LEU-LYS-GLY-HIS-SER-ASN-TYR-VAL-PHE-CYS-CYS-ASN-PHE-ASN-PRO-GLN-SER-ASN-LEU-ILE-VAL-SER-GLY-SER-PHE-ASP-GLU-SER-VAL-ARG-ILE-TRP-ASP-VAL-LYS-THR-GLY-LYS-CYS-LEU-LYS-THR-LEU-PRO-ALA-HIS-SER-ASP-PRO-VAL-SER-ALA-VAL-HIS-PHE-ASN-ARG-ASP-GLY-SER-LEU-ILE-VAL-SER-SER-SER-TYR-ASP-GLY-LEU-CYS-ARG-ILE-TRP-ASP-THR-ALA-SER-GLY-GLN-CYS-LEU-LYS-THR-LEU-ILE-ASP-ASP-ASP-ASN-PRO-PRO-VAL-SER-PHE-VAL-LYS-PHE-SER-PRO-ASN-GLY-LYS-TYR-ILE-LEU-ALA-ALA-THR-LEU-ASP-ASN-THR-LEU-LYS-LEU-TRP-ASP-TYR-SER-LYS-GLY-LYS-CYS-LEU-LYS-THR-TYR-THR-GLY-HIS-LYS-ASN-GLU-LYS-TYR-CYS-ILE-PHE-ALA-ASN-PHE-SER-VAL-THR-GLY-GLY-LYS-TRP-ILE-VAL-SER-GLY-SER-GLU-ASP-ASN-LEU-VAL-TYR-ILE-TRP-ASN-LEU-GLN-THR-LYS-GLU-ILE-VAL-GLN-LYS-LEU-GLN-GLY-HIS-THR-ASP-VAL-VAL-ILE-SER-THR-ALA-CYS-HIS-PRO-THR-GLU-ASN-ILE-ILE-ALA-SER-ALA-ALA-LEU-GLU-ASN-ASP-LYS-THR-ILE-LYS-LEU-TRP-LYS-SER-ASP-CYS,GLU-HIS-GLN-THR-GLY-SER-ALA-ARG-SER-GLU-GLY-TYR-TYR-PRO,312,14,OC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]([NH3+])C)CO)C)CCC[NH+]=C(N)N,Kd=541nM,6.266803,6.27,1,A,A,1,A,A,0,,C,A,,1,1,312,14,0,C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)CC[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)[C@@H](C)O,0.8937909603118896,0.7754135727882385,95.24393463134766,93.06841278076172,0.3513455986976623,0.7946694493293762,0.9337985515594482,0.8835681080818176,0.8358595967292786,0.7263396382331848,EHQTGSARSEGYYP,Low,"(6.26, 6.398]",train
4EZQ,protein-peptide,P37362 P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,PPRPIYNRN,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,PRO-PRO-ARG-PRO-ILE-TYR-ASN-ARG-ASN,219,9,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N)C,Kd=6.3uM,5.200659,5.2,1,A,A,1,A,A,0,,B,A,,1,1,219,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9078537225723268,0.8921693563461304,92.64754486083984,87.8379135131836,0.3423731029033661,0.5217412710189819,0.9185075163841248,0.9067358374595642,0.8805192112922668,0.8885276913642883,PPRPIYNRN,Low,"(5.105, 5.222]",train
4EZR,protein-peptide,P36193 P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,SHPRPIRV,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,SER-HIS-PRO-ARG-PRO-ILE-ARG-VAL,219,8,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CCC[NH+]=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)[NH3+])CCC[NH+]=C(N)N)C,Kd=6.3uM,5.200659,5.2,1,A,A,1,A,A,0,,B,A,,1,1,219,8,0,CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)C,0.9248388409614564,0.8472131490707397,91.79325103759766,86.5383529663086,0.3403372466564178,0.5564154386520386,0.9193337559700012,0.8808739185333252,0.904188632965088,0.8387979865074158,SHPRPIRV,Low,"(5.105, 5.222]",train
4EZT,protein-peptide,P83427 P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,PRRPVIMRR,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,PRO-ARG-ARG-PRO-VAL-ILE-MET-ARG-ARG,219,9,CSCC[C@@H](C(=O)N[C@H](C(=O)N)CCC[NH+]=C(N)N)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=7.4uM,5.130768,5.13,1,A,A,1,A,A,0,,B,A,,1,1,219,9,0,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1)C(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.90640527009964,0.8244578242301941,90.27244567871094,84.85852813720703,0.3552892506122589,0.6406232118606567,0.9037045836448668,0.8706351518630981,0.8824094533920288,0.8129134774208069,PRRPVIMRR,Low,"(5.105, 5.222]",train
4EZW,protein-peptide,P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,NRLLLTG,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,ASN-ARG-LEU-LEU-LEU-THR-GLY,219,7,CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N)CC(C)C)C,Kd=1.0uM,6.0,6.0,1,A,A,1,A,A,0,,E,A,,1,1,219,7,0,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.9026588201522828,0.8431354761123657,93.2681884765625,87.62477111816406,0.3572534918785095,0.5602672696113586,0.8986679315567017,0.8834002614021301,0.8842981457710266,0.8330692648887634,NRLLLTG,Low,"(5.959, 6.097]",val
4EZX,protein-peptide,P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,NRLMLTG,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,ASN-ARG-LEU-MET-LEU-THR-GLY,219,7,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)[C@H](O)C)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N)CC(C)C,Kd=1.6uM,5.79588,5.8,1,A,A,1,A,A,0,,C,A,,1,1,219,7,0,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.911262035369873,0.8505108952522278,93.30014038085938,86.41143035888672,0.3453631699085235,0.5472632646560669,0.9106472134590148,0.8793615698814392,0.8920572996139526,0.8432981967926025,NRLMLTG,Low,"(5.699, 5.821]",train
4EZY,protein-peptide,P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,NRLILTG,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,ASN-ARG-LEU-ILE-LEU-THR-GLY,219,7,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)N)[NH3+])CCC[NH+]=C(N)N)CC(C)C)C,Kd=2.26uM,5.645892,5.65,1,A,A,1,A,A,0,,B,A,,1,1,219,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)NCC(=O)O)[C@@H](C)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O,0.8968467712402344,0.8378887176513672,93.04977416992188,86.05784606933594,0.3534499406814575,0.5811131000518799,0.9037222862243652,0.8770914673805237,0.8757694959640503,0.8280879855155945,NRLILTG,Low,"(5.6, 5.699]",train
4EZZ,protein-peptide,P0A6Y8,VLLLDVTPLSLGIETMGGVMTTLIAKNTTIPTKHSQVFSTAEDNQSAVTIHVLQGERKRAADNKSLGQFNLDGINPAPRGMPQIEVTFDIDADGILHVSAKDKNSGKEQKITIKASSGLNEDEIQKMVRDAEANAEADRKFEELVQTRNQGDHLLHSTRKQVEEAGDKLPADDKTAIESALTALETALKGEDKAAIEAKMQELAQVSQKLMEIAQQQHA,ELPLVKI,VAL-LEU-LEU-LEU-ASP-VAL-THR-PRO-LEU-SER-LEU-GLY-ILE-GLU-THR-MET-GLY-GLY-VAL-MET-THR-THR-LEU-ILE-ALA-LYS-ASN-THR-THR-ILE-PRO-THR-LYS-HIS-SER-GLN-VAL-PHE-SER-THR-ALA-GLU-ASP-ASN-GLN-SER-ALA-VAL-THR-ILE-HIS-VAL-LEU-GLN-GLY-GLU-ARG-LYS-ARG-ALA-ALA-ASP-ASN-LYS-SER-LEU-GLY-GLN-PHE-ASN-LEU-ASP-GLY-ILE-ASN-PRO-ALA-PRO-ARG-GLY-MET-PRO-GLN-ILE-GLU-VAL-THR-PHE-ASP-ILE-ASP-ALA-ASP-GLY-ILE-LEU-HIS-VAL-SER-ALA-LYS-ASP-LYS-ASN-SER-GLY-LYS-GLU-GLN-LYS-ILE-THR-ILE-LYS-ALA-SER-SER-GLY-LEU-ASN-GLU-ASP-GLU-ILE-GLN-LYS-MET-VAL-ARG-ASP-ALA-GLU-ALA-ASN-ALA-GLU-ALA-ASP-ARG-LYS-PHE-GLU-GLU-LEU-VAL-GLN-THR-ARG-ASN-GLN-GLY-ASP-HIS-LEU-LEU-HIS-SER-THR-ARG-LYS-GLN-VAL-GLU-GLU-ALA-GLY-ASP-LYS-LEU-PRO-ALA-ASP-ASP-LYS-THR-ALA-ILE-GLU-SER-ALA-LEU-THR-ALA-LEU-GLU-THR-ALA-LEU-LYS-GLY-GLU-ASP-LYS-ALA-ALA-ILE-GLU-ALA-LYS-MET-GLN-GLU-LEU-ALA-GLN-VAL-SER-GLN-LYS-LEU-MET-GLU-ILE-ALA-GLN-GLN-GLN-HIS-ALA,GLU-LEU-PRO-LEU-VAL-LYS-ILE,219,7,[NH3+]CCCC[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])CC(C)C)CC(C)C,Kd=6.4uM,5.19382,5.19,1,A,A,1,A,A,0,,B,A,,1,1,219,7,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)C(=O)O,0.9139907360076904,0.8341851830482483,95.49909973144533,86.13594055175781,0.3510812819004059,0.5728535652160645,0.9069429636001588,0.8667665123939514,0.8963942527770996,0.8260398507118225,ELPLVKI,Low,"(5.105, 5.222]",train
4F14,protein-peptide,A4UGR9 O76041,GAMANLRTYRAMYDYSAQDEDEVSFRDGDYIVNVQPIDDGWMYGTVQRTGRTGMLPANYIEFVN,PPPTLPKPKLPKH,GLY-ALA-MET-ALA-ASN-LEU-ARG-THR-TYR-ARG-ALA-MET-TYR-ASP-TYR-SER-ALA-GLN-ASP-GLU-ASP-GLU-VAL-SER-PHE-ARG-ASP-GLY-ASP-TYR-ILE-VAL-ASN-VAL-GLN-PRO-ILE-ASP-ASP-GLY-TRP-MET-TYR-GLY-THR-VAL-GLN-ARG-THR-GLY-ARG-THR-GLY-MET-LEU-PRO-ALA-ASN-TYR-ILE-GLU-PHE-VAL-ASN,PRO-PRO-PRO-THR-LEU-PRO-LYS-PRO-LYS-LEU-PRO-LYS-HIS,64,13,[NH3+]CCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)CC(C)C,Kd=12.93uM,4.888401,4.89,1,A,A,1,A,A,0,,B,A,,1,1,64,13,0,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O,0.9652400016784668,0.7809208631515503,94.25159454345705,88.82696533203125,0.3051271438598633,0.5760714411735535,0.8979209661483765,0.8196883797645569,0.86843341588974,0.7516977190971375,PPPTLPKPKLPKH,Low,"(4.866, 5.014]",train
4F20,protein-peptide,Q6E0U4 Q6GDH2,MRGSHHHHHHENLYFQGSLAVAEPVVNAADAKGTNVNDKVTASDFKLEKTAFDPNQSGNTFMAANFKVTGQVKSGDYFTAKLPDSVTGNGDVDYSNSNNTMPIADIKSTNGDVVAKATYDILTKTYTFVFTDYVNDKENINGQFSLPLFTDRAKAPKSGTYDANINIADEMFDNKITYNYSSPIAGIDKPNGANISSQIIGVDTASGQNTYKQTVFVNPKQRVLGNTWVYIKGYQDKIEESSGKVSATDTKLRIFEVNDTSKLSDSYYADPNDSNLKEVTGEFKDKISYKYDNVASINFGDINKTYVVLVEGHYDNTGKNLKTQVIQENIDPATGKDYSIFGWNNENVVRYGGGSADGDSAVN,GQSGSSGSGSNGD,MET-ARG-GLY-SER-HIS-HIS-HIS-HIS-HIS-HIS-GLU-ASN-LEU-TYR-PHE-GLN-GLY-SER-LEU-ALA-VAL-ALA-GLU-PRO-VAL-VAL-ASN-ALA-ALA-ASP-ALA-LYS-GLY-THR-ASN-VAL-ASN-ASP-LYS-VAL-THR-ALA-SER-ASP-PHE-LYS-LEU-GLU-LYS-THR-ALA-PHE-ASP-PRO-ASN-GLN-SER-GLY-ASN-THR-PHE-MET-ALA-ALA-ASN-PHE-LYS-VAL-THR-GLY-GLN-VAL-LYS-SER-GLY-ASP-TYR-PHE-THR-ALA-LYS-LEU-PRO-ASP-SER-VAL-THR-GLY-ASN-GLY-ASP-VAL-ASP-TYR-SER-ASN-SER-ASN-ASN-THR-MET-PRO-ILE-ALA-ASP-ILE-LYS-SER-THR-ASN-GLY-ASP-VAL-VAL-ALA-LYS-ALA-THR-TYR-ASP-ILE-LEU-THR-LYS-THR-TYR-THR-PHE-VAL-PHE-THR-ASP-TYR-VAL-ASN-ASP-LYS-GLU-ASN-ILE-ASN-GLY-GLN-PHE-SER-LEU-PRO-LEU-PHE-THR-ASP-ARG-ALA-LYS-ALA-PRO-LYS-SER-GLY-THR-TYR-ASP-ALA-ASN-ILE-ASN-ILE-ALA-ASP-GLU-MET-PHE-ASP-ASN-LYS-ILE-THR-TYR-ASN-TYR-SER-SER-PRO-ILE-ALA-GLY-ILE-ASP-LYS-PRO-ASN-GLY-ALA-ASN-ILE-SER-SER-GLN-ILE-ILE-GLY-VAL-ASP-THR-ALA-SER-GLY-GLN-ASN-THR-TYR-LYS-GLN-THR-VAL-PHE-VAL-ASN-PRO-LYS-GLN-ARG-VAL-LEU-GLY-ASN-THR-TRP-VAL-TYR-ILE-LYS-GLY-TYR-GLN-ASP-LYS-ILE-GLU-GLU-SER-SER-GLY-LYS-VAL-SER-ALA-THR-ASP-THR-LYS-LEU-ARG-ILE-PHE-GLU-VAL-ASN-ASP-THR-SER-LYS-LEU-SER-ASP-SER-TYR-TYR-ALA-ASP-PRO-ASN-ASP-SER-ASN-LEU-LYS-GLU-VAL-THR-GLY-GLU-PHE-LYS-ASP-LYS-ILE-SER-TYR-LYS-TYR-ASP-ASN-VAL-ALA-SER-ILE-ASN-PHE-GLY-ASP-ILE-ASN-LYS-THR-TYR-VAL-VAL-LEU-VAL-GLU-GLY-HIS-TYR-ASP-ASN-THR-GLY-LYS-ASN-LEU-LYS-THR-GLN-VAL-ILE-GLN-GLU-ASN-ILE-ASP-PRO-ALA-THR-GLY-LYS-ASP-TYR-SER-ILE-PHE-GLY-TRP-ASN-ASN-GLU-ASN-VAL-VAL-ARG-TYR-GLY-GLY-GLY-SER-ALA-ASP-GLY-ASP-SER-ALA-VAL-ASN,GLY-GLN-SER-GLY-SER-SER-GLY-SER-GLY-SER-ASN-GLY-ASP,363,13,[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CC(=O)O)CC(=O)N)CO)CO)CO)CO,Kd=0.5083mM,3.29388,3.29,1,A,A,1,A,A,0,,Q,A,,1,1,363,13,0,NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)O,NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](N)C(=O)O)C(=O)NCC(=O)O,NC(=O)CC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)C[C@H](N)C(=O)O)C(=O)NCC(=O)O,0.8490489721298218,0.9066714644432068,79.86309051513672,82.92476654052734,0.5508551597595215,0.5869749188423157,0.8378161191940308,0.8557835221290588,0.7770566344261169,0.8729058504104614,GQSGSSGSGSNGD,Low,"(2.044, 3.548]",train
4FCM,protein-peptide,Q13283,GSHMVMEKPSPLLVGREFVRQYYTLLNQAPDMLHRFYGKNSSYVHGGLDSNGKPADAVYGQKEIHRKVMSQNFTNCHTKIRHVDAHATLNDGVVVQVMGLLSNNNQALRRFMQTFVLAPEGSVANKFYVHNDIFRYQDEVFG,DSGFSFGSK,GLY-SER-HIS-MET-VAL-MET-GLU-LYS-PRO-SER-PRO-LEU-LEU-VAL-GLY-ARG-GLU-PHE-VAL-ARG-GLN-TYR-TYR-THR-LEU-LEU-ASN-GLN-ALA-PRO-ASP-MET-LEU-HIS-ARG-PHE-TYR-GLY-LYS-ASN-SER-SER-TYR-VAL-HIS-GLY-GLY-LEU-ASP-SER-ASN-GLY-LYS-PRO-ALA-ASP-ALA-VAL-TYR-GLY-GLN-LYS-GLU-ILE-HIS-ARG-LYS-VAL-MET-SER-GLN-ASN-PHE-THR-ASN-CYS-HIS-THR-LYS-ILE-ARG-HIS-VAL-ASP-ALA-HIS-ALA-THR-LEU-ASN-ASP-GLY-VAL-VAL-VAL-GLN-VAL-MET-GLY-LEU-LEU-SER-ASN-ASN-ASN-GLN-ALA-LEU-ARG-ARG-PHE-MET-GLN-THR-PHE-VAL-LEU-ALA-PRO-GLU-GLY-SER-VAL-ALA-ASN-LYS-PHE-TYR-VAL-HIS-ASN-ASP-ILE-PHE-ARG-TYR-GLN-ASP-GLU-VAL-PHE-GLY,ASP-SER-GLY-PHE-SER-PHE-GLY-SER-LYS,142,9,OC[C@@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)[NH3+],Kd=115uM,3.939302,3.94,1,A,A,1,A,A,0,,C,A,,1,1,142,9,0,NCCCC[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,NCCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)O,0.9223437905311584,0.8921936750411987,93.10963439941406,89.8544921875,0.3460223972797394,0.5459830164909363,0.9200167655944824,0.8938990235328674,0.8691175580024719,0.8521547317504883,DSGFSFGSK,Low,"(3.924, 4.155]",train
4FGY,protein-peptide,P37231 Q15788,ESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDL,RHKILHRLLQE,GLU-SER-ALA-ASP-LEU-ARG-ALA-LEU-ALA-LYS-HIS-LEU-TYR-ASP-SER-TYR-ILE-LYS-SER-PHE-PRO-LEU-THR-LYS-ALA-LYS-ALA-ARG-ALA-ILE-LEU-THR-GLY-LYS-THR-THR-ASP-LYS-SER-PRO-PHE-VAL-ILE-TYR-ASP-MET-ASN-SER-LEU-MET-MET-GLY-GLU-ASP-LYS-ILE-LYS-PHE-LYS-HIS-ILE-THR-PRO-LEU-GLN-GLU-GLN-SER-LYS-GLU-VAL-ALA-ILE-ARG-ILE-PHE-GLN-GLY-CYS-GLN-PHE-ARG-SER-VAL-GLU-ALA-VAL-GLN-GLU-ILE-THR-GLU-TYR-ALA-LYS-SER-ILE-PRO-GLY-PHE-VAL-ASN-LEU-ASP-LEU-ASN-ASP-GLN-VAL-THR-LEU-LEU-LYS-TYR-GLY-VAL-HIS-GLU-ILE-ILE-TYR-THR-MET-LEU-ALA-SER-LEU-MET-ASN-LYS-ASP-GLY-VAL-LEU-ILE-SER-GLU-GLY-GLN-GLY-PHE-MET-THR-ARG-GLU-PHE-LEU-LYS-SER-LEU-ARG-LYS-PRO-PHE-GLY-ASP-PHE-MET-GLU-PRO-LYS-PHE-GLU-PHE-ALA-VAL-LYS-PHE-ASN-ALA-LEU-GLU-LEU-ASP-ASP-SER-ASP-LEU-ALA-ILE-PHE-ILE-ALA-VAL-ILE-ILE-LEU-SER-GLY-ASP-ARG-PRO-GLY-LEU-LEU-ASN-VAL-LYS-PRO-ILE-GLU-ASP-ILE-GLN-ASP-ASN-LEU-LEU-GLN-ALA-LEU-GLU-LEU-GLN-LEU-LYS-LEU-ASN-HIS-PRO-GLU-SER-SER-GLN-LEU-PHE-ALA-LYS-LEU-LEU-GLN-LYS-MET-THR-ASP-LEU-ARG-GLN-ILE-VAL-THR-GLU-HIS-VAL-GLN-LEU-LEU-GLN-VAL-ILE-LYS-LYS-THR-GLU-THR-ASP-MET-SER-LEU-HIS-PRO-LEU-LEU-GLN-GLU-ILE-TYR-LYS-ASP-LEU,ARG-HIS-LYS-ILE-LEU-HIS-ARG-LEU-LEU-GLN-GLU,270,11,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)O)CCC(=O)N)CC(C)C)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1)CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC[NH+]=C(N)N)[NH3+])CCCC[NH3+])C,IC50=500nM,6.30103,6.3,1,A,A,1,A,A,0,,B,A,,1,1,270,11,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CC[C@H](N)C(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9565417170524596,0.7980072498321533,90.63357543945312,86.74093627929688,0.3488113582134247,0.7651275992393494,0.9393588304519652,0.8871115446090698,0.9363712072372437,0.775731086730957,RHKILHRLLQE,Low,"(6.26, 6.398]",train
4FI9,protein-peptide,Q8WXH0 Q9UH99,VTEEQVHHIVKQALQRYSEDRIGLADYALESGGASVISTRCSETYETKTALLSLFGIPLWYHSQSPRVILQPDVHPGNCWAFQGPQGFAVVRLSARIRPTAVTLEHVPKALSPNSTISSAPKDFAIFGFDEDLQQEGTLLGKFTYDQDGEPIQTFHFQAPTMATYQVVELRILTNWGHPEYTCIYRFRVHGEPAH,FYPMLRYTNGPPPT,VAL-THR-GLU-GLU-GLN-VAL-HIS-HIS-ILE-VAL-LYS-GLN-ALA-LEU-GLN-ARG-TYR-SER-GLU-ASP-ARG-ILE-GLY-LEU-ALA-ASP-TYR-ALA-LEU-GLU-SER-GLY-GLY-ALA-SER-VAL-ILE-SER-THR-ARG-CYS-SER-GLU-THR-TYR-GLU-THR-LYS-THR-ALA-LEU-LEU-SER-LEU-PHE-GLY-ILE-PRO-LEU-TRP-TYR-HIS-SER-GLN-SER-PRO-ARG-VAL-ILE-LEU-GLN-PRO-ASP-VAL-HIS-PRO-GLY-ASN-CYS-TRP-ALA-PHE-GLN-GLY-PRO-GLN-GLY-PHE-ALA-VAL-VAL-ARG-LEU-SER-ALA-ARG-ILE-ARG-PRO-THR-ALA-VAL-THR-LEU-GLU-HIS-VAL-PRO-LYS-ALA-LEU-SER-PRO-ASN-SER-THR-ILE-SER-SER-ALA-PRO-LYS-ASP-PHE-ALA-ILE-PHE-GLY-PHE-ASP-GLU-ASP-LEU-GLN-GLN-GLU-GLY-THR-LEU-LEU-GLY-LYS-PHE-THR-TYR-ASP-GLN-ASP-GLY-GLU-PRO-ILE-GLN-THR-PHE-HIS-PHE-GLN-ALA-PRO-THR-MET-ALA-THR-TYR-GLN-VAL-VAL-GLU-LEU-ARG-ILE-LEU-THR-ASN-TRP-GLY-HIS-PRO-GLU-TYR-THR-CYS-ILE-TYR-ARG-PHE-ARG-VAL-HIS-GLY-GLU-PRO-ALA-HIS,PHE-TYR-PRO-MET-LEU-ARG-TYR-THR-ASN-GLY-PRO-PRO-PRO-THR,195,14,CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(=O)N)[C@H](O)C)Cc1ccc(cc1)O)CCC[NH+]=C(N)N)CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])Cc1ccc(cc1)O,Kd=45.6nM,7.341035,7.34,1,A,A,1,A,A,0,,B,A,,1,1,195,14,0,CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@H](C(=O)O)[C@@H](C)O)[C@@H](C)O,0.8873121738433838,0.7274823784828186,85.30200958251953,79.39623260498047,0.4282268285751343,0.8529258370399475,0.8914120197296143,0.8315214514732361,0.8234881162643433,0.7014725804328918,FYPMLRYTNGPPPT,Moderate,"(7.268, 7.523]",train
4FMQ,protein-peptide,P28482,GSMAAAAAAGAGPEMVRGQVFDVGPRYTNLSYIGEGAYGMVCSAYDNVNKVRVAIKKISPFEHQTYCQRTLREIKILLRFRHENIIGINDIIRAPTIEQMKDVYIVQDLMETDLYKLLKTQHLSNDHICYFLYQILRGLKYIHSANVLHRDLKPSNLLLNTTCDLKICDFGLARVADPDHDHTGFLTEYVATRWYRAPEIMLNSKGYTKSIDIWSVGCILAEMLSNRPIFPGKHYLDQLNHILGILGSPSQEDLNCIINLKARNYLLSLPHKNKVPWNRLFPNADSKALDLLDKMLTFNPHKRIEVEQALAHPYLEQYYDPSDEPIAEAPFKFDMELDDLPKEKLKELIFEETARFQPGYRS,LSLSSLAASSLAKRRQQ,GLY-SER-MET-ALA-ALA-ALA-ALA-ALA-ALA-GLY-ALA-GLY-PRO-GLU-MET-VAL-ARG-GLY-GLN-VAL-PHE-ASP-VAL-GLY-PRO-ARG-TYR-THR-ASN-LEU-SER-TYR-ILE-GLY-GLU-GLY-ALA-TYR-GLY-MET-VAL-CYS-SER-ALA-TYR-ASP-ASN-VAL-ASN-LYS-VAL-ARG-VAL-ALA-ILE-LYS-LYS-ILE-SER-PRO-PHE-GLU-HIS-GLN-THR-TYR-CYS-GLN-ARG-THR-LEU-ARG-GLU-ILE-LYS-ILE-LEU-LEU-ARG-PHE-ARG-HIS-GLU-ASN-ILE-ILE-GLY-ILE-ASN-ASP-ILE-ILE-ARG-ALA-PRO-THR-ILE-GLU-GLN-MET-LYS-ASP-VAL-TYR-ILE-VAL-GLN-ASP-LEU-MET-GLU-THR-ASP-LEU-TYR-LYS-LEU-LEU-LYS-THR-GLN-HIS-LEU-SER-ASN-ASP-HIS-ILE-CYS-TYR-PHE-LEU-TYR-GLN-ILE-LEU-ARG-GLY-LEU-LYS-TYR-ILE-HIS-SER-ALA-ASN-VAL-LEU-HIS-ARG-ASP-LEU-LYS-PRO-SER-ASN-LEU-LEU-LEU-ASN-THR-THR-CYS-ASP-LEU-LYS-ILE-CYS-ASP-PHE-GLY-LEU-ALA-ARG-VAL-ALA-ASP-PRO-ASP-HIS-ASP-HIS-THR-GLY-PHE-LEU-THR-GLU-TYR-VAL-ALA-THR-ARG-TRP-TYR-ARG-ALA-PRO-GLU-ILE-MET-LEU-ASN-SER-LYS-GLY-TYR-THR-LYS-SER-ILE-ASP-ILE-TRP-SER-VAL-GLY-CYS-ILE-LEU-ALA-GLU-MET-LEU-SER-ASN-ARG-PRO-ILE-PHE-PRO-GLY-LYS-HIS-TYR-LEU-ASP-GLN-LEU-ASN-HIS-ILE-LEU-GLY-ILE-LEU-GLY-SER-PRO-SER-GLN-GLU-ASP-LEU-ASN-CYS-ILE-ILE-ASN-LEU-LYS-ALA-ARG-ASN-TYR-LEU-LEU-SER-LEU-PRO-HIS-LYS-ASN-LYS-VAL-PRO-TRP-ASN-ARG-LEU-PHE-PRO-ASN-ALA-ASP-SER-LYS-ALA-LEU-ASP-LEU-LEU-ASP-LYS-MET-LEU-THR-PHE-ASN-PRO-HIS-LYS-ARG-ILE-GLU-VAL-GLU-GLN-ALA-LEU-ALA-HIS-PRO-TYR-LEU-GLU-GLN-TYR-TYR-ASP-PRO-SER-ASP-GLU-PRO-ILE-ALA-GLU-ALA-PRO-PHE-LYS-PHE-ASP-MET-GLU-LEU-ASP-ASP-LEU-PRO-LYS-GLU-LYS-LEU-LYS-GLU-LEU-ILE-PHE-GLU-GLU-THR-ALA-ARG-PHE-GLN-PRO-GLY-TYR-ARG-SER,LEU-SER-LEU-SER-SER-LEU-ALA-ALA-SER-SER-LEU-ALA-LYS-ARG-ARG-GLN-GLN,362,17,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC(=O)N)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CO)CO)CC(C)C)C)C)CO)CO)CC(C)C)C,Kd=9uM,5.045757,5.05,1,A,A,1,A,A,0,,B,A,,1,1,362,17,0,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O,CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)O,0.8194394707679749,0.7166168093681335,76.44310760498047,79.1456069946289,0.5700915455818176,1.054921269416809,0.8626368641853333,0.8340386748313904,0.7575187683105469,0.6630901098251343,LSLSSLAASSLAKRRQQ,Low,"(5.014, 5.105]",train
4FR3,protein-peptide,Q9NPC2 P31947,AMGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCEERNLLSVAYKNVVGGQRAAWRVLSSIEQKSNEEGSEEKPEVREYREKVETELQGVCDTVLGLLDSHLIKEAGDAESRVFYLKMKGDYYRYLAEVATGDDKKRIIDSARSAYQEAMDISKKEMPPTNPIRLGLALNFSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLIMQLLRDNLTLWT,KRRKSV,ALA-MET-GLY-SER-MET-GLU-ARG-ALA-SER-LEU-ILE-GLN-LYS-ALA-LYS-LEU-ALA-GLU-GLN-ALA-GLU-ARG-TYR-GLU-ASP-MET-ALA-ALA-PHE-MET-LYS-GLY-ALA-VAL-GLU-LYS-GLY-GLU-GLU-LEU-SER-CSO-GLU-GLU-ARG-ASN-LEU-LEU-SER-VAL-ALA-TYR-LYS-ASN-VAL-VAL-GLY-GLY-GLN-ARG-ALA-ALA-TRP-ARG-VAL-LEU-SER-SER-ILE-GLU-GLN-LYS-SER-ASN-GLU-GLU-GLY-SER-GLU-GLU-LYS-PRO-GLU-VAL-ARG-GLU-TYR-ARG-GLU-LYS-VAL-GLU-THR-GLU-LEU-GLN-GLY-VAL-CYS-ASP-THR-VAL-LEU-GLY-LEU-LEU-ASP-SER-HIS-LEU-ILE-LYS-GLU-ALA-GLY-ASP-ALA-GLU-SER-ARG-VAL-PHE-TYR-LEU-LYS-MET-LYS-GLY-ASP-TYR-TYR-ARG-TYR-LEU-ALA-GLU-VAL-ALA-THR-GLY-ASP-ASP-LYS-LYS-ARG-ILE-ILE-ASP-SER-ALA-ARG-SER-ALA-TYR-GLN-GLU-ALA-MET-ASP-ILE-SER-LYS-LYS-GLU-MET-PRO-PRO-THR-ASN-PRO-ILE-ARG-LEU-GLY-LEU-ALA-LEU-ASN-PHE-SER-VAL-PHE-HIS-TYR-GLU-ILE-ALA-ASN-SER-PRO-GLU-GLU-ALA-ILE-SER-LEU-ALA-LYS-THR-THR-PHE-ASP-GLU-ALA-MET-ALA-ASP-LEU-HIS-THR-LEU-SER-GLU-ASP-SER-TYR-LYS-ASP-SER-THR-LEU-ILE-MET-GLN-LEU-LEU-ARG-ASP-ASN-LEU-THR-LEU-TRP-THR,LYS-ARG-ARG-LYS-SEP-VAL,234,6,[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)COP(O)(O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CCC[NH+]=C(N)N)CCC[NH+]=C(N)N,Kd=0.07uM,7.154902,7.15,1,A,A,1,A,A,0,,P,A,,1,1,234,6,0,CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCCN)C(=O)O,CC(C)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,CC(C)[C@H](N)C(=O)NC(COP(=O)(O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)O,0.9399479627609252,0.8818672895431519,91.20289611816406,92.41661834716795,0.310582160949707,0.5185485482215881,0.9462710022926332,0.9320509433746338,0.9227421879768372,0.869321346282959,KRRKSV,Moderate,"(7.049, 7.268]",train
4FT2,protein-peptide,P59226 Q9AXT8,SAGDHEPEFIGSPVAADEARSNWPKRYGRSTAAKKPDEEEELKARCHYRSAKVDNVVYCLGDDVYVKAGENEADYIGRITEFFEGTDQCHYFTCRWFFRAEDTVINSLVSISVDGHKHDPRRVFLSEEKNDNVLDCIISKVKIVHVDPNMDPKAKAQLIESCDLYYDMSYSVAYSTFANISSENGQSGSDTASGISSDDVDLETSSSMPTRTATLLDLYSGCGGMSTGLCLGAALSGLKLETRWAVDFNSFACQSLKYNHPQTEVRNEKADEFLALLKEWAVLCKKYVQDVDSNLASSEDQADEDSPLDKDEFVVEKLVGICYGGSDRENGIYFKVQWEGYGPEEDTWEPIDNLSDCPQKIREFVQEGHKRKILPLPGDVDVICGGPPCQGISGFNRYRNRDEPLKDEKNKQMVTFMDIVAYLKPKYVLMENVVDILKFADGYLGKYALSCLVAMKYQARLGMMVAGCYGLPQFRMRVFLWGALSSMVLPKYPLPTYDVVVRGGAPNAFSQCMVAYDETQKPSLKKALLLGDAISDLPKVQNHQPNDVMEYGGSPKTEFQRYIRLSRKDMLDWSFGEGAGPDEGKLLDHQPLRLNNDDYERVQQIPVKKGANFRDLKGVRVGANNIVEWDPEIERVKLSSGKPLVPDYAMSFIKGKSLKPFGRLWWDETVPTVVTRAEPHNQVIIHPTQARVLTIRENARLQGFPDYYRLFGPIKEKYIQVGNAVAVPVARALGYCLGQAYLGESEGSDPLYQLPPSFTSVGGRTAGQARASPVGTPAGEVVEQ,ARTKQTARKSTGGKA,SER-ALA-GLY-ASP-HIS-GLU-PRO-GLU-PHE-ILE-GLY-SER-PRO-VAL-ALA-ALA-ASP-GLU-ALA-ARG-SER-ASN-TRP-PRO-LYS-ARG-TYR-GLY-ARG-SER-THR-ALA-ALA-LYS-LYS-PRO-ASP-GLU-GLU-GLU-GLU-LEU-LYS-ALA-ARG-CYS-HIS-TYR-ARG-SER-ALA-LYS-VAL-ASP-ASN-VAL-VAL-TYR-CYS-LEU-GLY-ASP-ASP-VAL-TYR-VAL-LYS-ALA-GLY-GLU-ASN-GLU-ALA-ASP-TYR-ILE-GLY-ARG-ILE-THR-GLU-PHE-PHE-GLU-GLY-THR-ASP-GLN-CYS-HIS-TYR-PHE-THR-CYS-ARG-TRP-PHE-PHE-ARG-ALA-GLU-ASP-THR-VAL-ILE-ASN-SER-LEU-VAL-SER-ILE-SER-VAL-ASP-GLY-HIS-LYS-HIS-ASP-PRO-ARG-ARG-VAL-PHE-LEU-SER-GLU-GLU-LYS-ASN-ASP-ASN-VAL-LEU-ASP-CYS-ILE-ILE-SER-LYS-VAL-LYS-ILE-VAL-HIS-VAL-ASP-PRO-ASN-MET-ASP-PRO-LYS-ALA-LYS-ALA-GLN-LEU-ILE-GLU-SER-CYS-ASP-LEU-TYR-TYR-ASP-MET-SER-TYR-SER-VAL-ALA-TYR-SER-THR-PHE-ALA-ASN-ILE-SER-SER-GLU-ASN-GLY-GLN-SER-GLY-SER-ASP-THR-ALA-SER-GLY-ILE-SER-SER-ASP-ASP-VAL-ASP-LEU-GLU-THR-SER-SER-SER-MET-PRO-THR-ARG-THR-ALA-THR-LEU-LEU-ASP-LEU-TYR-SER-GLY-CYS-GLY-GLY-MET-SER-THR-GLY-LEU-CYS-LEU-GLY-ALA-ALA-LEU-SER-GLY-LEU-LYS-LEU-GLU-THR-ARG-TRP-ALA-VAL-ASP-PHE-ASN-SER-PHE-ALA-CYS-GLN-SER-LEU-LYS-TYR-ASN-HIS-PRO-GLN-THR-GLU-VAL-ARG-ASN-GLU-LYS-ALA-ASP-GLU-PHE-LEU-ALA-LEU-LEU-LYS-GLU-TRP-ALA-VAL-LEU-CYS-LYS-LYS-TYR-VAL-GLN-ASP-VAL-ASP-SER-ASN-LEU-ALA-SER-SER-GLU-ASP-GLN-ALA-ASP-GLU-ASP-SER-PRO-LEU-ASP-LYS-ASP-GLU-PHE-VAL-VAL-GLU-LYS-LEU-VAL-GLY-ILE-CYS-TYR-GLY-GLY-SER-ASP-ARG-GLU-ASN-GLY-ILE-TYR-PHE-LYS-VAL-GLN-TRP-GLU-GLY-TYR-GLY-PRO-GLU-GLU-ASP-THR-TRP-GLU-PRO-ILE-ASP-ASN-LEU-SER-ASP-CYS-PRO-GLN-LYS-ILE-ARG-GLU-PHE-VAL-GLN-GLU-GLY-HIS-LYS-ARG-LYS-ILE-LEU-PRO-LEU-PRO-GLY-ASP-VAL-ASP-VAL-ILE-CYS-GLY-GLY-PRO-PRO-CYS-GLN-GLY-ILE-SER-GLY-PHE-ASN-ARG-TYR-ARG-ASN-ARG-ASP-GLU-PRO-LEU-LYS-ASP-GLU-LYS-ASN-LYS-GLN-MET-VAL-THR-PHE-MET-ASP-ILE-VAL-ALA-TYR-LEU-LYS-PRO-LYS-TYR-VAL-LEU-MET-GLU-ASN-VAL-VAL-ASP-ILE-LEU-LYS-PHE-ALA-ASP-GLY-TYR-LEU-GLY-LYS-TYR-ALA-LEU-SER-CYS-LEU-VAL-ALA-MET-LYS-TYR-GLN-ALA-ARG-LEU-GLY-MET-MET-VAL-ALA-GLY-CYS-TYR-GLY-LEU-PRO-GLN-PHE-ARG-MET-ARG-VAL-PHE-LEU-TRP-GLY-ALA-LEU-SER-SER-MET-VAL-LEU-PRO-LYS-TYR-PRO-LEU-PRO-THR-TYR-ASP-VAL-VAL-VAL-ARG-GLY-GLY-ALA-PRO-ASN-ALA-PHE-SER-GLN-CYS-MET-VAL-ALA-TYR-ASP-GLU-THR-GLN-LYS-PRO-SER-LEU-LYS-LYS-ALA-LEU-LEU-LEU-GLY-ASP-ALA-ILE-SER-ASP-LEU-PRO-LYS-VAL-GLN-ASN-HIS-GLN-PRO-ASN-ASP-VAL-MET-GLU-TYR-GLY-GLY-SER-PRO-LYS-THR-GLU-PHE-GLN-ARG-TYR-ILE-ARG-LEU-SER-ARG-LYS-ASP-MET-LEU-ASP-TRP-SER-PHE-GLY-GLU-GLY-ALA-GLY-PRO-ASP-GLU-GLY-LYS-LEU-LEU-ASP-HIS-GLN-PRO-LEU-ARG-LEU-ASN-ASN-ASP-ASP-TYR-GLU-ARG-VAL-GLN-GLN-ILE-PRO-VAL-LYS-LYS-GLY-ALA-ASN-PHE-ARG-ASP-LEU-LYS-GLY-VAL-ARG-VAL-GLY-ALA-ASN-ASN-ILE-VAL-GLU-TRP-ASP-PRO-GLU-ILE-GLU-ARG-VAL-LYS-LEU-SER-SER-GLY-LYS-PRO-LEU-VAL-PRO-ASP-TYR-ALA-MET-SER-PHE-ILE-LYS-GLY-LYS-SER-LEU-LYS-PRO-PHE-GLY-ARG-LEU-TRP-TRP-ASP-GLU-THR-VAL-PRO-THR-VAL-VAL-THR-ARG-ALA-GLU-PRO-HIS-ASN-GLN-VAL-ILE-ILE-HIS-PRO-THR-GLN-ALA-ARG-VAL-LEU-THR-ILE-ARG-GLU-ASN-ALA-ARG-LEU-GLN-GLY-PHE-PRO-ASP-TYR-TYR-ARG-LEU-PHE-GLY-PRO-ILE-LYS-GLU-LYS-TYR-ILE-GLN-VAL-GLY-ASN-ALA-VAL-ALA-VAL-PRO-VAL-ALA-ARG-ALA-LEU-GLY-TYR-CYS-LEU-GLY-GLN-ALA-TYR-LEU-GLY-GLU-SER-GLU-GLY-SER-ASP-PRO-LEU-TYR-GLN-LEU-PRO-PRO-SER-PHE-THR-SER-VAL-GLY-GLY-ARG-THR-ALA-GLY-GLN-ALA-ARG-ALA-SER-PRO-VAL-GLY-THR-PRO-ALA-GLY-GLU-VAL-VAL-GLU-GLN,ALA-ARG-THR-LYS-GLN-THR-ALA-ARG-MLY-SER-THR-GLY-GLY-LYS-ALA,784,15,OC[C@@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCC(=O)N)[NH3+])C)CCC[NH+]=C(N)N)CCCC[NH+](C)C,Kd=2.3uM,5.638272,5.64,1,A,A,1,A,A,0,,P,A,,0,1,784,15,0,C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,C[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NC(CCCCN(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O,0.7468432784080505,0.6955914497375488,67.63788604736328,68.14427947998047,0.6961628198623657,1.223364233970642,0.820084810256958,0.8049541115760803,0.6636080145835876,0.610852837562561,ARTKQTARKSTGGKA,Low,"(5.6, 5.699]",val
4FYS,protein-peptide,P15144 P01019,PDQSKAWNRYRLPNTLKPDSYRVTLRPYLTPNDRGLYVFKGSSTVRFTCKEATDVIIIHSKKLNYTLSQGHRVVLRGVGGSQPPDIDKTELVEPTEYLVVHLKGSLVKDSQYEMDSEFEGELADDLAGFYRSEYMEGNVRKVVATTQMQAADARKSFPCFDEPAMKAEFNITLIHPKDLTALSNMLPKGPSTPLPEDPNWNVTEFHTTPKMSTYLLAFIVSEFDYVEKQASNGVLIRIWARPSAIAAGHGDYALNVTGPILNFFAGHYDTPYPLPKSDQIGLPDFNAGAMENWGLVTYRENSLLFDPLSSSSSNKERVVTVIAHELAHQWFGNLVTIEWWNDLWLNEGFASYVEYLGADYAEPTWNLKDLMVLNDVYRVMAVDALASSHPLSTPASEINTPAQISELFDAISYSKGASVLRMLSSFLSEDVFKQGLASYLHTFAYQNTIYLNLWDHLQEAVNNRSIQLPTTVRDIMNRWTLQMGFPVITVDTSTGTLSQEHFLLDPDSNVTRPSEFNYVWIVPITSIRDGRQQQDYWLIDVRAQNDLFSTSGNEWVLLNLNVTGYYRVNYDEENWRKIQTQLQRDHSAIPVINRAQIINDAFNLASAHKVPVTLALNNTLFLIEERQYMPWEAALSSLSYFKLMFDRSEVYGPMKNYLKKQVTPLFIHFRNNTNNWREIPENLMDQYSEVNAISTACSNGVPECEEMVSGLFKQWMENPNNNPIHPNLRSTVYCNAIAQGGEEEWDFAWEQFRNATLVNEADKLRAALACSKELWILNRYLSYTLNPDLIRKQDATSTIISITNNVIGQGLVWDFVQSNWKKLFNDYGGGSFSFSNLIQAVTRRFSTEYELQQLEQFKKDNEETGFGSGTRALEQALEKTKANIKWVKENKEVVLQWFTENSK,VYIHPF,PRO-ASP-GLN-SER-LYS-ALA-TRP-ASN-ARG-TYR-ARG-LEU-PRO-ASN-THR-LEU-LYS-PRO-ASP-SER-TYR-ARG-VAL-THR-LEU-ARG-PRO-TYR-LEU-THR-PRO-ASN-ASP-ARG-GLY-LEU-TYR-VAL-PHE-LYS-GLY-SER-SER-THR-VAL-ARG-PHE-THR-CYS-LYS-GLU-ALA-THR-ASP-VAL-ILE-ILE-ILE-HIS-SER-LYS-LYS-LEU-ASN-TYR-THR-LEU-SER-GLN-GLY-HIS-ARG-VAL-VAL-LEU-ARG-GLY-VAL-GLY-GLY-SER-GLN-PRO-PRO-ASP-ILE-ASP-LYS-THR-GLU-LEU-VAL-GLU-PRO-THR-GLU-TYR-LEU-VAL-VAL-HIS-LEU-LYS-GLY-SER-LEU-VAL-LYS-ASP-SER-GLN-TYR-GLU-MET-ASP-SER-GLU-PHE-GLU-GLY-GLU-LEU-ALA-ASP-ASP-LEU-ALA-GLY-PHE-TYR-ARG-SER-GLU-TYR-MET-GLU-GLY-ASN-VAL-ARG-LYS-VAL-VAL-ALA-THR-THR-GLN-MET-GLN-ALA-ALA-ASP-ALA-ARG-LYS-SER-PHE-PRO-CYS-PHE-ASP-GLU-PRO-ALA-MET-LYS-ALA-GLU-PHE-ASN-ILE-THR-LEU-ILE-HIS-PRO-LYS-ASP-LEU-THR-ALA-LEU-SER-ASN-MET-LEU-PRO-LYS-GLY-PRO-SER-THR-PRO-LEU-PRO-GLU-ASP-PRO-ASN-TRP-ASN-VAL-THR-GLU-PHE-HIS-THR-THR-PRO-LYS-MET-SER-THR-TYR-LEU-LEU-ALA-PHE-ILE-VAL-SER-GLU-PHE-ASP-TYR-VAL-GLU-LYS-GLN-ALA-SER-ASN-GLY-VAL-LEU-ILE-ARG-ILE-TRP-ALA-ARG-PRO-SER-ALA-ILE-ALA-ALA-GLY-HIS-GLY-ASP-TYR-ALA-LEU-ASN-VAL-THR-GLY-PRO-ILE-LEU-ASN-PHE-PHE-ALA-GLY-HIS-TYR-ASP-THR-PRO-TYR-PRO-LEU-PRO-LYS-SER-ASP-GLN-ILE-GLY-LEU-PRO-ASP-PHE-ASN-ALA-GLY-ALA-MET-GLU-ASN-TRP-GLY-LEU-VAL-THR-TYR-ARG-GLU-ASN-SER-LEU-LEU-PHE-ASP-PRO-LEU-SER-SER-SER-SER-SER-ASN-LYS-GLU-ARG-VAL-VAL-THR-VAL-ILE-ALA-HIS-GLU-LEU-ALA-HIS-GLN-TRP-PHE-GLY-ASN-LEU-VAL-THR-ILE-GLU-TRP-TRP-ASN-ASP-LEU-TRP-LEU-ASN-GLU-GLY-PHE-ALA-SER-TYR-VAL-GLU-TYR-LEU-GLY-ALA-ASP-TYR-ALA-GLU-PRO-THR-TRP-ASN-LEU-LYS-ASP-LEU-MET-VAL-LEU-ASN-ASP-VAL-TYR-ARG-VAL-MET-ALA-VAL-ASP-ALA-LEU-ALA-SER-SER-HIS-PRO-LEU-SER-THR-PRO-ALA-SER-GLU-ILE-ASN-THR-PRO-ALA-GLN-ILE-SER-GLU-LEU-PHE-ASP-ALA-ILE-SER-TYR-SER-LYS-GLY-ALA-SER-VAL-LEU-ARG-MET-LEU-SER-SER-PHE-LEU-SER-GLU-ASP-VAL-PHE-LYS-GLN-GLY-LEU-ALA-SER-TYR-LEU-HIS-THR-PHE-ALA-TYR-GLN-ASN-THR-ILE-TYR-LEU-ASN-LEU-TRP-ASP-HIS-LEU-GLN-GLU-ALA-VAL-ASN-ASN-ARG-SER-ILE-GLN-LEU-PRO-THR-THR-VAL-ARG-ASP-ILE-MET-ASN-ARG-TRP-THR-LEU-GLN-MET-GLY-PHE-PRO-VAL-ILE-THR-VAL-ASP-THR-SER-THR-GLY-THR-LEU-SER-GLN-GLU-HIS-PHE-LEU-LEU-ASP-PRO-ASP-SER-ASN-VAL-THR-ARG-PRO-SER-GLU-PHE-ASN-TYR-VAL-TRP-ILE-VAL-PRO-ILE-THR-SER-ILE-ARG-ASP-GLY-ARG-GLN-GLN-GLN-ASP-TYR-TRP-LEU-ILE-ASP-VAL-ARG-ALA-GLN-ASN-ASP-LEU-PHE-SER-THR-SER-GLY-ASN-GLU-TRP-VAL-LEU-LEU-ASN-LEU-ASN-VAL-THR-GLY-TYR-TYR-ARG-VAL-ASN-TYR-ASP-GLU-GLU-ASN-TRP-ARG-LYS-ILE-GLN-THR-GLN-LEU-GLN-ARG-ASP-HIS-SER-ALA-ILE-PRO-VAL-ILE-ASN-ARG-ALA-GLN-ILE-ILE-ASN-ASP-ALA-PHE-ASN-LEU-ALA-SER-ALA-HIS-LYS-VAL-PRO-VAL-THR-LEU-ALA-LEU-ASN-ASN-THR-LEU-PHE-LEU-ILE-GLU-GLU-ARG-GLN-TYR-MET-PRO-TRP-GLU-ALA-ALA-LEU-SER-SER-LEU-SER-TYR-PHE-LYS-LEU-MET-PHE-ASP-ARG-SER-GLU-VAL-TYR-GLY-PRO-MET-LYS-ASN-TYR-LEU-LYS-LYS-GLN-VAL-THR-PRO-LEU-PHE-ILE-HIS-PHE-ARG-ASN-ASN-THR-ASN-ASN-TRP-ARG-GLU-ILE-PRO-GLU-ASN-LEU-MET-ASP-GLN-TYR-SER-GLU-VAL-ASN-ALA-ILE-SER-THR-ALA-CYS-SER-ASN-GLY-VAL-PRO-GLU-CYS-GLU-GLU-MET-VAL-SER-GLY-LEU-PHE-LYS-GLN-TRP-MET-GLU-ASN-PRO-ASN-ASN-ASN-PRO-ILE-HIS-PRO-ASN-LEU-ARG-SER-THR-VAL-TYR-CYS-ASN-ALA-ILE-ALA-GLN-GLY-GLY-GLU-GLU-GLU-TRP-ASP-PHE-ALA-TRP-GLU-GLN-PHE-ARG-ASN-ALA-THR-LEU-VAL-ASN-GLU-ALA-ASP-LYS-LEU-ARG-ALA-ALA-LEU-ALA-CYS-SER-LYS-GLU-LEU-TRP-ILE-LEU-ASN-ARG-TYR-LEU-SER-TYR-THR-LEU-ASN-PRO-ASP-LEU-ILE-ARG-LYS-GLN-ASP-ALA-THR-SER-THR-ILE-ILE-SER-ILE-THR-ASN-ASN-VAL-ILE-GLY-GLN-GLY-LEU-VAL-TRP-ASP-PHE-VAL-GLN-SER-ASN-TRP-LYS-LYS-LEU-PHE-ASN-ASP-TYR-GLY-GLY-GLY-SER-PHE-SER-PHE-SER-ASN-LEU-ILE-GLN-ALA-VAL-THR-ARG-ARG-PHE-SER-THR-GLU-TYR-GLU-LEU-GLN-GLN-LEU-GLU-GLN-PHE-LYS-LYS-ASP-ASN-GLU-GLU-THR-GLY-PHE-GLY-SER-GLY-THR-ARG-ALA-LEU-GLU-GLN-ALA-LEU-GLU-LYS-THR-LYS-ALA-ASN-ILE-LYS-TRP-VAL-LYS-GLU-ASN-LYS-GLU-VAL-VAL-LEU-GLN-TRP-PHE-THR-GLU-ASN-SER-LYS,VAL-TYR-ILE-HIS-PRO-PHE,903,6,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1nc[nH]c1)NC(=O)[C@@H](NC(=O)[C@H](C(C)C)[NH3+])Cc1ccc(cc1)O)C,Kd=15uM,4.823909,4.82,1,A,A,1,A,A,0,,C,A,,1,1,903,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C,0.9274608492851256,0.9028857946395874,83.960205078125,83.3525161743164,0.3813382089138031,0.467513769865036,0.938701033592224,0.9406239986419678,0.9205253720283508,0.8934512138366699,VYIHPF,Low,"(4.745, 4.866]",train
4G69,protein-peptide,Q12959 P25054,GSRKPVSEKIMEIKLIKGPKGLGFSIAGGVGNQHIPGDNSIYVTKIIEGGAAHKDGKLQIGDKLLAVNNVCLEEVTHEEAVTALKNTSDFVYLKVAKPTS,RHSGSYLVTSV,GLY-SER-ARG-LYS-PRO-VAL-SER-GLU-LYS-ILE-MET-GLU-ILE-LYS-LEU-ILE-LYS-GLY-PRO-LYS-GLY-LEU-GLY-PHE-SER-ILE-ALA-GLY-GLY-VAL-GLY-ASN-GLN-HIS-ILE-PRO-GLY-ASP-ASN-SER-ILE-TYR-VAL-THR-LYS-ILE-ILE-GLU-GLY-GLY-ALA-ALA-HIS-LYS-ASP-GLY-LYS-LEU-GLN-ILE-GLY-ASP-LYS-LEU-LEU-ALA-VAL-ASN-ASN-VAL-CYS-LEU-GLU-GLU-VAL-THR-HIS-GLU-GLU-ALA-VAL-THR-ALA-LEU-LYS-ASN-THR-SER-ASP-PHE-VAL-TYR-LEU-LYS-VAL-ALA-LYS-PRO-THR-SER,ARG-HIS-SER-GLY-SER-TYR-LEU-VAL-THR-SER-VAL,100,11,OC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)[NH3+])CC(C)C,Kd=1.05uM,5.978811,5.98,1,A,A,1,A,A,0,,B,A,,1,1,100,11,0,CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O)C(C)C,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O,0.9856090545654296,0.9336333870887756,91.87267303466795,92.85382843017578,0.3113331794738769,0.4708292484283447,0.9200560450553894,0.911834716796875,0.8893846869468689,0.8765829801559448,RHSGSYLVTSV,Low,"(5.959, 6.097]",val
2YQ7,protein-peptide,O43521 Q07817,GPLGSMSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,WIAQELREIGDKFNAYYA,GLY-PRO-LEU-GLY-SER-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,ACE-TRP-ILE-ALA-GLN-GLU-LEU-ARG-GLU-ILE-GLY-ASP-LYS-PHE-ASN-ALA-TYR-TYR-ALA-NH2,158,20,CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC1=O)[C@H](CC)C)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C)CC(=O)N)Cc1ccccc1)CCC[NH+]=C(N)N)CC(C)C)CCC(=O)O)CCC(=O)N)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)C)C,Ki=35nM,7.455932,7.46,1,A,A,1,A,A,0,,B,A,,1,1,158,20,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,,CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)O,0.9601961374282836,0.7645216584205627,77.64008331298828,74.76134490966797,0.555575430393219,0.9135655760765076,0.8013208508491516,0.7950947880744934,0.893380880355835,0.7291885018348694,WIAQELREIGDKFNAYYA,Moderate,"(7.268, 7.523]",train
4A1U,protein-peptide,O43521 Q07817,GPLGSMSQSNRELVVDFLSYKLSQKGYSWSQMAAVKQALREAGDEFELRYRRAFSDLTSQLHITPGTAYQSFEQVVNELFRDGVNWGRIVAFFSFGGALCVESVDKEMQVLVSRIAAWMATYLNDHLEPWIQENGGWDTFVELYGNNAAAESRKGQER,IWIAQELRRIGDEFNAYY,GLY-PRO-LEU-GLY-SER-MET-SER-GLN-SER-ASN-ARG-GLU-LEU-VAL-VAL-ASP-PHE-LEU-SER-TYR-LYS-LEU-SER-GLN-LYS-GLY-TYR-SER-TRP-SER-GLN-MET-ALA-ALA-VAL-LYS-GLN-ALA-LEU-ARG-GLU-ALA-GLY-ASP-GLU-PHE-GLU-LEU-ARG-TYR-ARG-ARG-ALA-PHE-SER-ASP-LEU-THR-SER-GLN-LEU-HIS-ILE-THR-PRO-GLY-THR-ALA-TYR-GLN-SER-PHE-GLU-GLN-VAL-VAL-ASN-GLU-LEU-PHE-ARG-ASP-GLY-VAL-ASN-TRP-GLY-ARG-ILE-VAL-ALA-PHE-PHE-SER-PHE-GLY-GLY-ALA-LEU-CYS-VAL-GLU-SER-VAL-ASP-LYS-GLU-MET-GLN-VAL-LEU-VAL-SER-ARG-ILE-ALA-ALA-TRP-MET-ALA-THR-TYR-LEU-ASN-ASP-HIS-LEU-GLU-PRO-TRP-ILE-GLN-GLU-ASN-GLY-GLY-TRP-ASP-THR-PHE-VAL-GLU-LEU-TYR-GLY-ASN-ASN-ALA-ALA-ALA-GLU-SER-ARG-LYS-GLY-GLN-GLU-ARG,ACE-ILE-HT7-ILE-ALA-GLN-B3E-LEU-ARG-HR7-ILE-GLY-ASP-B3E-PHE-ASN-B3A-TYR-TYR-NH2,158,20,CC[C@@H]([C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccc(cc1)O)Cc1ccc(cc1)O)C)CC(=O)N)Cc1ccccc1)CCC(=O)O)CC(=O)O)NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H]([C@H](CC)C)NC(=O)C)C)CCC(=O)N)CCC(=O)O)CC(C)C)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)C,Ki=0.54uM,6.267606,6.27,1,A,A,1,A,A,0,,B,A,,1,1,158,20,0,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,,CC[C@H](C)[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)CC)[C@@H](C)CC,0.9497492909431458,0.8182420134544373,80.25570678710938,74.81192779541016,0.5302614569664001,0.8241249918937683,0.8076808452606201,0.8200137615203857,0.907141387462616,0.7821977734565735,IWIAQELRRIGDEFNAYY,Low,"(6.26, 6.398]",train
1AWI,protein-peptide,P07737,GWNAYIDNLMADGTCQDAAIVGYKDSPSVWAAVPGKTFVNITPAEVGVLVGKDRSSFYVNGLTLGGQKCSVIRDSLLQDGEFSMDLRTKSTGGAPTFNVTVTKTDKTLVLLMGKEGVHGGLINKKCYEMASHLRRSQY,PPPPPPPPPP,GLY-TRP-ASN-ALA-TYR-ILE-ASP-ASN-LEU-MET-ALA-ASP-GLY-THR-CYS-GLN-ASP-ALA-ALA-ILE-VAL-GLY-TYR-LYS-ASP-SER-PRO-SER-VAL-TRP-ALA-ALA-VAL-PRO-GLY-LYS-THR-PHE-VAL-ASN-ILE-THR-PRO-ALA-GLU-VAL-GLY-VAL-LEU-VAL-GLY-LYS-ASP-ARG-SER-SER-PHE-TYR-VAL-ASN-GLY-LEU-THR-LEU-GLY-GLY-GLN-LYS-CYS-SER-VAL-ILE-ARG-ASP-SER-LEU-LEU-GLN-ASP-GLY-GLU-PHE-SER-MET-ASP-LEU-ARG-THR-LYS-SER-THR-GLY-GLY-ALA-PRO-THR-PHE-ASN-VAL-THR-VAL-THR-LYS-THR-ASP-LYS-THR-LEU-VAL-LEU-LEU-MET-GLY-LYS-GLU-GLY-VAL-HIS-GLY-GLY-LEU-ILE-ASN-LYS-LYS-CYS-TYR-GLU-MET-ALA-SER-HIS-LEU-ARG-ARG-SER-GLN-TYR,PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO,138,10,OC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1,Kd=90uM,4.045757,4.05,1,A,A,1,A,A,0,,P,A,dimer,1,1,138,10,0,O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,0.8843564391136169,0.7593978047370911,94.84966278076172,92.40153503417967,0.3175046145915985,0.527336835861206,0.9427652359008788,0.8576571345329285,0.8275244832038879,0.7348329424858093,PPPPPPPPPP,Low,"(3.924, 4.155]",train
5LRG,protein-peptide,P09955,TTGHSYEKYNNWETIEAWTKQVTSENPDLISRTAIGTTFLGNNIYLLKVGKPGPNKPAIFMDCGFHAREWISHAFCQWFVREAVLTYGYESHMTEFLNKLDFYVLPVLNIDGYIYTWTKNRMWRKTRSTNAGTTCIGTDPNRNFDAGWCTTGASTDPCDETYCGSAAESEKETKALADFIRNNLSSIKAYLTIHSYSQMILYPYSYDYKLPENNAELNNLAKAAVKELATLYGTKYTYGPGATTIYPAAGGSDDWAYDQGIKYSFTFELRDKGRYGFILPESQIQATCEETMLAIKYVTNYVLGHL,RKVYAF,THR-THR-GLY-HIS-SER-TYR-GLU-LYS-TYR-ASN-ASN-TRP-GLU-THR-ILE-GLU-ALA-TRP-THR-LYS-GLN-VAL-THR-SER-GLU-ASN-PRO-ASP-LEU-ILE-SER-ARG-THR-ALA-ILE-GLY-THR-THR-PHE-LEU-GLY-ASN-ASN-ILE-TYR-LEU-LEU-LYS-VAL-GLY-LYS-PRO-GLY-PRO-ASN-LYS-PRO-ALA-ILE-PHE-MET-ASP-CYS-GLY-PHE-HIS-ALA-ARG-GLU-TRP-ILE-SER-HIS-ALA-PHE-CYS-GLN-TRP-PHE-VAL-ARG-GLU-ALA-VAL-LEU-THR-TYR-GLY-TYR-GLU-SER-HIS-MET-THR-GLU-PHE-LEU-ASN-LYS-LEU-ASP-PHE-TYR-VAL-LEU-PRO-VAL-LEU-ASN-ILE-ASP-GLY-TYR-ILE-TYR-THR-TRP-THR-LYS-ASN-ARG-MET-TRP-ARG-LYS-THR-ARG-SER-THR-ASN-ALA-GLY-THR-THR-CYS-ILE-GLY-THR-ASP-PRO-ASN-ARG-ASN-PHE-ASP-ALA-GLY-TRP-CYS-THR-THR-GLY-ALA-SER-THR-ASP-PRO-CYS-ASP-GLU-THR-TYR-CYS-GLY-SER-ALA-ALA-GLU-SER-GLU-LYS-GLU-THR-LYS-ALA-LEU-ALA-ASP-PHE-ILE-ARG-ASN-ASN-LEU-SER-SER-ILE-LYS-ALA-TYR-LEU-THR-ILE-HIS-SER-TYR-SER-GLN-MET-ILE-LEU-TYR-PRO-TYR-SER-TYR-ASP-TYR-LYS-LEU-PRO-GLU-ASN-ASN-ALA-GLU-LEU-ASN-ASN-LEU-ALA-LYS-ALA-ALA-VAL-LYS-GLU-LEU-ALA-THR-LEU-TYR-GLY-THR-LYS-TYR-THR-TYR-GLY-PRO-GLY-ALA-THR-THR-ILE-TYR-PRO-ALA-ALA-GLY-GLY-SER-ASP-ASP-TRP-ALA-TYR-ASP-GLN-GLY-ILE-LYS-TYR-SER-PHE-THR-PHE-GLU-LEU-ARG-ASP-LYS-GLY-ARG-TYR-GLY-PHE-ILE-LEU-PRO-GLU-SER-GLN-ILE-GLN-ALA-THR-CYS-GLU-GLU-THR-MET-LEU-ALA-ILE-LYS-TYR-VAL-THR-ASN-TYR-VAL-LEU-GLY-HIS-LEU,73N-DLY-VAL-73O-MAA-PHE,306,6,O=C(N[C@@H]1CCCC[N@H+]2O[C@@]2(O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)CCc1ccc(cc1)O)C)C)N[C@H](C(=O)O)CCCNC(=[NH2+])N,IC50=1.5nM,8.823909,8.82,1,A,A,1,A,A,0,,F,A,,1,1,306,6,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)C[C@H](NC(=O)CC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](N)CS)C(=O)O)C(=O)NCC(=O)NC(CCCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9457293748855592,0.8777333498001099,96.16695404052734,95.99690246582033,0.292859822511673,0.4816092252731323,0.9649927020072936,0.9477099776268004,0.928894340991974,0.8602391481399536,RKVYAF,Moderate,"(8.383, 8.824]",train
5LRJ,protein-peptide,P09955,TTGHSYEKYNNWETIEAWTKQVTSENPDLISRTAIGTTFLGNNIYLLKVGKPGPNKPAIFMDCGFHAREWISHAFCQWFVREAVLTYGYESHMTEFLNKLDFYVLPVLNIDGYIYTWTKNRMWRKTRSTNAGTTCIGTDPNRNFDAGWCTTGASTDPCDETYCGSAAESEKETKALADFIRNNLSSIKAYLTIHSYSQMILYPYSYDYKLPENNAELNNLAKAAVKELATLYGTKYTYGPGATTIYPAAGGSDDWAYDQGIKYSFTFELRDKGRYGFILPESQIQATCEETMLAIKYVTNYVLGHL,KKVYAF,THR-THR-GLY-HIS-SER-TYR-GLU-LYS-TYR-ASN-ASN-TRP-GLU-THR-ILE-GLU-ALA-TRP-THR-LYS-GLN-VAL-THR-SER-GLU-ASN-PRO-ASP-LEU-ILE-SER-ARG-THR-ALA-ILE-GLY-THR-THR-PHE-LEU-GLY-ASN-ASN-ILE-TYR-LEU-LEU-LYS-VAL-GLY-LYS-PRO-GLY-PRO-ASN-LYS-PRO-ALA-ILE-PHE-MET-ASP-CYS-GLY-PHE-HIS-ALA-ARG-GLU-TRP-ILE-SER-HIS-ALA-PHE-CYS-GLN-TRP-PHE-VAL-ARG-GLU-ALA-VAL-LEU-THR-TYR-GLY-TYR-GLU-SER-HIS-MET-THR-GLU-PHE-LEU-ASN-LYS-LEU-ASP-PHE-TYR-VAL-LEU-PRO-VAL-LEU-ASN-ILE-ASP-GLY-TYR-ILE-TYR-THR-TRP-THR-LYS-ASN-ARG-MET-TRP-ARG-LYS-THR-ARG-SER-THR-ASN-ALA-GLY-THR-THR-CYS-ILE-GLY-THR-ASP-PRO-ASN-ARG-ASN-PHE-ASP-ALA-GLY-TRP-CYS-THR-THR-GLY-ALA-SER-THR-ASP-PRO-CYS-ASP-GLU-THR-TYR-CYS-GLY-SER-ALA-ALA-GLU-SER-GLU-LYS-GLU-THR-LYS-ALA-LEU-ALA-ASP-PHE-ILE-ARG-ASN-ASN-LEU-SER-SER-ILE-LYS-ALA-TYR-LEU-THR-ILE-HIS-SER-TYR-SER-GLN-MET-ILE-LEU-TYR-PRO-TYR-SER-TYR-ASP-TYR-LYS-LEU-PRO-GLU-ASN-ASN-ALA-GLU-LEU-ASN-ASN-LEU-ALA-LYS-ALA-ALA-VAL-LYS-GLU-LEU-ALA-THR-LEU-TYR-GLY-THR-LYS-TYR-THR-TYR-GLY-PRO-GLY-ALA-THR-THR-ILE-TYR-PRO-ALA-ALA-GLY-GLY-SER-ASP-ASP-TRP-ALA-TYR-ASP-GLN-GLY-ILE-LYS-TYR-SER-PHE-THR-PHE-GLU-LEU-ARG-ASP-LYS-GLY-ARG-TYR-GLY-PHE-ILE-LEU-PRO-GLU-SER-GLN-ILE-GLN-ALA-THR-CYS-GLU-GLU-THR-MET-LEU-ALA-ILE-LYS-TYR-VAL-THR-ASN-TYR-VAL-LEU-GLY-HIS-LEU,73P-DLY-VAL-73O-MAA-PHE,306,6,[NH3+]CCCC[C@@H](C(=O)O)NC(=O)N[C@@H]1CCCC[N@H+]2O[C@@]2(O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)CCc1ccc(cc1)O)C)C,IC50=1.9nM,8.721246,8.72,1,A,A,1,A,A,0,,F,A,,1,1,306,6,0,CC(C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)[C@H](NC(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC(C)[C@H](NC(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCc1ccc(O)cc1)C(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.918502390384674,0.8595207929611206,95.54811096191406,95.8828125,0.2962109744548797,0.4999264478683471,0.9649272561073304,0.9459896683692932,0.8948768973350525,0.8379034996032715,KKVYAF,Moderate,"(8.383, 8.824]",train
5LRK,protein-peptide,P09955,TTGHSYEKYNNWETIEAWTKQVTSENPDLISRTAIGTTFLGNNIYLLKVGKPGPNKPAIFMDCGFHAREWISHAFCQWFVREAVLTYGYESHMTEFLNKLDFYVLPVLNIDGYIYTWTKNRMWRKTRSTNAGTTCIGTDPNRNFDAGWCTTGASTDPCDETYCGSAAESEKETKALADFIRNNLSSIKAYLTIHSYSQMILYPYSYDYKLPENNAELNNLAKAAVKELATLYGTKYTYGPGATTIYPAAGGSDDWAYDQGIKYSFTFELRDKGRYGFILPESQIQATCEETMLAIKYVTNYVLGHL,RKIYAF,THR-THR-GLY-HIS-SER-TYR-GLU-LYS-TYR-ASN-ASN-TRP-GLU-THR-ILE-GLU-ALA-TRP-THR-LYS-GLN-VAL-THR-SER-GLU-ASN-PRO-ASP-LEU-ILE-SER-ARG-THR-ALA-ILE-GLY-THR-THR-PHE-LEU-GLY-ASN-ASN-ILE-TYR-LEU-LEU-LYS-VAL-GLY-LYS-PRO-GLY-PRO-ASN-LYS-PRO-ALA-ILE-PHE-MET-ASP-CYS-GLY-PHE-HIS-ALA-ARG-GLU-TRP-ILE-SER-HIS-ALA-PHE-CYS-GLN-TRP-PHE-VAL-ARG-GLU-ALA-VAL-LEU-THR-TYR-GLY-TYR-GLU-SER-HIS-MET-THR-GLU-PHE-LEU-ASN-LYS-LEU-ASP-PHE-TYR-VAL-LEU-PRO-VAL-LEU-ASN-ILE-ASP-GLY-TYR-ILE-TYR-THR-TRP-THR-LYS-ASN-ARG-MET-TRP-ARG-LYS-THR-ARG-SER-THR-ASN-ALA-GLY-THR-THR-CYS-ILE-GLY-THR-ASP-PRO-ASN-ARG-ASN-PHE-ASP-ALA-GLY-TRP-CYS-THR-THR-GLY-ALA-SER-THR-ASP-PRO-CYS-ASP-GLU-THR-TYR-CYS-GLY-SER-ALA-ALA-GLU-SER-GLU-LYS-GLU-THR-LYS-ALA-LEU-ALA-ASP-PHE-ILE-ARG-ASN-ASN-LEU-SER-SER-ILE-LYS-ALA-TYR-LEU-THR-ILE-HIS-SER-TYR-SER-GLN-MET-ILE-LEU-TYR-PRO-TYR-SER-TYR-ASP-TYR-LYS-LEU-PRO-GLU-ASN-ASN-ALA-GLU-LEU-ASN-ASN-LEU-ALA-LYS-ALA-ALA-VAL-LYS-GLU-LEU-ALA-THR-LEU-TYR-GLY-THR-LYS-TYR-THR-TYR-GLY-PRO-GLY-ALA-THR-THR-ILE-TYR-PRO-ALA-ALA-GLY-GLY-SER-ASP-ASP-TRP-ALA-TYR-ASP-GLN-GLY-ILE-LYS-TYR-SER-PHE-THR-PHE-GLU-LEU-ARG-ASP-LYS-GLY-ARG-TYR-GLY-PHE-ILE-LEU-PRO-GLU-SER-GLN-ILE-GLN-ALA-THR-CYS-GLU-GLU-THR-MET-LEU-ALA-ILE-LYS-TYR-VAL-THR-ASN-TYR-VAL-LEU-GLY-HIS-LEU,73N-DLY-IIL-73O-MAA-PHE,306,6,CC[C@H]([C@@H]1NC(=O)[C@@H](CCCC[N@H+]2O[C@]2([C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](NC1=O)CCc1ccc(cc1)O)C)C)Cc1ccccc1)O)NC(=O)N[C@H](C(=O)O)CCCNC(=[NH2+])N)C,IC50=1.5nM,8.823909,8.82,1,A,A,1,A,A,0,,F,A,,1,1,306,6,0,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CC[C@H](NC(=O)[C@H](CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N[C@@H](CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O)C(=O)N[C@@H](CCC(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)CC)C(C)C)NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(=O)O,CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O,0.9530868530273438,0.8745231628417969,96.49388885498048,96.07928466796876,0.2907247245311737,0.4834525287151336,0.9666153192520142,0.949345052242279,0.937685489654541,0.8558177351951599,RKIYAF,Moderate,"(8.383, 8.824]",train
5N8J,protein-peptide,P22629,MRKIVVAAIAVSLTTVSITASASADPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAASIDAAKKAGVNNGNPLDAVQQ,GYGLANVDESSG,MET-ARG-LYS-ILE-VAL-VAL-ALA-ALA-ILE-ALA-VAL-SER-LEU-THR-THR-VAL-SER-ILE-THR-ALA-SER-ALA-SER-ALA-ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER-ILE-ASP-ALA-ALA-LYS-LYS-ALA-GLY-VAL-ASN-ASN-GLY-ASN-PRO-LEU-ASP-ALA-VAL-GLN-GLN,GLY-DTY-GLY-DLE-DAL-DSG-DVA-DAS-DGL-DSN-DSN-GLY,183,12,[NH3+]CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)O)CO)CCC(=O)O)CC(=O)O)C(C)C)CC(=O)N)C)CC(C)C,Kd=2.87uM,5.542118,5.54,1,A,A,1,A,A,0,,E,A,dimer,0,1,183,12,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)O)C(C)C,CC(C)CC(NC(=O)C(C)NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)CCC(NC(=O)C(CO)NC(=O)C(CO)NC(=O)CN)C(=O)O)C(C)C)C(=O)NCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O,CC(C)CC(NC(=O)C(C)NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(=O)O)NC(=O)CCC(NC(=O)C(CO)NC(=O)C(CO)NC(=O)CN)C(=O)O)C(C)C)C(=O)NCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCC(=O)O,0.5045442581176758,0.8226314187049866,71.17346954345703,75.79411315917969,0.9536733627319336,0.9011470079421996,0.6968585848808289,0.7330935597419739,0.3186451196670532,0.7357262372970581,GYGLANVDESSG,Low,"(5.463, 5.6]",train
5N8W,protein-peptide,P22629,MRKIVVAAIAVSLTTVSITASASADPSKDSKAQVSAAEAGITGTWYNQLGSTFIVTAGADGALTGTYESAVGNAESRYVLTGRYDSAPATDGSGTALGWTVAWKNNYRNAHSATTWSGQYVGGAEARINTQWLLTSGTTEANAWKSTLVGHDTFTKVKPSAASIDAAKKAGVNNGNPLDAVQQ,GGWHDEATWKPGLY,MET-ARG-LYS-ILE-VAL-VAL-ALA-ALA-ILE-ALA-VAL-SER-LEU-THR-THR-VAL-SER-ILE-THR-ALA-SER-ALA-SER-ALA-ASP-PRO-SER-LYS-ASP-SER-LYS-ALA-GLN-VAL-SER-ALA-ALA-GLU-ALA-GLY-ILE-THR-GLY-THR-TRP-TYR-ASN-GLN-LEU-GLY-SER-THR-PHE-ILE-VAL-THR-ALA-GLY-ALA-ASP-GLY-ALA-LEU-THR-GLY-THR-TYR-GLU-SER-ALA-VAL-GLY-ASN-ALA-GLU-SER-ARG-TYR-VAL-LEU-THR-GLY-ARG-TYR-ASP-SER-ALA-PRO-ALA-THR-ASP-GLY-SER-GLY-THR-ALA-LEU-GLY-TRP-THR-VAL-ALA-TRP-LYS-ASN-ASN-TYR-ARG-ASN-ALA-HIS-SER-ALA-THR-THR-TRP-SER-GLY-GLN-TYR-VAL-GLY-GLY-ALA-GLU-ALA-ARG-ILE-ASN-THR-GLN-TRP-LEU-LEU-THR-SER-GLY-THR-THR-GLU-ALA-ASN-ALA-TRP-LYS-SER-THR-LEU-VAL-GLY-HIS-ASP-THR-PHE-THR-LYS-VAL-LYS-PRO-SER-ALA-ALA-SER-ILE-ASP-ALA-ALA-LYS-LYS-ALA-GLY-VAL-ASN-ASN-GLY-ASN-PRO-LEU-ASP-ALA-VAL-GLN-GLN,GLY-GLY-DTR-DHI-DAS-DGL-DAL-DTH-DTR-DLY-DPR-GLY-LEU-TYR,183,14,[NH3+]CCCC[C@H](C(=O)O)NC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]([C@@H](O)C)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)CNC(=O)C[NH3+])Cc1nc[nH]c1)CC(=O)O)CCC(=O)O)C,Kd=0.47uM,6.327902,6.33,1,A,A,1,A,A,0,,C,A,,0,1,183,14,0,CC(C)C[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,CC(C)C[C@H](NC(=O)CC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCCN)NC(=O)C1CCCN1)C(C)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(=O)NCC(=O)O)C(=O)O,CC(C)C[C@H](NC(=O)CC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CCCCN)NC(=O)C1CCCN1)C(C)O)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(=O)NC(Cc1cnc[nH]1)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCC(=O)NCC(=O)O)C(=O)O,0.684479832649231,0.8564983606338501,67.27122497558594,77.04689025878906,0.776297926902771,0.7854257822036743,0.7061426043510437,0.7714672684669495,0.5331250429153442,0.7684665322303772,GGWHDEATWKPGLY,Low,"(6.26, 6.398]",val
6EVM,protein-peptide,O15460,MHHHHHHMLSVDDCFGMGRSAYNEGDYYHTVLWMEQVLKQLDAGEEATTTKSQVLDYLSYAVFQLGDLHRALELTRRLLSLDPSHERAGGNLRYFEQLLEEE,PPPPPPPPP,MET-HIS-HIS-HIS-HIS-HIS-HIS-MET-LEU-SER-VAL-ASP-ASP-CYS-PHE-GLY-MET-GLY-ARG-SER-ALA-TYR-ASN-GLU-GLY-ASP-TYR-TYR-HIS-THR-VAL-LEU-TRP-MET-GLU-GLN-VAL-LEU-LYS-GLN-LEU-ASP-ALA-GLY-GLU-GLU-ALA-THR-THR-THR-LYS-SER-GLN-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-PHE-GLN-LEU-GLY-ASP-LEU-HIS-ARG-ALA-LEU-GLU-LEU-THR-ARG-ARG-LEU-LEU-SER-LEU-ASP-PRO-SER-HIS-GLU-ARG-ALA-GLY-GLY-ASN-LEU-ARG-TYR-PHE-GLU-GLN-LEU-LEU-GLU-GLU-GLU,PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO,102,9,OC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1,Kd=1500uM,2.823909,2.82,1,A,A,1,A,A,0,,C,A,,1,1,102,9,0,O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,0.9032931923866272,0.8241007328033447,92.61367797851562,92.33778381347656,0.3258045613765716,0.4307340085506439,0.9024196267127992,0.8694461584091187,0.8190521001815796,0.8127643465995789,PPPPPPPPP,Low,"(2.044, 3.548]",train
6PEK,protein-peptide,Q9UBP0,MAAKRSSGAAPAPASASAPAPVPGGEAERVRVFHKQAFEYISIALRIDEDEKAGQKEQAVEWYKKGIEELEKGIAVIVTGQGEQCERARRLQAKMMTNLVMAKDRLQLLESGAVPKRKDPLTHTSNSLPRSKTVMKTGSAGLSGHHRAPSYSGLSMVSGVKQGSGPAPTTHKGTPKTNRTNKPSTPTTATRKKKDLKNFRNVDSNLANLIMNEIVDNGTAVKFDDIAGQDLAKQALQEIVILPSLRPELFTGLRAPARGLLLFGPPGNGKTMLAKAVAAESNATFFNISAASLTSKYVGEGEKLVRALFAVARELQPSIIFIDEVDSLLCERREGEHDASRRLKTEFLIEFDGVQSAGDDRVLVMGATNRPQELDEAVLRRFIKRVYVSLPNEETRLLLLKNLLCKQGSPLTQKELAQLARMTDGYSGSDLTALAKDAALGPIRELKPEQVKNMSASEMRNIRLSDFTESLKKIKRSVSPQTLEAYIRWNKDFGDTTV,EYEYEYEYEY,MET-ALA-ALA-LYS-ARG-SER-SER-GLY-ALA-ALA-PRO-ALA-PRO-ALA-SER-ALA-SER-ALA-PRO-ALA-PRO-VAL-PRO-GLY-GLY-GLU-ALA-GLU-ARG-VAL-ARG-VAL-PHE-HIS-LYS-GLN-ALA-PHE-GLU-TYR-ILE-SER-ILE-ALA-LEU-ARG-ILE-ASP-GLU-ASP-GLU-LYS-ALA-GLY-GLN-LYS-GLU-GLN-ALA-VAL-GLU-TRP-TYR-LYS-LYS-GLY-ILE-GLU-GLU-LEU-GLU-LYS-GLY-ILE-ALA-VAL-ILE-VAL-THR-GLY-GLN-GLY-GLU-GLN-CYS-GLU-ARG-ALA-ARG-ARG-LEU-GLN-ALA-LYS-MET-MET-THR-ASN-LEU-VAL-MET-ALA-LYS-ASP-ARG-LEU-GLN-LEU-LEU-GLU-SER-GLY-ALA-VAL-PRO-LYS-ARG-LYS-ASP-PRO-LEU-THR-HIS-THR-SER-ASN-SER-LEU-PRO-ARG-SER-LYS-THR-VAL-MET-LYS-THR-GLY-SER-ALA-GLY-LEU-SER-GLY-HIS-HIS-ARG-ALA-PRO-SER-TYR-SER-GLY-LEU-SER-MET-VAL-SER-GLY-VAL-LYS-GLN-GLY-SER-GLY-PRO-ALA-PRO-THR-THR-HIS-LYS-GLY-THR-PRO-LYS-THR-ASN-ARG-THR-ASN-LYS-PRO-SER-THR-PRO-THR-THR-ALA-THR-ARG-LYS-LYS-LYS-ASP-LEU-LYS-ASN-PHE-ARG-ASN-VAL-ASP-SER-ASN-LEU-ALA-ASN-LEU-ILE-MET-ASN-GLU-ILE-VAL-ASP-ASN-GLY-THR-ALA-VAL-LYS-PHE-ASP-ASP-ILE-ALA-GLY-GLN-ASP-LEU-ALA-LYS-GLN-ALA-LEU-GLN-GLU-ILE-VAL-ILE-LEU-PRO-SER-LEU-ARG-PRO-GLU-LEU-PHE-THR-GLY-LEU-ARG-ALA-PRO-ALA-ARG-GLY-LEU-LEU-LEU-PHE-GLY-PRO-PRO-GLY-ASN-GLY-LYS-THR-MET-LEU-ALA-LYS-ALA-VAL-ALA-ALA-GLU-SER-ASN-ALA-THR-PHE-PHE-ASN-ILE-SER-ALA-ALA-SER-LEU-THR-SER-LYS-TYR-VAL-GLY-GLU-GLY-GLU-LYS-LEU-VAL-ARG-ALA-LEU-PHE-ALA-VAL-ALA-ARG-GLU-LEU-GLN-PRO-SER-ILE-ILE-PHE-ILE-ASP-GLU-VAL-ASP-SER-LEU-LEU-CYS-GLU-ARG-ARG-GLU-GLY-GLU-HIS-ASP-ALA-SER-ARG-ARG-LEU-LYS-THR-GLU-PHE-LEU-ILE-GLU-PHE-ASP-GLY-VAL-GLN-SER-ALA-GLY-ASP-ASP-ARG-VAL-LEU-VAL-MET-GLY-ALA-THR-ASN-ARG-PRO-GLN-GLU-LEU-ASP-GLU-ALA-VAL-LEU-ARG-ARG-PHE-ILE-LYS-ARG-VAL-TYR-VAL-SER-LEU-PRO-ASN-GLU-GLU-THR-ARG-LEU-LEU-LEU-LEU-LYS-ASN-LEU-LEU-CYS-LYS-GLN-GLY-SER-PRO-LEU-THR-GLN-LYS-GLU-LEU-ALA-GLN-LEU-ALA-ARG-MET-THR-ASP-GLY-TYR-SER-GLY-SER-ASP-LEU-THR-ALA-LEU-ALA-LYS-ASP-ALA-ALA-LEU-GLY-PRO-ILE-ARG-GLU-LEU-LYS-PRO-GLU-GLN-VAL-LYS-ASN-MET-SER-ALA-SER-GLU-MET-ARG-ASN-ILE-ARG-LEU-SER-ASP-PHE-THR-GLU-SER-LEU-LYS-LYS-ILE-LYS-ARG-SER-VAL-SER-PRO-GLN-THR-LEU-GLU-ALA-TYR-ILE-ARG-TRP-ASN-LYS-ASP-PHE-GLY-ASP-THR-THR-VAL,GLU-TYR-GLU-TYR-GLU-TYR-GLU-TYR-GLU-TYR,498,10,OC(=O)CC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CCC(=O)O)Cc1ccc(cc1)O)CCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccc(cc1)O)CCC(=O)O)Cc1ccc(cc1)O,Kd=0.3uM,6.522879,6.52,1,A,A,1,A,A,0,,G,A,4mer,1,1,498,10,0,N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O,N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O,0.7786244750022888,0.7327446341514587,53.38198852539063,53.71479797363281,0.8082478642463684,1.3700501918792725,0.6074836850166321,0.665878176689148,0.6725415587425232,0.6151740550994873,EYEYEYEYEY,Low,"(6.398, 6.523]",train
2JBU,protein-peptide,P14735,MHHHHHHAAGIPMNNPAIKRIGNHITKSPEDKREYRGLELANGIKVLLISDPTTDKSSAALDVHIGSLSDPPNIAGLSHFCQHMLFLGTKKYPKENEYSQFLSEHAGSSNAFTSGEHTNYYFDVSHEHLEGALDRFAQFFLCPLFDESCKDREVNAVDSEHEKNVMNDAWRLFQLEKATGNPKHPFSKFGTGNKYTLETRPNQEGIDVRQELLKFHSAYYSSNLMAVCVLGRESLDDLTNLVVKLFSEVENKNVPLPEFPEHPFQEEHLKQLYKIVPIKDIRNLYVTFPIPDLQKYYKSNPGHYLGHLIGHEGPGSLLSELKSKGWVNTLVGGQKEGARGFMFFIINVDLTEEGLLHVEDIILHMFQYIQKLRAEGPQEWVFQECKDLNAVAFRFKDKERPRGYTSKIAGILHYYPLEEVLTAEYLLEEFRPDLIEMVLDKLRPENVRVAIVSKSFEGKTDRTEEWYGTQYKQEAIPDEVIKKWQNADLNGKFKLPTKNEFIPTNFEILPLEKEATPYPALIKDTAMSKLWFKQDDKFFLPKACLNFEFFSPFAYVDPLHCNMAYLYLELLKDSLNEYAYAAELAGLSYDLQNTIYGMYLSVKGYNDKQPILLKKIIEKMATFEIDEKRFEIIKEAYMRSLNNFRAEQPHQHAMYYLRLLMTEVAWTKDELKEALDDVTLPRLKAFIPQLLSRLHIEALLHGNITKQAALGIMQMVEDTLIEHAHTKPLLPSQLVRYREVQLPDRGWFVYQQRNEVHNNCGIEIYYQTDMQSTSENMFLELFCQIISEPCFNTLRTKEQLGYIVFSGPRRANGIQGLRFIIQSEKPPHYLESRVEAFLITMEKSIEDMTEEAFQKHIQALAIRRLDKPKKLSAECAKYWGEIISQQYNFDRDNTEVAYLKTLTKEDIIKFYKEMLAVDAPRRHKVSVHVLAREMDSCPVVGEFPCQNDINLSQAPALPQPEVIQNMTEFKRGLPLFPLVKPHINFMAAKL,AAAAAAAAAAAA,MET-HIS-HIS-HIS-HIS-HIS-HIS-ALA-ALA-GLY-ILE-PRO-MET-ASN-ASN-PRO-ALA-ILE-LYS-ARG-ILE-GLY-ASN-HIS-ILE-THR-LYS-SER-PRO-GLU-ASP-LYS-ARG-GLU-TYR-ARG-GLY-LEU-GLU-LEU-ALA-ASN-GLY-ILE-LYS-VAL-LEU-LEU-ILE-SER-ASP-PRO-THR-THR-ASP-LYS-SER-SER-ALA-ALA-LEU-ASP-VAL-HIS-ILE-GLY-SER-LEU-SER-ASP-PRO-PRO-ASN-ILE-ALA-GLY-LEU-SER-HIS-PHE-CYS-GLN-HIS-MET-LEU-PHE-LEU-GLY-THR-LYS-LYS-TYR-PRO-LYS-GLU-ASN-GLU-TYR-SER-GLN-PHE-LEU-SER-GLU-HIS-ALA-GLY-SER-SER-ASN-ALA-PHE-THR-SER-GLY-GLU-HIS-THR-ASN-TYR-TYR-PHE-ASP-VAL-SER-HIS-GLU-HIS-LEU-GLU-GLY-ALA-LEU-ASP-ARG-PHE-ALA-GLN-PHE-PHE-LEU-CYS-PRO-LEU-PHE-ASP-GLU-SER-CYS-LYS-ASP-ARG-GLU-VAL-ASN-ALA-VAL-ASP-SER-GLU-HIS-GLU-LYS-ASN-VAL-MET-ASN-ASP-ALA-TRP-ARG-LEU-PHE-GLN-LEU-GLU-LYS-ALA-THR-GLY-ASN-PRO-LYS-HIS-PRO-PHE-SER-LYS-PHE-GLY-THR-GLY-ASN-LYS-TYR-THR-LEU-GLU-THR-ARG-PRO-ASN-GLN-GLU-GLY-ILE-ASP-VAL-ARG-GLN-GLU-LEU-LEU-LYS-PHE-HIS-SER-ALA-TYR-TYR-SER-SER-ASN-LEU-MET-ALA-VAL-CYS-VAL-LEU-GLY-ARG-GLU-SER-LEU-ASP-ASP-LEU-THR-ASN-LEU-VAL-VAL-LYS-LEU-PHE-SER-GLU-VAL-GLU-ASN-LYS-ASN-VAL-PRO-LEU-PRO-GLU-PHE-PRO-GLU-HIS-PRO-PHE-GLN-GLU-GLU-HIS-LEU-LYS-GLN-LEU-TYR-LYS-ILE-VAL-PRO-ILE-LYS-ASP-ILE-ARG-ASN-LEU-TYR-VAL-THR-PHE-PRO-ILE-PRO-ASP-LEU-GLN-LYS-TYR-TYR-LYS-SER-ASN-PRO-GLY-HIS-TYR-LEU-GLY-HIS-LEU-ILE-GLY-HIS-GLU-GLY-PRO-GLY-SER-LEU-LEU-SER-GLU-LEU-LYS-SER-LYS-GLY-TRP-VAL-ASN-THR-LEU-VAL-GLY-GLY-GLN-LYS-GLU-GLY-ALA-ARG-GLY-PHE-MET-PHE-PHE-ILE-ILE-ASN-VAL-ASP-LEU-THR-GLU-GLU-GLY-LEU-LEU-HIS-VAL-GLU-ASP-ILE-ILE-LEU-HIS-MET-PHE-GLN-TYR-ILE-GLN-LYS-LEU-ARG-ALA-GLU-GLY-PRO-GLN-GLU-TRP-VAL-PHE-GLN-GLU-CYS-LYS-ASP-LEU-ASN-ALA-VAL-ALA-PHE-ARG-PHE-LYS-ASP-LYS-GLU-ARG-PRO-ARG-GLY-TYR-THR-SER-LYS-ILE-ALA-GLY-ILE-LEU-HIS-TYR-TYR-PRO-LEU-GLU-GLU-VAL-LEU-THR-ALA-GLU-TYR-LEU-LEU-GLU-GLU-PHE-ARG-PRO-ASP-LEU-ILE-GLU-MET-VAL-LEU-ASP-LYS-LEU-ARG-PRO-GLU-ASN-VAL-ARG-VAL-ALA-ILE-VAL-SER-LYS-SER-PHE-GLU-GLY-LYS-THR-ASP-ARG-THR-GLU-GLU-TRP-TYR-GLY-THR-GLN-TYR-LYS-GLN-GLU-ALA-ILE-PRO-ASP-GLU-VAL-ILE-LYS-LYS-TRP-GLN-ASN-ALA-ASP-LEU-ASN-GLY-LYS-PHE-LYS-LEU-PRO-THR-LYS-ASN-GLU-PHE-ILE-PRO-THR-ASN-PHE-GLU-ILE-LEU-PRO-LEU-GLU-LYS-GLU-ALA-THR-PRO-TYR-PRO-ALA-LEU-ILE-LYS-ASP-THR-ALA-MET-SER-LYS-LEU-TRP-PHE-LYS-GLN-ASP-ASP-LYS-PHE-PHE-LEU-PRO-LYS-ALA-CYS-LEU-ASN-PHE-GLU-PHE-PHE-SER-PRO-PHE-ALA-TYR-VAL-ASP-PRO-LEU-HIS-CYS-ASN-MET-ALA-TYR-LEU-TYR-LEU-GLU-LEU-LEU-LYS-ASP-SER-LEU-ASN-GLU-TYR-ALA-TYR-ALA-ALA-GLU-LEU-ALA-GLY-LEU-SER-TYR-ASP-LEU-GLN-ASN-THR-ILE-TYR-GLY-MET-TYR-LEU-SER-VAL-LYS-GLY-TYR-ASN-ASP-LYS-GLN-PRO-ILE-LEU-LEU-LYS-LYS-ILE-ILE-GLU-LYS-MET-ALA-THR-PHE-GLU-ILE-ASP-GLU-LYS-ARG-PHE-GLU-ILE-ILE-LYS-GLU-ALA-TYR-MET-ARG-SER-LEU-ASN-ASN-PHE-ARG-ALA-GLU-GLN-PRO-HIS-GLN-HIS-ALA-MET-TYR-TYR-LEU-ARG-LEU-LEU-MET-THR-GLU-VAL-ALA-TRP-THR-LYS-ASP-GLU-LEU-LYS-GLU-ALA-LEU-ASP-ASP-VAL-THR-LEU-PRO-ARG-LEU-LYS-ALA-PHE-ILE-PRO-GLN-LEU-LEU-SER-ARG-LEU-HIS-ILE-GLU-ALA-LEU-LEU-HIS-GLY-ASN-ILE-THR-LYS-GLN-ALA-ALA-LEU-GLY-ILE-MET-GLN-MET-VAL-GLU-ASP-THR-LEU-ILE-GLU-HIS-ALA-HIS-THR-LYS-PRO-LEU-LEU-PRO-SER-GLN-LEU-VAL-ARG-TYR-ARG-GLU-VAL-GLN-LEU-PRO-ASP-ARG-GLY-TRP-PHE-VAL-TYR-GLN-GLN-ARG-ASN-GLU-VAL-HIS-ASN-ASN-CYS-GLY-ILE-GLU-ILE-TYR-TYR-GLN-THR-ASP-MET-GLN-SER-THR-SER-GLU-ASN-MET-PHE-LEU-GLU-LEU-PHE-CYS-GLN-ILE-ILE-SER-GLU-PRO-CYS-PHE-ASN-THR-LEU-ARG-THR-LYS-GLU-GLN-LEU-GLY-TYR-ILE-VAL-PHE-SER-GLY-PRO-ARG-ARG-ALA-ASN-GLY-ILE-GLN-GLY-LEU-ARG-PHE-ILE-ILE-GLN-SER-GLU-LYS-PRO-PRO-HIS-TYR-LEU-GLU-SER-ARG-VAL-GLU-ALA-PHE-LEU-ILE-THR-MET-GLU-LYS-SER-ILE-GLU-ASP-MET-THR-GLU-GLU-ALA-PHE-GLN-LYS-HIS-ILE-GLN-ALA-LEU-ALA-ILE-ARG-ARG-LEU-ASP-LYS-PRO-LYS-LYS-LEU-SER-ALA-GLU-CYS-ALA-LYS-TYR-TRP-GLY-GLU-ILE-ILE-SER-GLN-GLN-TYR-ASN-PHE-ASP-ARG-ASP-ASN-THR-GLU-VAL-ALA-TYR-LEU-LYS-THR-LEU-THR-LYS-GLU-ASP-ILE-ILE-LYS-PHE-TYR-LYS-GLU-MET-LEU-ALA-VAL-ASP-ALA-PRO-ARG-ARG-HIS-LYS-VAL-SER-VAL-HIS-VAL-LEU-ALA-ARG-GLU-MET-ASP-SER-CYS-PRO-VAL-VAL-GLY-GLU-PHE-PRO-CYS-GLN-ASN-ASP-ILE-ASN-LEU-SER-GLN-ALA-PRO-ALA-LEU-PRO-GLN-PRO-GLU-VAL-ILE-GLN-ASN-MET-THR-GLU-PHE-LYS-ARG-GLY-LEU-PRO-LEU-PHE-PRO-LEU-VAL-LYS-PRO-HIS-ILE-ASN-PHE-MET-ALA-ALA-LYS-LEU,ALA-ALA-ALA-ALA-ALA-ALA-ALA-ALA-ALA-ALA-ALA-ALA,990,12,O=C([C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C)C)C)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)C,IC50=400uM,3.39794,3.4,1,A,A,1,A,A,0,,C,A,,1,1,990,12,0,C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,0.7856534719467163,0.7813802361488342,81.74909973144531,85.59430694580078,0.4663881659507751,0.6512014865875244,0.908125102519989,0.894039511680603,0.7381942868232727,0.7437456846237183,AAAAAAAAAAAA,Low,"(2.044, 3.548]",train
3DRI,protein-peptide,A2RJ53,MGSNQSSSTSTKKLKAGNFDVAYQNPDKAIKGGNLKVAYQSDSPMKAQWLSGLSNDATFATMSGPGGGQDGLFFTDSGFKFIKGGAADVALDKESKTATITLRKDLKWSDGSEVTAKDYEFTYETIANPAYGSDRWTDSLANIVGLSDYHTGKAKTISGITFPDGENGKVIKVQFKEMKPGMTQSGNGYFLETVAPYQYLKDVAPKDLASSPKTTTKPLVTGPFKPENVVAGESIKYVPNPYYWGEKPKLNSITYEVVSTAKSVAALSSSKYDIINGMVSSQYKQVKNLKGYKVLGQQAMYISLMYYNLGHYDAKNSINVQDRKTPLQDQNVRQAIGYARNVAEVDNKFSNGLSTPANSLIPPIFKQFTSSSVKGYEKQDLDKANKLLDEDGWKLNKSTGYREKDGKELSLVYAARVGDANAETIAQNYIQQWKKIGVKVSLYNGKLMEFNSWVDHMTTPPGANDWDITDGSWSLASEPSQQDLFSAAAPYNFGHFNDSEITKDLNDIDSAKSENPTYRKAAFVKYQEDMNKKAYVIPTNFMLNYTPVNKRVVGMTLDYGAMNTWSEIGVSSAKLATKGSIEGRHHHHHH,AASASA,MET-GLY-SER-ASN-GLN-SER-SER-SER-THR-SER-THR-LYS-LYS-LEU-LYS-ALA-GLY-ASN-PHE-ASP-VAL-ALA-TYR-GLN-ASN-PRO-ASP-LYS-ALA-ILE-LYS-GLY-GLY-ASN-LEU-LYS-VAL-ALA-TYR-GLN-SER-ASP-SER-PRO-MET-LYS-ALA-GLN-TRP-LEU-SER-GLY-LEU-SER-ASN-ASP-ALA-THR-PHE-ALA-THR-MET-SER-GLY-PRO-GLY-GLY-GLY-GLN-ASP-GLY-LEU-PHE-PHE-THR-ASP-SER-GLY-PHE-LYS-PHE-ILE-LYS-GLY-GLY-ALA-ALA-ASP-VAL-ALA-LEU-ASP-LYS-GLU-SER-LYS-THR-ALA-THR-ILE-THR-LEU-ARG-LYS-ASP-LEU-LYS-TRP-SER-ASP-GLY-SER-GLU-VAL-THR-ALA-LYS-ASP-TYR-GLU-PHE-THR-TYR-GLU-THR-ILE-ALA-ASN-PRO-ALA-TYR-GLY-SER-ASP-ARG-TRP-THR-ASP-SER-LEU-ALA-ASN-ILE-VAL-GLY-LEU-SER-ASP-TYR-HIS-THR-GLY-LYS-ALA-LYS-THR-ILE-SER-GLY-ILE-THR-PHE-PRO-ASP-GLY-GLU-ASN-GLY-LYS-VAL-ILE-LYS-VAL-GLN-PHE-LYS-GLU-MET-LYS-PRO-GLY-MET-THR-GLN-SER-GLY-ASN-GLY-TYR-PHE-LEU-GLU-THR-VAL-ALA-PRO-TYR-GLN-TYR-LEU-LYS-ASP-VAL-ALA-PRO-LYS-ASP-LEU-ALA-SER-SER-PRO-LYS-THR-THR-THR-LYS-PRO-LEU-VAL-THR-GLY-PRO-PHE-LYS-PRO-GLU-ASN-VAL-VAL-ALA-GLY-GLU-SER-ILE-LYS-TYR-VAL-PRO-ASN-PRO-TYR-TYR-TRP-GLY-GLU-LYS-PRO-LYS-LEU-ASN-SER-ILE-THR-TYR-GLU-VAL-VAL-SER-THR-ALA-LYS-SER-VAL-ALA-ALA-LEU-SER-SER-SER-LYS-TYR-ASP-ILE-ILE-ASN-GLY-MET-VAL-SER-SER-GLN-TYR-LYS-GLN-VAL-LYS-ASN-LEU-LYS-GLY-TYR-LYS-VAL-LEU-GLY-GLN-GLN-ALA-MET-TYR-ILE-SER-LEU-MET-TYR-TYR-ASN-LEU-GLY-HIS-TYR-ASP-ALA-LYS-ASN-SER-ILE-ASN-VAL-GLN-ASP-ARG-LYS-THR-PRO-LEU-GLN-ASP-GLN-ASN-VAL-ARG-GLN-ALA-ILE-GLY-TYR-ALA-ARG-ASN-VAL-ALA-GLU-VAL-ASP-ASN-LYS-PHE-SER-ASN-GLY-LEU-SER-THR-PRO-ALA-ASN-SER-LEU-ILE-PRO-PRO-ILE-PHE-LYS-GLN-PHE-THR-SER-SER-SER-VAL-LYS-GLY-TYR-GLU-LYS-GLN-ASP-LEU-ASP-LYS-ALA-ASN-LYS-LEU-LEU-ASP-GLU-ASP-GLY-TRP-LYS-LEU-ASN-LYS-SER-THR-GLY-TYR-ARG-GLU-LYS-ASP-GLY-LYS-GLU-LEU-SER-LEU-VAL-TYR-ALA-ALA-ARG-VAL-GLY-ASP-ALA-ASN-ALA-GLU-THR-ILE-ALA-GLN-ASN-TYR-ILE-GLN-GLN-TRP-LYS-LYS-ILE-GLY-VAL-LYS-VAL-SER-LEU-TYR-ASN-GLY-LYS-LEU-MET-GLU-PHE-ASN-SER-TRP-VAL-ASP-HIS-MET-THR-THR-PRO-PRO-GLY-ALA-ASN-ASP-TRP-ASP-ILE-THR-ASP-GLY-SER-TRP-SER-LEU-ALA-SER-GLU-PRO-SER-GLN-GLN-ASP-LEU-PHE-SER-ALA-ALA-ALA-PRO-TYR-ASN-PHE-GLY-HIS-PHE-ASN-ASP-SER-GLU-ILE-THR-LYS-ASP-LEU-ASN-ASP-ILE-ASP-SER-ALA-LYS-SER-GLU-ASN-PRO-THR-TYR-ARG-LYS-ALA-ALA-PHE-VAL-LYS-TYR-GLN-GLU-ASP-MET-ASN-LYS-LYS-ALA-TYR-VAL-ILE-PRO-THR-ASN-PHE-MET-LEU-ASN-TYR-THR-PRO-VAL-ASN-LYS-ARG-VAL-VAL-GLY-MET-THR-LEU-ASP-TYR-GLY-ALA-MET-ASN-THR-TRP-SER-GLU-ILE-GLY-VAL-SER-SER-ALA-LYS-LEU-ALA-THR-LYS-GLY-SER-ILE-GLU-GLY-ARG-HIS-HIS-HIS-HIS-HIS-HIS,ALA-ALA-SER-ALA-SER-ALA,590,6,OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)CO)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C,Kd=37.7uM,4.423659,4.42,1,A,A,1,A,A,0,,B,A,,1,1,590,6,0,C[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O,C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O,0.7396384477615356,0.8008431196212769,72.34076690673828,72.4659652709961,0.5701223611831665,0.7116410732269287,0.8114421367645264,0.7841358780860901,0.6902278065681458,0.7795961499214172,AASASA,Low,"(4.319, 4.456]",train
3T5I,protein-peptide,O43924,GSMSAKDERAREILRGFKLNWMNLRDAETGKILWQGTEDLSVPGVEHEARVPKKILKCKAVSRELNFSSTEQMEKFRLEQKVYFKGQCLEEWFFEFGFVIPNSTNTWQSLIEAAPESQMMPASVLTGNVIIETKFFDDDLLVSTSRVRLFYV,CSQQGKSSC,GLY-SER-MET-SER-ALA-LYS-ASP-GLU-ARG-ALA-ARG-GLU-ILE-LEU-ARG-GLY-PHE-LYS-LEU-ASN-TRP-MET-ASN-LEU-ARG-ASP-ALA-GLU-THR-GLY-LYS-ILE-LEU-TRP-GLN-GLY-THR-GLU-ASP-LEU-SER-VAL-PRO-GLY-VAL-GLU-HIS-GLU-ALA-ARG-VAL-PRO-LYS-LYS-ILE-LEU-LYS-CYS-LYS-ALA-VAL-SER-ARG-GLU-LEU-ASN-PHE-SER-SER-THR-GLU-GLN-MET-GLU-LYS-PHE-ARG-LEU-GLU-GLN-LYS-VAL-TYR-PHE-LYS-GLY-GLN-CYS-LEU-GLU-GLU-TRP-PHE-PHE-GLU-PHE-GLY-PHE-VAL-ILE-PRO-ASN-SER-THR-ASN-THR-TRP-GLN-SER-LEU-ILE-GLU-ALA-ALA-PRO-GLU-SER-GLN-MET-MET-PRO-ALA-SER-VAL-LEU-THR-GLY-ASN-VAL-ILE-ILE-GLU-THR-LYS-PHE-PHE-ASP-ASP-ASP-LEU-LEU-VAL-SER-THR-SER-ARG-VAL-ARG-LEU-PHE-TYR-VAL,CYS-SER-GLN-GLN-GLY-LYS-SER-SER-CMT,152,9,OC[C@@H](C(=O)N[C@H](C(=O)OC)CS)NC(=O)[C@H](CO)[NH3+],Kd=0.15uM,6.823909,6.82,1,A,A,1,A,A,0,,Q,A,,0,1,152,9,0,NCCCC[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CS)C(=O)O,COC(=O)C(CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO,COC(=O)C(CS)NC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CO,0.8632670044898987,0.8712220788002014,88.8399658203125,96.53659057617188,0.3808458149433136,0.5880981683731079,0.9092620611190796,0.902523934841156,0.8168303966522217,0.8633965849876404,CSQQGKSSC,Low,"(6.696, 6.824]",train
4B8Y,protein-peptide,Q2FVW9,MKAETKSYKMDDGKTVDIPKDPKRIAVVAPTYAGGLKKLGANIVAVNQQVDQSKVLKDKFKGVTKIGDGDVEKVAKEKPDLIIVYSTDKDIKKYQKVAPTVVVDYNKHKYLEQQEMLGKIVGKEDKVKAWKKDWEETTAKDGKEIKKAIGQDATVSLFDEFDKKLYTYGDNWGRGGEVLYQAFGLKMQPEQQKLTAKAGWAEVKQEEIEKYAGDYIVSTSEGKPTPGYESTNMWKNLKATKEGHIVKVDAGTYWYNDPYTLDFMRKDLKEKLIKAAK,GGGAAA,MET-LYS-ALA-GLU-THR-LYS-SER-TYR-LYS-MET-ASP-ASP-GLY-LYS-THR-VAL-ASP-ILE-PRO-LYS-ASP-PRO-LYS-ARG-ILE-ALA-VAL-VAL-ALA-PRO-THR-TYR-ALA-GLY-GLY-LEU-LYS-LYS-LEU-GLY-ALA-ASN-ILE-VAL-ALA-VAL-ASN-GLN-GLN-VAL-ASP-GLN-SER-LYS-VAL-LEU-LYS-ASP-LYS-PHE-LYS-GLY-VAL-THR-LYS-ILE-GLY-ASP-GLY-ASP-VAL-GLU-LYS-VAL-ALA-LYS-GLU-LYS-PRO-ASP-LEU-ILE-ILE-VAL-TYR-SER-THR-ASP-LYS-ASP-ILE-LYS-LYS-TYR-GLN-LYS-VAL-ALA-PRO-THR-VAL-VAL-VAL-ASP-TYR-ASN-LYS-HIS-LYS-TYR-LEU-GLU-GLN-GLN-GLU-MET-LEU-GLY-LYS-ILE-VAL-GLY-LYS-GLU-ASP-LYS-VAL-LYS-ALA-TRP-LYS-LYS-ASP-TRP-GLU-GLU-THR-THR-ALA-LYS-ASP-GLY-LYS-GLU-ILE-LYS-LYS-ALA-ILE-GLY-GLN-ASP-ALA-THR-VAL-SER-LEU-PHE-ASP-GLU-PHE-ASP-LYS-LYS-LEU-TYR-THR-TYR-GLY-ASP-ASN-TRP-GLY-ARG-GLY-GLY-GLU-VAL-LEU-TYR-GLN-ALA-PHE-GLY-LEU-LYS-MET-GLN-PRO-GLU-GLN-GLN-LYS-LEU-THR-ALA-LYS-ALA-GLY-TRP-ALA-GLU-VAL-LYS-GLN-GLU-GLU-ILE-GLU-LYS-TYR-ALA-GLY-ASP-TYR-ILE-VAL-SER-THR-SER-GLU-GLY-LYS-PRO-THR-PRO-GLY-TYR-GLU-SER-THR-ASN-MET-TRP-LYS-ASN-LEU-LYS-ALA-THR-LYS-GLU-GLY-HIS-ILE-VAL-LYS-VAL-ASP-ALA-GLY-THR-TYR-TRP-TYR-ASN-ASP-PRO-TYR-THR-LEU-ASP-PHE-MET-ARG-LYS-ASP-LEU-LYS-GLU-LYS-LEU-ILE-LYS-ALA-ALA-LYS,GLY-GLY-GLY-AHO-AHO-AHO,277,6,O=C1NCC(=O)NCC(=O)N[C@@H](CCCN(C(=O)C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)NC1)CCCN(C(=O)C)O)CCCN(C(=O)C)O,Kd=9nM,8.045757,8.05,1,A,A,1,A,A,0,,B,A,,1,1,277,6,0,C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)CNC(=O)CNC(=O)CN)C(=O)O,CC(=O)N(O)CCCC(N)C(=O)NC(CCCN(O)C(C)=O)C(=O)NC(CCCN(O)C(C)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)O,CC(=O)N(O)CCCC(N)C(=O)NC(CCCN(O)C(C)=O)C(=O)NC(CCCN(O)C(C)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)O,0.8193483352661133,0.8834328055381775,83.93025970458984,89.66712951660156,0.3551511168479919,0.4294570982456207,0.9329329133033752,0.92572683095932,0.7777013182640076,0.8728592991828918,GGGAAA,Moderate,"(7.921, 8.383]",train
4BT9,protein-peptide,P13674,MHPGFFTSIGQMTDLIHTEKDLVTSLKDYIKAEEDKLEQIKKWAEKLDRLTSTATKDPEGFVGHPVNAFKLMKRLNTEWSELENLVLKDMSDGFISNLTIQRQYFPNDEDQVGAAKALLRLQDTYNLDTDTISKGNLPGVKHKSFLTAEDCFELGKVAYTEADYYHTELWMEQALRQLDEGEISTIDKVSVLDYLSYAVYQQGDLDKALLLTKKLLELDPEHQRANGNLKYFEYIMAKE,PPGPPGPPG,MET-HIS-PRO-GLY-PHE-PHE-THR-SER-ILE-GLY-GLN-MET-THR-ASP-LEU-ILE-HIS-THR-GLU-LYS-ASP-LEU-VAL-THR-SER-LEU-LYS-ASP-TYR-ILE-LYS-ALA-GLU-GLU-ASP-LYS-LEU-GLU-GLN-ILE-LYS-LYS-TRP-ALA-GLU-LYS-LEU-ASP-ARG-LEU-THR-SER-THR-ALA-THR-LYS-ASP-PRO-GLU-GLY-PHE-VAL-GLY-HIS-PRO-VAL-ASN-ALA-PHE-LYS-LEU-MET-LYS-ARG-LEU-ASN-THR-GLU-TRP-SER-GLU-LEU-GLU-ASN-LEU-VAL-LEU-LYS-ASP-MET-SER-ASP-GLY-PHE-ILE-SER-ASN-LEU-THR-ILE-GLN-ARG-GLN-TYR-PHE-PRO-ASN-ASP-GLU-ASP-GLN-VAL-GLY-ALA-ALA-LYS-ALA-LEU-LEU-ARG-LEU-GLN-ASP-THR-TYR-ASN-LEU-ASP-THR-ASP-THR-ILE-SER-LYS-GLY-ASN-LEU-PRO-GLY-VAL-LYS-HIS-LYS-SER-PHE-LEU-THR-ALA-GLU-ASP-CYS-PHE-GLU-LEU-GLY-LYS-VAL-ALA-TYR-THR-GLU-ALA-ASP-TYR-TYR-HIS-THR-GLU-LEU-TRP-MET-GLU-GLN-ALA-LEU-ARG-GLN-LEU-ASP-GLU-GLY-GLU-ILE-SER-THR-ILE-ASP-LYS-VAL-SER-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-TYR-GLN-GLN-GLY-ASP-LEU-ASP-LYS-ALA-LEU-LEU-LEU-THR-LYS-LYS-LEU-LEU-GLU-LEU-ASP-PRO-GLU-HIS-GLN-ARG-ALA-ASN-GLY-ASN-LEU-LYS-TYR-PHE-GLU-TYR-ILE-MET-ALA-LYS-GLU,PRO-PRO-GLY-PRO-PRO-GLY-PRO-PRO-GLY,239,9,OC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1,Kd=143.5uM,3.843148,3.84,1,A,A,1,A,A,0,,C,A,,1,1,239,9,0,O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1,O=C(O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1,O=C(O)CNC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1,0.8448570370674133,0.849399745464325,75.78694915771484,72.7496109008789,0.4871661365032196,0.5762609243392944,0.7318425178527832,0.7327824831008911,0.8504292368888855,0.8602486252784729,PPGPPGPPG,Low,"(3.548, 3.924]",train
4BTB,protein-peptide,P13674,MHPGFFTSIGQMTDLIHTEKDLVTSLKDYIKAEEDKLEQIKKWAEKLDRLTSTATKDPEGFVGHPVNAFKLMKRLNTEWSELENLVLKDMSDGFISNLTIQRQYFPNDEDQVGAAKALLRLQDTYNLDTDTISKGNLPGVKHKSFLTAEDCFELGKVAYTEADYYHTELWMEQALRQLDEGEISTIDKVSVLDYLSYAVYQQGDLDKALLLTKKLLELDPEHQRANGNLKYFEYIMAKE,PPPPPPPPP,MET-HIS-PRO-GLY-PHE-PHE-THR-SER-ILE-GLY-GLN-MET-THR-ASP-LEU-ILE-HIS-THR-GLU-LYS-ASP-LEU-VAL-THR-SER-LEU-LYS-ASP-TYR-ILE-LYS-ALA-GLU-GLU-ASP-LYS-LEU-GLU-GLN-ILE-LYS-LYS-TRP-ALA-GLU-LYS-LEU-ASP-ARG-LEU-THR-SER-THR-ALA-THR-LYS-ASP-PRO-GLU-GLY-PHE-VAL-GLY-HIS-PRO-VAL-ASN-ALA-PHE-LYS-LEU-MET-LYS-ARG-LEU-ASN-THR-GLU-TRP-SER-GLU-LEU-GLU-ASN-LEU-VAL-LEU-LYS-ASP-MET-SER-ASP-GLY-PHE-ILE-SER-ASN-LEU-THR-ILE-GLN-ARG-GLN-TYR-PHE-PRO-ASN-ASP-GLU-ASP-GLN-VAL-GLY-ALA-ALA-LYS-ALA-LEU-LEU-ARG-LEU-GLN-ASP-THR-TYR-ASN-LEU-ASP-THR-ASP-THR-ILE-SER-LYS-GLY-ASN-LEU-PRO-GLY-VAL-LYS-HIS-LYS-SER-PHE-LEU-THR-ALA-GLU-ASP-CYS-PHE-GLU-LEU-GLY-LYS-VAL-ALA-TYR-THR-GLU-ALA-ASP-TYR-TYR-HIS-THR-GLU-LEU-TRP-MET-GLU-GLN-ALA-LEU-ARG-GLN-LEU-ASP-GLU-GLY-GLU-ILE-SER-THR-ILE-ASP-LYS-VAL-SER-VAL-LEU-ASP-TYR-LEU-SER-TYR-ALA-VAL-TYR-GLN-GLN-GLY-ASP-LEU-ASP-LYS-ALA-LEU-LEU-LEU-THR-LYS-LYS-LEU-LEU-GLU-LEU-ASP-PRO-GLU-HIS-GLN-ARG-ALA-ASN-GLY-ASN-LEU-LYS-TYR-PHE-GLU-TYR-ILE-MET-ALA-LYS-GLU,PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO-PRO,239,9,OC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1,Kd=9.8uM,5.008774,5.01,1,A,A,1,A,A,0,,C,A,,1,1,239,9,0,O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,O=C(O)[C@@H]1CCCN1,0.8192530274391174,0.7880176901817322,77.77776336669922,72.13642883300781,0.4756245613098144,0.7348219156265259,0.7298757433891296,0.7259107828140259,0.8163956999778748,0.7852389812469482,PPPPPPPPP,Low,"(4.866, 5.014]",train