record_id stringlengths 64 64 | dataset_id stringclasses 1
value | source_file stringclasses 2
values | source_table stringclasses 2
values | source_row_index int64 0 8.47k | table_group stringclasses 1
value | task_name stringclasses 1
value | subtask_name stringclasses 2
values | entity_type stringclasses 2
values | assay_name stringclasses 2
values | sequence stringlengths 20 133 ⌀ | sequence_length int64 20 133 ⌀ | mutation stringlengths 1 4 | target stringclasses 689
values | score_value float64 -10 -3.9 ⌀ | label stringclasses 2
values | split_bucket int64 1 9 | bcut2d_chghi stringclasses 702
values | bcut2d_chglo stringlengths 9 12 | bcut2d_logphi stringclasses 986
values | bcut2d_logplow stringlengths 9 12 | bcut2d_mrhi stringlengths 3 23 | bcut2d_mrlow stringlengths 8 12 | bcut2d_mwhi stringlengths 3 11 | bcut2d_mwlow stringclasses 835
values | balabanj stringlengths 8 11 | bertzct stringlengths 8 11 | chcl3_3dpsa stringclasses 245
values | cxsmiles stringclasses 349
values | caco2 stringclasses 318
values | chi0 stringlengths 9 11 | chi0n stringlengths 9 11 | chi0v stringlengths 8 11 | chi1 stringlengths 9 11 | chi1n stringlengths 9 11 | chi1v stringlengths 9 11 | chi2n stringlengths 9 11 | chi2v stringlengths 9 11 | chi3n stringlengths 3 11 | chi3v stringlengths 3 11 | chi4n stringlengths 3 11 | chi4v stringlengths 3 11 | compound_name stringclasses 213
values | detection_limit_1 stringclasses 34
values | detection_limit_2 stringclasses 5
values | epsa stringclasses 33
values | estate_vsa1 stringlengths 8 11 | estate_vsa10 stringclasses 512
values | estate_vsa11 stringclasses 33
values | estate_vsa2 stringclasses 14
values | estate_vsa3 stringclasses 4
values | estate_vsa4 stringclasses 1
value | estate_vsa5 stringclasses 1
value | estate_vsa6 stringclasses 1
value | estate_vsa7 stringclasses 1
value | estate_vsa8 stringclasses 52
values | estate_vsa9 stringclasses 696
values | exactmolwt stringlengths 8 11 | fpdensitymorgan1 stringlengths 3 11 | fpdensitymorgan2 stringlengths 3 11 | fpdensitymorgan3 stringlengths 3 11 | fractioncsp3 stringclasses 527
values | h2o_3dpsa stringclasses 244
values | helm stringlengths 55 171 ⌀ | helm_url stringlengths 135 568 ⌀ | hallkieralpha stringclasses 439
values | heavyatomcount stringclasses 121
values | heavyatommolwt stringlengths 5 8 | id stringlengths 1 4 | iupac_condensed stringclasses 200
values | iupac_name stringclasses 338
values | ipc stringlengths 5 23 | kappa1 stringlengths 8 11 | kappa2 stringlengths 4 11 | kappa3 stringlengths 3 11 | labuteasa stringlengths 9 11 | mdck stringclasses 52
values | maxabsestateindex stringlengths 3 11 | maxabspartialcharge stringclasses 636
values | maxestateindex stringlengths 3 11 | maxpartialcharge stringclasses 878
values | minabsestateindex stringlengths 6 11 | minabspartialcharge stringclasses 893
values | minestateindex stringlengths 7 12 | minpartialcharge stringclasses 633
values | mollogp stringlengths 3 8 | molmr stringlengths 5 8 | molwt stringlengths 5 8 | molecule_shape stringclasses 2
values | monomer_length stringclasses 14
values | monomer_length_in_main_chain stringclasses 13
values | monomer_type stringclasses 2
values | nhohcount stringclasses 15
values | nocount stringclasses 33
values | null stringclasses 0
values | natural_analog stringclasses 21
values | numaliphaticcarbocycles stringclasses 5
values | numaliphaticheterocycles stringclasses 6
values | numaliphaticrings stringclasses 8
values | numaromaticcarbocycles stringclasses 6
values | numaromaticheterocycles stringclasses 4
values | numaromaticrings stringclasses 7
values | numhacceptors stringclasses 19
values | numhdonors stringclasses 15
values | numheteroatoms stringclasses 33
values | numradicalelectrons stringclasses 1
value | numrotatablebonds stringclasses 56
values | numsaturatedcarbocycles stringclasses 5
values | numsaturatedheterocycles stringclasses 6
values | numsaturatedrings stringclasses 8
values | numvalenceelectrons stringclasses 294
values | original_name_in_source_literature stringlengths 1 42 ⌀ | pampa stringclasses 638
values | pc1 stringlengths 9 12 ⌀ | pc2 stringlengths 8 12 ⌀ | peoe_vsa1 stringclasses 333
values | peoe_vsa10 stringclasses 162
values | peoe_vsa11 stringclasses 50
values | peoe_vsa12 stringclasses 65
values | peoe_vsa13 stringclasses 14
values | peoe_vsa14 stringclasses 13
values | peoe_vsa2 stringclasses 61
values | peoe_vsa3 stringclasses 20
values | peoe_vsa4 stringclasses 8
values | peoe_vsa5 stringclasses 12
values | peoe_vsa6 stringclasses 623
values | peoe_vsa7 stringclasses 914
values | peoe_vsa8 stringlengths 3 11 | peoe_vsa9 stringclasses 719
values | psa stringclasses 55
values | permeability stringclasses 689
values | polymer_type stringclasses 1
value | pubchem_cid stringclasses 274
values | r1 stringclasses 2
values | r2 stringclasses 2
values | r3 stringclasses 3
values | rrck stringclasses 119
values | r_caco2 stringclasses 23
values | r_mdck stringclasses 2
values | r_pamap stringlengths 3 11 ⌀ | r_rrck stringclasses 31
values | ringcount stringclasses 10
values | smiles stringlengths 47 320 ⌀ | smr_vsa1 stringlengths 9 11 | smr_vsa10 stringclasses 134
values | smr_vsa2 stringclasses 8
values | smr_vsa3 stringclasses 164
values | smr_vsa4 stringclasses 38
values | smr_vsa5 stringlengths 3 11 | smr_vsa6 stringclasses 263
values | smr_vsa7 stringclasses 177
values | smr_vsa8 stringclasses 1
value | smr_vsa9 stringclasses 4
values | same_peptides_assay stringclasses 39
values | same_peptides_id stringclasses 813
values | same_peptides_permeability stringclasses 321
values | same_peptides_source stringclasses 62
values | raw_sequence stringlengths 20 133 ⌀ | sequence_logp stringlengths 27 292 ⌀ | sequence_tpsa stringlengths 14 104 ⌀ | slogp_vsa1 stringclasses 49
values | slogp_vsa10 stringclasses 12
values | slogp_vsa11 stringclasses 4
values | slogp_vsa12 stringclasses 11
values | slogp_vsa2 stringclasses 904
values | slogp_vsa3 stringclasses 218
values | slogp_vsa4 stringclasses 41
values | slogp_vsa5 stringlengths 8 11 | slogp_vsa6 stringclasses 118
values | slogp_vsa7 stringclasses 28
values | slogp_vsa8 stringclasses 10
values | slogp_vsa9 stringclasses 1
value | source stringclasses 56
values | structurally_unique_id stringlengths 1 4 ⌀ | symbol stringclasses 350
values | tpsa stringclasses 451
values | t_pampa stringlengths 3 6 ⌀ | vsa_estate1 stringlengths 8 11 | vsa_estate10 stringclasses 436
values | vsa_estate2 stringlengths 3 12 | vsa_estate3 stringlengths 3 12 | vsa_estate4 stringlengths 3 12 | vsa_estate5 stringlengths 3 12 | vsa_estate6 stringlengths 3 12 | vsa_estate7 stringlengths 3 12 | vsa_estate8 stringlengths 3 12 | vsa_estate9 stringclasses 119
values | version stringclasses 2
values | year stringclasses 15
values | x_3dpsa stringclasses 13
values | capped_smiles stringclasses 347
values | contain_id stringclasses 328
values | contain_count stringclasses 110
values | contain_pepnum stringclasses 87
values | contain_perme stringclasses 215
values | fr_al_coo stringclasses 3
values | fr_al_oh stringclasses 5
values | fr_al_oh_notert stringclasses 1
value | fr_arn stringclasses 2
values | fr_ar_coo stringclasses 1
value | fr_ar_n stringclasses 5
values | fr_ar_nh stringclasses 4
values | fr_ar_oh stringclasses 3
values | fr_coo stringclasses 3
values | fr_coo2 stringclasses 3
values | fr_c_o stringclasses 17
values | fr_c_o_nocoo stringclasses 17
values | fr_c_s stringclasses 2
values | fr_hoccn stringclasses 2
values | fr_imine stringclasses 3
values | fr_nh0 stringclasses 12
values | fr_nh1 stringclasses 13
values | fr_nh2 stringclasses 5
values | fr_n_o stringclasses 1
value | fr_ndealkylation1 stringclasses 10
values | fr_ndealkylation2 stringclasses 3
values | fr_nhpyrrole stringclasses 4
values | fr_sh stringclasses 1
value | fr_aldehyde stringclasses 3
values | fr_alkyl_carbamate stringclasses 2
values | fr_alkyl_halide stringclasses 6
values | fr_allylic_oxid stringclasses 5
values | fr_amide stringclasses 16
values | fr_amidine stringclasses 1
value | fr_aniline stringclasses 2
values | fr_aryl_methyl stringclasses 2
values | fr_azide stringclasses 1
value | fr_azo stringclasses 1
value | fr_barbitur stringclasses 1
value | fr_benzene stringclasses 6
values | fr_benzodiazepine stringclasses 1
value | fr_bicyclic stringclasses 17
values | fr_diazo stringclasses 1
value | fr_dihydropyridine stringclasses 1
value | fr_epoxide stringclasses 1
value | fr_ester stringclasses 4
values | fr_ether stringclasses 5
values | fr_furan stringclasses 2
values | fr_guanido stringclasses 3
values | fr_halogen stringclasses 7
values | fr_hdrzine stringclasses 1
value | fr_hdrzone stringclasses 1
value | fr_imidazole stringclasses 2
values | fr_imide stringclasses 2
values | fr_isocyan stringclasses 1
value | fr_isothiocyan stringclasses 1
value | fr_ketone stringclasses 2
values | fr_ketone_topliss stringclasses 2
values | fr_lactam stringclasses 1
value | fr_lactone stringclasses 4
values | fr_methoxy stringclasses 3
values | fr_morpholine stringclasses 2
values | fr_nitrile stringclasses 1
value | fr_nitro stringclasses 2
values | fr_nitro_arom stringclasses 2
values | fr_nitro_arom_nonortho stringclasses 1
value | fr_nitroso stringclasses 1
value | fr_oxazole stringclasses 2
values | fr_oxime stringclasses 1
value | fr_para_hydroxylation stringclasses 4
values | fr_phenol stringclasses 3
values | fr_phenol_noorthohbond stringclasses 3
values | fr_phos_acid stringclasses 1
value | fr_phos_ester stringclasses 1
value | fr_piperdine stringclasses 4
values | fr_piperzine stringclasses 1
value | fr_priamide stringclasses 4
values | fr_prisulfonamd stringclasses 1
value | fr_pyridine stringclasses 2
values | fr_quatn stringclasses 1
value | fr_sulfide stringclasses 2
values | fr_sulfonamd stringclasses 2
values | fr_sulfone stringclasses 2
values | fr_term_acetylene stringclasses 1
value | fr_tetrazole stringclasses 2
values | fr_thiazole stringclasses 3
values | fr_thiocyan stringclasses 1
value | fr_thiophene stringclasses 2
values | fr_unbrch_alkane stringclasses 1
value | fr_urea stringclasses 1
value | qed stringlengths 8 11 | replaced_smiles stringclasses 348
values |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
0b875561fd4ef68f311e59adf0ad65e785f7db2dee9062b4ea6ca4dfef1f9ef3 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,340 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'dL', 'dP', 'Bn_Gly', 'F'] | 49 | 4341 | -6.03 | -6.03 | Circle | 8 | -1.65e-16 | -2.715597743 | -1.75e-16 | -2.852684226 | 7.04e-17 | -1.135665765 | 1.91e-15 | -0.249287767 | 2.598535165 | 4584.247812 | 113.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.745762712 | 1.322033898 | 1.915254237 | 0.577777778 | 112.0 | PEPTIDE4341{[dP].[Me_dA].[meL].[dL].[dP].[Bn_Gly].F}$PEPTIDE4341,PEPTIDE4341,1:R1-7:R2$$$ | PEPTIDE4341{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4341,PEPTIDE4341,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4341 | null | null | 1.15e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.7462191 | 0.342496078 | 16.7462191 | 0.245675462 | 1.758839313 | 0.245675462 | -7.168632199 | -0.342496078 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_764 | -6.03 | 4.120442253 | 1.105729543 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -6.03 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4341 | null | 159.75 | 12.97 | 560.631853 | 0.0 | 103.3051672 | -5.189948543 | -5.276729542 | -43.25642692 | -61.31348445 | -42.29190339 | -64.44186071 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
08f82ee7adf1d931fcf83aa330e8b7d50a017230dcc12fdd2d51842f7bbb057b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,341 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'dL', 'F'] | 45 | 4342 | -10.0 | -10 | Circle | 6 | -1.16e-16 | -2.695474594 | -1.58e-16 | -2.86859636 | 7.5e-18 | -1.134687049 | 1.87e-15 | -0.249287762 | 2.533503079 | 4593.757587 | 143.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.94251654 | 46.26903896 | 14.98018458 | 10.12836652 | 10.12836652 | 6.245098969 | 6.245098969 | 3.870211046 | 3.870211046 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.3388244 | 28.95026377 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 813.4788974 | 0.711864407 | 1.254237288 | 1.847457627 | 0.577777778 | 143.0 | PEPTIDE4342{[dP].[Me_dA].L.[bHph].[dP].[dL].F}$PEPTIDE4342,PEPTIDE4342,1:R1-7:R2$$$ | PEPTIDE4342{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4342,PEPTIDE4342,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4342 | null | null | 2.1199999999999998e+39 | 10.24948353 | 20.61658265 | 11.91281718 | 436.8690661 | null | 16.56547364 | 0.350730365 | 16.56547364 | 0.245675664 | 1.784890333 | 0.245675664 | -6.789276857 | -0.350730365 | 2.7358 | 223.2438 | 814.041 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 14 | 0 | 3 | 3 | 320 | hepta_765 | -10.0 | 3.644397346 | 0.83232513 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 96.3051479 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 133.741032 | 19.96954627 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 170.8715927 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4342 | null | 177.33 | 0.0 | 559.5947409 | 0.0 | 106.8936535 | -10.20946275 | -5.395688371 | -42.28351349 | -67.30421173 | -54.04490989 | -45.08394147 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316968996 | null |
148c23debd2ea73f39fc9aabc2244b3edcf61370e30701898736270b633cd3ac | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,342 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'dL', 'meL', 'dP', 'Bn_Gly', 'F'] | 49 | 4343 | -10.0 | -10 | Circle | 2 | -2.05e-16 | -2.718718702 | -1.49e-16 | -2.852834077 | 9.05e-17 | -1.135755959 | 1.95e-15 | -0.249287767 | 2.601408493 | 4584.247812 | 109.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.7248211 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 813.4788974 | 0.745762712 | 1.338983051 | 1.949152542 | 0.577777778 | 110.0 | PEPTIDE4343{[dP].[Me_dA].[dL].[meL].[dP].[Bn_Gly].F}$PEPTIDE4343,PEPTIDE4343,1:R1-7:R2$$$ | PEPTIDE4343{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4343,PEPTIDE4343,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4343 | null | null | 6.39e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.93021795 | 0.342505861 | 16.93021795 | 0.245675462 | 1.754331899 | 0.245675462 | -7.230529842 | -0.342505861 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_766 | -10.0 | 4.051441918 | 1.131152099 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'dL', 'meL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4343 | null | 159.75 | 0.0 | 560.8784285 | 0.0 | 103.2392123 | -5.12399364 | -5.285224972 | -43.30155695 | -61.3163404 | -42.37193976 | -64.55191844 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
f6a1b4ec02b36fdacad966f1d5fab63085c64e87daa2f32efea95889c941f254 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,343 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'dL', 'Bn_Gly', 'dP', 'meL', 'F'] | 49 | 4344 | -5.77 | -5.77 | Circle | 9 | -2.12e-16 | -2.70049204 | -1.15e-16 | -2.847513682 | 3.88e-17 | -1.134994817 | 2.41e-15 | -0.249287762 | 2.594896442 | 4584.247812 | 123.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.967941623 | 3.967941623 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.322033898 | 1.949152542 | 0.577777778 | 120.0 | PEPTIDE4344{[dP].[Me_dA].[dL].[Bn_Gly].[dP].[meL].F}$PEPTIDE4344,PEPTIDE4344,1:R1-7:R2$$$ | PEPTIDE4344{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4344,PEPTIDE4344,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4344 | null | null | 1.04e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.74209516 | 0.342505615 | 16.74209516 | 0.245675665 | 1.808960417 | 0.245675665 | -7.032168051 | -0.342505615 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_767 | -5.77 | 4.210992399 | 0.981716191 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -5.77 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'dL', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4344 | null | 159.75 | 22.56 | 560.8101853 | 0.0 | 103.3450775 | -5.229858843 | -5.462877273 | -43.09317568 | -61.71264536 | -42.25555106 | -64.23448795 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
b4bddfafbd3fae540df8724cbe789a3ede107275f12e6132c6c75eb722f793e7 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,344 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | 50 | 4345 | -6.12 | -6.12 | Circle | 8 | -2.19e-16 | -2.718718702 | -6.23e-17 | -2.852834077 | 4.18e-17 | -1.135755959 | 2.16e-15 | -0.249287767 | 2.601408493 | 4584.247812 | 118.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 813.4788974 | 0.745762712 | 1.338983051 | 1.949152542 | 0.577777778 | 117.0 | PEPTIDE4345{[dP].[Me_dA].L.[Me_dL].[dP].[Bn_Gly].F}$PEPTIDE4345,PEPTIDE4345,1:R1-7:R2$$$ | PEPTIDE4345{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4345,PEPTIDE4345,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4345 | null | null | 4.59e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.93021795 | 0.342505861 | 16.93021795 | 0.245675462 | 1.754331899 | 0.245675462 | -7.230529842 | -0.342505861 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_768 | -6.12 | 4.051441918 | 1.131152099 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -6.12 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4345 | null | 159.75 | 10.75 | 560.8784285 | 0.0 | 103.2392123 | -5.12399364 | -5.285224972 | -43.30155695 | -61.3163404 | -42.37193976 | -64.55191844 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
bd789ca1f54141324bf1c7ab2d79123fd097ac9cf3eaae6a7e19474999236e2f | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,345 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | 50 | 4346 | -5.24 | -5.24 | Circle | 7 | -2.42e-16 | -2.70049204 | -1.25e-16 | -2.847513682 | 9.11e-17 | -1.134994817 | 2.45e-15 | -0.249287762 | 2.594896442 | 4584.247812 | 93.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.967941623 | 3.967941623 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.322033898 | 1.949152542 | 0.577777778 | 94.0 | PEPTIDE4346{[dP].[Me_dA].L.[Bn_Gly].[dP].[Me_dL].F}$PEPTIDE4346,PEPTIDE4346,1:R1-7:R2$$$ | PEPTIDE4346{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4346,PEPTIDE4346,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4346 | null | null | 1.2899999999999999e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.74209516 | 0.342505615 | 16.74209516 | 0.245675665 | 1.808960417 | 0.245675665 | -7.032168051 | -0.342505615 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_769 | -5.24 | 4.210992399 | 0.981716191 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -5.24 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4346 | null | 159.75 | 57.91 | 560.8101853 | 0.0 | 103.3450775 | -5.229858843 | -5.462877273 | -43.09317568 | -61.71264536 | -42.25555106 | -64.23448795 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
f9960dd9c840197cf72976626fd09a65741773135ba1d300813723d1ae0789b8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,346 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'Me_dL', 'F'] | 50 | 4347 | -5.69 | -5.69 | Circle | 9 | -2.35e-16 | -2.703149193 | -1.19e-16 | -2.848708369 | -3.37e-17 | -1.134960512 | 1.72e-15 | -0.249287762 | 2.595108979 | 4584.247812 | 125.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.305084746 | 1.881355932 | 0.577777778 | 127.0 | PEPTIDE4347{[dP].[Me_dA].[Bn_Gly].L.[dP].[Me_dL].F}$PEPTIDE4347,PEPTIDE4347,1:R1-7:R2$$$ | PEPTIDE4347{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4347,PEPTIDE4347,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4347 | null | null | 8.27e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.72733741 | 0.342747537 | 16.72733741 | 0.245675665 | 1.769864786 | 0.245675665 | -7.073927324 | -0.342747537 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_770 | -5.69 | 4.221568949 | 1.10642026 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -5.69 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4347 | null | 159.75 | 26.49 | 560.7260265 | 0.0 | 103.3397515 | -5.22453282 | -5.400419577 | -43.09724467 | -61.62262196 | -42.42649036 | -64.12780191 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
408cbeaa5d25e6beb259a4d09bc9b7dcc647166c38d7fc48c2e739787af4cc85 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,348 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'meL', 'dP', 'meL', 'F'] | 47 | 4349 | -5.77 | -5.77 | Circle | 6 | -2.53e-16 | -2.728611251 | -2.29e-16 | -2.848007412 | -9.06e-17 | -1.136012854 | 6.66e-16 | -0.249287767 | 3.194145574 | 4518.643012 | 113.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.40106466 | 48.84821857 | 14.40100497 | 10.04918691 | 10.04918691 | 6.362386751 | 6.362386751 | 3.934680614 | 3.934680614 | null | null | null | null | 311.4858662 | 27.45625465 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.689655172 | 1.172413793 | 1.706896552 | 0.704545455 | 111.0 | PEPTIDE4349{[dP].[Me_dA].[meL].[meL].[dP].[meL].F}$PEPTIDE4349,PEPTIDE4349,1:R1-7:R2$$$ | PEPTIDE4349{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4349,PEPTIDE4349,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4349 | null | null | 2.39e+42 | 9.366176303 | 19.97782252 | 10.56862906 | 442.5222501 | null | 17.05456233 | 0.342180206 | 17.05456233 | 0.245675665 | 1.873069011 | 0.245675665 | -7.480397538 | -0.342180206 | 3.1757 | 221.8177 | 808.078 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_772 | -5.77 | 2.967921041 | -0.217752521 | 34.70927174 | 42.12524728 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 124.032431 | 16.44910267 | null | -5.77 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 128.1851842 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.0718913 | 40.89702697 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'meL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 191.3487524 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4349 | null | 150.96 | 22.57 | 614.2081859 | 0.0 | 101.1836246 | -2.703900398 | -2.8308388 | -52.0293601 | -60.61135228 | -50.80633711 | -77.99335518 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.424272131 | null |
f33bdb082721bf1c4d8e57b7474bc704e35e9f2394e1a1f9c9ff1717005f30e4 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,349 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'L', 'F'] | 48 | 4350 | -6.35 | -6.35 | Circle | 5 | -1.54e-16 | -2.707545291 | -1.7e-16 | -2.855770806 | 7.04e-18 | -1.134995374 | 2.34e-15 | -0.249287762 | 2.592948797 | 4584.247812 | 114.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.967941623 | 3.967941623 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.355932203 | 2.0 | 0.577777778 | 114.0 | PEPTIDE4350{[dP].[Me_dA].[meL].[Bn_Gly].[dP].L.F}$PEPTIDE4350,PEPTIDE4350,1:R1-7:R2$$$ | PEPTIDE4350{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4350,PEPTIDE4350,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4350 | null | null | 2.6899999999999998e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.97167505 | 0.342504272 | 16.97167505 | 0.245675664 | 1.792903542 | 0.245675664 | -7.145703151 | -0.342504272 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_773 | -6.35 | 4.046252125 | 0.958272512 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -6.35 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'L', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4350 | null | 159.75 | 6.42 | 560.8600663 | 0.0 | 103.2023686 | -5.087149873 | -5.465718924 | -43.08351665 | -61.69128477 | -42.05008271 | -64.5180153 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
72d88c3a09dd1519a31915b4fc6e1bc98e7cec7cdee075ef33a5a477da4c91d0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,351 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'meL', 'F'] | 48 | 4352 | -6.25 | -6.25 | Circle | 8 | -2.42e-16 | -2.70049204 | -1.25e-16 | -2.847513682 | 9.11e-17 | -1.134994817 | 2.45e-15 | -0.249287762 | 2.594896442 | 4584.247812 | 99.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.967941623 | 3.967941623 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.322033898 | 1.949152542 | 0.577777778 | 98.0 | PEPTIDE4352{[dP].[Me_dA].L.[Bn_Gly].[dP].[meL].F}$PEPTIDE4352,PEPTIDE4352,1:R1-7:R2$$$ | PEPTIDE4352{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4352,PEPTIDE4352,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4352 | null | null | 1.2899999999999999e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.74209516 | 0.342505615 | 16.74209516 | 0.245675665 | 1.808960417 | 0.245675665 | -7.032168051 | -0.342505615 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_775 | -6.25 | 4.210992399 | 0.981716191 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -6.25 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4352 | null | 159.75 | 8.13 | 560.8101853 | 0.0 | 103.3450775 | -5.229858843 | -5.462877273 | -43.09317568 | -61.71264536 | -42.25555106 | -64.23448795 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
f9fad5bb1ff2939dffc2087bff046f040c5dbd3698dc539590f697760693ebb2 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,352 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'L', 'dP', 'Bn_Gly', 'F'] | 48 | 4353 | -5.74 | -5.74 | Circle | 8 | -1.81e-16 | -2.715597743 | -1.16e-16 | -2.852684226 | 5.38e-17 | -1.135665765 | 2.29e-15 | -0.249287767 | 2.598535165 | 4584.247812 | 110.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.745762712 | 1.322033898 | 1.915254237 | 0.577777778 | 110.0 | PEPTIDE4353{[dP].[Me_dA].[meL].L.[dP].[Bn_Gly].F}$PEPTIDE4353,PEPTIDE4353,1:R1-7:R2$$$ | PEPTIDE4353{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4353,PEPTIDE4353,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4353 | null | null | 2.91e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.7462191 | 0.342496078 | 16.7462191 | 0.245675462 | 1.758839313 | 0.245675462 | -7.168632199 | -0.342496078 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_776 | -5.74 | 4.120442253 | 1.105729543 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -5.74 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'L', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4353 | null | 159.75 | 23.77 | 560.631853 | 0.0 | 103.3051672 | -5.189948543 | -5.276729542 | -43.25642692 | -61.31348445 | -42.29190339 | -64.44186071 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
5ef04f9bb3983498caec8abf78dd606694e94e00774259f7fafa0b76643653c5 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,353 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'meL', 'F'] | 48 | 4354 | -5.72 | -5.72 | Circle | 3 | -2.35e-16 | -2.703149193 | -1.19e-16 | -2.848708369 | -3.37e-17 | -1.134960512 | 1.72e-15 | -0.249287762 | 2.595108979 | 4584.247812 | 110.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 813.4788974 | 0.745762712 | 1.305084746 | 1.881355932 | 0.577777778 | 109.0 | PEPTIDE4354{[dP].[Me_dA].[Bn_Gly].L.[dP].[meL].F}$PEPTIDE4354,PEPTIDE4354,1:R1-7:R2$$$ | PEPTIDE4354{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4354,PEPTIDE4354,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4354 | null | null | 8.27e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.72733741 | 0.342747537 | 16.72733741 | 0.245675665 | 1.769864786 | 0.245675665 | -7.073927324 | -0.342747537 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_777 | -5.72 | 4.221568949 | 1.10642026 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -5.72 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C1=O | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4354 | null | 159.75 | 24.84 | 560.7260265 | 0.0 | 103.3397515 | -5.22453282 | -5.400419577 | -43.09724467 | -61.62262196 | -42.42649036 | -64.12780191 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
2216e06e84ff263aa2623968e26d8300e1e8e8882b0ac7ee5a91c10996ac1cae | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,354 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'Me_dL', 'dP', 'Me_dL', 'F'] | 54 | 4355 | -5.62 | -5.62 | Circle | 3 | -2.02e-16 | -2.708333315 | -1.42e-16 | -2.847553557 | 1.55e-16 | -1.135165431 | 1.52e-15 | -0.249287762 | 2.649833666 | 4693.516449 | 100.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.096665096 | 4.096665096 | null | null | null | null | 321.2907444 | 28.8270132 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 827.4945474 | 0.733333333 | 1.283333333 | 1.85 | 0.586956522 | 101.0 | PEPTIDE4355{[dP].[Me_dA].[Bn_Gly].[Me_dL].[dP].[Me_dL].F}$PEPTIDE4355,PEPTIDE4355,1:R1-7:R2$$$ | PEPTIDE4355{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4355,PEPTIDE4355,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4355 | null | null | 6.34e+40 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 16.88470148 | 0.342180206 | 16.88470148 | 0.245675665 | 1.815009414 | 0.245675665 | -7.152003775 | -0.342180206 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_778 | -5.62 | 3.990698689 | 1.119825312 | 34.70927174 | 42.60421449 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 27.41517112 | null | -5.62 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'Me_dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4355 | null | 150.96 | 30.1 | 580.9547605 | 0.0 | 101.6394501 | -2.648245813 | -5.505450756 | -43.99244889 | -62.68082687 | -43.0189601 | -71.33161152 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
a0fd9e8fe8e85e7fcaf3c31849874edbef103f0a8863ff4bd20907bce3e0699e | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,355 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'dL', 'bHph', 'dP', 'Me_dL', 'F'] | 49 | 4356 | -5.97 | -5.97 | Circle | 3 | -2.25e-16 | -2.703042909 | -1.17e-16 | -2.864993579 | -2.04e-17 | -1.134987542 | 1.67e-15 | -0.249287763 | 2.591051242 | 4703.026224 | 118.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 3.998934518 | 3.998934518 | null | null | null | null | 320.9047477 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 827.4945474 | 0.716666667 | 1.283333333 | 1.9 | 0.586956522 | 116.0 | PEPTIDE4356{[dP].[Me_dA].[dL].[bHph].[dP].[Me_dL].F}$PEPTIDE4356,PEPTIDE4356,1:R1-7:R2$$$ | PEPTIDE4356{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4356,PEPTIDE4356,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4356 | null | null | 6.34e+40 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.69814146 | 0.350730365 | 16.69814146 | 0.245675665 | 1.813721392 | 0.245675665 | -7.067198502 | -0.350730365 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_779 | -5.97 | 3.536230794 | 0.898346641 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -5.97 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'dL', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4356 | null | 168.54 | 14.66 | 579.850458 | 0.0 | 105.3706755 | -7.81882065 | -5.505696039 | -43.1539351 | -68.57402443 | -54.96464183 | -51.78734883 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
65374594eb75797b9deaf9529a099fbf229fa09ddc9936813532a3eb14eeb3bb | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,356 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | 54 | 4357 | -6.26 | -6.26 | Circle | 8 | -1.91e-16 | -2.707788095 | -1.36e-16 | -2.846386196 | -1.18e-17 | -1.135205623 | 1.55e-15 | -0.249287762 | 2.649644767 | 4693.516449 | 102.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.096665096 | 4.096665096 | null | null | null | null | 321.2907444 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 104.0 | PEPTIDE4357{[dP].[Me_dA].[Me_dL].[Bn_Gly].[dP].[Me_dL].F}$PEPTIDE4357,PEPTIDE4357,1:R1-7:R2$$$ | PEPTIDE4357{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4357,PEPTIDE4357,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4357 | null | null | 6.11e+41 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 17.05876182 | 0.342180206 | 17.05876182 | 0.245675665 | 1.831356251 | 0.245675665 | -7.201178358 | -0.342180206 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_780 | -6.26 | 3.949069637 | 1.085483947 | 34.70927174 | 42.60421449 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 27.41517112 | null | -6.26 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4357 | null | 150.96 | 7.84 | 581.1201112 | 0.0 | 101.6093126 | -2.618108324 | -5.575726592 | -43.97211398 | -62.88914428 | -42.81096719 | -71.4466968 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
89730590867b105be380f1fe634ed5876561f7f509dbc78b74a4c46bf2a61cd4 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,357 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'dL', 'F'] | 49 | 4358 | -6.18 | -6.18 | Circle | 7 | -1.85e-16 | -2.710361087 | -1.27e-16 | -2.863551145 | -3.51e-17 | -1.134997977 | 1.44e-15 | -0.249287763 | 2.586596872 | 4703.026224 | 136.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 3.998934518 | 3.998934518 | null | null | null | null | 320.9047477 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 827.4945474 | 0.716666667 | 1.316666667 | 1.95 | 0.586956522 | 135.0 | PEPTIDE4358{[dP].[Me_dA].[Me_dL].[bHph].[dP].[dL].F}$PEPTIDE4358,PEPTIDE4358,1:R1-7:R2$$$ | PEPTIDE4358{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4358,PEPTIDE4358,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4358 | null | null | 1.22e+41 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.65256042 | 0.35072394 | 16.65256042 | 0.245675664 | 1.812949348 | 0.245675664 | -7.075735191 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_781 | -6.18 | 3.552464772 | 0.904933329 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -6.18 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4358 | null | 168.54 | 9.32 | 579.7512997 | 0.0 | 105.3024352 | -7.766634993 | -5.493681342 | -43.13731482 | -68.5439608 | -54.77780214 | -51.91767417 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
bfa383ae7a6943a9bff76d9b0b07268174220ff0f550243df8c85b07001f465e | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,358 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'dL', 'F'] | 47 | 4359 | -6.3 | -6.3 | Circle | 9 | -2.45e-16 | -2.710361087 | -1.14e-16 | -2.863551145 | 5.13e-17 | -1.134997977 | 1.82e-15 | -0.249287763 | 2.586596872 | 4703.026224 | 135.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 3.998934518 | 3.998934518 | null | null | null | null | 320.9047477 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 827.4945474 | 0.716666667 | 1.316666667 | 1.95 | 0.586956522 | 136.0 | PEPTIDE4359{[dP].[Me_dA].[meL].[bHph].[dP].[dL].F}$PEPTIDE4359,PEPTIDE4359,1:R1-7:R2$$$ | PEPTIDE4359{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4359,PEPTIDE4359,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4359 | null | null | 7.26e+41 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.65256042 | 0.35072394 | 16.65256042 | 0.245675664 | 1.812949348 | 0.245675664 | -7.075735191 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_782 | -6.3 | 3.552464772 | 0.904933329 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -6.3 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4359 | null | 168.54 | 7.2 | 579.7512997 | 0.0 | 105.3024352 | -7.766634993 | -5.493681342 | -43.13731482 | -68.5439608 | -54.77780214 | -51.91767417 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
79bfd0f60914f56112f1c4c8939c411d6dfa63386c198f0a7e7ae663e10e9495 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,361 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'meL', 'dP', 'Bn_Gly', 'F'] | 52 | 4362 | -6.28 | -6.28 | Circle | 5 | -1.86e-16 | -2.727892217 | -8.07e-17 | -2.84220054 | 4.43e-17 | -1.136012131 | 1.88e-15 | -0.249287767 | 2.65730088 | 4693.516449 | 114.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.124615946 | 4.124615946 | null | null | null | null | 321.2907444 | 28.8270132 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 827.4945474 | 0.716666667 | 1.25 | 1.816666667 | 0.586956522 | 111.0 | PEPTIDE4362{[dP].[Me_dA].[Me_dL].[meL].[dP].[Bn_Gly].F}$PEPTIDE4362,PEPTIDE4362,1:R1-7:R2$$$ | PEPTIDE4362{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4362,PEPTIDE4362,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4362 | null | null | 1.43e+42 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 17.06288577 | 0.342431664 | 17.06288577 | 0.245675462 | 1.776727732 | 0.245675462 | -7.384257199 | -0.342431664 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_785 | -6.28 | 3.872635346 | 1.28261471 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 33.91203081 | null | -6.28 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'meL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4362 | null | 150.96 | 7.58 | 581.2606292 | 0.0 | 101.3875602 | -2.396355939 | -5.347185962 | -44.22992304 | -62.41082888 | -42.99139792 | -71.855831 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
ba9d2bf6453da90db53f14df336ebf9d8b8ba8bd56d5f6be005c1a8726d43d34 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,362 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | 52 | 4363 | -5.75 | -5.75 | Circle | 4 | -1.91e-16 | -2.707788095 | -1.36e-16 | -2.846386196 | -1.18e-17 | -1.135205623 | 1.55e-15 | -0.249287762 | 2.649644767 | 4693.516449 | 105.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.096665096 | 4.096665096 | null | null | null | null | 321.2907444 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 106.0 | PEPTIDE4363{[dP].[Me_dA].[meL].[Bn_Gly].[dP].[Me_dL].F}$PEPTIDE4363,PEPTIDE4363,1:R1-7:R2$$$ | PEPTIDE4363{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4363,PEPTIDE4363,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4363 | null | null | 6.11e+41 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 17.05876182 | 0.342180206 | 17.05876182 | 0.245675665 | 1.831356251 | 0.245675665 | -7.201178358 | -0.342180206 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_786 | -5.75 | 3.949069637 | 1.085483947 | 34.70927174 | 42.60421449 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 27.41517112 | null | -5.75 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4363 | null | 150.96 | 23.52 | 581.1201112 | 0.0 | 101.6093126 | -2.618108324 | -5.575726592 | -43.97211398 | -62.88914428 | -42.81096719 | -71.4466968 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
9e63a388ca5cee36c6d7375a71cfb8de88a84f7bed93702ec5427bdb0ed4e792 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,363 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'Me_dL', 'F'] | 48 | 4364 | -6.25 | -6.25 | Circle | 4 | -2.25e-16 | -2.703042909 | -1.17e-16 | -2.864993579 | -2.04e-17 | -1.134987542 | 1.67e-15 | -0.249287763 | 2.591051242 | 4703.026224 | 124.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 3.998934518 | 3.998934518 | null | null | null | null | 320.9047477 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 827.4945474 | 0.716666667 | 1.283333333 | 1.9 | 0.586956522 | 122.0 | PEPTIDE4364{[dP].[Me_dA].L.[bHph].[dP].[Me_dL].F}$PEPTIDE4364,PEPTIDE4364,1:R1-7:R2$$$ | PEPTIDE4364{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4364,PEPTIDE4364,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4364 | null | null | 6.34e+40 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.69814146 | 0.350730365 | 16.69814146 | 0.245675665 | 1.813721392 | 0.245675665 | -7.067198502 | -0.350730365 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_787 | -6.25 | 3.536230794 | 0.898346641 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -6.25 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4364 | null | 168.54 | 8.04 | 579.850458 | 0.0 | 105.3706755 | -7.81882065 | -5.505696039 | -43.1539351 | -68.57402443 | -54.96464183 | -51.78734883 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
3395b61191cf0d188a8f1e285290ddc21cf40f25e85d726b6607a0bdb29f0df4 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,364 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 52 | 4365 | -6.76 | -6.76 | Circle | 3 | -1.06e-16 | -2.690277484 | -1.26e-17 | -2.840518582 | 3.05e-16 | -1.13319578 | 10.13260376 | -0.248079406 | 2.218480075 | 4758.997523 | 124.0 | null | null | 95.47520861 | 88.4882332 | 29.4882332 | 52.54059275 | 45.07182536 | 15.67739817 | 10.57558011 | 10.57558011 | 6.671976033 | 6.671976033 | 4.157876955 | 4.157876955 | null | null | null | null | 324.5296993 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 52.08882513 | 833.4475972 | 0.721311475 | 1.278688525 | 1.852459016 | 0.468085106 | 121.0 | PEPTIDE4365{[dP].[Me_dA].[dL].[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4365,PEPTIDE4365,1:R1-7:R2$$$ | PEPTIDE4365{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4365,PEPTIDE4365,1:R1-7:R2$$$ | -6.05 | 61 | 774.559 | 4365 | null | null | 1.28e+39 | 11.30372809 | 20.47536328 | 11.21331168 | 441.1503396 | null | 16.74720417 | 0.342505615 | 16.74720417 | 0.245675462 | 1.712619139 | 0.245675462 | -6.841249475 | -0.342505615 | 3.1449 | 228.8824 | 834.031 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 12 | 0 | 3 | 3 | 324 | hepta_788 | -6.76 | 5.134955583 | 2.9328128 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 79.08818867 | 44.87809926 | null | -6.76 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 114.5186821 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 101.8764075 | 32.96326564 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 147.243893 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4365 | null | 159.75 | 2.55 | 527.7800367 | 0.0 | 103.4933586 | -4.866659799 | -7.766850753 | -35.52039405 | -63.02910021 | -34.70988725 | -58.21383651 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.353104375 | null |
aeaa3b2be95bc77a5376bf0990d47006cdc1ba1caa3c7598b6ea5aadd06c698d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,365 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'L', 'F'] | 46 | 4366 | -10.0 | -10 | Circle | 7 | -1.85e-16 | -2.710361087 | -1.27e-16 | -2.863551145 | -3.51e-17 | -1.134997977 | 1.44e-15 | -0.249287763 | 2.586596872 | 4703.026224 | 139.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 3.998934518 | 3.998934518 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 320.9047477 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.68413503 | 827.4945474 | 0.716666667 | 1.316666667 | 1.95 | 0.586956522 | 138.0 | PEPTIDE4366{[dP].[Me_dA].[meL].[bHph].[dP].L.F}$PEPTIDE4366,PEPTIDE4366,1:R1-7:R2$$$ | PEPTIDE4366{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4366,PEPTIDE4366,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4366 | null | null | 1.22e+41 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.65256042 | 0.35072394 | 16.65256042 | 0.245675664 | 1.812949348 | 0.245675664 | -7.075735191 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_789 | -10.0 | 3.552464772 | 0.904933329 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'L', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4366 | null | 168.54 | 0.0 | 579.7512997 | 0.0 | 105.3024352 | -7.766634993 | -5.493681342 | -43.13731482 | -68.5439608 | -54.77780214 | -51.91767417 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
2cb29c5dcd40790305679de6987e3e71109491308bf3e1df3419fcfbb55733d7 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,366 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'meL', 'F'] | 50 | 4367 | -5.42 | -5.42 | Circle | 4 | -1.91e-16 | -2.707788095 | -1.36e-16 | -2.846386196 | -1.18e-17 | -1.135205623 | 1.55e-15 | -0.249287762 | 2.649644767 | 4693.516449 | 101.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.096665096 | 4.096665096 | null | null | null | null | 321.2907444 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 101.0 | PEPTIDE4367{[dP].[Me_dA].[meL].[Bn_Gly].[dP].[meL].F}$PEPTIDE4367,PEPTIDE4367,1:R1-7:R2$$$ | PEPTIDE4367{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4367,PEPTIDE4367,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4367 | null | null | 6.11e+41 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 17.05876182 | 0.342180206 | 17.05876182 | 0.245675665 | 1.831356251 | 0.245675665 | -7.201178358 | -0.342180206 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_790 | -5.42 | 3.949069637 | 1.085483947 | 34.70927174 | 42.60421449 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 27.41517112 | null | -5.42 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4367 | null | 150.96 | 43.05 | 581.1201112 | 0.0 | 101.6093126 | -2.618108324 | -5.575726592 | -43.97211398 | -62.88914428 | -42.81096719 | -71.4466968 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
92b8d453b8d21d6ef5ef1213876b3642f779a2f6fd3e59dc48e7699fe6893e74 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,368 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'meL', 'dP', 'Bn_Gly', 'F'] | 50 | 4369 | -5.71 | -5.71 | Circle | 2 | -1.86e-16 | -2.727892217 | -8.07e-17 | -2.84220054 | 4.43e-17 | -1.136012131 | 1.88e-15 | -0.249287767 | 2.65730088 | 4693.516449 | 103.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.07649114 | 47.59821857 | 15.15100497 | 10.42418691 | 10.42418691 | 6.623855714 | 6.623855714 | 4.124615946 | 4.124615946 | null | null | null | null | 321.2907444 | 28.8270132 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 827.4945474 | 0.716666667 | 1.25 | 1.816666667 | 0.586956522 | 101.0 | PEPTIDE4369{[dP].[Me_dA].[meL].[meL].[dP].[Bn_Gly].F}$PEPTIDE4369,PEPTIDE4369,1:R1-7:R2$$$ | PEPTIDE4369{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4369,PEPTIDE4369,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4369 | null | null | 1.43e+42 | 10.32069879 | 20.32669337 | 10.7198508 | 446.4996938 | null | 17.06288577 | 0.342431664 | 17.06288577 | 0.245675462 | 1.776727732 | 0.245675462 | -7.384257199 | -0.342431664 | 3.3314 | 227.6637 | 828.068 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_792 | -5.71 | 3.872635346 | 1.28261471 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 107.1043611 | 33.91203081 | null | -5.71 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 122.70215 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.4741494 | 40.41805975 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'meL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 171.3524606 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4369 | null | 150.96 | 25.29 | 581.2606292 | 0.0 | 101.3875602 | -2.396355939 | -5.347185962 | -44.22992304 | -62.41082888 | -42.99139792 | -71.855831 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.429298935 | null |
a0fe7469e2a8d2ad39027b4e52379b60f187eef981cb4487537baa04370b174f | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,369 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 51 | 4370 | -5.71 | -5.71 | Circle | 5 | -1.06e-16 | -2.690277484 | -1.26e-17 | -2.840518582 | 3.05e-16 | -1.13319578 | 10.13260376 | -0.248079406 | 2.218480075 | 4758.997523 | 113.0 | null | null | 95.47520861 | 88.4882332 | 29.4882332 | 52.54059275 | 45.07182536 | 15.67739817 | 10.57558011 | 10.57558011 | 6.671976033 | 6.671976033 | 4.157876955 | 4.157876955 | null | null | null | null | 324.5296993 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 52.08882513 | 833.4475972 | 0.721311475 | 1.278688525 | 1.852459016 | 0.468085106 | 111.0 | PEPTIDE4370{[dP].[Me_dA].L.[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4370,PEPTIDE4370,1:R1-7:R2$$$ | PEPTIDE4370{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4370,PEPTIDE4370,1:R1-7:R2$$$ | -6.05 | 61 | 774.559 | 4370 | null | null | 1.28e+39 | 11.30372809 | 20.47536328 | 11.21331168 | 441.1503396 | null | 16.74720417 | 0.342505615 | 16.74720417 | 0.245675462 | 1.712619139 | 0.245675462 | -6.841249475 | -0.342505615 | 3.1449 | 228.8824 | 834.031 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 12 | 0 | 3 | 3 | 324 | hepta_793 | -5.71 | 5.134955583 | 2.9328128 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 79.08818867 | 44.87809926 | null | -5.71 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 114.5186821 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 101.8764075 | 32.96326564 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 147.243893 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4370 | null | 159.75 | 25.16 | 527.7800367 | 0.0 | 103.4933586 | -4.866659799 | -7.766850753 | -35.52039405 | -63.02910021 | -34.70988725 | -58.21383651 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.353104375 | null |
0ef5718c0a756a901987bc4908d4bbc8f0bad1314a5afbc9dadcb55c09a64fc8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,370 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'Bn_Gly', 'F'] | 51 | 4371 | -6.56 | -6.56 | Circle | 3 | -1.51e-16 | -2.684526497 | -2.33e-17 | -2.828024493 | 3.18e-16 | -1.133174228 | 10.13377471 | -0.248079711 | 2.218327108 | 4758.997523 | 127.0 | null | null | 95.47520861 | 88.4882332 | 29.4882332 | 52.54059275 | 45.07182536 | 15.67739817 | 10.57558011 | 10.57558011 | 6.671976033 | 6.671976033 | 4.185827804 | 4.185827804 | null | null | null | null | 324.5296993 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 52.08882513 | 833.4475972 | 0.68852459 | 1.163934426 | 1.672131148 | 0.468085106 | 105.0 | PEPTIDE4371{[dP].[Me_dA].[Bn_Gly].L.[dP].[Bn_Gly].F}$PEPTIDE4371,PEPTIDE4371,1:R1-7:R2$$$ | PEPTIDE4371{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4371,PEPTIDE4371,1:R1-7:R2$$$ | -6.05 | 61 | 774.559 | 4371 | null | null | 2.24e+39 | 11.30372809 | 20.47536328 | 11.21331168 | 441.1503396 | null | 16.64790793 | 0.342747537 | 16.64790793 | 0.245675462 | 1.723099594 | 0.245675462 | -6.741102916 | -0.342747537 | 3.1449 | 228.8824 | 834.031 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 12 | 0 | 3 | 3 | 324 | hepta_794 | -6.56 | 5.261368118 | 3.134806355 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 79.08818867 | 51.37495894 | null | -6.56 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C1=O | 114.5186821 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 101.8764075 | 32.96326564 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'L', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 147.243893 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4371 | null | 159.75 | 4.04 | 527.7398171 | 0.0 | 103.4534483 | -4.826749499 | -7.756204597 | -35.46864481 | -63.02347195 | -34.80961593 | -58.1419119 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.353104375 | null |
1d674273739f1dc8778ed06b6b0611c0510f08486ff80f8e7247d824e6189243 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,371 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'Me_dL', 'F'] | 52 | 4372 | -10.0 | -10 | Circle | 1 | -2.62e-16 | -2.7115768 | -1.11e-16 | -2.857911419 | 3.97e-17 | -1.135202217 | 1.3e-15 | -0.249287763 | 2.642362924 | 4812.633734 | 118.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.36516627 | 48.82182536 | 15.42739817 | 10.57558011 | 10.57558011 | 6.671796259 | 6.671796259 | 4.127657991 | 4.127657991 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 327.4706709 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 841.5101975 | 0.704918033 | 1.213114754 | 1.770491803 | 0.595744681 | 124.0 | PEPTIDE4372{[dP].[Me_dA].[Me_dL].[bHph].[dP].[Me_dL].F}$PEPTIDE4372,PEPTIDE4372,1:R1-7:R2$$$ | PEPTIDE4372{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4372,PEPTIDE4372,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4372 | null | null | 5.12e+42 | 10.39396068 | 21.00489121 | 11.56077646 | 455.5226621 | null | 16.78522824 | 0.35072394 | 16.78522824 | 0.245675665 | 1.851402057 | 0.245675665 | -7.122868455 | -0.35072394 | 3.4202 | 232.4984 | 842.095 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_795 | -10.0 | 3.433322532 | 1.02301486 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 118.481353 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 133.741032 | 33.92120007 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 46.30761009 | 11.78791537 | 179.096144 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4372 | null | 159.75 | 0.0 | 600.0774341 | 0.0 | 103.7250317 | -5.321567352 | -5.60368901 | -44.00773643 | -69.8137735 | -55.69753409 | -58.69149875 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.412453619 | null |
6a56fcc1ba295605e160e9a089628a532a04da5a716636e58900013b2121a147 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,373 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'meL', 'F'] | 50 | 4374 | -10.0 | -10 | Circle | 8 | -2.12e-16 | -2.7115768 | -1.37e-16 | -2.857911419 | 6.03e-17 | -1.135202217 | 1.5e-15 | -0.249287763 | 2.642362924 | 4812.633734 | 109.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.36516627 | 48.82182536 | 15.42739817 | 10.57558011 | 10.57558011 | 6.671796259 | 6.671796259 | 4.127657991 | 4.127657991 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 327.4706709 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 841.5101975 | 0.704918033 | 1.213114754 | 1.770491803 | 0.595744681 | 106.0 | PEPTIDE4374{[dP].[Me_dA].[Me_dL].[bHph].[dP].[meL].F}$PEPTIDE4374,PEPTIDE4374,1:R1-7:R2$$$ | PEPTIDE4374{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4374,PEPTIDE4374,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4374 | null | null | 1.86e+43 | 10.39396068 | 21.00489121 | 11.56077646 | 455.5226621 | null | 16.78522824 | 0.35072394 | 16.78522824 | 0.245675665 | 1.851402057 | 0.245675665 | -7.122868455 | -0.35072394 | 3.4202 | 232.4984 | 842.095 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_797 | -10.0 | 3.433322532 | 1.02301486 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 118.481353 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 133.741032 | 33.92120007 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'bHph', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 46.30761009 | 11.78791537 | 179.096144 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4374 | null | 159.75 | 0.0 | 600.0774341 | 0.0 | 103.7250317 | -5.321567352 | -5.60368901 | -44.00773643 | -69.8137735 | -55.69753409 | -58.69149875 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.412453619 | null |
030f8ca6fe8b14ab5ff946f6ddd40a23f9b4f8171b706330900dea2856a11b6b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,374 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Me_dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 55 | 4375 | -6.84 | -6.84 | Circle | 4 | -1.51e-16 | -2.707541293 | -3.83e-17 | -2.830641907 | 2.41e-16 | -1.133974154 | 10.10836126 | -0.248274572 | 2.267309049 | 4868.893139 | 114.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.75191762 | 46.34821857 | 15.90100497 | 10.79918691 | 10.79918691 | 6.885324678 | 6.885324678 | 4.286600427 | 4.286600427 | null | null | null | null | 331.0956226 | 27.45625465 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 847.4632473 | 0.709677419 | 1.258064516 | 1.822580645 | 0.479166667 | 113.0 | PEPTIDE4375{[dP].[Me_dA].[Me_dL].[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4375,PEPTIDE4375,1:R1-7:R2$$$ | PEPTIDE4375{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4375,PEPTIDE4375,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4375 | null | null | 1.75e+40 | 11.35983112 | 20.67658958 | 10.87245171 | 450.4771376 | null | 17.06387084 | 0.342431664 | 17.06387084 | 0.245675462 | 1.733057592 | 0.245675462 | -7.127707808 | -0.342431664 | 3.4871 | 233.5097 | 848.058 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 1 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_798 | -6.84 | 4.874969718 | 3.062343749 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 90.17629124 | 44.87809926 | null | -6.84 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 117.2191157 | 41.35025811 | 0.0 | 34.70927174 | 5.893957685 | 101.8764075 | 39.93909254 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Me_dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 140.7782714 | 52.92840456 | 5.893957685 | 151.3561687 | 90.63628061 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4375 | null | 150.96 | 2.14 | 548.0583611 | 0.0 | 101.8132483 | -2.310563865 | -7.908531131 | -36.368465 | -64.28044163 | -35.23009477 | -65.35684633 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364998551 | null |
028b00c07efe18719d5e3ed89eb277c57e826a6b42760dbddde6cd469cd69f7c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,375 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'meL', 'F'] | 48 | 4376 | -5.93 | -5.93 | Circle | 8 | -2.62e-16 | -2.7115768 | -1.11e-16 | -2.857911419 | 3.97e-17 | -1.135202217 | 1.3e-15 | -0.249287763 | 2.642362924 | 4812.633734 | 100.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.36516627 | 48.82182536 | 15.42739817 | 10.57558011 | 10.57558011 | 6.671796259 | 6.671796259 | 4.127657991 | 4.127657991 | null | null | null | null | 327.4706709 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 841.5101975 | 0.704918033 | 1.213114754 | 1.770491803 | 0.595744681 | 96.0 | PEPTIDE4376{[dP].[Me_dA].[meL].[bHph].[dP].[meL].F}$PEPTIDE4376,PEPTIDE4376,1:R1-7:R2$$$ | PEPTIDE4376{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4376,PEPTIDE4376,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4376 | null | null | 5.12e+42 | 10.39396068 | 21.00489121 | 11.56077646 | 455.5226621 | null | 16.78522824 | 0.35072394 | 16.78522824 | 0.245675665 | 1.851402057 | 0.245675665 | -7.122868455 | -0.35072394 | 3.4202 | 232.4984 | 842.095 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_799 | -5.93 | 3.433322532 | 1.02301486 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 118.481353 | 23.30289545 | null | -5.93 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 133.741032 | 33.92120007 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 46.30761009 | 11.78791537 | 179.096144 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4376 | null | 159.75 | 16.07 | 600.0774341 | 0.0 | 103.7250317 | -5.321567352 | -5.60368901 | -44.00773643 | -69.8137735 | -55.69753409 | -58.69149875 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.412453619 | null |
03eb7315f1595ac51ed305fa148b8c708f1bffeecbc07e13363aa4f9d1af00c8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,376 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'Bn_Gly', 'dP', 'meL', 'F'] | 53 | 4377 | -6.41 | -6.41 | Circle | 4 | -1.54e-16 | -2.700232662 | -4.17e-17 | -2.846109133 | 3.76e-16 | -1.133987715 | 10.09048244 | -0.24827205 | 2.2615177 | 4868.893139 | 110.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.75191762 | 46.34821857 | 15.90100497 | 10.79918691 | 10.79918691 | 6.885324678 | 6.885324678 | 4.258649578 | 4.258649578 | null | null | null | null | 331.0956226 | 30.19777176 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 847.4632473 | 0.709677419 | 1.241935484 | 1.822580645 | 0.479166667 | 107.0 | PEPTIDE4377{[dP].[Me_dA].[Bn_Gly].[Bn_Gly].[dP].[meL].F}$PEPTIDE4377,PEPTIDE4377,1:R1-7:R2$$$ | PEPTIDE4377{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4377,PEPTIDE4377,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4377 | null | null | 1.6499999999999998e+41 | 11.35983112 | 20.67658958 | 10.87245171 | 450.4771376 | null | 16.76150374 | 0.342180206 | 16.76150374 | 0.245675665 | 1.740762925 | 0.245675665 | -6.980082696 | -0.342180206 | 3.4871 | 233.5097 | 848.058 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 1 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_800 | -6.41 | 4.840245348 | 2.886790438 | 34.70927174 | 43.08318171 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 90.17629124 | 38.38123957 | null | -6.41 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N1C | 117.2191157 | 41.35025811 | 0.0 | 34.70927174 | 5.893957685 | 101.8764075 | 39.93909254 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 140.7782714 | 52.92840456 | 5.893957685 | 151.3561687 | 90.63628061 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4377 | null | 150.96 | 5.7 | 547.7445001 | 0.0 | 102.0651381 | -2.562453739 | -7.917777914 | -36.28785865 | -64.38463309 | -35.47125646 | -64.76899171 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364998551 | null |
13da31891e22dd764869d5e929ae8d4c959312ed05e827d5b79148adba8236ff | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,377 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 53 | 4378 | -5.87 | -5.87 | Circle | 7 | -1.51e-16 | -2.707541293 | -3.83e-17 | -2.830641907 | 2.41e-16 | -1.133974154 | 10.10836126 | -0.248274572 | 2.267309049 | 4868.893139 | 114.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.75191762 | 46.34821857 | 15.90100497 | 10.79918691 | 10.79918691 | 6.885324678 | 6.885324678 | 4.286600427 | 4.286600427 | null | null | null | null | 331.0956226 | 27.45625465 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 847.4632473 | 0.709677419 | 1.258064516 | 1.822580645 | 0.479166667 | 114.0 | PEPTIDE4378{[dP].[Me_dA].[meL].[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4378,PEPTIDE4378,1:R1-7:R2$$$ | PEPTIDE4378{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4378,PEPTIDE4378,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4378 | null | null | 1.75e+40 | 11.35983112 | 20.67658958 | 10.87245171 | 450.4771376 | null | 17.06387084 | 0.342431664 | 17.06387084 | 0.245675462 | 1.733057592 | 0.245675462 | -7.127707808 | -0.342431664 | 3.4871 | 233.5097 | 848.058 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 1 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_801 | -5.87 | 4.874969718 | 3.062343749 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 90.17629124 | 44.87809926 | null | -5.87 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 117.2191157 | 41.35025811 | 0.0 | 34.70927174 | 5.893957685 | 101.8764075 | 39.93909254 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 140.7782714 | 52.92840456 | 5.893957685 | 151.3561687 | 90.63628061 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4378 | null | 150.96 | 18.37 | 548.0583611 | 0.0 | 101.8132483 | -2.310563865 | -7.908531131 | -36.368465 | -64.28044163 | -35.23009477 | -65.35684633 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364998551 | null |
69880aa50a2db17d37e37f47351829356bff03cb1dc4eaca30ac6db2e2fe413d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,378 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'Bn_Gly', 'F'] | 49 | 4379 | -10.0 | -10 | Circle | 9 | -1.52e-16 | -2.694100643 | -2.48e-17 | -2.861267968 | 1.86e-16 | -1.133252392 | 10.09935991 | -0.248081056 | 2.215205584 | 4878.402914 | 117.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.82926789 | 46.29543216 | 15.95379138 | 10.72697332 | 10.72697332 | 6.719916578 | 6.719916578 | 4.18886985 | 4.18886985 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 330.7096259 | 31.65069736 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 52.08882513 | 847.4632473 | 0.741935484 | 1.338709677 | 1.951612903 | 0.479166667 | 135.0 | PEPTIDE4379{[dP].[Me_dA].L.[bHph].[dP].[Bn_Gly].F}$PEPTIDE4379,PEPTIDE4379,1:R1-7:R2$$$ | PEPTIDE4379{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4379,PEPTIDE4379,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4379 | null | null | 9.099999999999999e+39 | 11.35983112 | 21.15492169 | 11.64916291 | 450.1733078 | null | 16.64439979 | 0.350730365 | 16.64439979 | 0.245675462 | 1.72808705 | 0.245675462 | -6.773073885 | -0.350730365 | 3.2337 | 233.7171 | 848.058 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 12 | 0 | 3 | 3 | 330 | hepta_802 | -10.0 | 4.601704689 | 2.788806965 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 90.46518058 | 40.76582359 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)[C@@H](C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 114.1432901 | 26.46640595 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'L', 'bHph', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 52.80446978 | 5.893957685 | 154.9875765 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4379 | null | 168.54 | 0.0 | 546.8065334 | 0.0 | 105.4094562 | -7.387011959 | -7.831069753 | -35.56851191 | -69.84889605 | -47.1863923 | -45.97744095 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.313081439 | null |
f444f32223b484cc83ae8a5ac3f88ef97d8a382d7c6bb31576d25828bf614ea8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,379 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'bHph', 'dP', 'Me_dL', 'F'] | 53 | 4380 | -5.73 | -5.73 | Circle | 5 | -2.05e-16 | -2.701087895 | -8.94e-17 | -2.850201354 | 1.75e-16 | -1.133988994 | 4.42e-15 | -0.248273327 | 2.25669327 | 4988.623117 | 118.0 | null | null | 100.4752086 | 93.4882332 | 30.4882332 | 55.04059275 | 47.57182536 | 16.17739817 | 10.95058011 | 10.95058011 | 6.933265223 | 6.933265223 | 4.317593323 | 4.317593323 | null | null | null | null | 337.2755492 | 32.98037239 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 861.4788974 | 0.746031746 | 1.317460317 | 1.920634921 | 0.489795918 | 114.0 | PEPTIDE4380{[dP].[Me_dA].[Bn_Gly].[bHph].[dP].[Me_dL].F}$PEPTIDE4380,PEPTIDE4380,1:R1-7:R2$$$ | PEPTIDE4380{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4380,PEPTIDE4380,1:R1-7:R2$$$ | -6.05 | 63 | 798.581 | 4380 | null | null | 1.61e+42 | 11.41882426 | 21.35224675 | 11.70542262 | 459.5001058 | null | 16.79033726 | 0.350975417 | 16.79033726 | 0.245675665 | 1.742288523 | 0.245675665 | -7.023153796 | -0.350975417 | 3.5759 | 238.3444 | 862.085 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 13 | 0 | 3 | 3 | 336 | hepta_803 | -5.73 | 4.30808821 | 2.517791907 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 101.5532831 | 40.76582359 | null | -5.73 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 114.1432901 | 33.44223285 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 52.80446978 | 5.893957685 | 159.0998522 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4380 | null | 159.75 | 24.4 | 566.9957476 | 0.0 | 103.9158275 | -4.958368307 | -7.975087785 | -36.44832604 | -71.19567469 | -47.96353943 | -52.70391223 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.350639061 | null |
cde2856e986619b2a13d879f457df73ac9e0e2f232f1bb0f6962b7397ebda35c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,380 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'Bn_Gly', 'F'] | 51 | 4381 | -7.18 | -7.18 | Circle | 5 | -1.24e-16 | -2.710003586 | -3.99e-17 | -2.851193236 | 1.87e-16 | -1.134026561 | 6.12e-15 | -0.248275854 | 2.260998676 | 4988.623117 | 101.0 | null | null | 100.4752086 | 93.4882332 | 30.4882332 | 55.04059275 | 47.57182536 | 16.17739817 | 10.95058011 | 10.95058011 | 6.933265223 | 6.933265223 | 4.317593323 | 4.317593323 | null | null | null | null | 337.2755492 | 32.98037239 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 861.4788974 | 0.746031746 | 1.333333333 | 1.936507937 | 0.489795918 | 104.0 | PEPTIDE4381{[dP].[Me_dA].[meL].[bHph].[dP].[Bn_Gly].F}$PEPTIDE4381,PEPTIDE4381,1:R1-7:R2$$$ | PEPTIDE4381{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4381,PEPTIDE4381,1:R1-7:R2$$$ | -6.05 | 63 | 798.581 | 4381 | null | null | 9.869999999999999e+41 | 11.41882426 | 21.35224675 | 11.70542262 | 459.5001058 | null | 16.70594442 | 0.35072394 | 16.70594442 | 0.245675462 | 1.745975469 | 0.245675462 | -7.059532218 | -0.35072394 | 3.5759 | 238.3444 | 862.085 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 13 | 0 | 3 | 3 | 336 | hepta_804 | -7.18 | 4.281181884 | 2.512546619 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 101.5532831 | 40.76582359 | null | -7.18 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 114.1432901 | 33.44223285 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'meL', 'bHph', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 52.80446978 | 5.893957685 | 159.0998522 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4381 | null | 159.75 | 0.99 | 567.0062174 | 0.0 | 103.8122934 | -4.938239677 | -7.954374516 | -36.39503459 | -71.15602388 | -47.88841721 | -52.81975426 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.350639061 | null |
a8ff545a13cefab476c7c7b154ced6cf57927bf896a42fe898ea4120e81372e8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,382 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['dP', 'Me_dA', 'Bn_Gly', 'bHph', 'dP', 'Bn_Gly', 'F'] | 54 | 4383 | -7.79 | -7.79 | Circle | 1 | -1.13e-16 | -2.646441521 | 1.37e-16 | -2.833005441 | 8.97e-16 | -1.010394001 | 10.3300223 | -0.246507753 | 1.970558554 | 5165.063838 | 111.0 | null | null | 97.93931023 | 90.4882332 | 31.4882332 | 54.71601924 | 46.32182536 | 16.92739817 | 11.32558011 | 11.32558011 | 7.194734186 | 7.194734186 | 4.507528654 | 4.507528654 | null | null | null | null | 347.0804274 | 37.09264806 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 43.8642738 | 881.4475972 | 0.615384615 | 1.092307692 | 1.630769231 | 0.392156863 | 105.0 | PEPTIDE4383{[dP].[Me_dA].[Bn_Gly].[bHph].[dP].[Bn_Gly].F}$PEPTIDE4383,PEPTIDE4383,1:R1-7:R2$$$ | PEPTIDE4383{<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4383,PEPTIDE4383,1:R1-7:R2$$$ | -6.83 | 65 | 822.603 | 4383 | null | null | 1.3399999999999998e+41 | 12.53214945 | 21.70066938 | 11.85178991 | 463.4775496 | null | 16.64884777 | 0.350975417 | 16.64884777 | 0.245675462 | 1.704262708 | 0.245675462 | -6.44600302 | -0.350975417 | 3.7316 | 244.1904 | 882.075 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 4 | 0 | 4 | 7 | 2 | 14 | 0 | 10 | 0 | 3 | 3 | 340 | hepta_806 | -7.79 | 5.701668594 | 4.975853579 | 35.11917536 | 24.07156987 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 120.8483742 | 60.97032259 | 84.62521326 | 58.22875172 | null | -7.79 | null | null | null | null | null | null | null | null | null | null | 7 | C[C@@H]1C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@@H]2C(=O)N1C | 114.5186821 | 41.35025811 | 0.0 | 35.11917536 | 0.0 | 94.54554814 | 32.96326564 | 143.1021801 | 0 | 0.0 | null | null | null | null | ['dP', 'Me_dA', 'Bn_Gly', 'bHph', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.1353999999999999, 1.3173, 1.4060999999999997, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 59.30132946 | 0.0 | 139.1035603 | 120.8483742 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4383 | null | 159.75 | 0.24 | 533.8400104 | 0.0 | 104.0030892 | -4.575040632 | -10.22483842 | -28.94392775 | -72.27374875 | -40.2781265 | -46.88075089 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.273108991 | null |
251db507f4fcddefbb51ec5068f8e2d363e935e8337200aec329dd102f0c561d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,383 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'dL', 'F'] | 44 | 4384 | -6.77 | -6.77 | Circle | 7 | -2.48e-16 | -2.703951957 | -2.21e-16 | -2.863922302 | -1.72e-16 | -1.13535425 | 5.26e-16 | -0.249287767 | 3.012574928 | 4308.753031 | 126.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 52.01709006 | 46.26903896 | 13.98018458 | 9.378366518 | 9.378366518 | 5.67130978 | 5.67130978 | 3.604411895 | 3.604411895 | null | null | null | null | 298.1610213 | 23.42614602 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.732142857 | 1.25 | 1.857142857 | 0.69047619 | 127.0 | PEPTIDE4384{P.[Pr_Gly].[dL].[dL].[dP].[dL].F}$PEPTIDE4384,PEPTIDE4384,1:R1-7:R2$$$ | PEPTIDE4384{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4384,PEPTIDE4384,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4384 | null | null | 1.6399999999999998e+39 | 9.201058546 | 20.60856476 | 12.0059032 | 423.7167393 | null | 16.60877009 | 0.342755981 | 16.60877009 | 0.245675664 | 1.819643841 | 0.245675664 | -6.991576729 | -0.342755981 | 2.5408 | 212.5748 | 780.024 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_807 | -6.77 | 3.248413466 | -0.42645757 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 91.65991465 | 24.31672091 | null | -6.77 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.4269237 | 25.98743874 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 188.1263674 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4384 | null | 177.33 | 2.51 | 571.1860805 | 0.0 | 106.6711 | -10.71774692 | -2.745986747 | -49.47624822 | -51.35104537 | -54.63076214 | -63.01872448 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.282224884 | null |
6e7f5c0b7307189d0fd0c7ed41f0b11eb607ba95291a97c8fd987ca58c310b96 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,384 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'dL', 'F'] | 43 | 4385 | -6.95 | -6.95 | Circle | 3 | -2.48e-16 | -2.703951957 | -2.21e-16 | -2.863922302 | -1.72e-16 | -1.13535425 | 5.26e-16 | -0.249287767 | 3.012574928 | 4308.753031 | 129.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 52.01709006 | 46.26903896 | 13.98018458 | 9.378366518 | 9.378366518 | 5.67130978 | 5.67130978 | 3.604411895 | 3.604411895 | null | null | null | null | 298.1610213 | 23.42614602 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.732142857 | 1.25 | 1.857142857 | 0.69047619 | 127.0 | PEPTIDE4385{P.[Pr_Gly].[dL].L.[dP].[dL].F}$PEPTIDE4385,PEPTIDE4385,1:R1-7:R2$$$ | PEPTIDE4385{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4385,PEPTIDE4385,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4385 | null | null | 1.6399999999999998e+39 | 9.201058546 | 20.60856476 | 12.0059032 | 423.7167393 | null | 16.60877009 | 0.342755981 | 16.60877009 | 0.245675664 | 1.819643841 | 0.245675664 | -6.991576729 | -0.342755981 | 2.5408 | 212.5748 | 780.024 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_808 | -6.95 | 3.248413466 | -0.42645757 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 91.65991465 | 24.31672091 | null | -6.95 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.4269237 | 25.98743874 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 188.1263674 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4385 | null | 177.33 | 1.67 | 571.1860805 | 0.0 | 106.6711 | -10.71774692 | -2.745986747 | -49.47624822 | -51.35104537 | -54.63076214 | -63.01872448 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.282224884 | null |
daf673f247e571b6f6b8864054866ea9d55d1109543edd2f2e2555dd00b88b19 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,385 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'L', 'F'] | 42 | 4386 | -6.48 | -6.48 | Circle | 3 | -2.48e-16 | -2.703951957 | -2.21e-16 | -2.863922302 | -1.72e-16 | -1.13535425 | 5.26e-16 | -0.249287767 | 3.012574928 | 4308.753031 | 117.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 52.01709006 | 46.26903896 | 13.98018458 | 9.378366518 | 9.378366518 | 5.67130978 | 5.67130978 | 3.604411895 | 3.604411895 | null | null | null | null | 298.1610213 | 23.42614602 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.732142857 | 1.25 | 1.857142857 | 0.69047619 | 114.0 | PEPTIDE4386{P.[Pr_Gly].L.[dL].[dP].L.F}$PEPTIDE4386,PEPTIDE4386,1:R1-7:R2$$$ | PEPTIDE4386{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4386,PEPTIDE4386,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4386 | null | null | 1.6399999999999998e+39 | 9.201058546 | 20.60856476 | 12.0059032 | 423.7167393 | null | 16.60877009 | 0.342755981 | 16.60877009 | 0.245675664 | 1.819643841 | 0.245675664 | -6.991576729 | -0.342755981 | 2.5408 | 212.5748 | 780.024 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_809 | -6.48 | 3.248413466 | -0.42645757 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 91.65991465 | 24.31672091 | null | -6.48 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.4269237 | 25.98743874 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 188.1263674 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4386 | null | 177.33 | 4.86 | 571.1860805 | 0.0 | 106.6711 | -10.71774692 | -2.745986747 | -49.47624822 | -51.35104537 | -54.63076214 | -63.01872448 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.282224884 | null |
803ac1b8de7b4c59d4901fc5d9e65f4f37d57def01a777c67e552a6175b19e23 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,386 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'L', 'F'] | 42 | 4387 | -5.91 | -5.91 | Circle | 1 | -2.48e-16 | -2.703951957 | -2.21e-16 | -2.863922302 | -1.72e-16 | -1.13535425 | 5.26e-16 | -0.249287767 | 3.012574928 | 4308.753031 | 134.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 52.01709006 | 46.26903896 | 13.98018458 | 9.378366518 | 9.378366518 | 5.67130978 | 5.67130978 | 3.604411895 | 3.604411895 | null | null | null | null | 298.1610213 | 23.42614602 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.732142857 | 1.25 | 1.857142857 | 0.69047619 | 139.0 | PEPTIDE4387{P.[Pr_Gly].[dL].L.[dP].L.F}$PEPTIDE4387,PEPTIDE4387,1:R1-7:R2$$$ | PEPTIDE4387{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4387,PEPTIDE4387,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4387 | null | null | 1.6399999999999998e+39 | 9.201058546 | 20.60856476 | 12.0059032 | 423.7167393 | null | 16.60877009 | 0.342755981 | 16.60877009 | 0.245675664 | 1.819643841 | 0.245675664 | -6.991576729 | -0.342755981 | 2.5408 | 212.5748 | 780.024 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_810 | -5.91 | 3.248413466 | -0.42645757 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 91.65991465 | 24.31672091 | null | -5.91 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.4269237 | 25.98743874 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 188.1263674 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4387 | null | 177.33 | 16.64 | 571.1860805 | 0.0 | 106.6711 | -10.71774692 | -2.745986747 | -49.47624822 | -51.35104537 | -54.63076214 | -63.01872448 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.282224884 | null |
1ccf0c2942fccb59f8ab2e3c7658820245683d4695cc446d99d2aacd09f4033a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,387 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'L', 'F'] | 41 | 4388 | -6.55 | -6.55 | Circle | 3 | -2.48e-16 | -2.703951957 | -2.21e-16 | -2.863922302 | -1.72e-16 | -1.13535425 | 5.26e-16 | -0.249287767 | 3.012574928 | 4308.753031 | 129.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 52.01709006 | 46.26903896 | 13.98018458 | 9.378366518 | 9.378366518 | 5.67130978 | 5.67130978 | 3.604411895 | 3.604411895 | null | null | null | null | 298.1610213 | 23.42614602 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.732142857 | 1.25 | 1.857142857 | 0.69047619 | 130.0 | PEPTIDE4388{P.[Pr_Gly].L.L.[dP].L.F}$PEPTIDE4388,PEPTIDE4388,1:R1-7:R2$$$ | PEPTIDE4388{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4388,PEPTIDE4388,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4388 | null | null | 1.6399999999999998e+39 | 9.201058546 | 20.60856476 | 12.0059032 | 423.7167393 | null | 16.60877009 | 0.342755981 | 16.60877009 | 0.245675664 | 1.819643841 | 0.245675664 | -6.991576729 | -0.342755981 | 2.5408 | 212.5748 | 780.024 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_811 | -6.55 | 3.248413466 | -0.42645757 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 91.65991465 | 24.31672091 | null | -6.55 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.4269237 | 25.98743874 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 188.1263674 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4388 | null | 177.33 | 4.15 | 571.1860805 | 0.0 | 106.6711 | -10.71774692 | -2.745986747 | -49.47624822 | -51.35104537 | -54.63076214 | -63.01872448 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.282224884 | null |
4fb3ab15c67e1e6c493162d5f8eb5254434329142c5e488941a669b49fb26bfe | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,388 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'dL', 'F'] | 47 | 4389 | -6.26 | -6.26 | Circle | 4 | -2.74e-16 | -2.714070056 | -2.18e-16 | -2.860898164 | -1.17e-16 | -1.135669702 | 5.9e-16 | -0.249287767 | 3.078401787 | 4417.027602 | 111.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.705184518 | 3.705184518 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.350877193 | 2.0 | 0.697674419 | 111.0 | PEPTIDE4389{P.[Pr_Gly].[Me_dL].[dL].[dP].[dL].F}$PEPTIDE4389,PEPTIDE4389,1:R1-7:R2$$$ | PEPTIDE4389{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4389,PEPTIDE4389,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4389 | null | null | 1.1599999999999999e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.69585687 | 0.342504271 | 16.69585687 | 0.245675664 | 1.842039674 | 0.245675664 | -7.203673319 | -0.342504271 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_812 | -6.26 | 3.234908224 | -0.356300594 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -6.26 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4389 | null | 168.54 | 7.85 | 591.3020711 | 0.0 | 105.0088337 | -8.179494975 | -2.779116678 | -50.43548166 | -52.15506634 | -55.38467955 | -70.21039888 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
1809342fe26873ceba4a7980e9c238246296496678d41adaf0c9faf95f96abd7 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,389 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Me_dL', 'dP', 'dL', 'F'] | 47 | 4390 | -5.31 | -5.31 | Circle | 1 | -2.61e-16 | -2.718243534 | -2.52e-16 | -2.858444941 | -1.19e-16 | -1.135757491 | 1.03e-15 | -0.249287767 | 3.079347335 | 4417.027602 | 110.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.385964912 | 2.035087719 | 0.697674419 | 109.0 | PEPTIDE4390{P.[Pr_Gly].[dL].[Me_dL].[dP].[dL].F}$PEPTIDE4390,PEPTIDE4390,1:R1-7:R2$$$ | PEPTIDE4390{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4390,PEPTIDE4390,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4390 | null | null | 5.67e+40 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.77887333 | 0.342747938 | 16.77887333 | 0.245675664 | 1.83753226 | 0.245675664 | -7.278035062 | -0.342747938 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_813 | -5.31 | 3.207839548 | -0.346244407 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.31 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Me_dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4390 | null | 168.54 | 52.23 | 591.5290062 | 0.0 | 104.9517994 | -8.122460697 | -2.771298538 | -50.49687761 | -52.24334653 | -55.44120708 | -70.23894848 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
d45205b78034235f22d7a5bc287956c1789d5a8ccea77583667e6fe98aaf57ea | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,390 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'Me_dL', 'F'] | 47 | 4391 | -5.81 | -5.81 | Circle | 6 | -3.08e-16 | -2.707636121 | -2.82e-16 | -2.860167341 | -1.3e-16 | -1.135354871 | 6.66e-16 | -0.249287767 | 3.083626329 | 4417.027602 | 123.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.771929825 | 1.350877193 | 1.964912281 | 0.697674419 | 124.0 | PEPTIDE4391{P.[Pr_Gly].[dL].[dL].[dP].[Me_dL].F}$PEPTIDE4391,PEPTIDE4391,1:R1-7:R2$$$ | PEPTIDE4391{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4391,PEPTIDE4391,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4391 | null | null | 1.19e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.74143791 | 0.342755981 | 16.74143791 | 0.245675665 | 1.85809655 | 0.245675665 | -7.16653906 | -0.342755981 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_814 | -5.81 | 3.24235547 | -0.364135139 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.81 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4391 | null | 168.54 | 20.63 | 591.4947565 | 0.0 | 105.0717087 | -8.242369986 | -2.810849787 | -50.43104926 | -52.4356328 | -55.50715037 | -69.97274639 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
d414e5cffde5382eb1c944577a06327ac28af8999614debe5b42c77aaf4038a2 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,392 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'L', 'F'] | 46 | 4393 | -6.42 | -6.42 | Circle | 3 | -2.74e-16 | -2.714070056 | -2.18e-16 | -2.860898164 | -1.17e-16 | -1.135669702 | 5.9e-16 | -0.249287767 | 3.078401787 | 4417.027602 | 131.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.705184518 | 3.705184518 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.350877193 | 2.0 | 0.697674419 | 130.0 | PEPTIDE4393{P.[Pr_Gly].[Me_dL].[dL].[dP].L.F}$PEPTIDE4393,PEPTIDE4393,1:R1-7:R2$$$ | PEPTIDE4393{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4393,PEPTIDE4393,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4393 | null | null | 1.1599999999999999e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.69585687 | 0.342504271 | 16.69585687 | 0.245675664 | 1.842039674 | 0.245675664 | -7.203673319 | -0.342504271 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_816 | -6.42 | 3.234908224 | -0.356300594 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -6.42 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4393 | null | 168.54 | 5.57 | 591.3020711 | 0.0 | 105.0088337 | -8.179494975 | -2.779116678 | -50.43548166 | -52.15506634 | -55.38467955 | -70.21039888 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
480e2055471ce6ed2d8ae4943a16864143ab732ed87eb5102f7a05f534caadfd | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,394 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'Me_dL', 'F'] | 46 | 4395 | -5.37 | -5.37 | Circle | 5 | -3.08e-16 | -2.707636121 | -2.82e-16 | -2.860167341 | -1.3e-16 | -1.135354871 | 6.66e-16 | -0.249287767 | 3.083626329 | 4417.027602 | 111.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.771929825 | 1.350877193 | 1.964912281 | 0.697674419 | 111.0 | PEPTIDE4395{P.[Pr_Gly].L.[dL].[dP].[Me_dL].F}$PEPTIDE4395,PEPTIDE4395,1:R1-7:R2$$$ | PEPTIDE4395{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4395,PEPTIDE4395,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4395 | null | null | 1.19e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.74143791 | 0.342755981 | 16.74143791 | 0.245675665 | 1.85809655 | 0.245675665 | -7.16653906 | -0.342755981 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_818 | -5.37 | 3.24235547 | -0.364135139 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.37 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4395 | null | 168.54 | 46.86 | 591.4947565 | 0.0 | 105.0717087 | -8.242369986 | -2.810849787 | -50.43104926 | -52.4356328 | -55.50715037 | -69.97274639 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
bbdd053de2960f5a0e7c771640e1e22f6b360081ead482e76d85bad3e269f6c0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,395 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'dL', 'F'] | 45 | 4396 | -5.73 | -5.73 | Circle | 4 | -2.61e-16 | -2.718243534 | -2.52e-16 | -2.858444941 | -1.19e-16 | -1.135757491 | 1.03e-15 | -0.249287767 | 3.079347335 | 4417.027602 | 128.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.385964912 | 2.035087719 | 0.697674419 | 124.0 | PEPTIDE4396{P.[Pr_Gly].[dL].[meL].[dP].[dL].F}$PEPTIDE4396,PEPTIDE4396,1:R1-7:R2$$$ | PEPTIDE4396{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4396,PEPTIDE4396,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4396 | null | null | 5.67e+40 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.77887333 | 0.342747938 | 16.77887333 | 0.245675664 | 1.83753226 | 0.245675664 | -7.278035062 | -0.342747938 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_819 | -5.73 | 3.207839548 | -0.346244407 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.73 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4396 | null | 168.54 | 24.29 | 591.5290062 | 0.0 | 104.9517994 | -8.122460697 | -2.771298538 | -50.49687761 | -52.24334653 | -55.44120708 | -70.23894848 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
07ef3499a78709d3ef982b2eab6592d0f5f9967308807706f5d2bc2704f0899c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,396 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'dL', 'dP', 'L', 'F'] | 44 | 4397 | -6.77 | -6.77 | Circle | 9 | -2.74e-16 | -2.714070056 | -2.18e-16 | -2.860898164 | -1.17e-16 | -1.135669702 | 5.9e-16 | -0.249287767 | 3.078401787 | 4417.027602 | 110.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.705184518 | 3.705184518 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.350877193 | 2.0 | 0.697674419 | 111.0 | PEPTIDE4397{P.[Pr_Gly].[meL].[dL].[dP].L.F}$PEPTIDE4397,PEPTIDE4397,1:R1-7:R2$$$ | PEPTIDE4397{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4397,PEPTIDE4397,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4397 | null | null | 1.1599999999999999e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.69585687 | 0.342504271 | 16.69585687 | 0.245675664 | 1.842039674 | 0.245675664 | -7.203673319 | -0.342504271 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_820 | -6.77 | 3.234908224 | -0.356300594 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -6.77 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4397 | null | 168.54 | 2.53 | 591.3020711 | 0.0 | 105.0088337 | -8.179494975 | -2.779116678 | -50.43548166 | -52.15506634 | -55.38467955 | -70.21039888 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
bff5e1939d5167a794db3a17c52c8988033ac69068c82414164b92f94cbfd5a6 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,397 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'dL', 'F'] | 44 | 4398 | -5.9 | -5.9 | Circle | 6 | -2.61e-16 | -2.718243534 | -2.52e-16 | -2.858444941 | -1.19e-16 | -1.135757491 | 1.03e-15 | -0.249287767 | 3.079347335 | 4417.027602 | 127.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.385964912 | 2.035087719 | 0.697674419 | 129.0 | PEPTIDE4398{P.[Pr_Gly].L.[meL].[dP].[dL].F}$PEPTIDE4398,PEPTIDE4398,1:R1-7:R2$$$ | PEPTIDE4398{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4398,PEPTIDE4398,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4398 | null | null | 5.67e+40 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.77887333 | 0.342747938 | 16.77887333 | 0.245675664 | 1.83753226 | 0.245675664 | -7.278035062 | -0.342747938 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_821 | -5.9 | 3.207839548 | -0.346244407 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.9 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4398 | null | 168.54 | 17.31 | 591.5290062 | 0.0 | 104.9517994 | -8.122460697 | -2.771298538 | -50.49687761 | -52.24334653 | -55.44120708 | -70.23894848 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
eb2bab5f9e44011d3d2bac62d8187441a84d9cfa2332a4fedd1653fe0a8c4cff | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,400 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'meL', 'F'] | 44 | 4401 | -5.21 | -5.21 | Circle | 5 | -3.08e-16 | -2.707636121 | -2.82e-16 | -2.860167341 | -1.3e-16 | -1.135354871 | 6.66e-16 | -0.249287767 | 3.083626329 | 4417.027602 | 120.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.771929825 | 1.350877193 | 1.964912281 | 0.697674419 | 118.0 | PEPTIDE4401{P.[Pr_Gly].L.[dL].[dP].[meL].F}$PEPTIDE4401,PEPTIDE4401,1:R1-7:R2$$$ | PEPTIDE4401{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4401,PEPTIDE4401,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4401 | null | null | 1.19e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.74143791 | 0.342755981 | 16.74143791 | 0.245675665 | 1.85809655 | 0.245675665 | -7.16653906 | -0.342755981 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_824 | -5.21 | 3.24235547 | -0.364135139 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.21 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4401 | null | 168.54 | 60.22 | 591.4947565 | 0.0 | 105.0717087 | -8.242369986 | -2.810849787 | -50.43104926 | -52.4356328 | -55.50715037 | -69.97274639 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
882996b59739b9fc4dc9b67b190bedfc12a65964613166c0ac39ca539e3282a1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,401 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'meL', 'F'] | 44 | 4402 | -5.07 | -5.07 | Circle | 8 | -3.08e-16 | -2.707636121 | -2.82e-16 | -2.860167341 | -1.3e-16 | -1.135354871 | 6.66e-16 | -0.249287767 | 3.083626329 | 4417.027602 | 116.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.771929825 | 1.350877193 | 1.964912281 | 0.697674419 | 113.0 | PEPTIDE4402{P.[Pr_Gly].[dL].L.[dP].[meL].F}$PEPTIDE4402,PEPTIDE4402,1:R1-7:R2$$$ | PEPTIDE4402{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4402,PEPTIDE4402,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4402 | null | null | 1.19e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.74143791 | 0.342755981 | 16.74143791 | 0.245675665 | 1.85809655 | 0.245675665 | -7.16653906 | -0.342755981 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_825 | -5.07 | 3.24235547 | -0.364135139 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.07 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'L', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4402 | null | 168.54 | 71.99 | 591.4947565 | 0.0 | 105.0717087 | -8.242369986 | -2.810849787 | -50.43104926 | -52.4356328 | -55.50715037 | -69.97274639 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
304df4c4ed6077c2e8a18f76ac1dfb4a9bdf29d6aa5315be0d30d3454f3b9df6 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,402 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'L', 'F'] | 43 | 4403 | -5.82 | -5.82 | Circle | 1 | -2.61e-16 | -2.718243534 | -2.52e-16 | -2.858444941 | -1.19e-16 | -1.135757491 | 1.03e-15 | -0.249287767 | 3.079347335 | 4417.027602 | 129.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.7964107 | 793.5101975 | 0.771929825 | 1.385964912 | 2.035087719 | 0.697674419 | 127.0 | PEPTIDE4403{P.[Pr_Gly].L.[meL].[dP].L.F}$PEPTIDE4403,PEPTIDE4403,1:R1-7:R2$$$ | PEPTIDE4403{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4403,PEPTIDE4403,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4403 | null | null | 5.67e+40 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.77887333 | 0.342747938 | 16.77887333 | 0.245675664 | 1.83753226 | 0.245675664 | -7.278035062 | -0.342747938 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_826 | -5.82 | 3.207839548 | -0.346244407 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.82 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4403 | null | 168.54 | 20.42 | 591.5290062 | 0.0 | 104.9517994 | -8.122460697 | -2.771298538 | -50.49687761 | -52.24334653 | -55.44120708 | -70.23894848 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
0b5e2e5611c686547985698b1efeb593536867c73a3b6de3550a9c1ebe924389 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,403 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'meL', 'F'] | 43 | 4404 | -5.7 | -5.7 | Circle | 3 | -3.08e-16 | -2.707636121 | -2.82e-16 | -2.860167341 | -1.3e-16 | -1.135354871 | 6.66e-16 | -0.249287767 | 3.083626329 | 4417.027602 | 129.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.22841493 | 47.54543216 | 14.20379138 | 9.601973316 | 9.601973316 | 5.884658425 | 5.884658425 | 3.733135368 | 3.733135368 | null | null | null | null | 304.7269446 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.771929825 | 1.350877193 | 1.964912281 | 0.697674419 | 126.0 | PEPTIDE4404{P.[Pr_Gly].L.L.[dP].[meL].F}$PEPTIDE4404,PEPTIDE4404,1:R1-7:R2$$$ | PEPTIDE4404{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4404,PEPTIDE4404,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4404 | null | null | 1.19e+41 | 9.28286508 | 20.78752478 | 12.01558543 | 433.0435372 | null | 16.74143791 | 0.342755981 | 16.74143791 | 0.245675665 | 1.85809655 | 0.245675665 | -7.16653906 | -0.342755981 | 2.883 | 217.2021 | 794.051 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_827 | -5.7 | 3.24235547 | -0.364135139 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 102.7480172 | 24.31672091 | null | -5.7 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.4269237 | 32.96326564 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 192.2386431 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4404 | null | 168.54 | 25.79 | 591.4947565 | 0.0 | 105.0717087 | -8.242369986 | -2.810849787 | -50.43104926 | -52.4356328 | -55.50715037 | -69.97274639 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.327611986 | null |
0d5a16ca39e90a786875e01b754ce86be0df896e09076371c73613d5f9e16dc3 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,404 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'dL', 'F'] | 50 | 4405 | -5.88 | -5.88 | Circle | 3 | -2.57e-16 | -2.726648893 | -2.86e-16 | -2.85804292 | -9.28e-17 | -1.136010649 | 6e-16 | -0.249287767 | 3.146474109 | 4525.662562 | 110.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 110.0 | PEPTIDE4405{P.[Pr_Gly].[Me_dL].[Me_dL].[dP].[dL].F}$PEPTIDE4405,PEPTIDE4405,1:R1-7:R2$$$ | PEPTIDE4405{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4405,PEPTIDE4405,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4405 | null | null | 9.63e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.97914699 | 0.342504271 | 16.97914699 | 0.245675664 | 1.859928093 | 0.245675664 | -7.419298319 | -0.342504271 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_828 | -5.88 | 3.020403693 | -0.251454402 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.88 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4405 | null | 159.75 | 17.78 | 611.895847 | 0.0 | 103.0895331 | -5.38420875 | -2.804428469 | -51.45611104 | -53.0473675 | -56.19512449 | -77.68147322 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
1c0c2ef3f6a5c714306aa9fe852c0fd5866ce4e0847ff91d83dac335d988ff33 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,405 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'Me_dL', 'F'] | 50 | 4406 | -5.22 | -5.22 | Circle | 1 | -2.6e-16 | -2.715100507 | -2.4e-16 | -2.853303128 | -9.83e-17 | -1.135673535 | 6.76e-16 | -0.249287767 | 3.147600908 | 4525.662562 | 103.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.293103448 | 1.862068966 | 0.704545455 | 111.0 | PEPTIDE4406{P.[Pr_Gly].[Me_dL].[dL].[dP].[Me_dL].F}$PEPTIDE4406,PEPTIDE4406,1:R1-7:R2$$$ | PEPTIDE4406{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4406,PEPTIDE4406,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4406 | null | null | 5.4e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.82852469 | 0.34249608 | 16.82852469 | 0.245675665 | 1.880492383 | 0.245675665 | -7.259148525 | -0.34249608 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_829 | -5.22 | 3.142152808 | -0.232940831 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.22 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4406 | null | 159.75 | 59.12 | 611.6917998 | 0.0 | 103.3464259 | -5.64110151 | -2.843979718 | -51.39028269 | -53.23965376 | -56.26106778 | -77.24547355 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
9b3c9a1223ddc77498dfc47a6d08d872c426b9215237becdd37e37a551e24b27 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,406 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'Me_dL', 'F'] | 49 | 4407 | -6.01 | -6.01 | Circle | 1 | -3.09e-16 | -2.719659456 | -2.24e-16 | -2.849786608 | -7.66e-17 | -1.135757659 | 6.31e-16 | -0.249287767 | 3.149977335 | 4525.662562 | 94.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.861858841 | 3.861858841 | null | null | null | null | 311.2928678 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 94.0 | PEPTIDE4407{P.[Pr_Gly].L.[Me_dL].[dP].[Me_dL].F}$PEPTIDE4407,PEPTIDE4407,1:R1-7:R2$$$ | PEPTIDE4407{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4407,PEPTIDE4407,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4407 | null | null | 1.55e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.94915395 | 0.342747938 | 16.94915395 | 0.245675665 | 1.875984969 | 0.245675665 | -7.3772857 | -0.342747938 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_830 | -6.01 | 3.126780557 | -0.205327385 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -6.01 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4407 | null | 159.75 | 13.58 | 611.9700896 | 0.0 | 103.2473734 | -5.54204904 | -2.836161578 | -51.45167864 | -53.32793395 | -56.31759532 | -77.32537779 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
be474a71ec7d49ecf2c70078febb42f50a1bfa7ac7ff4a612811abbea891646e | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,407 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'dL', 'F'] | 48 | 4408 | -5.29 | -5.29 | Circle | 7 | -2.57e-16 | -2.726648893 | -2.86e-16 | -2.85804292 | -9.28e-17 | -1.136010649 | 6e-16 | -0.249287767 | 3.146474109 | 4525.662562 | 107.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 108.0 | PEPTIDE4408{P.[Pr_Gly].[Me_dL].[meL].[dP].[dL].F}$PEPTIDE4408,PEPTIDE4408,1:R1-7:R2$$$ | PEPTIDE4408{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4408,PEPTIDE4408,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4408 | null | null | 9.63e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.97914699 | 0.342504271 | 16.97914699 | 0.245675664 | 1.859928093 | 0.245675664 | -7.419298319 | -0.342504271 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_831 | -5.29 | 3.020403693 | -0.251454402 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.29 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4408 | null | 159.75 | 53.18 | 611.895847 | 0.0 | 103.0895331 | -5.38420875 | -2.804428469 | -51.45611104 | -53.0473675 | -56.19512449 | -77.68147322 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
8938cb50eca506278dada257605d4fa1f5071d2becb3003e67322a989958c7d4 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,408 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'L', 'dP', 'Me_dL', 'F'] | 49 | 4409 | -5.2 | -5.2 | Circle | 3 | -2.6e-16 | -2.715100507 | -2.4e-16 | -2.853303128 | -9.83e-17 | -1.135673535 | 6.76e-16 | -0.249287767 | 3.147600908 | 4525.662562 | 115.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.293103448 | 1.862068966 | 0.704545455 | 115.0 | PEPTIDE4409{P.[Pr_Gly].[Me_dL].L.[dP].[Me_dL].F}$PEPTIDE4409,PEPTIDE4409,1:R1-7:R2$$$ | PEPTIDE4409{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4409,PEPTIDE4409,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4409 | null | null | 5.4e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.82852469 | 0.34249608 | 16.82852469 | 0.245675665 | 1.880492383 | 0.245675665 | -7.259148525 | -0.34249608 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_832 | -5.2 | 3.142152808 | -0.232940831 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.2 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'L', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4409 | null | 159.75 | 60.72 | 611.6917998 | 0.0 | 103.3464259 | -5.64110151 | -2.843979718 | -51.39028269 | -53.23965376 | -56.26106778 | -77.24547355 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
b66921c7f24dcb12b37aaa0173182e1d7d3594d079f5ba5db3fc7e3c3ce0c8c1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,409 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'Me_dL', 'F'] | 48 | 4410 | -5.36 | -5.36 | Circle | 6 | -3.09e-16 | -2.719659456 | -2.24e-16 | -2.849786608 | -7.66e-17 | -1.135757659 | 6.31e-16 | -0.249287767 | 3.149977335 | 4525.662562 | 113.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.861858841 | 3.861858841 | null | null | null | null | 311.2928678 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 111.0 | PEPTIDE4410{P.[Pr_Gly].[dL].[meL].[dP].[Me_dL].F}$PEPTIDE4410,PEPTIDE4410,1:R1-7:R2$$$ | PEPTIDE4410{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4410,PEPTIDE4410,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4410 | null | null | 1.55e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.94915395 | 0.342747938 | 16.94915395 | 0.245675665 | 1.875984969 | 0.245675665 | -7.3772857 | -0.342747938 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_833 | -5.36 | 3.126780557 | -0.205327385 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.36 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4410 | null | 159.75 | 47.84 | 611.9700896 | 0.0 | 103.2473734 | -5.54204904 | -2.836161578 | -51.45167864 | -53.32793395 | -56.31759532 | -77.32537779 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
00dae711178fd75fe3b0538226252e655db7c29be886b470f7b79b6c4d2db3cb | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,410 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'dL', 'F'] | 48 | 4411 | -5.0 | -5 | Circle | 3 | -2.57e-16 | -2.726648893 | -2.86e-16 | -2.85804292 | -9.28e-17 | -1.136010649 | 6e-16 | -0.249287767 | 3.146474109 | 4525.662562 | 119.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 116.0 | PEPTIDE4411{P.[Pr_Gly].[meL].[Me_dL].[dP].[dL].F}$PEPTIDE4411,PEPTIDE4411,1:R1-7:R2$$$ | PEPTIDE4411{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4411,PEPTIDE4411,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4411 | null | null | 9.63e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.97914699 | 0.342504271 | 16.97914699 | 0.245675664 | 1.859928093 | 0.245675664 | -7.419298319 | -0.342504271 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_834 | -5.0 | 3.020403693 | -0.251454402 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.0 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4411 | null | 159.75 | 77.92 | 611.895847 | 0.0 | 103.0895331 | -5.38420875 | -2.804428469 | -51.45611104 | -53.0473675 | -56.19512449 | -77.68147322 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
93dc19b03bfb4feb9c81f581dbb1a84556b2e99610fd8f0ca3c29b44d841b29a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,411 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'L', 'F'] | 49 | 4412 | -5.57 | -5.57 | Circle | 7 | -2.57e-16 | -2.726648893 | -2.86e-16 | -2.85804292 | -9.28e-17 | -1.136010649 | 6e-16 | -0.249287767 | 3.146474109 | 4525.662562 | 112.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 110.0 | PEPTIDE4412{P.[Pr_Gly].[Me_dL].[Me_dL].[dP].L.F}$PEPTIDE4412,PEPTIDE4412,1:R1-7:R2$$$ | PEPTIDE4412{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4412,PEPTIDE4412,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4412 | null | null | 9.63e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.97914699 | 0.342504271 | 16.97914699 | 0.245675664 | 1.859928093 | 0.245675664 | -7.419298319 | -0.342504271 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_835 | -5.57 | 3.020403693 | -0.251454402 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.57 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4412 | null | 159.75 | 33.3 | 611.895847 | 0.0 | 103.0895331 | -5.38420875 | -2.804428469 | -51.45611104 | -53.0473675 | -56.19512449 | -77.68147322 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
2757722e18c66172cc1eff72359ac1b6e6614ba6c52485ee2754c26fb01f0891 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,412 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'dL', 'F'] | 48 | 4413 | -5.88 | -5.88 | Circle | 7 | -2.56e-16 | -2.688903928 | -1.21e-16 | -2.855811484 | -3.12e-17 | -1.134688709 | 1.67e-15 | -0.249287762 | 2.556048219 | 4591.267362 | 134.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.89511985 | 3.89511985 | null | null | null | null | 314.5318228 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.728813559 | 1.338983051 | 2.0 | 0.577777778 | 129.0 | PEPTIDE4413{P.[Pr_Gly].[dL].[Bn_Gly].[dP].[dL].F}$PEPTIDE4413,PEPTIDE4413,1:R1-7:R2$$$ | PEPTIDE4413{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4413,PEPTIDE4413,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4413 | null | null | 1.07e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.67811084 | 0.342747692 | 16.67811084 | 0.245675664 | 1.7958195 | 0.245675664 | -6.876290595 | -0.342747692 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_836 | -5.88 | 4.120274895 | 1.073467373 | 35.52907898 | 36.58632203 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 35.28278936 | null | -5.88 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4413 | null | 168.54 | 17.98 | 558.7289537 | 0.0 | 105.055288 | -7.714469237 | -5.40920125 | -42.56587054 | -54.47325978 | -47.53045646 | -63.92431778 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
3690784c5b23934f0640d66666daf912fa5deac07df957ad652e1c74c79cf376 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,413 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'Bn_Gly', 'F'] | 48 | 4414 | -5.57 | -5.57 | Circle | 8 | -2.31e-16 | -2.703362032 | -1.5e-16 | -2.858878462 | -1.14e-16 | -1.135353889 | 1.66e-15 | -0.249287767 | 2.559983955 | 4591.267362 | 119.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.9230707 | 3.9230707 | null | null | null | null | 314.5318228 | 30.2799388 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 813.4788974 | 0.711864407 | 1.220338983 | 1.796610169 | 0.577777778 | 123.0 | PEPTIDE4414{P.[Pr_Gly].[dL].[dL].[dP].[Bn_Gly].F}$PEPTIDE4414,PEPTIDE4414,1:R1-7:R2$$$ | PEPTIDE4414{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4414,PEPTIDE4414,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4414 | null | null | 1.18e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.68079741 | 0.342755981 | 16.68079741 | 0.245675463 | 1.761755271 | 0.245675463 | -6.966384841 | -0.342755981 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_837 | -5.57 | 3.965098616 | 1.233709474 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 41.77964905 | null | -5.57 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4414 | null | 168.54 | 33.03 | 558.5566194 | 0.0 | 105.1297509 | -7.78893208 | -5.275617094 | -42.67874546 | -54.19837048 | -47.66843308 | -63.90960544 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
3fa181b7c5b854ea50f71ec48188b89be1cc42b2139eb266b3e42df6470e0695 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,415 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'meL', 'F'] | 47 | 4416 | -5.73 | -5.73 | Circle | 4 | -3.09e-16 | -2.719659456 | -2.24e-16 | -2.849786608 | -7.66e-17 | -1.135757659 | 6.31e-16 | -0.249287767 | 3.149977335 | 4525.662562 | 102.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.861858841 | 3.861858841 | null | null | null | null | 311.2928678 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 102.0 | PEPTIDE4416{P.[Pr_Gly].L.[Me_dL].[dP].[meL].F}$PEPTIDE4416,PEPTIDE4416,1:R1-7:R2$$$ | PEPTIDE4416{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4416,PEPTIDE4416,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4416 | null | null | 1.55e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.94915395 | 0.342747938 | 16.94915395 | 0.245675665 | 1.875984969 | 0.245675665 | -7.3772857 | -0.342747938 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_839 | -5.73 | 3.126780557 | -0.205327385 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.73 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4416 | null | 159.75 | 24.47 | 611.9700896 | 0.0 | 103.2473734 | -5.54204904 | -2.836161578 | -51.45167864 | -53.32793395 | -56.31759532 | -77.32537779 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
de512aff72c05040a1595d5c6bcbb96fc066a74e4de15d2c2e12ff7c09340894 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,416 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'L', 'dP', 'Me_dL', 'F'] | 47 | 4417 | -5.16 | -5.16 | Circle | 9 | -2.6e-16 | -2.715100507 | -2.4e-16 | -2.853303128 | -9.83e-17 | -1.135673535 | 6.76e-16 | -0.249287767 | 3.147600908 | 4525.662562 | 100.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.293103448 | 1.862068966 | 0.704545455 | 102.0 | PEPTIDE4417{P.[Pr_Gly].[meL].L.[dP].[Me_dL].F}$PEPTIDE4417,PEPTIDE4417,1:R1-7:R2$$$ | PEPTIDE4417{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4417,PEPTIDE4417,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4417 | null | null | 5.4e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.82852469 | 0.34249608 | 16.82852469 | 0.245675665 | 1.880492383 | 0.245675665 | -7.259148525 | -0.34249608 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_840 | -5.16 | 3.142152808 | -0.232940831 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.16 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'L', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4417 | null | 159.75 | 64.33 | 611.6917998 | 0.0 | 103.3464259 | -5.64110151 | -2.843979718 | -51.39028269 | -53.23965376 | -56.26106778 | -77.24547355 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
87920fe9c09efaa69e15fe2f846c52d688d2e816c84b2c02bb6a68c7246cd0d6 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,418 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'L', 'dP', 'meL', 'F'] | 47 | 4419 | -4.97 | -4.97 | Circle | 8 | -2.6e-16 | -2.715100507 | -2.4e-16 | -2.853303128 | -9.83e-17 | -1.135673535 | 6.76e-16 | -0.249287767 | 3.147600908 | 4525.662562 | 122.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.833907991 | 3.833907991 | null | null | null | null | 311.2928678 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 69.90868636 | 807.5258475 | 0.75862069 | 1.293103448 | 1.862068966 | 0.704545455 | 126.0 | PEPTIDE4419{P.[Pr_Gly].[Me_dL].L.[dP].[meL].F}$PEPTIDE4419,PEPTIDE4419,1:R1-7:R2$$$ | PEPTIDE4419{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4419,PEPTIDE4419,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4419 | null | null | 5.4e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.82852469 | 0.34249608 | 16.82852469 | 0.245675665 | 1.880492383 | 0.245675665 | -7.259148525 | -0.34249608 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_842 | -4.97 | 3.142152808 | -0.232940831 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -4.97 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'L', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4419 | null | 159.75 | 79.81 | 611.6917998 | 0.0 | 103.3464259 | -5.64110151 | -2.843979718 | -51.39028269 | -53.23965376 | -56.26106778 | -77.24547355 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
f8102d5dbec7294d33e8cf1c24b16b5a115d4de17e061d36b890069b529bfada | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,419 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'meL', 'F'] | 46 | 4420 | -5.07 | -5.07 | Circle | 3 | -3.09e-16 | -2.719659456 | -2.24e-16 | -2.849786608 | -7.66e-17 | -1.135757659 | 6.31e-16 | -0.249287767 | 3.149977335 | 4525.662562 | 111.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.861858841 | 3.861858841 | null | null | null | null | 311.2928678 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 125.0 | PEPTIDE4420{P.[Pr_Gly].[dL].[meL].[dP].[meL].F}$PEPTIDE4420,PEPTIDE4420,1:R1-7:R2$$$ | PEPTIDE4420{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4420,PEPTIDE4420,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4420 | null | null | 1.55e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.94915395 | 0.342747938 | 16.94915395 | 0.245675665 | 1.875984969 | 0.245675665 | -7.3772857 | -0.342747938 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_843 | -5.07 | 3.126780557 | -0.205327385 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.07 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4420 | null | 159.75 | 72.16 | 611.9700896 | 0.0 | 103.2473734 | -5.54204904 | -2.836161578 | -51.45167864 | -53.32793395 | -56.31759532 | -77.32537779 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
5f8ace5ff467126c686dc35a0981115481daaefcb1c468504acdaf71584db436 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,420 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'dL', 'F'] | 47 | 4421 | -10.0 | -10 | Circle | 9 | -2.11e-16 | -2.689862864 | -1.88e-16 | -2.858762616 | -3.51e-17 | -1.134655901 | 1.24e-15 | -0.249287762 | 2.557093046 | 4591.267362 | 123.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.89511985 | 3.89511985 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.5318228 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.728813559 | 1.305084746 | 1.949152542 | 0.577777778 | 124.0 | PEPTIDE4421{P.[Pr_Gly].[Bn_Gly].L.[dP].[dL].F}$PEPTIDE4421,PEPTIDE4421,1:R1-7:R2$$$ | PEPTIDE4421{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4421,PEPTIDE4421,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4421 | null | null | 9.43e+39 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.70096588 | 0.342747538 | 16.70096588 | 0.245675664 | 1.767790083 | 0.245675664 | -6.827995372 | -0.342747538 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_844 | -10.0 | 4.144433648 | 1.194917434 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 41.77964905 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4421 | null | 168.54 | 0.0 | 558.6003223 | 0.0 | 105.0713227 | -7.730503857 | -5.363829964 | -42.54209372 | -54.43110316 | -47.6614196 | -63.77602801 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
4bb2a86d86f3891293807278c06a6d7394a22ae7a368ab51ed05055f187c386b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,421 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'L', 'F'] | 47 | 4422 | -10.0 | -10 | Circle | 7 | -2.56e-16 | -2.688903928 | -1.21e-16 | -2.855811484 | -3.12e-17 | -1.134688709 | 1.67e-15 | -0.249287762 | 2.556048219 | 4591.267362 | 132.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.89511985 | 3.89511985 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.5318228 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.728813559 | 1.338983051 | 2.0 | 0.577777778 | 133.0 | PEPTIDE4422{P.[Pr_Gly].[dL].[Bn_Gly].[dP].L.F}$PEPTIDE4422,PEPTIDE4422,1:R1-7:R2$$$ | PEPTIDE4422{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4422,PEPTIDE4422,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4422 | null | null | 1.07e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.67811084 | 0.342747692 | 16.67811084 | 0.245675664 | 1.7958195 | 0.245675664 | -6.876290595 | -0.342747692 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_845 | -10.0 | 4.120274895 | 1.073467373 | 35.52907898 | 36.58632203 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 35.28278936 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4422 | null | 168.54 | 0.0 | 558.7289537 | 0.0 | 105.055288 | -7.714469237 | -5.40920125 | -42.56587054 | -54.47325978 | -47.53045646 | -63.92431778 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
52447fd60b1c5860ad941176d641fd6fb27fc7f53a80159ccd83aa31cc1d21da | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,422 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'dL', 'F'] | 47 | 4423 | -6.65 | -6.65 | Circle | 7 | -2.56e-16 | -2.688903928 | -1.21e-16 | -2.855811484 | -3.12e-17 | -1.134688709 | 1.67e-15 | -0.249287762 | 2.556048219 | 4591.267362 | 128.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.89511985 | 3.89511985 | null | null | null | null | 314.5318228 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.728813559 | 1.338983051 | 2.0 | 0.577777778 | 128.0 | PEPTIDE4423{P.[Pr_Gly].L.[Bn_Gly].[dP].[dL].F}$PEPTIDE4423,PEPTIDE4423,1:R1-7:R2$$$ | PEPTIDE4423{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4423,PEPTIDE4423,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4423 | null | null | 1.07e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.67811084 | 0.342747692 | 16.67811084 | 0.245675664 | 1.7958195 | 0.245675664 | -6.876290595 | -0.342747692 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_846 | -6.65 | 4.120274895 | 1.073467373 | 35.52907898 | 36.58632203 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 35.28278936 | null | -6.65 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4423 | null | 168.54 | 3.32 | 558.7289537 | 0.0 | 105.055288 | -7.714469237 | -5.40920125 | -42.56587054 | -54.47325978 | -47.53045646 | -63.92431778 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
9669623b13c48f777b9b1af7d33e0a6c3c5209e48a4efcb1aea77a543144ff46 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,423 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'Bn_Gly', 'F'] | 47 | 4424 | -5.69 | -5.69 | Circle | 4 | -2.31e-16 | -2.703362032 | -1.5e-16 | -2.858878462 | -1.14e-16 | -1.135353889 | 1.66e-15 | -0.249287767 | 2.559983955 | 4591.267362 | 122.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.9230707 | 3.9230707 | null | null | null | null | 314.5318228 | 30.2799388 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 813.4788974 | 0.711864407 | 1.220338983 | 1.796610169 | 0.577777778 | 117.0 | PEPTIDE4424{P.[Pr_Gly].L.[dL].[dP].[Bn_Gly].F}$PEPTIDE4424,PEPTIDE4424,1:R1-7:R2$$$ | PEPTIDE4424{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4424,PEPTIDE4424,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4424 | null | null | 1.18e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.68079741 | 0.342755981 | 16.68079741 | 0.245675463 | 1.761755271 | 0.245675463 | -6.966384841 | -0.342755981 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_847 | -5.69 | 3.965098616 | 1.233709474 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 41.77964905 | null | -5.69 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4424 | null | 168.54 | 26.19 | 558.5566194 | 0.0 | 105.1297509 | -7.78893208 | -5.275617094 | -42.67874546 | -54.19837048 | -47.66843308 | -63.90960544 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
c5028daac3bf3dd522e9d298b593f3378e606826319728764f242cd0d3dcd869 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,425 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'meL', 'F'] | 45 | 4426 | -5.09 | -5.09 | Circle | 2 | -3.09e-16 | -2.719659456 | -2.24e-16 | -2.849786608 | -7.66e-17 | -1.135757659 | 6.31e-16 | -0.249287767 | 3.149977335 | 4525.662562 | 112.0 | null | null | 103.0470054 | 96.9882332 | 27.9882332 | 54.43973979 | 48.82182536 | 14.42739817 | 9.825580114 | 9.825580114 | 6.09800707 | 6.09800707 | 3.861858841 | 3.861858841 | null | null | null | null | 311.2928678 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.16716925 | 807.5258475 | 0.75862069 | 1.344827586 | 1.965517241 | 0.704545455 | 112.0 | PEPTIDE4426{P.[Pr_Gly].L.[meL].[dP].[meL].F}$PEPTIDE4426,PEPTIDE4426,1:R1-7:R2$$$ | PEPTIDE4426{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4426,PEPTIDE4426,1:R1-7:R2$$$ | -4.49 | 58 | 738.526 | 4426 | null | null | 1.55e+42 | 9.366176303 | 20.97023666 | 11.58418588 | 442.3703352 | null | 16.94915395 | 0.342747938 | 16.94915395 | 0.245675665 | 1.875984969 | 0.245675665 | -7.3772857 | -0.342747938 | 3.2252 | 221.8294 | 808.078 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 19 | 0 | 3 | 3 | 322 | hepta_849 | -5.09 | 3.126780557 | -0.205327385 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 113.8361198 | 24.31672091 | null | -5.09 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.4269237 | 39.93909254 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 196.3509188 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4426 | null | 159.75 | 70.58 | 611.9700896 | 0.0 | 103.2473734 | -5.54204904 | -2.836161578 | -51.45167864 | -53.32793395 | -56.31759532 | -77.32537779 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367564368 | null |
7d7876daf00bff90c5ba9c1f47e6bff0569e7034266c1866713e82a4c30cc9a5 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,427 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'L', 'F'] | 46 | 4428 | -10.0 | -10 | Circle | 5 | -2.56e-16 | -2.688903928 | -1.21e-16 | -2.855811484 | -3.12e-17 | -1.134688709 | 1.67e-15 | -0.249287762 | 2.556048219 | 4591.267362 | 137.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.89511985 | 3.89511985 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.5318228 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.728813559 | 1.338983051 | 2.0 | 0.577777778 | 130.0 | PEPTIDE4428{P.[Pr_Gly].L.[Bn_Gly].[dP].L.F}$PEPTIDE4428,PEPTIDE4428,1:R1-7:R2$$$ | PEPTIDE4428{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4428,PEPTIDE4428,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4428 | null | null | 1.07e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.67811084 | 0.342747692 | 16.67811084 | 0.245675664 | 1.7958195 | 0.245675664 | -6.876290595 | -0.342747692 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_851 | -10.0 | 4.120274895 | 1.073467373 | 35.52907898 | 36.58632203 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 35.28278936 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4428 | null | 168.54 | 0.0 | 558.7289537 | 0.0 | 105.055288 | -7.714469237 | -5.40920125 | -42.56587054 | -54.47325978 | -47.53045646 | -63.92431778 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
1eaab5a65efaecd984d637356d3336eb6b807e0bd9a08ae99d1fb5c45125fcf9 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,428 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'Bn_Gly', 'F'] | 46 | 4429 | -5.52 | -5.52 | Circle | 9 | -2.31e-16 | -2.703362032 | -1.5e-16 | -2.858878462 | -1.14e-16 | -1.135353889 | 1.66e-15 | -0.249287767 | 2.559983955 | 4591.267362 | 138.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.90384141 | 46.29543216 | 14.95379138 | 9.976973316 | 9.976973316 | 6.146127389 | 6.146127389 | 3.9230707 | 3.9230707 | null | null | null | null | 314.5318228 | 30.2799388 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 813.4788974 | 0.711864407 | 1.220338983 | 1.796610169 | 0.577777778 | 141.0 | PEPTIDE4429{P.[Pr_Gly].L.L.[dP].[Bn_Gly].F}$PEPTIDE4429,PEPTIDE4429,1:R1-7:R2$$$ | PEPTIDE4429{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4429,PEPTIDE4429,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4429 | null | null | 1.18e+40 | 10.24948353 | 21.12417372 | 12.13922697 | 437.020981 | null | 16.68079741 | 0.342755981 | 16.68079741 | 0.245675463 | 1.761755271 | 0.245675463 | -6.966384841 | -0.342755981 | 3.0387 | 223.0481 | 814.041 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_852 | -5.52 | 3.965098616 | 1.233709474 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 85.81994733 | 41.77964905 | null | -5.52 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.8291818 | 32.48429842 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'L', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 172.2423512 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4429 | null | 168.54 | 36.19 | 558.5566194 | 0.0 | 105.1297509 | -7.78893208 | -5.275617094 | -42.67874546 | -54.19837048 | -47.66843308 | -63.90960544 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33164421 | null |
7ba00bc17c62c7896090075ba0c02c765243a123fa46ba1ad83f735161463830 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,429 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'Me_dL', 'F'] | 51 | 4430 | -4.96 | -4.96 | Circle | 9 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 104.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 93.0 | PEPTIDE4430{P.[Pr_Gly].[Me_dL].[meL].[dP].[Me_dL].F}$PEPTIDE4430,PEPTIDE4430,1:R1-7:R2$$$ | PEPTIDE4430{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4430,PEPTIDE4430,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4430 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_853 | -4.96 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -4.96 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4430 | null | 150.96 | 80.71 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
cbcdae8176d1fe77658b806640251f17f24435aef4407019e70ff4d2b2061354 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,430 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'meL', 'F'] | 51 | 4431 | -5.13 | -5.13 | Circle | 2 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 99.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 87.0 | PEPTIDE4431{P.[Pr_Gly].[Me_dL].[Me_dL].[dP].[meL].F}$PEPTIDE4431,PEPTIDE4431,1:R1-7:R2$$$ | PEPTIDE4431{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4431,PEPTIDE4431,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4431 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_854 | -5.13 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -5.13 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Me_dL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4431 | null | 150.96 | 67.39 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
df5e91720f285b9c9c55bb0f06e9893cd4289e4a7cedabbd49fddddfde9f59db | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,431 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'Me_dL', 'F'] | 51 | 4432 | -5.29 | -5.29 | Circle | 7 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 109.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 108.0 | PEPTIDE4432{P.[Pr_Gly].[meL].[Me_dL].[dP].[Me_dL].F}$PEPTIDE4432,PEPTIDE4432,1:R1-7:R2$$$ | PEPTIDE4432{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4432,PEPTIDE4432,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4432 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_855 | -5.29 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -5.29 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4432 | null | 150.96 | 53.77 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
effac625d1d2f5cf4504b375bbb41e7abe236facd29016bb9afd53b5000dff98 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,432 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | 51 | 4433 | -5.74 | -5.74 | Circle | 8 | -2.28e-16 | -2.700506149 | -1.2e-16 | -2.846554605 | 4.11e-17 | -1.134996664 | 1.68e-15 | -0.249287762 | 2.613427182 | 4700.535999 | 116.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 827.4945474 | 0.766666667 | 1.4 | 2.05 | 0.586956522 | 105.0 | PEPTIDE4433{P.[Pr_Gly].[dL].[Bn_Gly].[dP].[Me_dL].F}$PEPTIDE4433,PEPTIDE4433,1:R1-7:R2$$$ | PEPTIDE4433{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4433,PEPTIDE4433,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4433 | null | null | 2.11e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.77560425 | 0.342747692 | 16.77560425 | 0.245675665 | 1.825221797 | 0.245675665 | -7.072694432 | -0.342747692 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_856 | -5.74 | 4.098020867 | 1.151417239 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 35.28278936 | null | -5.74 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4433 | null | 159.75 | 23.6 | 578.9696805 | 0.0 | 103.5015196 | -5.284715199 | -5.519208918 | -43.45446787 | -55.6305929 | -48.32654955 | -70.83899898 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
8ca06e3a46bebc39b26e2333d3369c66b2cbc09eea2bc0d2aa8b8ccffcd5d69d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,433 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | 51 | 4434 | -5.88 | -5.88 | Circle | 8 | -2.18e-16 | -2.717931349 | -1.14e-16 | -2.84788271 | 1.13e-16 | -1.135756046 | 1.9e-15 | -0.249287767 | 2.617045627 | 4700.535999 | 127.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.051794172 | 4.051794172 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 124.0 | PEPTIDE4434{P.[Pr_Gly].[dL].[Me_dL].[dP].[Bn_Gly].F}$PEPTIDE4434,PEPTIDE4434,1:R1-7:R2$$$ | PEPTIDE4434{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4434,PEPTIDE4434,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4434 | null | null | 9.02e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.95747739 | 0.342747938 | 16.95747739 | 0.245675463 | 1.77964369 | 0.245675463 | -7.252843174 | -0.342747938 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_857 | -5.88 | 3.873243942 | 1.352641409 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.88 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4434 | null | 159.75 | 17.75 | 578.9791719 | 0.0 | 103.3956544 | -5.178849995 | -5.346073514 | -43.65224158 | -55.19646427 | -48.42340281 | -71.16112749 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
2b5cac9ec81d198e2b067d15dc09fe7ca48fc12fa470b72a871bcfeb83dc71d2 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,434 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'dL', 'F'] | 51 | 4435 | -6.27 | -6.27 | Circle | 4 | -1.87e-16 | -2.702295707 | -1.42e-16 | -2.857569688 | 1.85e-17 | -1.134956894 | 1.47e-15 | -0.249287762 | 2.611520038 | 4700.535999 | 110.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 3.995892473 | 3.995892473 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.75 | 1.35 | 2.0 | 0.586956522 | 106.0 | PEPTIDE4435{P.[Pr_Gly].[Bn_Gly].[Me_dL].[dP].[dL].F}$PEPTIDE4435,PEPTIDE4435,1:R1-7:R2$$$ | PEPTIDE4435{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4435,PEPTIDE4435,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4435 | null | null | 2.36e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.75376747 | 0.342504271 | 16.75376747 | 0.245675664 | 1.812934712 | 0.245675664 | -7.07506647 | -0.342504271 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_858 | -6.27 | 3.970500553 | 1.163386938 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 35.28278936 | null | -6.27 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4435 | null | 159.75 | 7.64 | 578.7412756 | 0.0 | 103.4595665 | -5.242762091 | -5.468861144 | -43.43729793 | -55.39005744 | -48.30936455 | -70.93583231 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
979698d989ee5fa88d695deec6db5fbf9addad6454a05250dca9ca3410be8b9d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,436 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'Bn_Gly', 'F'] | 51 | 4437 | -5.21 | -5.21 | Circle | 7 | -2.43e-16 | -2.713922197 | -1.06e-16 | -2.849340844 | 1.42e-17 | -1.135661617 | 1.87e-15 | -0.249287767 | 2.615463999 | 4700.535999 | 109.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.766666667 | 1.35 | 1.95 | 0.586956522 | 107.0 | PEPTIDE4437{P.[Pr_Gly].[Me_dL].[dL].[dP].[Bn_Gly].F}$PEPTIDE4437,PEPTIDE4437,1:R1-7:R2$$$ | PEPTIDE4437{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4437,PEPTIDE4437,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4437 | null | null | 1.11e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.77347855 | 0.34249608 | 16.77347855 | 0.245675463 | 1.784151105 | 0.245675463 | -7.185677976 | -0.34249608 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_860 | -5.21 | 4.012773495 | 1.309833891 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.21 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4437 | null | 159.75 | 60.49 | 578.7220613 | 0.0 | 103.4601226 | -5.243318189 | -5.337578084 | -43.60711155 | -55.07723396 | -48.38714187 | -71.11313358 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
50273d6e125afbcdebcdee5df1ba5f26ec3cd06a0b5f44efb7703542d48d198c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,437 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'meL', 'F'] | 49 | 4438 | -4.97 | -4.97 | Circle | 7 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 100.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 95.0 | PEPTIDE4438{P.[Pr_Gly].[meL].[Me_dL].[dP].[meL].F}$PEPTIDE4438,PEPTIDE4438,1:R1-7:R2$$$ | PEPTIDE4438{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4438,PEPTIDE4438,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4438 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_861 | -4.97 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -4.97 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4438 | null | 150.96 | 80.18 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
06ebcd8322014b7e07d31e09176745a6baeae49667268a74fca8d4957943644a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,438 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'meL', 'F'] | 49 | 4439 | -4.96 | -4.96 | Circle | 6 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 107.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 108.0 | PEPTIDE4439{P.[Pr_Gly].[Me_dL].[meL].[dP].[meL].F}$PEPTIDE4439,PEPTIDE4439,1:R1-7:R2$$$ | PEPTIDE4439{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4439,PEPTIDE4439,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4439 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_862 | -4.96 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -4.96 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'meL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4439 | null | 150.96 | 80.87 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
9c27c2982413686874ca9b9bcea699f028fb8e557c1c52b2902352a2ce43a61c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,439 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'meL', 'dP', 'Me_dL', 'F'] | 49 | 4440 | -5.16 | -5.16 | Circle | 3 | -2.79e-16 | -2.727340681 | -2.63e-16 | -2.848153499 | -1.04e-16 | -1.136011021 | 5.23e-16 | -0.249287767 | 3.215273717 | 4634.65073 | 100.0 | null | null | 105.5470054 | 99.4882332 | 28.4882332 | 55.65106466 | 50.09821857 | 14.65100497 | 10.04918691 | 10.04918691 | 6.311355714 | 6.311355714 | 3.962631464 | 3.962631464 | null | null | null | null | 317.8587911 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 821.5414976 | 0.745762712 | 1.288135593 | 1.86440678 | 0.711111111 | 96.0 | PEPTIDE4440{P.[Pr_Gly].[meL].[meL].[dP].[Me_dL].F}$PEPTIDE4440,PEPTIDE4440,1:R1-7:R2$$$ | PEPTIDE4440{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4440,PEPTIDE4440,1:R1-7:R2$$$ | -4.49 | 59 | 750.537 | 4440 | null | null | 2.89e+43 | 9.450879737 | 21.15641221 | 11.62558706 | 451.6971332 | null | 17.08182177 | 0.342180206 | 17.08182177 | 0.245675665 | 1.898380802 | 0.245675665 | -7.50271087 | -0.342180206 | 3.5674 | 226.4567 | 822.105 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 1 | 14 | 0 | 20 | 0 | 3 | 3 | 328 | hepta_863 | -5.16 | 2.915916108 | -0.038480107 | 34.70927174 | 36.10735481 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 78.17533836 | 74.22872376 | 124.9242224 | 24.31672091 | null | -5.16 | null | null | null | null | null | null | null | null | null | null | 4 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 130.9267013 | 41.35025811 | 0.0 | 34.70927174 | 17.68187306 | 141.4269237 | 46.91491944 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'meL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 153.7719907 | 39.93468519 | 17.68187306 | 200.4631945 | 30.21209354 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4440 | null | 150.96 | 64.17 | 632.4179832 | 0.0 | 101.3220905 | -2.740780564 | -2.869291509 | -52.41091208 | -54.13195492 | -57.07151272 | -84.8489553 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.379469306 | null |
578ac9048b3fe8cac1fae36999b362c88ebb415cbcca8bcd90f1189a7079d9d1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,440 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'L', 'F'] | 50 | 4441 | -7.28 | -7.28 | Circle | 6 | -1.87e-16 | -2.702295707 | -1.42e-16 | -2.857569688 | 1.85e-17 | -1.134956894 | 1.47e-15 | -0.249287762 | 2.611520038 | 4700.535999 | 123.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 3.995892473 | 3.995892473 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.75 | 1.35 | 2.0 | 0.586956522 | 122.0 | PEPTIDE4441{P.[Pr_Gly].[Bn_Gly].[Me_dL].[dP].L.F}$PEPTIDE4441,PEPTIDE4441,1:R1-7:R2$$$ | PEPTIDE4441{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4441,PEPTIDE4441,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4441 | null | null | 2.36e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.75376747 | 0.342504271 | 16.75376747 | 0.245675664 | 1.812934712 | 0.245675664 | -7.07506647 | -0.342504271 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_864 | -7.28 | 3.970500553 | 1.163386938 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 35.28278936 | null | -7.28 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4441 | null | 159.75 | 0.78 | 578.7412756 | 0.0 | 103.4595665 | -5.242762091 | -5.468861144 | -43.43729793 | -55.39005744 | -48.30936455 | -70.93583231 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
14fd52156e708cbeb0afdf795669cc7c8c7b0de213927a848e51847bf6b6cfb7 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,441 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'L', 'F'] | 50 | 4442 | -7.05 | -7.05 | Circle | 3 | -2.09e-16 | -2.705217473 | -1.55e-16 | -2.855748311 | -2.16e-17 | -1.134989109 | 1.28e-15 | -0.249287762 | 2.612896707 | 4700.535999 | 116.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 3.995892473 | 3.995892473 | null | null | null | null | 321.097746 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 827.4945474 | 0.75 | 1.366666667 | 2.033333333 | 0.586956522 | 115.0 | PEPTIDE4442{P.[Pr_Gly].[Me_dL].[Bn_Gly].[dP].L.F}$PEPTIDE4442,PEPTIDE4442,1:R1-7:R2$$$ | PEPTIDE4442{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4442,PEPTIDE4442,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4442 | null | null | 1.6099999999999998e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.99477751 | 0.342504272 | 16.99477751 | 0.245675664 | 1.818215333 | 0.245675664 | -7.162748928 | -0.342504272 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_865 | -7.05 | 3.894526355 | 1.15755985 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 35.28278936 | null | -7.05 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4442 | null | 159.75 | 1.34 | 578.9919183 | 0.0 | 103.3645635 | -5.147759056 | -5.522050569 | -43.44480884 | -55.43413369 | -48.18512323 | -71.20593978 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
d439374aff4d34c3171c470985892485a12220c54910958678f417323f6c197c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,442 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'dL', 'F'] | 45 | 4443 | -6.5 | -6.5 | Circle | 2 | -1.95e-16 | -2.694347706 | -8.19e-17 | -2.866058496 | -9.81e-17 | -1.134685698 | 1.65e-15 | -0.249287762 | 2.552647139 | 4710.045774 | 128.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.19251654 | 47.51903896 | 15.23018458 | 10.12836652 | 10.12836652 | 6.194067933 | 6.194067933 | 3.926112745 | 3.926112745 | null | null | null | null | 320.7117493 | 30.32102232 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 827.4945474 | 0.733333333 | 1.3 | 1.933333333 | 0.586956522 | 130.0 | PEPTIDE4443{P.[Pr_Gly].L.[bHph].[dP].[dL].F}$PEPTIDE4443,PEPTIDE4443,1:R1-7:R2$$$ | PEPTIDE4443{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4443,PEPTIDE4443,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4443 | null | null | 4.08e+41 | 10.32069879 | 21.82761749 | 12.6225257 | 446.0439492 | null | 16.67176994 | 0.350730367 | 16.67176994 | 0.245675664 | 1.798408746 | 0.245675664 | -6.821266549 | -0.350730367 | 3.1275 | 227.8828 | 828.068 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_866 | -6.5 | 3.545178528 | 1.012624177 | 35.93898261 | 30.08946234 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 97.19693924 | 31.1705137 | null | -6.5 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 134.0960644 | 25.98743874 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 179.9860347 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4443 | null | 177.33 | 4.61 | 577.7151581 | 0.0 | 107.096973 | -10.3045376 | -5.450957442 | -42.64804198 | -61.2776208 | -60.13164058 | -51.58266602 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.28462279 | null |
85622bb76b63a7fe95b44d2fec76164207e800adb0e3d9c83ab47900f8560492 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,443 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'L', 'F'] | 45 | 4444 | -10.0 | -10 | Circle | 6 | -1.95e-16 | -2.694347706 | -8.19e-17 | -2.866058496 | -9.81e-17 | -1.134685698 | 1.65e-15 | -0.249287762 | 2.552647139 | 4710.045774 | 140.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.19251654 | 47.51903896 | 15.23018458 | 10.12836652 | 10.12836652 | 6.194067933 | 6.194067933 | 3.926112745 | 3.926112745 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 320.7117493 | 30.32102232 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 827.4945474 | 0.733333333 | 1.3 | 1.933333333 | 0.586956522 | 142.0 | PEPTIDE4444{P.[Pr_Gly].[dL].[bHph].[dP].L.F}$PEPTIDE4444,PEPTIDE4444,1:R1-7:R2$$$ | PEPTIDE4444{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4444,PEPTIDE4444,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4444 | null | null | 4.08e+41 | 10.32069879 | 21.82761749 | 12.6225257 | 446.0439492 | null | 16.67176994 | 0.350730367 | 16.67176994 | 0.245675664 | 1.798408746 | 0.245675664 | -6.821266549 | -0.350730367 | 3.1275 | 227.8828 | 828.068 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_867 | -10.0 | 3.545178528 | 1.012624177 | 35.93898261 | 30.08946234 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 97.19693924 | 31.1705137 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 134.0960644 | 25.98743874 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 179.9860347 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4444 | null | 177.33 | 0.0 | 577.7151581 | 0.0 | 107.096973 | -10.3045376 | -5.450957442 | -42.64804198 | -61.2776208 | -60.13164058 | -51.58266602 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.28462279 | null |
2a14a9d9ed0464b2be52f84d31bccf4bc75615d32a17094ce034e9c21628ca1c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,445 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | 50 | 4446 | -5.93 | -5.93 | Circle | 8 | -2.18e-16 | -2.717931349 | -1.14e-16 | -2.84788271 | 1.13e-16 | -1.135756046 | 1.9e-15 | -0.249287767 | 2.617045627 | 4700.535999 | 99.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.051794172 | 4.051794172 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 98.0 | PEPTIDE4446{P.[Pr_Gly].L.[Me_dL].[dP].[Bn_Gly].F}$PEPTIDE4446,PEPTIDE4446,1:R1-7:R2$$$ | PEPTIDE4446{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4446,PEPTIDE4446,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4446 | null | null | 9.02e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.95747739 | 0.342747938 | 16.95747739 | 0.245675463 | 1.77964369 | 0.245675463 | -7.252843174 | -0.342747938 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_869 | -5.93 | 3.873243942 | 1.352641409 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.93 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4446 | null | 159.75 | 16.27 | 578.9791719 | 0.0 | 103.3956544 | -5.178849995 | -5.346073514 | -43.65224158 | -55.19646427 | -48.42340281 | -71.16112749 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
c8e057ee2bbf3d20e8e09c146ea61d5f84ee8bdad9c2c09e711d044f0e435d1c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,446 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'Me_dL', 'F'] | 50 | 4447 | -5.71 | -5.71 | Circle | 7 | -2.58e-16 | -2.703165936 | -1.67e-16 | -2.848862063 | 3.95e-17 | -1.134960528 | 1.72e-15 | -0.249287762 | 2.614129753 | 4700.535999 | 116.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.766666667 | 1.366666667 | 1.983333333 | 0.586956522 | 117.0 | PEPTIDE4447{P.[Pr_Gly].[Bn_Gly].L.[dP].[Me_dL].F}$PEPTIDE4447,PEPTIDE4447,1:R1-7:R2$$$ | PEPTIDE4447{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4447,PEPTIDE4447,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4447 | null | null | 5.4e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.8336337 | 0.342747538 | 16.8336337 | 0.245675665 | 1.787743722 | 0.245675665 | -7.114453705 | -0.342747538 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_870 | -5.71 | 4.077876901 | 1.316257709 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.71 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4447 | null | 159.75 | 25.06 | 578.8835624 | 0.0 | 103.4947069 | -5.277902466 | -5.457524064 | -43.45636837 | -55.57558427 | -48.49067457 | -70.70354893 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
4c244a474473cb7a077b69978a64ead50413fe802563c0cc9b5fcf986e6c051c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,447 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'dL', 'dP', 'Bn_Gly', 'F'] | 49 | 4448 | -5.22 | -5.22 | Circle | 7 | -2.43e-16 | -2.713922197 | -1.06e-16 | -2.849340844 | 1.42e-17 | -1.135661617 | 1.87e-15 | -0.249287767 | 2.615463999 | 4700.535999 | 110.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.766666667 | 1.35 | 1.95 | 0.586956522 | 103.0 | PEPTIDE4448{P.[Pr_Gly].[meL].[dL].[dP].[Bn_Gly].F}$PEPTIDE4448,PEPTIDE4448,1:R1-7:R2$$$ | PEPTIDE4448{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4448,PEPTIDE4448,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4448 | null | null | 1.11e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.77347855 | 0.34249608 | 16.77347855 | 0.245675463 | 1.784151105 | 0.245675463 | -7.185677976 | -0.34249608 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_871 | -5.22 | 4.012773495 | 1.309833891 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.22 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4448 | null | 159.75 | 59.78 | 578.7220613 | 0.0 | 103.4601226 | -5.243318189 | -5.337578084 | -43.60711155 | -55.07723396 | -48.38714187 | -71.11313358 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
139a3fd6fb362cc98be5440d2d08124e17d55665acbddf886a3365ffc5ff729d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,448 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'Bn_Gly', 'F'] | 49 | 4449 | -5.8 | -5.8 | Circle | 3 | -2.18e-16 | -2.717931349 | -1.14e-16 | -2.84788271 | 1.13e-16 | -1.135756046 | 1.9e-15 | -0.249287767 | 2.617045627 | 4700.535999 | 107.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.051794172 | 4.051794172 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 106.0 | PEPTIDE4449{P.[Pr_Gly].[dL].[meL].[dP].[Bn_Gly].F}$PEPTIDE4449,PEPTIDE4449,1:R1-7:R2$$$ | PEPTIDE4449{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4449,PEPTIDE4449,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4449 | null | null | 9.02e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.95747739 | 0.342747938 | 16.95747739 | 0.245675463 | 1.77964369 | 0.245675463 | -7.252843174 | -0.342747938 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_872 | -5.8 | 3.873243942 | 1.352641409 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.8 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'meL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4449 | null | 159.75 | 21.14 | 578.9791719 | 0.0 | 103.3956544 | -5.178849995 | -5.346073514 | -43.65224158 | -55.19646427 | -48.42340281 | -71.16112749 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
0528993786f498e175e54f0a9db5a54e96550dd42cb464359ca51d41ba3ef409 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,450 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'L', 'F'] | 44 | 4451 | -6.81 | -6.81 | Circle | 6 | -1.95e-16 | -2.694347706 | -8.19e-17 | -2.866058496 | -9.81e-17 | -1.134685698 | 1.65e-15 | -0.249287762 | 2.552647139 | 4710.045774 | 141.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.19251654 | 47.51903896 | 15.23018458 | 10.12836652 | 10.12836652 | 6.194067933 | 6.194067933 | 3.926112745 | 3.926112745 | null | null | null | null | 320.7117493 | 30.32102232 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 827.4945474 | 0.733333333 | 1.3 | 1.933333333 | 0.586956522 | 142.0 | PEPTIDE4451{P.[Pr_Gly].L.[bHph].[dP].L.F}$PEPTIDE4451,PEPTIDE4451,1:R1-7:R2$$$ | PEPTIDE4451{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4451,PEPTIDE4451,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4451 | null | null | 4.08e+41 | 10.32069879 | 21.82761749 | 12.6225257 | 446.0439492 | null | 16.67176994 | 0.350730367 | 16.67176994 | 0.245675664 | 1.798408746 | 0.245675664 | -6.821266549 | -0.350730367 | 3.1275 | 227.8828 | 828.068 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_874 | -6.81 | 3.545178528 | 1.012624177 | 35.93898261 | 30.08946234 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 97.19693924 | 31.1705137 | null | -6.81 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.8254005 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 134.0960644 | 25.98743874 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 179.9860347 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4451 | null | 177.33 | 2.29 | 577.7151581 | 0.0 | 107.096973 | -10.3045376 | -5.450957442 | -42.64804198 | -61.2776208 | -60.13164058 | -51.58266602 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.28462279 | null |
9830393d390212e4436a9c6ceadcca431ea3a8f4a7413e2797a02f077a6952d3 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,452 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'Bn_Gly', 'F'] | 48 | 4453 | -5.5 | -5.5 | Circle | 4 | -2.18e-16 | -2.717931349 | -1.14e-16 | -2.84788271 | 1.13e-16 | -1.135756046 | 1.9e-15 | -0.249287767 | 2.617045627 | 4700.535999 | 123.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.051794172 | 4.051794172 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.733333333 | 1.283333333 | 1.883333333 | 0.586956522 | 123.0 | PEPTIDE4453{P.[Pr_Gly].L.[meL].[dP].[Bn_Gly].F}$PEPTIDE4453,PEPTIDE4453,1:R1-7:R2$$$ | PEPTIDE4453{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4453,PEPTIDE4453,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4453 | null | null | 9.02e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.95747739 | 0.342747938 | 16.95747739 | 0.245675463 | 1.77964369 | 0.245675463 | -7.252843174 | -0.342747938 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_876 | -5.5 | 3.873243942 | 1.352641409 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.5 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'meL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4453 | null | 159.75 | 38.0 | 578.9791719 | 0.0 | 103.3956544 | -5.178849995 | -5.346073514 | -43.65224158 | -55.19646427 | -48.42340281 | -71.16112749 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
14143fb2a1e6170ee3289d2a3320ec982da258dd2019c3f1c28de1380744cc00 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,453 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'meL', 'F'] | 48 | 4454 | -5.56 | -5.56 | Circle | 6 | -2.28e-16 | -2.700506149 | -1.2e-16 | -2.846554605 | 4.11e-17 | -1.134996664 | 1.68e-15 | -0.249287762 | 2.613427182 | 4700.535999 | 115.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 827.4945474 | 0.766666667 | 1.4 | 2.05 | 0.586956522 | 122.0 | PEPTIDE4454{P.[Pr_Gly].L.[Bn_Gly].[dP].[meL].F}$PEPTIDE4454,PEPTIDE4454,1:R1-7:R2$$$ | PEPTIDE4454{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4454,PEPTIDE4454,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4454 | null | null | 2.11e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.77560425 | 0.342747692 | 16.77560425 | 0.245675665 | 1.825221797 | 0.245675665 | -7.072694432 | -0.342747692 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_877 | -5.56 | 4.098020867 | 1.151417239 | 35.11917536 | 36.58632203 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 35.28278936 | null | -5.56 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4454 | null | 159.75 | 33.68 | 578.9696805 | 0.0 | 103.5015196 | -5.284715199 | -5.519208918 | -43.45446787 | -55.6305929 | -48.32654955 | -70.83899898 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
87497579bfb5f6dadcfec4489172f849a6d4122cf2ea25263ae5f7a5eec23bf1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,454 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'meL', 'F'] | 48 | 4455 | -5.26 | -5.26 | Circle | 9 | -2.58e-16 | -2.703165936 | -1.67e-16 | -2.848862063 | 3.95e-17 | -1.134960528 | 1.72e-15 | -0.249287762 | 2.614129753 | 4700.535999 | 93.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.11516627 | 47.57182536 | 15.17739817 | 10.20058011 | 10.20058011 | 6.359476033 | 6.359476033 | 4.023843323 | 4.023843323 | null | null | null | null | 321.097746 | 31.60961384 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.57185936 | 827.4945474 | 0.766666667 | 1.366666667 | 1.983333333 | 0.586956522 | 90.0 | PEPTIDE4455{P.[Pr_Gly].[Bn_Gly].L.[dP].[meL].F}$PEPTIDE4455,PEPTIDE4455,1:R1-7:R2$$$ | PEPTIDE4455{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4455,PEPTIDE4455,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4455 | null | null | 5.4e+41 | 10.32069879 | 21.30934991 | 11.7190382 | 446.3477789 | null | 16.8336337 | 0.342747538 | 16.8336337 | 0.245675665 | 1.787743722 | 0.245675665 | -7.114453705 | -0.342747538 | 3.3809 | 227.6754 | 828.068 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 16 | 0 | 3 | 3 | 326 | hepta_878 | -5.26 | 4.077876901 | 1.316257709 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 96.9080499 | 41.77964905 | null | -5.26 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 122.7432335 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.8291818 | 39.46012532 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'L', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 176.3546269 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4455 | null | 159.75 | 55.99 | 578.8835624 | 0.0 | 103.4947069 | -5.277902466 | -5.457524064 | -43.45636837 | -55.57558427 | -48.49067457 | -70.70354893 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.371848608 | null |
38bae6d38a335704cfea635212eb457812e56d55265775ac233833177a2545b7 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,455 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | 54 | 4456 | -6.12 | -6.12 | Circle | 4 | -2.55e-16 | -2.705559521 | -1.65e-16 | -2.846164464 | 5.43e-17 | -1.135203807 | 1.21e-15 | -0.249287762 | 2.668731259 | 4810.143509 | 96.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | null | null | null | 327.6636693 | 35.68080598 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 841.5101975 | 0.737704918 | 1.327868852 | 1.950819672 | 0.595744681 | 93.0 | PEPTIDE4456{P.[Pr_Gly].[Me_dL].[Bn_Gly].[dP].[Me_dL].F}$PEPTIDE4456,PEPTIDE4456,1:R1-7:R2$$$ | PEPTIDE4456{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4456,PEPTIDE4456,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4456 | null | null | 6.13e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 17.08186428 | 0.342180206 | 17.08186428 | 0.245675665 | 1.856668042 | 0.245675665 | -7.218224135 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_879 | -6.12 | 3.806255276 | 1.345051751 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -6.12 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4456 | null | 150.96 | 10.69 | 599.3136979 | 0.0 | 101.7477785 | -2.65498849 | -5.632058237 | -44.33340617 | -56.59146681 | -48.98121632 | -78.20167375 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
2b2d1364de6249ceb8535fac41de80ef4efe259f2cf80cbba60895588bdac0ee | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,456 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'Me_dL', 'F'] | 49 | 4457 | -5.83 | -5.83 | Circle | 9 | -2.35e-16 | -2.702845834 | -1.82e-16 | -2.861579014 | -3.31e-17 | -1.13498946 | 1.42e-15 | -0.249287763 | 2.609337397 | 4819.653284 | 141.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.40384141 | 48.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.407416578 | 6.407416578 | 4.054836218 | 4.054836218 | null | null | null | null | 327.2776726 | 28.90918025 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 841.5101975 | 0.770491803 | 1.393442623 | 2.032786885 | 0.595744681 | 136.0 | PEPTIDE4457{P.[Pr_Gly].[dL].[bHph].[dP].[Me_dL].F}$PEPTIDE4457,PEPTIDE4457,1:R1-7:R2$$$ | PEPTIDE4457{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4457,PEPTIDE4457,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4457 | null | null | 6.96e+42 | 10.39396068 | 22.00820975 | 12.63834575 | 455.3707472 | null | 16.80443776 | 0.350730367 | 16.80443776 | 0.245675665 | 1.827239805 | 0.245675665 | -7.107724883 | -0.350730367 | 3.4697 | 232.5101 | 842.095 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_880 | -5.83 | 3.48404148 | 1.059332156 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 108.2850418 | 31.1705137 | null | -5.83 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 134.0960644 | 32.96326564 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 184.0983104 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4457 | null | 168.54 | 19.94 | 598.03261 | 0.0 | 105.550266 | -7.890166487 | -5.56096511 | -43.51846359 | -62.50690712 | -61.08658113 | -58.35312584 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.329491408 | null |
9175a6ba22d5f5b4cbcb9c688a8ca6d08276884dbb3544d2926578992580d311 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,457 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'Me_dL', 'F'] | 54 | 4458 | -10.0 | -10 | Circle | 6 | -2.2e-16 | -2.708209303 | -1.9e-16 | -2.847646938 | 8.22e-17 | -1.135165428 | 1.07e-15 | -0.249287762 | 2.668313638 | 4810.143509 | 97.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 327.6636693 | 38.42232309 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 841.5101975 | 0.737704918 | 1.31147541 | 1.918032787 | 0.595744681 | 96.0 | PEPTIDE4458{P.[Pr_Gly].[Bn_Gly].[Me_dL].[dP].[Me_dL].F}$PEPTIDE4458,PEPTIDE4458,1:R1-7:R2$$$ | PEPTIDE4458{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4458,PEPTIDE4458,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4458 | null | null | 7.94e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 16.91196093 | 0.342180206 | 16.91196093 | 0.245675665 | 1.83288835 | 0.245675665 | -7.180657409 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_881 | -10.0 | 3.835717058 | 1.361994561 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'Me_dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4458 | null | 150.96 | 0.0 | 599.1569231 | 0.0 | 101.777916 | -2.685125979 | -5.562555243 | -44.35157259 | -56.53453854 | -49.13861952 | -77.99576064 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
4596c2675ec20c6a77275d14c16e4c4470589072e9322cc65836384820b6330b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,458 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'dL', 'F'] | 49 | 4459 | -6.73 | -6.73 | Circle | 6 | -2.09e-16 | -2.708264211 | -1.53e-16 | -2.862162324 | 3.12e-17 | -1.134991628 | 9.07e-16 | -0.249287763 | 2.606349191 | 4819.653284 | 125.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.40384141 | 48.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.407416578 | 6.407416578 | 4.026885368 | 4.026885368 | null | null | null | null | 327.2776726 | 31.65069736 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 841.5101975 | 0.754098361 | 1.37704918 | 2.032786885 | 0.595744681 | 130.0 | PEPTIDE4459{P.[Pr_Gly].[Me_dL].[bHph].[dP].[dL].F}$PEPTIDE4459,PEPTIDE4459,1:R1-7:R2$$$ | PEPTIDE4459{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4459,PEPTIDE4459,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4459 | null | null | 4.62e+42 | 10.39396068 | 22.00820975 | 12.63834575 | 455.3707472 | null | 16.75885671 | 0.350723941 | 16.75885671 | 0.245675664 | 1.836861455 | 0.245675664 | -7.092780967 | -0.350723941 | 3.4697 | 232.5101 | 842.095 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_882 | -6.73 | 3.454343857 | 1.088948869 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 108.2850418 | 31.1705137 | null | -6.73 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 134.0960644 | 32.96326564 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 184.0983104 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4459 | null | 168.54 | 2.77 | 597.9058085 | 0.0 | 105.4877785 | -7.843733658 | -5.548950413 | -43.50184331 | -62.30174487 | -60.96378348 | -58.56686463 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.329491408 | null |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.