diff --git "a/2uzk/2uzk.cif" "b/2uzk/2uzk.cif" new file mode 100644--- /dev/null +++ "b/2uzk/2uzk.cif" @@ -0,0 +1,5686 @@ +data_2UZK +# +_entry.id 2UZK +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.382 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 2UZK pdb_00002uzk 10.2210/pdb2uzk/pdb +PDBE EBI-32413 ? ? +WWPDB D_1290032413 ? ? +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 2UZK +_pdbx_database_status.deposit_site PDBE +_pdbx_database_status.process_site PDBE +_pdbx_database_status.SG_entry . +_pdbx_database_status.recvd_initial_deposition_date 2007-04-30 +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_sf REL +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Tsai, K.-L.' 1 +'Sun, Y.-J.' 2 +'Huang, C.-Y.' 3 +'Yang, J.-Y.' 4 +'Hung, M.-C.' 5 +'Hsiao, C.-D.' 6 +# +_citation.id primary +_citation.title +'Crystal Structure of the Human Foxo3A-Dbd/DNA Complex Suggests the Effects of Post-Translational Modification.' +_citation.journal_abbrev 'Nucleic Acids Res.' +_citation.journal_volume 35 +_citation.page_first 6984 +_citation.page_last ? +_citation.year 2007 +_citation.journal_id_ASTM NARHAD +_citation.country UK +_citation.journal_id_ISSN 0305-1048 +_citation.journal_id_CSD 0389 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 17940099 +_citation.pdbx_database_id_DOI 10.1093/NAR/GKM703 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Tsai, K.-L.' 1 ? +primary 'Sun, Y.-J.' 2 ? +primary 'Huang, C.-Y.' 3 ? +primary 'Yang, J.-Y.' 4 ? +primary 'Hung, M.-C.' 5 ? +primary 'Hsiao, C.-D.' 6 ? +# +_cell.entry_id 2UZK +_cell.length_a 41.964 +_cell.length_b 41.964 +_cell.length_c 354.817 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 120.00 +_cell.Z_PDB 12 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 2UZK +_symmetry.space_group_name_H-M 'P 61' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 169 +# +loop_ +_entity.id +_entity.type +_entity.src_method +_entity.pdbx_description +_entity.formula_weight +_entity.pdbx_number_of_molecules +_entity.pdbx_ec +_entity.pdbx_mutation +_entity.pdbx_fragment +_entity.details +1 polymer man 'FORKHEAD BOX PROTEIN O3A' 11019.484 2 ? ? 'DNA-BINDING DOMAIN, RESIDUES 158-253' ? +2 polymer syn "5'-D(*CP*TP*AP*TP*GP*TP*AP*AP*AP*CP*AP*AP*C)-3'" 3943.613 2 ? ? ? ? +3 polymer syn "5'-D(*GP*TP*TP*GP*TP*TP*TP*AP*CP*AP*TP*AP*G)-3'" 3996.619 2 ? ? ? ? +4 water nat water 18.015 209 ? ? ? ? +# +loop_ +_entity_name_com.entity_id +_entity_name_com.name +1 'FORKHEAD IN RHABDOMYOSARCOMA-LIKE 1, AF6Q21 PROTEIN' +2 'FOXO CONSENSUS BINDING SEQUENCE' +3 'FOXO CONSENSUS BINDING SEQUENCE' +# +loop_ +_entity_poly.entity_id +_entity_poly.type +_entity_poly.nstd_linkage +_entity_poly.nstd_monomer +_entity_poly.pdbx_seq_one_letter_code +_entity_poly.pdbx_seq_one_letter_code_can +_entity_poly.pdbx_strand_id +_entity_poly.pdbx_target_identifier +1 'polypeptide(L)' no no +;MGNLSYADLITRAIESSPDKRLTLSQIYEWMVRCVPYFKDKGDSNSSAGWKNSIRHNLSLHSRFMRVQNEGTGKSSWWII +NPDGGKSGKAPRRRAVS +; +;MGNLSYADLITRAIESSPDKRLTLSQIYEWMVRCVPYFKDKGDSNSSAGWKNSIRHNLSLHSRFMRVQNEGTGKSSWWII +NPDGGKSGKAPRRRAVS +; +A,C ? +2 polydeoxyribonucleotide no no '(DC)(DT)(DA)(DT)(DG)(DT)(DA)(DA)(DA)(DC)(DA)(DA)(DC)' CTATGTAAACAAC B,D ? +3 polydeoxyribonucleotide no no '(DG)(DT)(DT)(DG)(DT)(DT)(DT)(DA)(DC)(DA)(DT)(DA)(DG)' GTTGTTTACATAG E,F ? +# +loop_ +_entity_poly_seq.entity_id +_entity_poly_seq.num +_entity_poly_seq.mon_id +_entity_poly_seq.hetero +1 1 MET n +1 2 GLY n +1 3 ASN n +1 4 LEU n +1 5 SER n +1 6 TYR n +1 7 ALA n +1 8 ASP n +1 9 LEU n +1 10 ILE n +1 11 THR n +1 12 ARG n +1 13 ALA n +1 14 ILE n +1 15 GLU n +1 16 SER n +1 17 SER n +1 18 PRO n +1 19 ASP n +1 20 LYS n +1 21 ARG n +1 22 LEU n +1 23 THR n +1 24 LEU n +1 25 SER n +1 26 GLN n +1 27 ILE n +1 28 TYR n +1 29 GLU n +1 30 TRP n +1 31 MET n +1 32 VAL n +1 33 ARG n +1 34 CYS n +1 35 VAL n +1 36 PRO n +1 37 TYR n +1 38 PHE n +1 39 LYS n +1 40 ASP n +1 41 LYS n +1 42 GLY n +1 43 ASP n +1 44 SER n +1 45 ASN n +1 46 SER n +1 47 SER n +1 48 ALA n +1 49 GLY n +1 50 TRP n +1 51 LYS n +1 52 ASN n +1 53 SER n +1 54 ILE n +1 55 ARG n +1 56 HIS n +1 57 ASN n +1 58 LEU n +1 59 SER n +1 60 LEU n +1 61 HIS n +1 62 SER n +1 63 ARG n +1 64 PHE n +1 65 MET n +1 66 ARG n +1 67 VAL n +1 68 GLN n +1 69 ASN n +1 70 GLU n +1 71 GLY n +1 72 THR n +1 73 GLY n +1 74 LYS n +1 75 SER n +1 76 SER n +1 77 TRP n +1 78 TRP n +1 79 ILE n +1 80 ILE n +1 81 ASN n +1 82 PRO n +1 83 ASP n +1 84 GLY n +1 85 GLY n +1 86 LYS n +1 87 SER n +1 88 GLY n +1 89 LYS n +1 90 ALA n +1 91 PRO n +1 92 ARG n +1 93 ARG n +1 94 ARG n +1 95 ALA n +1 96 VAL n +1 97 SER n +2 1 DC n +2 2 DT n +2 3 DA n +2 4 DT n +2 5 DG n +2 6 DT n +2 7 DA n +2 8 DA n +2 9 DA n +2 10 DC n +2 11 DA n +2 12 DA n +2 13 DC n +3 1 DG n +3 2 DT n +3 3 DT n +3 4 DG n +3 5 DT n +3 6 DT n +3 7 DT n +3 8 DA n +3 9 DC n +3 10 DA n +3 11 DT n +3 12 DA n +3 13 DG n +# +_entity_src_gen.entity_id 1 +_entity_src_gen.pdbx_src_id 1 +_entity_src_gen.pdbx_alt_source_flag sample +_entity_src_gen.pdbx_seq_type ? +_entity_src_gen.pdbx_beg_seq_num ? +_entity_src_gen.pdbx_end_seq_num ? +_entity_src_gen.gene_src_common_name HUMAN +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'HOMO SAPIENS' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'ESCHERICHIA COLI' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 511693 +_entity_src_gen.host_org_genus ? +_entity_src_gen.pdbx_host_org_gene ? +_entity_src_gen.pdbx_host_org_organ ? +_entity_src_gen.host_org_species ? +_entity_src_gen.pdbx_host_org_tissue ? +_entity_src_gen.pdbx_host_org_tissue_fraction ? +_entity_src_gen.pdbx_host_org_strain BL21 +_entity_src_gen.pdbx_host_org_variant ? +_entity_src_gen.pdbx_host_org_cell_line ? +_entity_src_gen.pdbx_host_org_atcc ? +_entity_src_gen.pdbx_host_org_culture_collection ? +_entity_src_gen.pdbx_host_org_cell ? +_entity_src_gen.pdbx_host_org_organelle ? +_entity_src_gen.pdbx_host_org_cellular_location ? +_entity_src_gen.pdbx_host_org_vector_type PLASMID +_entity_src_gen.pdbx_host_org_vector PET-21B +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name ? +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +loop_ +_pdbx_entity_src_syn.entity_id +_pdbx_entity_src_syn.pdbx_src_id +_pdbx_entity_src_syn.pdbx_alt_source_flag +_pdbx_entity_src_syn.pdbx_beg_seq_num +_pdbx_entity_src_syn.pdbx_end_seq_num +_pdbx_entity_src_syn.organism_scientific +_pdbx_entity_src_syn.organism_common_name +_pdbx_entity_src_syn.ncbi_taxonomy_id +_pdbx_entity_src_syn.details +2 1 sample ? ? 'HOMO SAPIENS' HUMAN 9606 ? +3 1 sample ? ? 'HOMO SAPIENS' HUMAN 9606 ? +# +loop_ +_struct_ref.id +_struct_ref.db_name +_struct_ref.db_code +_struct_ref.entity_id +_struct_ref.pdbx_seq_one_letter_code +_struct_ref.pdbx_align_begin +_struct_ref.pdbx_db_accession +_struct_ref.pdbx_db_isoform +1 PDB 2UZK 1 ? ? 2UZK ? +2 UNP FOXO3_HUMAN 1 ? ? O43524 ? +3 PDB 2UZK 2 ? ? 2UZK ? +4 PDB 2UZK 3 ? ? 2UZK ? +# +loop_ +_struct_ref_seq.align_id +_struct_ref_seq.ref_id +_struct_ref_seq.pdbx_PDB_id_code +_struct_ref_seq.pdbx_strand_id +_struct_ref_seq.seq_align_beg +_struct_ref_seq.pdbx_seq_align_beg_ins_code +_struct_ref_seq.seq_align_end +_struct_ref_seq.pdbx_seq_align_end_ins_code +_struct_ref_seq.pdbx_db_accession +_struct_ref_seq.db_align_beg +_struct_ref_seq.pdbx_db_align_beg_ins_code +_struct_ref_seq.db_align_end +_struct_ref_seq.pdbx_db_align_end_ins_code +_struct_ref_seq.pdbx_auth_seq_align_beg +_struct_ref_seq.pdbx_auth_seq_align_end +1 1 2UZK A 1 ? 1 ? 2UZK 157 ? 157 ? 157 157 +2 2 2UZK A 2 ? 97 ? O43524 158 ? 253 ? 158 253 +3 3 2UZK B 1 ? 13 ? 2UZK 1 ? 13 ? 1 13 +4 1 2UZK C 1 ? 1 ? 2UZK 1157 ? 1157 ? 1157 1157 +5 2 2UZK C 2 ? 97 ? O43524 158 ? 253 ? 1158 1253 +6 3 2UZK D 1 ? 13 ? 2UZK 1001 ? 1013 ? 1001 1013 +7 4 2UZK E 1 ? 13 ? 2UZK 25 ? 37 ? 25 37 +8 4 2UZK F 1 ? 13 ? 2UZK 1025 ? 1037 ? 1025 1037 +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +DA 'DNA linking' y "2'-DEOXYADENOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O6 P' 331.222 +DC 'DNA linking' y "2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE" ? 'C9 H14 N3 O7 P' 307.197 +DG 'DNA linking' y "2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.221 +DT 'DNA linking' y "THYMIDINE-5'-MONOPHOSPHATE" ? 'C10 H15 N2 O8 P' 322.208 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +# +_exptl.entry_id 2UZK +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number ? +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 2.32 +_exptl_crystal.density_percent_sol 46.50 +_exptl_crystal.description NONE +# +_diffrn.id 1 +_diffrn.ambient_temp 100 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector CCD +_diffrn_detector.type 'ADSC CCD' +_diffrn_detector.pdbx_collection_date ? +_diffrn_detector.details MIRROR +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.0000 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source SYNCHROTRON +_diffrn_source.type 'NSRRC BEAMLINE BL13B1' +_diffrn_source.pdbx_synchrotron_site NSRRC +_diffrn_source.pdbx_synchrotron_beamline BL13B1 +_diffrn_source.pdbx_wavelength 1.0000 +_diffrn_source.pdbx_wavelength_list ? +# +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.entry_id 2UZK +_reflns.observed_criterion_sigma_I 2.0 +_reflns.observed_criterion_sigma_F ? +_reflns.d_resolution_low 25.00 +_reflns.d_resolution_high 2.70 +_reflns.number_obs 9491 +_reflns.number_all ? +_reflns.percent_possible_obs 97.1 +_reflns.pdbx_Rmerge_I_obs 0.05 +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI 40.20 +_reflns.B_iso_Wilson_estimate 23.0 +_reflns.pdbx_redundancy 4.2 +# +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.d_res_high 2.70 +_reflns_shell.d_res_low 2.80 +_reflns_shell.percent_possible_all 97.3 +_reflns_shell.Rmerge_I_obs 0.42 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs 2.50 +_reflns_shell.pdbx_redundancy 2.5 +# +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.entry_id 2UZK +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.ls_number_reflns_obs 9125 +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 2 +_refine.pdbx_data_cutoff_high_absF 25787.54 +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low 24.13 +_refine.ls_d_res_high 2.70 +_refine.ls_percent_reflns_obs 94.6 +_refine.ls_R_factor_obs 0.242 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.242 +_refine.ls_R_factor_R_free 0.266 +_refine.ls_R_factor_R_free_error 0.012 +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 5.3 +_refine.ls_number_reflns_R_free 488 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.B_iso_mean 18.6 +_refine.aniso_B[1][1] 1.57 +_refine.aniso_B[2][2] 1.57 +_refine.aniso_B[3][3] -3.13 +_refine.aniso_B[1][2] 2.68 +_refine.aniso_B[1][3] 0.00 +_refine.aniso_B[2][3] 0.00 +_refine.solvent_model_details 'FLAT MODEL' +_refine.solvent_model_param_ksol 0.283777 +_refine.solvent_model_param_bsol 247.326 +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_ls_cross_valid_method THROUGHOUT +_refine.details +;RESIDUES 157 AND 1157 ARE MET AND ALA, RESPECTIVELY. THESE TWO RESIDUES ARE GENERATED FORM VECTOR, NOT THE WILD TYPE FOXO3A AMINO ACIDS. THE SIDE CHAINS OF THESE RESIDUES 1242, 1243, 1245, 1246, AND 1247 IN CHAIN D ARE DISAPPEARED. GLY RESIDUES ARE SUBSTITUTED FOR THESE RESIDUES IN THIS MODEL. RESIDUES 1248-1253 IN CHAIN D ARE DISORDERED, AND NOT DETERMINED IN THE MODEL. +; +_refine.pdbx_starting_model 'PDB ENTRY 2C6Y' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_isotropic_thermal_model RESTRAINED +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.pdbx_overall_phase_error ? +_refine.overall_SU_B ? +_refine.overall_SU_R_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? +_refine.pdbx_overall_SU_R_Blow_DPI ? +_refine.pdbx_overall_SU_R_free_Blow_DPI ? +# +_refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_analyze.entry_id 2UZK +_refine_analyze.Luzzati_coordinate_error_obs 0.35 +_refine_analyze.Luzzati_sigma_a_obs 0.42 +_refine_analyze.Luzzati_d_res_low_obs 5.00 +_refine_analyze.Luzzati_coordinate_error_free 0.39 +_refine_analyze.Luzzati_sigma_a_free 0.20 +_refine_analyze.Luzzati_d_res_low_free ? +_refine_analyze.number_disordered_residues ? +_refine_analyze.occupancy_sum_hydrogen ? +_refine_analyze.occupancy_sum_non_hydrogen ? +# +_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_hist.cycle_id LAST +_refine_hist.pdbx_number_atoms_protein 1478 +_refine_hist.pdbx_number_atoms_nucleic_acid 1054 +_refine_hist.pdbx_number_atoms_ligand 0 +_refine_hist.number_atoms_solvent 209 +_refine_hist.number_atoms_total 2741 +_refine_hist.d_res_high 2.70 +_refine_hist.d_res_low 24.13 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +c_bond_d 0.012 ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg 2.6 ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d 32.6 ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d 2.45 ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_mcbond_it 2.01 1.50 ? ? 'X-RAY DIFFRACTION' ? +c_mcangle_it 3.41 2.00 ? ? 'X-RAY DIFFRACTION' ? +c_scbond_it 2.08 2.00 ? ? 'X-RAY DIFFRACTION' ? +c_scangle_it 2.94 2.50 ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.pdbx_total_number_of_bins_used 6 +_refine_ls_shell.d_res_high 2.70 +_refine_ls_shell.d_res_low 2.87 +_refine_ls_shell.number_reflns_R_work 1273 +_refine_ls_shell.R_factor_R_work 0.324 +_refine_ls_shell.percent_reflns_obs 84.7 +_refine_ls_shell.R_factor_R_free 0.278 +_refine_ls_shell.R_factor_R_free_error 0.034 +_refine_ls_shell.percent_reflns_R_free 5.1 +_refine_ls_shell.number_reflns_R_free 69 +_refine_ls_shell.number_reflns_all ? +_refine_ls_shell.R_factor_all ? +# +loop_ +_pdbx_xplor_file.pdbx_refine_id +_pdbx_xplor_file.serial_no +_pdbx_xplor_file.param_file +_pdbx_xplor_file.topol_file +'X-RAY DIFFRACTION' 1 PROTEIN_REP.PARAM PROTEIN.TOP +'X-RAY DIFFRACTION' 2 WATER_REP.PARAM WATER.TOP +'X-RAY DIFFRACTION' 3 DNA-RNA_REP.PARAM DNA-RNA_REP.TOP +# +_struct.entry_id 2UZK +_struct.title 'Crystal structure of the human FOXO3a-DBD bound to DNA' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 2UZK +_struct_keywords.pdbx_keywords TRANSCRIPTION +_struct_keywords.text +;TRANSCRIPTION, TRANSCRIPTION REGULATION, CHROMOSOMAL REARRANGEMENT, ACTIVATOR, APOPTOSIS, DNA-BINDING, WINGED HELIX, PROTO-ONCOGENE, FORKHEAD TRANSCRIPTION FACTORS, NUCLEAR PROTEIN, PHOSPHORYLATION, DNA-BINDING DOMAIN +; +# +loop_ +_struct_asym.id +_struct_asym.pdbx_blank_PDB_chainid_flag +_struct_asym.pdbx_modified +_struct_asym.entity_id +_struct_asym.details +A N N 1 ? +B N N 2 ? +C N N 1 ? +D N N 2 ? +E N N 3 ? +F N N 3 ? +G N N 4 ? +H N N 4 ? +I N N 4 ? +J N N 4 ? +K N N 4 ? +L N N 4 ? +# +_struct_biol.id 1 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 SER A 5 ? ILE A 14 ? SER A 161 ILE A 170 1 ? 10 +HELX_P HELX_P2 2 THR A 23 ? CYS A 34 ? THR A 179 CYS A 190 1 ? 12 +HELX_P HELX_P3 3 GLY A 49 ? HIS A 61 ? GLY A 205 HIS A 217 1 ? 13 +HELX_P HELX_P4 4 SER C 5 ? SER C 17 ? SER C 1161 SER C 1173 1 ? 13 +HELX_P HELX_P5 5 THR C 23 ? VAL C 35 ? THR C 1179 VAL C 1191 1 ? 13 +HELX_P HELX_P6 6 GLY C 49 ? HIS C 61 ? GLY C 1205 HIS C 1217 1 ? 13 +# +_struct_conf_type.id HELX_P +_struct_conf_type.criteria ? +_struct_conf_type.reference ? +# +loop_ +_struct_conn.id +_struct_conn.conn_type_id +_struct_conn.pdbx_leaving_atom_flag +_struct_conn.pdbx_PDB_id +_struct_conn.ptnr1_label_asym_id +_struct_conn.ptnr1_label_comp_id +_struct_conn.ptnr1_label_seq_id +_struct_conn.ptnr1_label_atom_id +_struct_conn.pdbx_ptnr1_label_alt_id +_struct_conn.pdbx_ptnr1_PDB_ins_code +_struct_conn.pdbx_ptnr1_standard_comp_id +_struct_conn.ptnr1_symmetry +_struct_conn.ptnr2_label_asym_id +_struct_conn.ptnr2_label_comp_id +_struct_conn.ptnr2_label_seq_id +_struct_conn.ptnr2_label_atom_id +_struct_conn.pdbx_ptnr2_label_alt_id +_struct_conn.pdbx_ptnr2_PDB_ins_code +_struct_conn.ptnr1_auth_asym_id +_struct_conn.ptnr1_auth_comp_id +_struct_conn.ptnr1_auth_seq_id +_struct_conn.ptnr2_auth_asym_id +_struct_conn.ptnr2_auth_comp_id +_struct_conn.ptnr2_auth_seq_id +_struct_conn.ptnr2_symmetry +_struct_conn.pdbx_ptnr3_label_atom_id +_struct_conn.pdbx_ptnr3_label_seq_id +_struct_conn.pdbx_ptnr3_label_comp_id +_struct_conn.pdbx_ptnr3_label_asym_id +_struct_conn.pdbx_ptnr3_label_alt_id +_struct_conn.pdbx_ptnr3_PDB_ins_code +_struct_conn.details +_struct_conn.pdbx_dist_value +_struct_conn.pdbx_value_order +_struct_conn.pdbx_role +hydrog1 hydrog ? ? B DC 1 N3 ? ? ? 1_555 E DG 13 N1 ? ? B DC 1 E DG 37 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog2 hydrog ? ? B DC 1 N4 ? ? ? 1_555 E DG 13 O6 ? ? B DC 1 E DG 37 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog3 hydrog ? ? B DC 1 O2 ? ? ? 1_555 E DG 13 N2 ? ? B DC 1 E DG 37 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog4 hydrog ? ? B DT 2 N3 ? ? ? 1_555 E DA 12 N1 ? ? B DT 2 E DA 36 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog5 hydrog ? ? B DT 2 O4 ? ? ? 1_555 E DA 12 N6 ? ? B DT 2 E DA 36 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog6 hydrog ? ? B DA 3 N1 ? ? ? 1_555 E DT 11 N3 ? ? B DA 3 E DT 35 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog7 hydrog ? ? B DA 3 N6 ? ? ? 1_555 E DT 11 O4 ? ? B DA 3 E DT 35 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog8 hydrog ? ? B DT 4 N3 ? ? ? 1_555 E DA 10 N1 ? ? B DT 4 E DA 34 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog9 hydrog ? ? B DT 4 O4 ? ? ? 1_555 E DA 10 N6 ? ? B DT 4 E DA 34 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog10 hydrog ? ? B DG 5 N1 ? ? ? 1_555 E DC 9 N3 ? ? B DG 5 E DC 33 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog11 hydrog ? ? B DG 5 N2 ? ? ? 1_555 E DC 9 O2 ? ? B DG 5 E DC 33 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog12 hydrog ? ? B DG 5 O6 ? ? ? 1_555 E DC 9 N4 ? ? B DG 5 E DC 33 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog13 hydrog ? ? B DT 6 N3 ? ? ? 1_555 E DA 8 N1 ? ? B DT 6 E DA 32 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog14 hydrog ? ? B DT 6 O4 ? ? ? 1_555 E DA 8 N6 ? ? B DT 6 E DA 32 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog15 hydrog ? ? B DA 7 N1 ? ? ? 1_555 E DT 7 N3 ? ? B DA 7 E DT 31 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog16 hydrog ? ? B DA 7 N6 ? ? ? 1_555 E DT 7 O4 ? ? B DA 7 E DT 31 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog17 hydrog ? ? B DA 8 N1 ? ? ? 1_555 E DT 6 N3 ? ? B DA 8 E DT 30 1_555 ? ? ? ? ? ? 'DA-DT PAIR' ? ? ? +hydrog18 hydrog ? ? B DA 9 N1 ? ? ? 1_555 E DT 5 N3 ? ? B DA 9 E DT 29 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog19 hydrog ? ? B DA 9 N6 ? ? ? 1_555 E DT 5 O4 ? ? B DA 9 E DT 29 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog20 hydrog ? ? B DC 10 N3 ? ? ? 1_555 E DG 4 N2 ? ? B DC 10 E DG 28 1_555 ? ? ? ? ? ? 'REVERSED WATSON-CRICK' ? ? ? +hydrog21 hydrog ? ? B DC 10 O2 ? ? ? 1_555 E DG 4 N1 ? ? B DC 10 E DG 28 1_555 ? ? ? ? ? ? 'REVERSED WATSON-CRICK' ? ? ? +hydrog22 hydrog ? ? B DA 11 N1 ? ? ? 1_555 E DT 3 N3 ? ? B DA 11 E DT 27 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog23 hydrog ? ? B DA 11 N6 ? ? ? 1_555 E DT 3 O4 ? ? B DA 11 E DT 27 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog24 hydrog ? ? B DA 12 N1 ? ? ? 1_555 E DT 2 N3 ? ? B DA 12 E DT 26 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog25 hydrog ? ? B DA 12 N6 ? ? ? 1_555 E DT 2 O4 ? ? B DA 12 E DT 26 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog26 hydrog ? ? B DC 13 N3 ? ? ? 1_555 E DG 1 N1 ? ? B DC 13 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog27 hydrog ? ? B DC 13 N4 ? ? ? 1_555 E DG 1 O6 ? ? B DC 13 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog28 hydrog ? ? B DC 13 O2 ? ? ? 1_555 E DG 1 N2 ? ? B DC 13 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog29 hydrog ? ? D DT 2 N3 ? ? ? 1_555 F DA 12 N1 ? ? D DT 1002 F DA 1036 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog30 hydrog ? ? D DT 2 O4 ? ? ? 1_555 F DA 12 N6 ? ? D DT 1002 F DA 1036 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog31 hydrog ? ? D DA 3 N1 ? ? ? 1_555 F DT 11 N3 ? ? D DA 1003 F DT 1035 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog32 hydrog ? ? D DA 3 N6 ? ? ? 1_555 F DT 11 O4 ? ? D DA 1003 F DT 1035 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog33 hydrog ? ? D DT 4 N3 ? ? ? 1_555 F DA 10 N1 ? ? D DT 1004 F DA 1034 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog34 hydrog ? ? D DT 4 O4 ? ? ? 1_555 F DA 10 N6 ? ? D DT 1004 F DA 1034 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog35 hydrog ? ? D DG 5 N1 ? ? ? 1_555 F DC 9 N3 ? ? D DG 1005 F DC 1033 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog36 hydrog ? ? D DG 5 N2 ? ? ? 1_555 F DC 9 O2 ? ? D DG 1005 F DC 1033 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog37 hydrog ? ? D DG 5 O6 ? ? ? 1_555 F DC 9 N4 ? ? D DG 1005 F DC 1033 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog38 hydrog ? ? D DT 6 N3 ? ? ? 1_555 F DA 8 N1 ? ? D DT 1006 F DA 1032 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog39 hydrog ? ? D DT 6 O4 ? ? ? 1_555 F DA 8 N6 ? ? D DT 1006 F DA 1032 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog40 hydrog ? ? D DA 7 N1 ? ? ? 1_555 F DT 7 N3 ? ? D DA 1007 F DT 1031 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog41 hydrog ? ? D DA 7 N6 ? ? ? 1_555 F DT 7 O4 ? ? D DA 1007 F DT 1031 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog42 hydrog ? ? D DA 8 N1 ? ? ? 1_555 F DT 6 N3 ? ? D DA 1008 F DT 1030 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog43 hydrog ? ? D DA 8 N6 ? ? ? 1_555 F DT 6 O4 ? ? D DA 1008 F DT 1030 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog44 hydrog ? ? D DA 9 N1 ? ? ? 1_555 F DT 5 N3 ? ? D DA 1009 F DT 1029 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog45 hydrog ? ? D DA 9 N6 ? ? ? 1_555 F DT 5 O4 ? ? D DA 1009 F DT 1029 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog46 hydrog ? ? D DC 10 N3 ? ? ? 1_555 F DG 4 N1 ? ? D DC 1010 F DG 1028 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog47 hydrog ? ? D DC 10 N4 ? ? ? 1_555 F DG 4 O6 ? ? D DC 1010 F DG 1028 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog48 hydrog ? ? D DC 10 O2 ? ? ? 1_555 F DG 4 N2 ? ? D DC 1010 F DG 1028 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog49 hydrog ? ? D DA 11 N1 ? ? ? 1_555 F DT 3 N3 ? ? D DA 1011 F DT 1027 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog50 hydrog ? ? D DA 11 N6 ? ? ? 1_555 F DT 3 O4 ? ? D DA 1011 F DT 1027 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog51 hydrog ? ? D DA 12 N1 ? ? ? 1_555 F DT 2 N3 ? ? D DA 1012 F DT 1026 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog52 hydrog ? ? D DA 12 N6 ? ? ? 1_555 F DT 2 O4 ? ? D DA 1012 F DT 1026 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog53 hydrog ? ? D DC 13 N3 ? ? ? 1_555 F DG 1 N1 ? ? D DC 1013 F DG 1025 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog54 hydrog ? ? D DC 13 N4 ? ? ? 1_555 F DG 1 O6 ? ? D DC 1013 F DG 1025 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +hydrog55 hydrog ? ? D DC 13 O2 ? ? ? 1_555 F DG 1 N2 ? ? D DC 1013 F DG 1025 1_555 ? ? ? ? ? ? WATSON-CRICK ? ? ? +# +_struct_conn_type.id hydrog +_struct_conn_type.criteria ? +_struct_conn_type.reference ? +# +_struct_sheet.id AA +_struct_sheet.type ? +_struct_sheet.number_strands 5 +_struct_sheet.details ? +# +loop_ +_struct_sheet_order.sheet_id +_struct_sheet_order.range_id_1 +_struct_sheet_order.range_id_2 +_struct_sheet_order.offset +_struct_sheet_order.sense +AA 1 2 ? anti-parallel +AA 2 3 ? anti-parallel +AA 3 4 ? anti-parallel +AA 4 5 ? anti-parallel +# +loop_ +_struct_sheet_range.sheet_id +_struct_sheet_range.id +_struct_sheet_range.beg_label_comp_id +_struct_sheet_range.beg_label_asym_id +_struct_sheet_range.beg_label_seq_id +_struct_sheet_range.pdbx_beg_PDB_ins_code +_struct_sheet_range.end_label_comp_id +_struct_sheet_range.end_label_asym_id +_struct_sheet_range.end_label_seq_id +_struct_sheet_range.pdbx_end_PDB_ins_code +_struct_sheet_range.beg_auth_comp_id +_struct_sheet_range.beg_auth_asym_id +_struct_sheet_range.beg_auth_seq_id +_struct_sheet_range.end_auth_comp_id +_struct_sheet_range.end_auth_asym_id +_struct_sheet_range.end_auth_seq_id +AA 1 TRP A 77 ? ILE A 80 ? TRP A 233 ILE A 236 +AA 2 PHE A 64 ? ASN A 69 ? PHE A 220 ASN A 225 +AA 3 PHE C 64 ? GLN C 68 ? PHE C 1220 GLN C 1224 +AA 4 SER C 76 ? ILE C 80 ? SER C 1232 ILE C 1236 +AA 5 ARG C 21 ? LEU C 22 ? ARG C 1177 LEU C 1178 +# +loop_ +_pdbx_struct_sheet_hbond.sheet_id +_pdbx_struct_sheet_hbond.range_id_1 +_pdbx_struct_sheet_hbond.range_id_2 +_pdbx_struct_sheet_hbond.range_1_label_atom_id +_pdbx_struct_sheet_hbond.range_1_label_comp_id +_pdbx_struct_sheet_hbond.range_1_label_asym_id +_pdbx_struct_sheet_hbond.range_1_label_seq_id +_pdbx_struct_sheet_hbond.range_1_PDB_ins_code +_pdbx_struct_sheet_hbond.range_1_auth_atom_id +_pdbx_struct_sheet_hbond.range_1_auth_comp_id +_pdbx_struct_sheet_hbond.range_1_auth_asym_id +_pdbx_struct_sheet_hbond.range_1_auth_seq_id +_pdbx_struct_sheet_hbond.range_2_label_atom_id +_pdbx_struct_sheet_hbond.range_2_label_comp_id +_pdbx_struct_sheet_hbond.range_2_label_asym_id +_pdbx_struct_sheet_hbond.range_2_label_seq_id +_pdbx_struct_sheet_hbond.range_2_PDB_ins_code +_pdbx_struct_sheet_hbond.range_2_auth_atom_id +_pdbx_struct_sheet_hbond.range_2_auth_comp_id +_pdbx_struct_sheet_hbond.range_2_auth_asym_id +_pdbx_struct_sheet_hbond.range_2_auth_seq_id +AA 1 2 N ILE A 79 ? N ILE A 235 O MET A 65 ? O MET A 221 +AA 2 3 O GLN A 68 ? O GLN A 224 N GLN C 68 ? N GLN C 1224 +AA 3 4 N VAL C 67 ? N VAL C 1223 O TRP C 77 ? O TRP C 1233 +AA 4 5 N TRP C 78 ? N TRP C 1234 O LEU C 22 ? O LEU C 1178 +# +_database_PDB_matrix.entry_id 2UZK +_database_PDB_matrix.origx[1][1] 1.000000 +_database_PDB_matrix.origx[1][2] 0.000000 +_database_PDB_matrix.origx[1][3] 0.000000 +_database_PDB_matrix.origx[2][1] 0.000000 +_database_PDB_matrix.origx[2][2] 1.000000 +_database_PDB_matrix.origx[2][3] 0.000000 +_database_PDB_matrix.origx[3][1] 0.000000 +_database_PDB_matrix.origx[3][2] 0.000000 +_database_PDB_matrix.origx[3][3] 1.000000 +_database_PDB_matrix.origx_vector[1] 0.00000 +_database_PDB_matrix.origx_vector[2] 0.00000 +_database_PDB_matrix.origx_vector[3] 0.00000 +# +_atom_sites.entry_id 2UZK +_atom_sites.fract_transf_matrix[1][1] 0.023830 +_atom_sites.fract_transf_matrix[1][2] 0.013758 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.027516 +_atom_sites.fract_transf_matrix[2][3] 0.000000 +_atom_sites.fract_transf_matrix[3][1] 0.000000 +_atom_sites.fract_transf_matrix[3][2] 0.000000 +_atom_sites.fract_transf_matrix[3][3] 0.002818 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +P +S +# +loop_ +_atom_site.group_PDB +_atom_site.id +_atom_site.type_symbol +_atom_site.label_atom_id +_atom_site.label_alt_id +_atom_site.label_comp_id +_atom_site.label_asym_id +_atom_site.label_entity_id +_atom_site.label_seq_id +_atom_site.pdbx_PDB_ins_code +_atom_site.Cartn_x +_atom_site.Cartn_y +_atom_site.Cartn_z +_atom_site.occupancy +_atom_site.B_iso_or_equiv +_atom_site.pdbx_formal_charge +_atom_site.auth_seq_id +_atom_site.auth_comp_id +_atom_site.auth_asym_id +_atom_site.auth_atom_id +_atom_site.pdbx_PDB_model_num +ATOM 1 N N . MET A 1 1 ? -2.579 -19.429 -9.177 1.00 19.98 ? 157 MET A N 1 +ATOM 2 C CA . MET A 1 1 ? -3.096 -19.690 -7.821 1.00 21.70 ? 157 MET A CA 1 +ATOM 3 C C . MET A 1 1 ? -4.513 -20.295 -7.825 1.00 23.70 ? 157 MET A C 1 +ATOM 4 O O . MET A 1 1 ? -5.495 -19.624 -8.185 1.00 24.51 ? 157 MET A O 1 +ATOM 5 C CB . MET A 1 1 ? -3.100 -18.379 -7.050 1.00 20.22 ? 157 MET A CB 1 +ATOM 6 C CG . MET A 1 1 ? -2.112 -17.353 -7.592 1.00 18.96 ? 157 MET A CG 1 +ATOM 7 S SD . MET A 1 1 ? -2.079 -15.793 -6.643 1.00 15.38 ? 157 MET A SD 1 +ATOM 8 C CE . MET A 1 1 ? -0.617 -16.035 -5.625 1.00 16.43 ? 157 MET A CE 1 +ATOM 9 N N . GLY A 1 2 ? -4.621 -21.564 -7.441 1.00 25.81 ? 158 GLY A N 1 +ATOM 10 C CA . GLY A 1 2 ? -5.928 -22.185 -7.368 1.00 28.61 ? 158 GLY A CA 1 +ATOM 11 C C . GLY A 1 2 ? -6.713 -21.433 -6.315 1.00 30.63 ? 158 GLY A C 1 +ATOM 12 O O . GLY A 1 2 ? -7.460 -20.513 -6.607 1.00 32.40 ? 158 GLY A O 1 +ATOM 13 N N . ASN A 1 3 ? -6.523 -21.821 -5.041 1.00 31.37 ? 159 ASN A N 1 +ATOM 14 C CA . ASN A 1 3 ? -7.192 -21.094 -3.956 1.00 32.13 ? 159 ASN A CA 1 +ATOM 15 C C . ASN A 1 3 ? -6.408 -20.086 -3.217 1.00 31.67 ? 159 ASN A C 1 +ATOM 16 O O . ASN A 1 3 ? -6.885 -18.934 -3.095 1.00 33.08 ? 159 ASN A O 1 +ATOM 17 C CB . ASN A 1 3 ? -7.734 -22.166 -2.970 1.00 34.43 ? 159 ASN A CB 1 +ATOM 18 C CG . ASN A 1 3 ? -8.926 -22.942 -3.486 1.00 36.10 ? 159 ASN A CG 1 +ATOM 19 O OD1 . ASN A 1 3 ? -9.213 -22.932 -4.687 1.00 37.54 ? 159 ASN A OD1 1 +ATOM 20 N ND2 . ASN A 1 3 ? -9.624 -23.623 -2.588 1.00 37.83 ? 159 ASN A ND2 1 +ATOM 21 N N . LEU A 1 4 ? -5.192 -20.383 -2.782 1.00 30.87 ? 160 LEU A N 1 +ATOM 22 C CA . LEU A 1 4 ? -4.496 -19.418 -1.934 1.00 26.51 ? 160 LEU A CA 1 +ATOM 23 C C . LEU A 1 4 ? -3.632 -18.260 -2.391 1.00 23.33 ? 160 LEU A C 1 +ATOM 24 O O . LEU A 1 4 ? -3.286 -18.146 -3.553 1.00 22.47 ? 160 LEU A O 1 +ATOM 25 C CB . LEU A 1 4 ? -3.782 -20.180 -0.848 1.00 27.72 ? 160 LEU A CB 1 +ATOM 26 C CG . LEU A 1 4 ? -2.971 -21.321 -1.436 1.00 29.16 ? 160 LEU A CG 1 +ATOM 27 C CD1 . LEU A 1 4 ? -1.543 -20.996 -1.218 1.00 30.45 ? 160 LEU A CD1 1 +ATOM 28 C CD2 . LEU A 1 4 ? -3.311 -22.642 -0.767 1.00 30.59 ? 160 LEU A CD2 1 +ATOM 29 N N . SER A 1 5 ? -3.291 -17.421 -1.410 1.00 20.38 ? 161 SER A N 1 +ATOM 30 C CA . SER A 1 5 ? -2.505 -16.202 -1.592 1.00 19.05 ? 161 SER A CA 1 +ATOM 31 C C . SER A 1 5 ? -1.011 -16.326 -1.337 1.00 17.98 ? 161 SER A C 1 +ATOM 32 O O . SER A 1 5 ? -0.546 -17.287 -0.716 1.00 18.65 ? 161 SER A O 1 +ATOM 33 C CB . SER A 1 5 ? -3.035 -15.109 -0.659 1.00 15.94 ? 161 SER A CB 1 +ATOM 34 O OG . SER A 1 5 ? -4.428 -15.265 -0.407 1.00 12.38 ? 161 SER A OG 1 +ATOM 35 N N . TYR A 1 6 ? -0.268 -15.331 -1.821 1.00 14.76 ? 162 TYR A N 1 +ATOM 36 C CA . TYR A 1 6 ? 1.176 -15.271 -1.611 1.00 13.12 ? 162 TYR A CA 1 +ATOM 37 C C . TYR A 1 6 ? 1.361 -15.168 -0.105 1.00 12.96 ? 162 TYR A C 1 +ATOM 38 O O . TYR A 1 6 ? 2.169 -15.879 0.487 1.00 12.67 ? 162 TYR A O 1 +ATOM 39 C CB . TYR A 1 6 ? 1.769 -14.022 -2.252 1.00 12.08 ? 162 TYR A CB 1 +ATOM 40 C CG . TYR A 1 6 ? 2.258 -14.207 -3.661 1.00 12.07 ? 162 TYR A CG 1 +ATOM 41 C CD1 . TYR A 1 6 ? 2.616 -13.109 -4.442 1.00 11.22 ? 162 TYR A CD1 1 +ATOM 42 C CD2 . TYR A 1 6 ? 2.371 -15.480 -4.216 1.00 11.07 ? 162 TYR A CD2 1 +ATOM 43 C CE1 . TYR A 1 6 ? 3.068 -13.277 -5.740 1.00 11.97 ? 162 TYR A CE1 1 +ATOM 44 C CE2 . TYR A 1 6 ? 2.824 -15.658 -5.509 1.00 11.41 ? 162 TYR A CE2 1 +ATOM 45 C CZ . TYR A 1 6 ? 3.168 -14.557 -6.267 1.00 11.87 ? 162 TYR A CZ 1 +ATOM 46 O OH . TYR A 1 6 ? 3.594 -14.723 -7.566 1.00 13.62 ? 162 TYR A OH 1 +ATOM 47 N N . ALA A 1 7 ? 0.605 -14.277 0.517 1.00 13.30 ? 163 ALA A N 1 +ATOM 48 C CA . ALA A 1 7 ? 0.681 -14.092 1.957 1.00 14.94 ? 163 ALA A CA 1 +ATOM 49 C C . ALA A 1 7 ? 0.693 -15.463 2.617 1.00 15.76 ? 163 ALA A C 1 +ATOM 50 O O . ALA A 1 7 ? 1.669 -15.862 3.251 1.00 15.89 ? 163 ALA A O 1 +ATOM 51 C CB . ALA A 1 7 ? -0.534 -13.289 2.440 1.00 16.29 ? 163 ALA A CB 1 +ATOM 52 N N . ASP A 1 8 ? -0.406 -16.185 2.439 1.00 16.39 ? 164 ASP A N 1 +ATOM 53 C CA . ASP A 1 8 ? -0.570 -17.514 2.998 1.00 16.87 ? 164 ASP A CA 1 +ATOM 54 C C . ASP A 1 8 ? 0.576 -18.475 2.653 1.00 17.38 ? 164 ASP A C 1 +ATOM 55 O O . ASP A 1 8 ? 1.211 -19.034 3.553 1.00 15.92 ? 164 ASP A O 1 +ATOM 56 C CB . ASP A 1 8 ? -1.917 -18.086 2.542 1.00 17.31 ? 164 ASP A CB 1 +ATOM 57 C CG . ASP A 1 8 ? -2.908 -18.227 3.689 1.00 17.31 ? 164 ASP A CG 1 +ATOM 58 O OD1 . ASP A 1 8 ? -2.774 -17.490 4.693 1.00 16.12 ? 164 ASP A OD1 1 +ATOM 59 O OD2 . ASP A 1 8 ? -3.827 -19.068 3.583 1.00 20.51 ? 164 ASP A OD2 1 +ATOM 60 N N . LEU A 1 9 ? 0.845 -18.667 1.362 1.00 18.96 ? 165 LEU A N 1 +ATOM 61 C CA . LEU A 1 9 ? 1.917 -19.571 0.933 1.00 17.91 ? 165 LEU A CA 1 +ATOM 62 C C . LEU A 1 9 ? 3.176 -19.418 1.757 1.00 18.83 ? 165 LEU A C 1 +ATOM 63 O O . LEU A 1 9 ? 3.711 -20.390 2.270 1.00 17.65 ? 165 LEU A O 1 +ATOM 64 C CB . LEU A 1 9 ? 2.279 -19.340 -0.532 1.00 17.00 ? 165 LEU A CB 1 +ATOM 65 C CG . LEU A 1 9 ? 1.825 -20.395 -1.544 1.00 18.48 ? 165 LEU A CG 1 +ATOM 66 C CD1 . LEU A 1 9 ? 1.448 -21.701 -0.831 1.00 18.27 ? 165 LEU A CD1 1 +ATOM 67 C CD2 . LEU A 1 9 ? 0.674 -19.831 -2.361 1.00 13.28 ? 165 LEU A CD2 1 +ATOM 68 N N . ILE A 1 10 ? 3.654 -18.185 1.868 1.00 21.37 ? 166 ILE A N 1 +ATOM 69 C CA . ILE A 1 10 ? 4.858 -17.902 2.639 1.00 21.41 ? 166 ILE A CA 1 +ATOM 70 C C . ILE A 1 10 ? 4.681 -18.412 4.079 1.00 22.96 ? 166 ILE A C 1 +ATOM 71 O O . ILE A 1 10 ? 5.512 -19.167 4.593 1.00 24.55 ? 166 ILE A O 1 +ATOM 72 C CB . ILE A 1 10 ? 5.146 -16.390 2.663 1.00 20.34 ? 166 ILE A CB 1 +ATOM 73 C CG1 . ILE A 1 10 ? 5.386 -15.887 1.242 1.00 20.29 ? 166 ILE A CG1 1 +ATOM 74 C CG2 . ILE A 1 10 ? 6.356 -16.104 3.535 1.00 18.86 ? 166 ILE A CG2 1 +ATOM 75 C CD1 . ILE A 1 10 ? 5.544 -14.377 1.150 1.00 21.96 ? 166 ILE A CD1 1 +ATOM 76 N N . THR A 1 11 ? 3.586 -18.006 4.714 1.00 20.59 ? 167 THR A N 1 +ATOM 77 C CA . THR A 1 11 ? 3.282 -18.422 6.075 1.00 18.77 ? 167 THR A CA 1 +ATOM 78 C C . THR A 1 11 ? 3.244 -19.953 6.189 1.00 18.07 ? 167 THR A C 1 +ATOM 79 O O . THR A 1 11 ? 3.392 -20.513 7.281 1.00 17.92 ? 167 THR A O 1 +ATOM 80 C CB . THR A 1 11 ? 1.899 -17.879 6.496 1.00 19.13 ? 167 THR A CB 1 +ATOM 81 O OG1 . THR A 1 11 ? 1.834 -16.469 6.244 1.00 17.46 ? 167 THR A OG1 1 +ATOM 82 C CG2 . THR A 1 11 ? 1.640 -18.143 7.967 1.00 19.35 ? 167 THR A CG2 1 +ATOM 83 N N . ARG A 1 12 ? 3.037 -20.613 5.052 1.00 14.40 ? 168 ARG A N 1 +ATOM 84 C CA . ARG A 1 12 ? 2.921 -22.063 4.980 1.00 13.61 ? 168 ARG A CA 1 +ATOM 85 C C . ARG A 1 12 ? 4.283 -22.749 4.876 1.00 12.76 ? 168 ARG A C 1 +ATOM 86 O O . ARG A 1 12 ? 4.551 -23.735 5.559 1.00 10.65 ? 168 ARG A O 1 +ATOM 87 C CB . ARG A 1 12 ? 2.026 -22.401 3.778 1.00 12.34 ? 168 ARG A CB 1 +ATOM 88 C CG . ARG A 1 12 ? 1.612 -23.839 3.617 1.00 12.59 ? 168 ARG A CG 1 +ATOM 89 C CD . ARG A 1 12 ? 0.902 -24.034 2.273 1.00 15.20 ? 168 ARG A CD 1 +ATOM 90 N NE . ARG A 1 12 ? -0.532 -23.732 2.302 1.00 16.26 ? 168 ARG A NE 1 +ATOM 91 C CZ . ARG A 1 12 ? -1.497 -24.641 2.465 1.00 16.97 ? 168 ARG A CZ 1 +ATOM 92 N NH1 . ARG A 1 12 ? -2.766 -24.264 2.475 1.00 17.25 ? 168 ARG A NH1 1 +ATOM 93 N NH2 . ARG A 1 12 ? -1.205 -25.930 2.610 1.00 14.67 ? 168 ARG A NH2 1 +ATOM 94 N N . ALA A 1 13 ? 5.139 -22.211 4.017 1.00 15.56 ? 169 ALA A N 1 +ATOM 95 C CA . ALA A 1 13 ? 6.475 -22.753 3.818 1.00 18.03 ? 169 ALA A CA 1 +ATOM 96 C C . ALA A 1 13 ? 7.171 -22.689 5.154 1.00 19.93 ? 169 ALA A C 1 +ATOM 97 O O . ALA A 1 13 ? 7.750 -23.662 5.625 1.00 21.31 ? 169 ALA A O 1 +ATOM 98 C CB . ALA A 1 13 ? 7.228 -21.912 2.808 1.00 16.94 ? 169 ALA A CB 1 +ATOM 99 N N . ILE A 1 14 ? 7.068 -21.512 5.760 1.00 23.92 ? 170 ILE A N 1 +ATOM 100 C CA . ILE A 1 14 ? 7.657 -21.184 7.052 1.00 24.31 ? 170 ILE A CA 1 +ATOM 101 C C . ILE A 1 14 ? 7.062 -22.043 8.189 1.00 25.72 ? 170 ILE A C 1 +ATOM 102 O O . ILE A 1 14 ? 7.669 -22.182 9.260 1.00 25.01 ? 170 ILE A O 1 +ATOM 103 C CB . ILE A 1 14 ? 7.457 -19.660 7.316 1.00 24.96 ? 170 ILE A CB 1 +ATOM 104 C CG1 . ILE A 1 14 ? 8.516 -19.132 8.276 1.00 24.11 ? 170 ILE A CG1 1 +ATOM 105 C CG2 . ILE A 1 14 ? 6.063 -19.392 7.814 1.00 27.63 ? 170 ILE A CG2 1 +ATOM 106 C CD1 . ILE A 1 14 ? 9.850 -18.935 7.603 1.00 26.61 ? 170 ILE A CD1 1 +ATOM 107 N N . GLU A 1 15 ? 5.890 -22.635 7.940 1.00 26.80 ? 171 GLU A N 1 +ATOM 108 C CA . GLU A 1 15 ? 5.226 -23.498 8.924 1.00 26.68 ? 171 GLU A CA 1 +ATOM 109 C C . GLU A 1 15 ? 5.872 -24.878 9.022 1.00 26.86 ? 171 GLU A C 1 +ATOM 110 O O . GLU A 1 15 ? 6.182 -25.342 10.116 1.00 26.64 ? 171 GLU A O 1 +ATOM 111 C CB . GLU A 1 15 ? 3.742 -23.665 8.590 1.00 28.90 ? 171 GLU A CB 1 +ATOM 112 C CG . GLU A 1 15 ? 2.959 -24.530 9.590 1.00 31.73 ? 171 GLU A CG 1 +ATOM 113 C CD . GLU A 1 15 ? 2.911 -25.997 9.197 1.00 32.10 ? 171 GLU A CD 1 +ATOM 114 O OE1 . GLU A 1 15 ? 2.410 -26.822 9.994 1.00 31.46 ? 171 GLU A OE1 1 +ATOM 115 O OE2 . GLU A 1 15 ? 3.368 -26.324 8.083 1.00 33.77 ? 171 GLU A OE2 1 +ATOM 116 N N . SER A 1 16 ? 6.075 -25.553 7.895 1.00 26.13 ? 172 SER A N 1 +ATOM 117 C CA . SER A 1 16 ? 6.712 -26.862 7.979 1.00 26.30 ? 172 SER A CA 1 +ATOM 118 C C . SER A 1 16 ? 8.178 -26.845 7.550 1.00 24.58 ? 172 SER A C 1 +ATOM 119 O O . SER A 1 16 ? 8.504 -26.905 6.363 1.00 26.80 ? 172 SER A O 1 +ATOM 120 C CB . SER A 1 16 ? 5.929 -27.926 7.188 1.00 26.86 ? 172 SER A CB 1 +ATOM 121 O OG . SER A 1 16 ? 6.020 -27.741 5.787 1.00 29.96 ? 172 SER A OG 1 +ATOM 122 N N . SER A 1 17 ? 9.039 -26.740 8.557 1.00 22.61 ? 173 SER A N 1 +ATOM 123 C CA . SER A 1 17 ? 10.486 -26.733 8.416 1.00 21.73 ? 173 SER A CA 1 +ATOM 124 C C . SER A 1 17 ? 11.010 -27.471 9.660 1.00 19.80 ? 173 SER A C 1 +ATOM 125 O O . SER A 1 17 ? 10.344 -27.483 10.700 1.00 22.34 ? 173 SER A O 1 +ATOM 126 C CB . SER A 1 17 ? 11.009 -25.296 8.397 1.00 21.97 ? 173 SER A CB 1 +ATOM 127 O OG . SER A 1 17 ? 10.574 -24.600 7.244 1.00 23.78 ? 173 SER A OG 1 +ATOM 128 N N . PRO A 1 18 ? 12.192 -28.109 9.568 1.00 17.44 ? 174 PRO A N 1 +ATOM 129 C CA . PRO A 1 18 ? 12.789 -28.844 10.692 1.00 13.71 ? 174 PRO A CA 1 +ATOM 130 C C . PRO A 1 18 ? 12.731 -27.948 11.916 1.00 10.25 ? 174 PRO A C 1 +ATOM 131 O O . PRO A 1 18 ? 12.371 -28.366 13.014 1.00 9.39 ? 174 PRO A O 1 +ATOM 132 C CB . PRO A 1 18 ? 14.218 -29.084 10.221 1.00 15.45 ? 174 PRO A CB 1 +ATOM 133 C CG . PRO A 1 18 ? 14.050 -29.242 8.753 1.00 17.90 ? 174 PRO A CG 1 +ATOM 134 C CD . PRO A 1 18 ? 13.106 -28.096 8.414 1.00 18.06 ? 174 PRO A CD 1 +ATOM 135 N N . ASP A 1 19 ? 13.120 -26.701 11.703 1.00 7.53 ? 175 ASP A N 1 +ATOM 136 C CA . ASP A 1 19 ? 13.063 -25.681 12.734 1.00 4.64 ? 175 ASP A CA 1 +ATOM 137 C C . ASP A 1 19 ? 12.299 -24.619 11.970 1.00 4.24 ? 175 ASP A C 1 +ATOM 138 O O . ASP A 1 19 ? 12.428 -24.522 10.754 1.00 5.11 ? 175 ASP A O 1 +ATOM 139 C CB . ASP A 1 19 ? 14.458 -25.197 13.119 1.00 2.62 ? 175 ASP A CB 1 +ATOM 140 C CG . ASP A 1 19 ? 15.381 -26.330 13.481 1.00 0.00 ? 175 ASP A CG 1 +ATOM 141 O OD1 . ASP A 1 19 ? 16.208 -26.744 12.636 1.00 0.00 ? 175 ASP A OD1 1 +ATOM 142 O OD2 . ASP A 1 19 ? 15.269 -26.810 14.616 1.00 0.00 ? 175 ASP A OD2 1 +ATOM 143 N N . LYS A 1 20 ? 11.507 -23.828 12.670 1.00 5.50 ? 176 LYS A N 1 +ATOM 144 C CA . LYS A 1 20 ? 10.671 -22.825 12.024 1.00 7.23 ? 176 LYS A CA 1 +ATOM 145 C C . LYS A 1 20 ? 11.215 -21.840 10.979 1.00 7.04 ? 176 LYS A C 1 +ATOM 146 O O . LYS A 1 20 ? 10.493 -21.457 10.068 1.00 9.90 ? 176 LYS A O 1 +ATOM 147 C CB . LYS A 1 20 ? 9.963 -22.017 13.106 1.00 7.84 ? 176 LYS A CB 1 +ATOM 148 C CG . LYS A 1 20 ? 9.190 -20.843 12.551 1.00 8.53 ? 176 LYS A CG 1 +ATOM 149 C CD . LYS A 1 20 ? 8.690 -19.973 13.653 1.00 7.31 ? 176 LYS A CD 1 +ATOM 150 C CE . LYS A 1 20 ? 7.775 -18.906 13.125 1.00 5.10 ? 176 LYS A CE 1 +ATOM 151 N NZ . LYS A 1 20 ? 7.184 -18.174 14.267 1.00 6.58 ? 176 LYS A NZ 1 +ATOM 152 N N . ARG A 1 21 ? 12.472 -21.447 11.090 1.00 6.68 ? 177 ARG A N 1 +ATOM 153 C CA . ARG A 1 21 ? 13.039 -20.434 10.202 1.00 6.75 ? 177 ARG A CA 1 +ATOM 154 C C . ARG A 1 21 ? 13.474 -20.713 8.762 1.00 4.60 ? 177 ARG A C 1 +ATOM 155 O O . ARG A 1 21 ? 14.163 -21.692 8.480 1.00 6.96 ? 177 ARG A O 1 +ATOM 156 C CB . ARG A 1 21 ? 14.224 -19.802 10.917 1.00 9.31 ? 177 ARG A CB 1 +ATOM 157 C CG . ARG A 1 21 ? 15.384 -20.741 11.028 1.00 5.58 ? 177 ARG A CG 1 +ATOM 158 C CD . ARG A 1 21 ? 16.159 -20.458 12.270 1.00 4.23 ? 177 ARG A CD 1 +ATOM 159 N NE . ARG A 1 21 ? 16.030 -21.542 13.235 1.00 5.22 ? 177 ARG A NE 1 +ATOM 160 C CZ . ARG A 1 21 ? 17.058 -22.061 13.900 1.00 5.39 ? 177 ARG A CZ 1 +ATOM 161 N NH1 . ARG A 1 21 ? 16.866 -23.051 14.772 1.00 4.65 ? 177 ARG A NH1 1 +ATOM 162 N NH2 . ARG A 1 21 ? 18.284 -21.589 13.682 1.00 2.28 ? 177 ARG A NH2 1 +ATOM 163 N N . LEU A 1 22 ? 13.090 -19.802 7.869 1.00 2.72 ? 178 LEU A N 1 +ATOM 164 C CA . LEU A 1 22 ? 13.471 -19.859 6.465 1.00 0.00 ? 178 LEU A CA 1 +ATOM 165 C C . LEU A 1 22 ? 14.109 -18.528 6.019 1.00 0.00 ? 178 LEU A C 1 +ATOM 166 O O . LEU A 1 22 ? 14.098 -17.501 6.730 1.00 0.00 ? 178 LEU A O 1 +ATOM 167 C CB . LEU A 1 22 ? 12.279 -20.172 5.564 1.00 0.00 ? 178 LEU A CB 1 +ATOM 168 C CG . LEU A 1 22 ? 11.728 -21.600 5.645 1.00 0.00 ? 178 LEU A CG 1 +ATOM 169 C CD1 . LEU A 1 22 ? 10.568 -21.764 4.682 1.00 0.00 ? 178 LEU A CD1 1 +ATOM 170 C CD2 . LEU A 1 22 ? 12.844 -22.606 5.336 1.00 0.00 ? 178 LEU A CD2 1 +ATOM 171 N N . THR A 1 23 ? 14.653 -18.567 4.814 1.00 0.00 ? 179 THR A N 1 +ATOM 172 C CA . THR A 1 23 ? 15.338 -17.439 4.224 1.00 1.05 ? 179 THR A CA 1 +ATOM 173 C C . THR A 1 23 ? 14.814 -17.258 2.813 1.00 0.50 ? 179 THR A C 1 +ATOM 174 O O . THR A 1 23 ? 14.369 -18.222 2.185 1.00 0.00 ? 179 THR A O 1 +ATOM 175 C CB . THR A 1 23 ? 16.828 -17.740 4.186 1.00 0.00 ? 179 THR A CB 1 +ATOM 176 O OG1 . THR A 1 23 ? 17.233 -18.116 5.506 1.00 0.00 ? 179 THR A OG1 1 +ATOM 177 C CG2 . THR A 1 23 ? 17.627 -16.518 3.708 1.00 0.00 ? 179 THR A CG2 1 +ATOM 178 N N . LEU A 1 24 ? 14.853 -16.032 2.310 1.00 0.71 ? 180 LEU A N 1 +ATOM 179 C CA . LEU A 1 24 ? 14.371 -15.811 0.962 1.00 0.22 ? 180 LEU A CA 1 +ATOM 180 C C . LEU A 1 24 ? 14.788 -17.021 0.131 1.00 0.00 ? 180 LEU A C 1 +ATOM 181 O O . LEU A 1 24 ? 13.949 -17.831 -0.250 1.00 0.00 ? 180 LEU A O 1 +ATOM 182 C CB . LEU A 1 24 ? 14.962 -14.524 0.390 1.00 0.00 ? 180 LEU A CB 1 +ATOM 183 C CG . LEU A 1 24 ? 14.338 -13.204 0.835 1.00 0.00 ? 180 LEU A CG 1 +ATOM 184 C CD1 . LEU A 1 24 ? 14.396 -13.085 2.317 1.00 0.00 ? 180 LEU A CD1 1 +ATOM 185 C CD2 . LEU A 1 24 ? 15.078 -12.057 0.191 1.00 0.00 ? 180 LEU A CD2 1 +ATOM 186 N N . SER A 1 25 ? 16.087 -17.156 -0.122 1.00 0.78 ? 181 SER A N 1 +ATOM 187 C CA . SER A 1 25 ? 16.594 -18.290 -0.901 1.00 2.74 ? 181 SER A CA 1 +ATOM 188 C C . SER A 1 25 ? 15.828 -19.579 -0.573 1.00 1.03 ? 181 SER A C 1 +ATOM 189 O O . SER A 1 25 ? 15.271 -20.222 -1.470 1.00 0.00 ? 181 SER A O 1 +ATOM 190 C CB . SER A 1 25 ? 18.082 -18.483 -0.625 1.00 3.17 ? 181 SER A CB 1 +ATOM 191 O OG . SER A 1 25 ? 18.347 -18.291 0.758 1.00 12.97 ? 181 SER A OG 1 +ATOM 192 N N . GLN A 1 26 ? 15.778 -19.922 0.714 1.00 0.42 ? 182 GLN A N 1 +ATOM 193 C CA . GLN A 1 26 ? 15.080 -21.116 1.196 1.00 0.00 ? 182 GLN A CA 1 +ATOM 194 C C . GLN A 1 26 ? 13.593 -21.043 0.910 1.00 0.00 ? 182 GLN A C 1 +ATOM 195 O O . GLN A 1 26 ? 12.984 -22.036 0.537 1.00 0.00 ? 182 GLN A O 1 +ATOM 196 C CB . GLN A 1 26 ? 15.294 -21.288 2.708 1.00 0.00 ? 182 GLN A CB 1 +ATOM 197 C CG . GLN A 1 26 ? 16.757 -21.464 3.100 1.00 1.73 ? 182 GLN A CG 1 +ATOM 198 C CD . GLN A 1 26 ? 16.955 -21.477 4.593 1.00 1.40 ? 182 GLN A CD 1 +ATOM 199 O OE1 . GLN A 1 26 ? 16.434 -22.339 5.278 1.00 3.20 ? 182 GLN A OE1 1 +ATOM 200 N NE2 . GLN A 1 26 ? 17.704 -20.517 5.107 1.00 5.21 ? 182 GLN A NE2 1 +ATOM 201 N N . ILE A 1 27 ? 13.001 -19.871 1.111 1.00 1.08 ? 183 ILE A N 1 +ATOM 202 C CA . ILE A 1 27 ? 11.578 -19.704 0.841 1.00 1.80 ? 183 ILE A CA 1 +ATOM 203 C C . ILE A 1 27 ? 11.445 -19.895 -0.659 1.00 3.63 ? 183 ILE A C 1 +ATOM 204 O O . ILE A 1 27 ? 10.718 -20.756 -1.125 1.00 5.55 ? 183 ILE A O 1 +ATOM 205 C CB . ILE A 1 27 ? 11.082 -18.296 1.221 1.00 1.22 ? 183 ILE A CB 1 +ATOM 206 C CG1 . ILE A 1 27 ? 11.380 -18.008 2.694 1.00 0.00 ? 183 ILE A CG1 1 +ATOM 207 C CG2 . ILE A 1 27 ? 9.597 -18.196 0.971 1.00 0.95 ? 183 ILE A CG2 1 +ATOM 208 C CD1 . ILE A 1 27 ? 11.217 -16.572 3.068 1.00 0.00 ? 183 ILE A CD1 1 +ATOM 209 N N . TYR A 1 28 ? 12.183 -19.099 -1.416 1.00 7.49 ? 184 TYR A N 1 +ATOM 210 C CA . TYR A 1 28 ? 12.160 -19.204 -2.867 1.00 8.95 ? 184 TYR A CA 1 +ATOM 211 C C . TYR A 1 28 ? 12.221 -20.677 -3.281 1.00 9.71 ? 184 TYR A C 1 +ATOM 212 O O . TYR A 1 28 ? 11.502 -21.105 -4.176 1.00 9.45 ? 184 TYR A O 1 +ATOM 213 C CB . TYR A 1 28 ? 13.345 -18.443 -3.470 1.00 10.26 ? 184 TYR A CB 1 +ATOM 214 C CG . TYR A 1 28 ? 13.267 -16.940 -3.309 1.00 10.28 ? 184 TYR A CG 1 +ATOM 215 C CD1 . TYR A 1 28 ? 12.140 -16.234 -3.737 1.00 12.55 ? 184 TYR A CD1 1 +ATOM 216 C CD2 . TYR A 1 28 ? 14.337 -16.216 -2.782 1.00 7.23 ? 184 TYR A CD2 1 +ATOM 217 C CE1 . TYR A 1 28 ? 12.084 -14.836 -3.650 1.00 12.97 ? 184 TYR A CE1 1 +ATOM 218 C CE2 . TYR A 1 28 ? 14.287 -14.816 -2.689 1.00 7.65 ? 184 TYR A CE2 1 +ATOM 219 C CZ . TYR A 1 28 ? 13.160 -14.139 -3.128 1.00 9.20 ? 184 TYR A CZ 1 +ATOM 220 O OH . TYR A 1 28 ? 13.101 -12.767 -3.076 1.00 6.82 ? 184 TYR A OH 1 +ATOM 221 N N . GLU A 1 29 ? 13.072 -21.456 -2.619 1.00 12.33 ? 185 GLU A N 1 +ATOM 222 C CA . GLU A 1 29 ? 13.190 -22.877 -2.944 1.00 13.12 ? 185 GLU A CA 1 +ATOM 223 C C . GLU A 1 29 ? 11.864 -23.593 -2.733 1.00 12.55 ? 185 GLU A C 1 +ATOM 224 O O . GLU A 1 29 ? 11.436 -24.384 -3.589 1.00 13.52 ? 185 GLU A O 1 +ATOM 225 C CB . GLU A 1 29 ? 14.272 -23.539 -2.094 1.00 11.28 ? 185 GLU A CB 1 +ATOM 226 C CG . GLU A 1 29 ? 15.632 -22.939 -2.313 1.00 17.44 ? 185 GLU A CG 1 +ATOM 227 C CD . GLU A 1 29 ? 16.121 -23.119 -3.734 1.00 20.88 ? 185 GLU A CD 1 +ATOM 228 O OE1 . GLU A 1 29 ? 17.128 -22.485 -4.129 1.00 21.98 ? 185 GLU A OE1 1 +ATOM 229 O OE2 . GLU A 1 29 ? 15.497 -23.916 -4.460 1.00 26.48 ? 185 GLU A OE2 1 +ATOM 230 N N . TRP A 1 30 ? 11.216 -23.322 -1.602 1.00 9.39 ? 186 TRP A N 1 +ATOM 231 C CA . TRP A 1 30 ? 9.943 -23.964 -1.327 1.00 8.03 ? 186 TRP A CA 1 +ATOM 232 C C . TRP A 1 30 ? 9.060 -23.723 -2.544 1.00 6.60 ? 186 TRP A C 1 +ATOM 233 O O . TRP A 1 30 ? 8.680 -24.652 -3.251 1.00 4.23 ? 186 TRP A O 1 +ATOM 234 C CB . TRP A 1 30 ? 9.278 -23.380 -0.070 1.00 7.86 ? 186 TRP A CB 1 +ATOM 235 C CG . TRP A 1 30 ? 8.258 -24.320 0.546 1.00 9.38 ? 186 TRP A CG 1 +ATOM 236 C CD1 . TRP A 1 30 ? 8.518 -25.492 1.198 1.00 11.93 ? 186 TRP A CD1 1 +ATOM 237 C CD2 . TRP A 1 30 ? 6.826 -24.203 0.498 1.00 11.37 ? 186 TRP A CD2 1 +ATOM 238 N NE1 . TRP A 1 30 ? 7.344 -26.116 1.555 1.00 10.57 ? 186 TRP A NE1 1 +ATOM 239 C CE2 . TRP A 1 30 ? 6.291 -25.349 1.136 1.00 11.50 ? 186 TRP A CE2 1 +ATOM 240 C CE3 . TRP A 1 30 ? 5.943 -23.244 -0.024 1.00 11.35 ? 186 TRP A CE3 1 +ATOM 241 C CZ2 . TRP A 1 30 ? 4.913 -25.562 1.261 1.00 11.51 ? 186 TRP A CZ2 1 +ATOM 242 C CZ3 . TRP A 1 30 ? 4.570 -23.456 0.102 1.00 9.68 ? 186 TRP A CZ3 1 +ATOM 243 C CH2 . TRP A 1 30 ? 4.071 -24.606 0.739 1.00 11.89 ? 186 TRP A CH2 1 +ATOM 244 N N . MET A 1 31 ? 8.767 -22.458 -2.801 1.00 5.51 ? 187 MET A N 1 +ATOM 245 C CA . MET A 1 31 ? 7.917 -22.074 -3.915 1.00 5.54 ? 187 MET A CA 1 +ATOM 246 C C . MET A 1 31 ? 8.196 -22.859 -5.191 1.00 5.28 ? 187 MET A C 1 +ATOM 247 O O . MET A 1 31 ? 7.352 -23.618 -5.673 1.00 4.17 ? 187 MET A O 1 +ATOM 248 C CB . MET A 1 31 ? 8.079 -20.577 -4.189 1.00 4.63 ? 187 MET A CB 1 +ATOM 249 C CG . MET A 1 31 ? 7.887 -19.741 -2.949 1.00 4.84 ? 187 MET A CG 1 +ATOM 250 S SD . MET A 1 31 ? 6.394 -20.244 -2.082 1.00 5.00 ? 187 MET A SD 1 +ATOM 251 C CE . MET A 1 31 ? 5.235 -18.895 -2.646 1.00 4.47 ? 187 MET A CE 1 +ATOM 252 N N . VAL A 1 32 ? 9.390 -22.652 -5.732 1.00 5.80 ? 188 VAL A N 1 +ATOM 253 C CA . VAL A 1 32 ? 9.824 -23.284 -6.963 1.00 4.99 ? 188 VAL A CA 1 +ATOM 254 C C . VAL A 1 32 ? 9.738 -24.806 -6.975 1.00 5.57 ? 188 VAL A C 1 +ATOM 255 O O . VAL A 1 32 ? 9.522 -25.396 -8.021 1.00 1.92 ? 188 VAL A O 1 +ATOM 256 C CB . VAL A 1 32 ? 11.275 -22.918 -7.273 1.00 7.94 ? 188 VAL A CB 1 +ATOM 257 C CG1 . VAL A 1 32 ? 11.598 -23.343 -8.673 1.00 9.32 ? 188 VAL A CG1 1 +ATOM 258 C CG2 . VAL A 1 32 ? 11.516 -21.422 -7.082 1.00 6.83 ? 188 VAL A CG2 1 +ATOM 259 N N . ARG A 1 33 ? 9.928 -25.445 -5.823 1.00 10.99 ? 189 ARG A N 1 +ATOM 260 C CA . ARG A 1 33 ? 9.890 -26.906 -5.755 1.00 14.67 ? 189 ARG A CA 1 +ATOM 261 C C . ARG A 1 33 ? 8.521 -27.505 -5.458 1.00 13.62 ? 189 ARG A C 1 +ATOM 262 O O . ARG A 1 33 ? 8.193 -28.584 -5.953 1.00 10.19 ? 189 ARG A O 1 +ATOM 263 C CB . ARG A 1 33 ? 10.895 -27.426 -4.721 1.00 21.28 ? 189 ARG A CB 1 +ATOM 264 C CG . ARG A 1 33 ? 10.859 -28.955 -4.583 1.00 28.69 ? 189 ARG A CG 1 +ATOM 265 C CD . ARG A 1 33 ? 12.103 -29.507 -3.900 1.00 36.02 ? 189 ARG A CD 1 +ATOM 266 N NE . ARG A 1 33 ? 12.001 -30.950 -3.698 1.00 41.45 ? 189 ARG A NE 1 +ATOM 267 C CZ . ARG A 1 33 ? 12.970 -31.704 -3.187 1.00 44.23 ? 189 ARG A CZ 1 +ATOM 268 N NH1 . ARG A 1 33 ? 12.786 -33.016 -3.036 1.00 43.92 ? 189 ARG A NH1 1 +ATOM 269 N NH2 . ARG A 1 33 ? 14.128 -31.149 -2.832 1.00 43.34 ? 189 ARG A NH2 1 +ATOM 270 N N . CYS A 1 34 ? 7.731 -26.815 -4.640 1.00 16.32 ? 190 CYS A N 1 +ATOM 271 C CA . CYS A 1 34 ? 6.397 -27.298 -4.301 1.00 19.91 ? 190 CYS A CA 1 +ATOM 272 C C . CYS A 1 34 ? 5.332 -26.638 -5.171 1.00 17.58 ? 190 CYS A C 1 +ATOM 273 O O . CYS A 1 34 ? 5.600 -25.644 -5.844 1.00 18.18 ? 190 CYS A O 1 +ATOM 274 C CB . CYS A 1 34 ? 6.099 -27.051 -2.822 1.00 20.60 ? 190 CYS A CB 1 +ATOM 275 S SG . CYS A 1 34 ? 7.350 -27.742 -1.717 1.00 29.07 ? 190 CYS A SG 1 +ATOM 276 N N . VAL A 1 35 ? 4.129 -27.205 -5.140 1.00 18.12 ? 191 VAL A N 1 +ATOM 277 C CA . VAL A 1 35 ? 2.989 -26.726 -5.927 1.00 20.71 ? 191 VAL A CA 1 +ATOM 278 C C . VAL A 1 35 ? 3.390 -26.390 -7.360 1.00 18.33 ? 191 VAL A C 1 +ATOM 279 O O . VAL A 1 35 ? 4.014 -25.368 -7.634 1.00 17.14 ? 191 VAL A O 1 +ATOM 280 C CB . VAL A 1 35 ? 2.318 -25.484 -5.311 1.00 18.71 ? 191 VAL A CB 1 +ATOM 281 C CG1 . VAL A 1 35 ? 1.088 -25.110 -6.141 1.00 17.47 ? 191 VAL A CG1 1 +ATOM 282 C CG2 . VAL A 1 35 ? 1.923 -25.765 -3.878 1.00 18.12 ? 191 VAL A CG2 1 +ATOM 283 N N . PRO A 1 36 ? 3.007 -27.250 -8.302 1.00 17.57 ? 192 PRO A N 1 +ATOM 284 C CA . PRO A 1 36 ? 3.337 -27.038 -9.706 1.00 20.13 ? 192 PRO A CA 1 +ATOM 285 C C . PRO A 1 36 ? 3.484 -25.585 -10.152 1.00 17.64 ? 192 PRO A C 1 +ATOM 286 O O . PRO A 1 36 ? 4.373 -25.266 -10.930 1.00 17.64 ? 192 PRO A O 1 +ATOM 287 C CB . PRO A 1 36 ? 2.203 -27.765 -10.425 1.00 19.88 ? 192 PRO A CB 1 +ATOM 288 C CG . PRO A 1 36 ? 1.996 -28.966 -9.536 1.00 20.90 ? 192 PRO A CG 1 +ATOM 289 C CD . PRO A 1 36 ? 2.033 -28.349 -8.147 1.00 19.99 ? 192 PRO A CD 1 +ATOM 290 N N . TYR A 1 37 ? 2.624 -24.708 -9.649 1.00 18.17 ? 193 TYR A N 1 +ATOM 291 C CA . TYR A 1 37 ? 2.628 -23.301 -10.048 1.00 19.28 ? 193 TYR A CA 1 +ATOM 292 C C . TYR A 1 37 ? 3.977 -22.636 -10.344 1.00 19.66 ? 193 TYR A C 1 +ATOM 293 O O . TYR A 1 37 ? 4.247 -22.312 -11.501 1.00 17.15 ? 193 TYR A O 1 +ATOM 294 C CB . TYR A 1 37 ? 1.835 -22.472 -9.035 1.00 18.86 ? 193 TYR A CB 1 +ATOM 295 C CG . TYR A 1 37 ? 1.611 -21.042 -9.461 1.00 22.13 ? 193 TYR A CG 1 +ATOM 296 C CD1 . TYR A 1 37 ? 0.952 -20.726 -10.659 1.00 20.50 ? 193 TYR A CD1 1 +ATOM 297 C CD2 . TYR A 1 37 ? 2.068 -19.995 -8.668 1.00 24.32 ? 193 TYR A CD2 1 +ATOM 298 C CE1 . TYR A 1 37 ? 0.760 -19.398 -11.046 1.00 19.88 ? 193 TYR A CE1 1 +ATOM 299 C CE2 . TYR A 1 37 ? 1.886 -18.668 -9.045 1.00 23.31 ? 193 TYR A CE2 1 +ATOM 300 C CZ . TYR A 1 37 ? 1.232 -18.375 -10.230 1.00 22.86 ? 193 TYR A CZ 1 +ATOM 301 O OH . TYR A 1 37 ? 1.057 -17.052 -10.576 1.00 23.75 ? 193 TYR A OH 1 +ATOM 302 N N . PHE A 1 38 ? 4.817 -22.407 -9.334 1.00 23.37 ? 194 PHE A N 1 +ATOM 303 C CA . PHE A 1 38 ? 6.128 -21.774 -9.580 1.00 27.80 ? 194 PHE A CA 1 +ATOM 304 C C . PHE A 1 38 ? 7.140 -22.752 -10.164 1.00 29.64 ? 194 PHE A C 1 +ATOM 305 O O . PHE A 1 38 ? 7.196 -23.907 -9.762 1.00 29.55 ? 194 PHE A O 1 +ATOM 306 C CB . PHE A 1 38 ? 6.730 -21.180 -8.303 1.00 26.51 ? 194 PHE A CB 1 +ATOM 307 C CG . PHE A 1 38 ? 6.049 -19.934 -7.822 1.00 23.79 ? 194 PHE A CG 1 +ATOM 308 C CD1 . PHE A 1 38 ? 5.118 -19.992 -6.792 1.00 24.48 ? 194 PHE A CD1 1 +ATOM 309 C CD2 . PHE A 1 38 ? 6.370 -18.703 -8.361 1.00 21.20 ? 194 PHE A CD2 1 +ATOM 310 C CE1 . PHE A 1 38 ? 4.518 -18.833 -6.302 1.00 24.40 ? 194 PHE A CE1 1 +ATOM 311 C CE2 . PHE A 1 38 ? 5.776 -17.546 -7.878 1.00 23.05 ? 194 PHE A CE2 1 +ATOM 312 C CZ . PHE A 1 38 ? 4.852 -17.608 -6.846 1.00 22.33 ? 194 PHE A CZ 1 +ATOM 313 N N . LYS A 1 39 ? 7.965 -22.271 -11.089 1.00 34.76 ? 195 LYS A N 1 +ATOM 314 C CA . LYS A 1 39 ? 8.955 -23.120 -11.759 1.00 38.49 ? 195 LYS A CA 1 +ATOM 315 C C . LYS A 1 39 ? 10.362 -22.521 -11.862 1.00 40.15 ? 195 LYS A C 1 +ATOM 316 O O . LYS A 1 39 ? 11.338 -23.221 -12.136 1.00 38.56 ? 195 LYS A O 1 +ATOM 317 C CB . LYS A 1 39 ? 8.451 -23.442 -13.171 1.00 39.63 ? 195 LYS A CB 1 +ATOM 318 C CG . LYS A 1 39 ? 9.343 -24.390 -13.965 1.00 41.00 ? 195 LYS A CG 1 +ATOM 319 C CD . LYS A 1 39 ? 9.925 -23.719 -15.204 1.00 40.70 ? 195 LYS A CD 1 +ATOM 320 C CE . LYS A 1 39 ? 11.448 -23.691 -15.153 1.00 41.47 ? 195 LYS A CE 1 +ATOM 321 N NZ . LYS A 1 39 ? 12.034 -25.048 -14.966 1.00 37.53 ? 195 LYS A NZ 1 +ATOM 322 N N . ASP A 1 40 ? 10.447 -21.226 -11.604 1.00 44.36 ? 196 ASP A N 1 +ATOM 323 C CA . ASP A 1 40 ? 11.673 -20.453 -11.711 1.00 48.20 ? 196 ASP A CA 1 +ATOM 324 C C . ASP A 1 40 ? 13.046 -20.928 -11.294 1.00 50.95 ? 196 ASP A C 1 +ATOM 325 O O . ASP A 1 40 ? 13.910 -21.032 -12.147 1.00 52.65 ? 196 ASP A O 1 +ATOM 326 C CB . ASP A 1 40 ? 11.397 -19.090 -11.125 1.00 49.30 ? 196 ASP A CB 1 +ATOM 327 C CG . ASP A 1 40 ? 10.209 -18.473 -11.775 1.00 50.55 ? 196 ASP A CG 1 +ATOM 328 O OD1 . ASP A 1 40 ? 10.017 -18.792 -12.964 1.00 52.85 ? 196 ASP A OD1 1 +ATOM 329 O OD2 . ASP A 1 40 ? 9.466 -17.703 -11.149 1.00 51.70 ? 196 ASP A OD2 1 +ATOM 330 N N . LYS A 1 41 ? 13.273 -21.216 -10.020 1.00 54.45 ? 197 LYS A N 1 +ATOM 331 C CA . LYS A 1 41 ? 14.609 -21.631 -9.594 1.00 57.08 ? 197 LYS A CA 1 +ATOM 332 C C . LYS A 1 41 ? 14.896 -23.138 -9.639 1.00 57.83 ? 197 LYS A C 1 +ATOM 333 O O . LYS A 1 41 ? 16.045 -23.552 -9.493 1.00 59.88 ? 197 LYS A O 1 +ATOM 334 C CB . LYS A 1 41 ? 14.872 -21.074 -8.187 1.00 58.90 ? 197 LYS A CB 1 +ATOM 335 C CG . LYS A 1 41 ? 15.128 -22.117 -7.118 1.00 62.31 ? 197 LYS A CG 1 +ATOM 336 C CD . LYS A 1 41 ? 16.612 -22.427 -7.007 1.00 64.89 ? 197 LYS A CD 1 +ATOM 337 C CE . LYS A 1 41 ? 16.854 -23.902 -6.719 1.00 65.23 ? 197 LYS A CE 1 +ATOM 338 N NZ . LYS A 1 41 ? 18.219 -24.127 -6.169 1.00 63.93 ? 197 LYS A NZ 1 +ATOM 339 N N . GLY A 1 42 ? 13.861 -23.944 -9.866 1.00 58.51 ? 198 GLY A N 1 +ATOM 340 C CA . GLY A 1 42 ? 13.995 -25.397 -9.897 1.00 58.39 ? 198 GLY A CA 1 +ATOM 341 C C . GLY A 1 42 ? 15.265 -25.993 -10.479 1.00 58.46 ? 198 GLY A C 1 +ATOM 342 O O . GLY A 1 42 ? 16.361 -25.789 -9.951 1.00 58.10 ? 198 GLY A O 1 +ATOM 343 N N . ASP A 1 43 ? 15.117 -26.763 -11.553 1.00 57.97 ? 199 ASP A N 1 +ATOM 344 C CA . ASP A 1 43 ? 16.267 -27.367 -12.207 1.00 58.52 ? 199 ASP A CA 1 +ATOM 345 C C . ASP A 1 43 ? 17.012 -26.250 -12.942 1.00 58.68 ? 199 ASP A C 1 +ATOM 346 O O . ASP A 1 43 ? 18.241 -26.254 -13.002 1.00 59.37 ? 199 ASP A O 1 +ATOM 347 C CB . ASP A 1 43 ? 15.816 -28.462 -13.181 1.00 57.72 ? 199 ASP A CB 1 +ATOM 348 C CG . ASP A 1 43 ? 14.947 -29.513 -12.512 1.00 57.04 ? 199 ASP A CG 1 +ATOM 349 O OD1 . ASP A 1 43 ? 14.761 -30.603 -13.095 1.00 57.76 ? 199 ASP A OD1 1 +ATOM 350 O OD2 . ASP A 1 43 ? 14.440 -29.245 -11.404 1.00 57.08 ? 199 ASP A OD2 1 +ATOM 351 N N . SER A 1 44 ? 16.253 -25.296 -13.488 1.00 58.08 ? 200 SER A N 1 +ATOM 352 C CA . SER A 1 44 ? 16.801 -24.125 -14.192 1.00 56.56 ? 200 SER A CA 1 +ATOM 353 C C . SER A 1 44 ? 16.507 -22.927 -13.289 1.00 54.40 ? 200 SER A C 1 +ATOM 354 O O . SER A 1 44 ? 16.206 -23.133 -12.115 1.00 53.84 ? 200 SER A O 1 +ATOM 355 C CB . SER A 1 44 ? 16.124 -23.930 -15.552 1.00 58.02 ? 200 SER A CB 1 +ATOM 356 O OG . SER A 1 44 ? 16.609 -22.767 -16.207 1.00 54.93 ? 200 SER A OG 1 +ATOM 357 N N . ASN A 1 45 ? 16.566 -21.690 -13.793 1.00 53.20 ? 201 ASN A N 1 +ATOM 358 C CA . ASN A 1 45 ? 16.293 -20.583 -12.871 1.00 52.22 ? 201 ASN A CA 1 +ATOM 359 C C . ASN A 1 45 ? 15.853 -19.141 -13.209 1.00 50.79 ? 201 ASN A C 1 +ATOM 360 O O . ASN A 1 45 ? 16.397 -18.456 -14.078 1.00 48.78 ? 201 ASN A O 1 +ATOM 361 C CB . ASN A 1 45 ? 17.461 -20.471 -11.881 1.00 53.24 ? 201 ASN A CB 1 +ATOM 362 C CG . ASN A 1 45 ? 18.736 -19.986 -12.532 1.00 54.57 ? 201 ASN A CG 1 +ATOM 363 O OD1 . ASN A 1 45 ? 19.398 -20.726 -13.262 1.00 55.35 ? 201 ASN A OD1 1 +ATOM 364 N ND2 . ASN A 1 45 ? 19.086 -18.729 -12.277 1.00 55.46 ? 201 ASN A ND2 1 +ATOM 365 N N . SER A 1 46 ? 14.841 -18.722 -12.450 1.00 50.61 ? 202 SER A N 1 +ATOM 366 C CA . SER A 1 46 ? 14.256 -17.382 -12.424 1.00 49.61 ? 202 SER A CA 1 +ATOM 367 C C . SER A 1 46 ? 13.315 -16.712 -13.430 1.00 48.38 ? 202 SER A C 1 +ATOM 368 O O . SER A 1 46 ? 13.717 -16.333 -14.532 1.00 48.88 ? 202 SER A O 1 +ATOM 369 C CB . SER A 1 46 ? 15.377 -16.386 -12.125 1.00 49.17 ? 202 SER A CB 1 +ATOM 370 O OG . SER A 1 46 ? 15.934 -16.633 -10.848 1.00 50.57 ? 202 SER A OG 1 +ATOM 371 N N . SER A 1 47 ? 12.060 -16.545 -13.005 1.00 46.87 ? 203 SER A N 1 +ATOM 372 C CA . SER A 1 47 ? 11.050 -15.814 -13.770 1.00 42.88 ? 203 SER A CA 1 +ATOM 373 C C . SER A 1 47 ? 10.953 -14.494 -13.012 1.00 41.74 ? 203 SER A C 1 +ATOM 374 O O . SER A 1 47 ? 11.542 -14.332 -11.939 1.00 39.06 ? 203 SER A O 1 +ATOM 375 C CB . SER A 1 47 ? 9.665 -16.475 -13.765 1.00 43.08 ? 203 SER A CB 1 +ATOM 376 O OG . SER A 1 47 ? 9.428 -17.245 -14.934 1.00 38.89 ? 203 SER A OG 1 +ATOM 377 N N . ALA A 1 48 ? 10.175 -13.573 -13.562 1.00 37.74 ? 204 ALA A N 1 +ATOM 378 C CA . ALA A 1 48 ? 10.010 -12.233 -13.021 1.00 35.07 ? 204 ALA A CA 1 +ATOM 379 C C . ALA A 1 48 ? 9.587 -11.973 -11.569 1.00 32.57 ? 204 ALA A C 1 +ATOM 380 O O . ALA A 1 48 ? 9.989 -12.664 -10.633 1.00 32.49 ? 204 ALA A O 1 +ATOM 381 C CB . ALA A 1 48 ? 9.096 -11.455 -13.951 1.00 31.71 ? 204 ALA A CB 1 +ATOM 382 N N . GLY A 1 49 ? 8.764 -10.918 -11.448 1.00 27.80 ? 205 GLY A N 1 +ATOM 383 C CA . GLY A 1 49 ? 8.234 -10.385 -10.200 1.00 20.93 ? 205 GLY A CA 1 +ATOM 384 C C . GLY A 1 49 ? 7.780 -11.127 -8.957 1.00 18.62 ? 205 GLY A C 1 +ATOM 385 O O . GLY A 1 49 ? 7.776 -10.528 -7.887 1.00 20.67 ? 205 GLY A O 1 +ATOM 386 N N . TRP A 1 50 ? 7.375 -12.385 -9.042 1.00 15.10 ? 206 TRP A N 1 +ATOM 387 C CA . TRP A 1 50 ? 6.953 -13.061 -7.821 1.00 11.19 ? 206 TRP A CA 1 +ATOM 388 C C . TRP A 1 50 ? 8.079 -12.951 -6.799 1.00 11.99 ? 206 TRP A C 1 +ATOM 389 O O . TRP A 1 50 ? 7.833 -12.948 -5.588 1.00 13.02 ? 206 TRP A O 1 +ATOM 390 C CB . TRP A 1 50 ? 6.654 -14.522 -8.088 1.00 6.09 ? 206 TRP A CB 1 +ATOM 391 C CG . TRP A 1 50 ? 7.828 -15.243 -8.579 1.00 0.00 ? 206 TRP A CG 1 +ATOM 392 C CD1 . TRP A 1 50 ? 8.390 -15.137 -9.807 1.00 0.00 ? 206 TRP A CD1 1 +ATOM 393 C CD2 . TRP A 1 50 ? 8.620 -16.188 -7.849 1.00 0.00 ? 206 TRP A CD2 1 +ATOM 394 N NE1 . TRP A 1 50 ? 9.483 -15.960 -9.896 1.00 0.00 ? 206 TRP A NE1 1 +ATOM 395 C CE2 . TRP A 1 50 ? 9.645 -16.619 -8.709 1.00 0.00 ? 206 TRP A CE2 1 +ATOM 396 C CE3 . TRP A 1 50 ? 8.556 -16.719 -6.551 1.00 0.00 ? 206 TRP A CE3 1 +ATOM 397 C CZ2 . TRP A 1 50 ? 10.605 -17.546 -8.321 1.00 0.00 ? 206 TRP A CZ2 1 +ATOM 398 C CZ3 . TRP A 1 50 ? 9.510 -17.640 -6.171 1.00 0.00 ? 206 TRP A CZ3 1 +ATOM 399 C CH2 . TRP A 1 50 ? 10.522 -18.047 -7.057 1.00 0.00 ? 206 TRP A CH2 1 +ATOM 400 N N . LYS A 1 51 ? 9.308 -12.881 -7.307 1.00 12.46 ? 207 LYS A N 1 +ATOM 401 C CA . LYS A 1 51 ? 10.508 -12.732 -6.493 1.00 12.48 ? 207 LYS A CA 1 +ATOM 402 C C . LYS A 1 51 ? 10.254 -11.509 -5.644 1.00 13.11 ? 207 LYS A C 1 +ATOM 403 O O . LYS A 1 51 ? 10.273 -11.565 -4.416 1.00 14.74 ? 207 LYS A O 1 +ATOM 404 C CB . LYS A 1 51 ? 11.729 -12.485 -7.406 1.00 13.13 ? 207 LYS A CB 1 +ATOM 405 C CG . LYS A 1 51 ? 12.981 -11.905 -6.735 1.00 9.00 ? 207 LYS A CG 1 +ATOM 406 C CD . LYS A 1 51 ? 14.043 -11.389 -7.747 1.00 8.09 ? 207 LYS A CD 1 +ATOM 407 C CE . LYS A 1 51 ? 14.827 -12.523 -8.456 1.00 9.82 ? 207 LYS A CE 1 +ATOM 408 N NZ . LYS A 1 51 ? 16.074 -12.045 -9.135 1.00 6.18 ? 207 LYS A NZ 1 +ATOM 409 N N . ASN A 1 52 ? 9.985 -10.409 -6.336 1.00 13.04 ? 208 ASN A N 1 +ATOM 410 C CA . ASN A 1 52 ? 9.736 -9.109 -5.727 1.00 14.92 ? 208 ASN A CA 1 +ATOM 411 C C . ASN A 1 52 ? 8.468 -9.085 -4.882 1.00 14.51 ? 208 ASN A C 1 +ATOM 412 O O . ASN A 1 52 ? 8.390 -8.391 -3.865 1.00 16.78 ? 208 ASN A O 1 +ATOM 413 C CB . ASN A 1 52 ? 9.633 -8.056 -6.830 1.00 16.16 ? 208 ASN A CB 1 +ATOM 414 C CG . ASN A 1 52 ? 10.031 -6.670 -6.359 1.00 17.90 ? 208 ASN A CG 1 +ATOM 415 O OD1 . ASN A 1 52 ? 10.035 -5.721 -7.147 1.00 21.08 ? 208 ASN A OD1 1 +ATOM 416 N ND2 . ASN A 1 52 ? 10.379 -6.545 -5.074 1.00 14.96 ? 208 ASN A ND2 1 +ATOM 417 N N . SER A 1 53 ? 7.471 -9.846 -5.306 1.00 13.39 ? 209 SER A N 1 +ATOM 418 C CA . SER A 1 53 ? 6.224 -9.887 -4.577 1.00 10.93 ? 209 SER A CA 1 +ATOM 419 C C . SER A 1 53 ? 6.393 -10.506 -3.197 1.00 10.36 ? 209 SER A C 1 +ATOM 420 O O . SER A 1 53 ? 6.049 -9.885 -2.189 1.00 9.00 ? 209 SER A O 1 +ATOM 421 C CB . SER A 1 53 ? 5.172 -10.642 -5.390 1.00 12.48 ? 209 SER A CB 1 +ATOM 422 O OG . SER A 1 53 ? 4.849 -9.929 -6.576 1.00 8.67 ? 209 SER A OG 1 +ATOM 423 N N . ILE A 1 54 ? 6.930 -11.719 -3.132 1.00 9.36 ? 210 ILE A N 1 +ATOM 424 C CA . ILE A 1 54 ? 7.100 -12.361 -1.837 1.00 11.36 ? 210 ILE A CA 1 +ATOM 425 C C . ILE A 1 54 ? 7.753 -11.419 -0.809 1.00 12.99 ? 210 ILE A C 1 +ATOM 426 O O . ILE A 1 54 ? 7.314 -11.354 0.344 1.00 14.37 ? 210 ILE A O 1 +ATOM 427 C CB . ILE A 1 54 ? 7.914 -13.684 -1.960 1.00 12.15 ? 210 ILE A CB 1 +ATOM 428 C CG1 . ILE A 1 54 ? 6.970 -14.860 -2.277 1.00 8.89 ? 210 ILE A CG1 1 +ATOM 429 C CG2 . ILE A 1 54 ? 8.666 -13.967 -0.664 1.00 9.66 ? 210 ILE A CG2 1 +ATOM 430 C CD1 . ILE A 1 54 ? 6.414 -14.853 -3.676 1.00 8.15 ? 210 ILE A CD1 1 +ATOM 431 N N . ARG A 1 55 ? 8.775 -10.675 -1.226 1.00 11.72 ? 211 ARG A N 1 +ATOM 432 C CA . ARG A 1 55 ? 9.450 -9.744 -0.317 1.00 11.29 ? 211 ARG A CA 1 +ATOM 433 C C . ARG A 1 55 ? 8.460 -8.736 0.250 1.00 10.38 ? 211 ARG A C 1 +ATOM 434 O O . ARG A 1 55 ? 8.601 -8.272 1.380 1.00 11.51 ? 211 ARG A O 1 +ATOM 435 C CB . ARG A 1 55 ? 10.552 -8.967 -1.043 1.00 10.33 ? 211 ARG A CB 1 +ATOM 436 C CG . ARG A 1 55 ? 11.617 -9.792 -1.734 1.00 7.20 ? 211 ARG A CG 1 +ATOM 437 C CD . ARG A 1 55 ? 12.607 -8.841 -2.395 1.00 10.85 ? 211 ARG A CD 1 +ATOM 438 N NE . ARG A 1 55 ? 12.966 -9.232 -3.757 1.00 10.72 ? 211 ARG A NE 1 +ATOM 439 C CZ . ARG A 1 55 ? 13.445 -8.394 -4.669 1.00 10.32 ? 211 ARG A CZ 1 +ATOM 440 N NH1 . ARG A 1 55 ? 13.742 -8.836 -5.880 1.00 14.77 ? 211 ARG A NH1 1 +ATOM 441 N NH2 . ARG A 1 55 ? 13.616 -7.114 -4.374 1.00 8.81 ? 211 ARG A NH2 1 +ATOM 442 N N . HIS A 1 56 ? 7.468 -8.391 -0.562 1.00 10.50 ? 212 HIS A N 1 +ATOM 443 C CA . HIS A 1 56 ? 6.424 -7.440 -0.196 1.00 8.93 ? 212 HIS A CA 1 +ATOM 444 C C . HIS A 1 56 ? 5.584 -7.993 0.956 1.00 7.42 ? 212 HIS A C 1 +ATOM 445 O O . HIS A 1 56 ? 5.584 -7.462 2.071 1.00 5.18 ? 212 HIS A O 1 +ATOM 446 C CB . HIS A 1 56 ? 5.525 -7.209 -1.409 1.00 12.18 ? 212 HIS A CB 1 +ATOM 447 C CG . HIS A 1 56 ? 4.796 -5.906 -1.389 1.00 13.88 ? 212 HIS A CG 1 +ATOM 448 N ND1 . HIS A 1 56 ? 3.484 -5.784 -1.789 1.00 17.21 ? 212 HIS A ND1 1 +ATOM 449 C CD2 . HIS A 1 56 ? 5.201 -4.662 -1.050 1.00 14.20 ? 212 HIS A CD2 1 +ATOM 450 C CE1 . HIS A 1 56 ? 3.114 -4.517 -1.698 1.00 18.16 ? 212 HIS A CE1 1 +ATOM 451 N NE2 . HIS A 1 56 ? 4.140 -3.816 -1.253 1.00 16.43 ? 212 HIS A NE2 1 +ATOM 452 N N . ASN A 1 57 ? 4.861 -9.068 0.670 1.00 5.75 ? 213 ASN A N 1 +ATOM 453 C CA . ASN A 1 57 ? 4.017 -9.704 1.672 1.00 5.80 ? 213 ASN A CA 1 +ATOM 454 C C . ASN A 1 57 ? 4.745 -9.814 3.021 1.00 5.52 ? 213 ASN A C 1 +ATOM 455 O O . ASN A 1 57 ? 4.295 -9.231 4.015 1.00 4.92 ? 213 ASN A O 1 +ATOM 456 C CB . ASN A 1 57 ? 3.585 -11.090 1.183 1.00 4.60 ? 213 ASN A CB 1 +ATOM 457 C CG . ASN A 1 57 ? 2.878 -11.042 -0.168 1.00 3.58 ? 213 ASN A CG 1 +ATOM 458 O OD1 . ASN A 1 57 ? 1.962 -11.808 -0.415 1.00 5.18 ? 213 ASN A OD1 1 +ATOM 459 N ND2 . ASN A 1 57 ? 3.315 -10.150 -1.048 1.00 5.05 ? 213 ASN A ND2 1 +ATOM 460 N N . LEU A 1 58 ? 5.866 -10.550 3.040 1.00 5.65 ? 214 LEU A N 1 +ATOM 461 C CA . LEU A 1 58 ? 6.687 -10.760 4.249 1.00 3.90 ? 214 LEU A CA 1 +ATOM 462 C C . LEU A 1 58 ? 6.879 -9.489 5.056 1.00 3.27 ? 214 LEU A C 1 +ATOM 463 O O . LEU A 1 58 ? 6.493 -9.398 6.222 1.00 0.00 ? 214 LEU A O 1 +ATOM 464 C CB . LEU A 1 58 ? 8.081 -11.289 3.880 1.00 2.24 ? 214 LEU A CB 1 +ATOM 465 C CG . LEU A 1 58 ? 8.289 -12.779 3.584 1.00 2.88 ? 214 LEU A CG 1 +ATOM 466 C CD1 . LEU A 1 58 ? 9.605 -13.015 2.841 1.00 0.00 ? 214 LEU A CD1 1 +ATOM 467 C CD2 . LEU A 1 58 ? 8.260 -13.543 4.890 1.00 1.27 ? 214 LEU A CD2 1 +ATOM 468 N N . SER A 1 59 ? 7.493 -8.495 4.421 1.00 5.29 ? 215 SER A N 1 +ATOM 469 C CA . SER A 1 59 ? 7.758 -7.270 5.123 1.00 7.59 ? 215 SER A CA 1 +ATOM 470 C C . SER A 1 59 ? 6.509 -6.504 5.533 1.00 9.44 ? 215 SER A C 1 +ATOM 471 O O . SER A 1 59 ? 6.504 -5.828 6.560 1.00 9.98 ? 215 SER A O 1 +ATOM 472 C CB . SER A 1 59 ? 8.668 -6.391 4.274 1.00 8.19 ? 215 SER A CB 1 +ATOM 473 O OG . SER A 1 59 ? 9.847 -7.106 3.932 1.00 6.84 ? 215 SER A OG 1 +ATOM 474 N N . LEU A 1 60 ? 5.418 -6.618 4.739 1.00 10.83 ? 216 LEU A N 1 +ATOM 475 C CA . LEU A 1 60 ? 4.220 -5.914 5.011 1.00 11.70 ? 216 LEU A CA 1 +ATOM 476 C C . LEU A 1 60 ? 3.293 -6.227 6.196 1.00 14.13 ? 216 LEU A C 1 +ATOM 477 O O . LEU A 1 60 ? 3.207 -5.405 7.100 1.00 18.24 ? 216 LEU A O 1 +ATOM 478 C CB . LEU A 1 60 ? 3.332 -5.840 3.788 1.00 11.41 ? 216 LEU A CB 1 +ATOM 479 C CG . LEU A 1 60 ? 2.124 -4.899 3.972 1.00 9.43 ? 216 LEU A CG 1 +ATOM 480 C CD1 . LEU A 1 60 ? 2.535 -3.453 3.741 1.00 9.24 ? 216 LEU A CD1 1 +ATOM 481 C CD2 . LEU A 1 60 ? 1.043 -5.271 3.002 1.00 9.49 ? 216 LEU A CD2 1 +ATOM 482 N N . HIS A 1 61 ? 2.703 -7.368 6.318 1.00 12.71 ? 217 HIS A N 1 +ATOM 483 C CA . HIS A 1 61 ? 1.658 -7.594 7.321 1.00 10.36 ? 217 HIS A CA 1 +ATOM 484 C C . HIS A 1 61 ? 2.056 -7.691 8.782 1.00 11.31 ? 217 HIS A C 1 +ATOM 485 O O . HIS A 1 61 ? 2.772 -6.842 9.324 1.00 11.97 ? 217 HIS A O 1 +ATOM 486 C CB . HIS A 1 61 ? 0.825 -8.833 7.016 1.00 12.73 ? 217 HIS A CB 1 +ATOM 487 C CG . HIS A 1 61 ? 0.678 -9.127 5.561 1.00 13.18 ? 217 HIS A CG 1 +ATOM 488 N ND1 . HIS A 1 61 ? -0.012 -10.226 5.104 1.00 13.98 ? 217 HIS A ND1 1 +ATOM 489 C CD2 . HIS A 1 61 ? 1.168 -8.506 4.463 1.00 11.23 ? 217 HIS A CD2 1 +ATOM 490 C CE1 . HIS A 1 61 ? 0.063 -10.272 3.786 1.00 12.05 ? 217 HIS A CE1 1 +ATOM 491 N NE2 . HIS A 1 61 ? 0.775 -9.239 3.372 1.00 8.24 ? 217 HIS A NE2 1 +ATOM 492 N N . SER A 1 62 ? 1.555 -8.755 9.414 1.00 8.94 ? 218 SER A N 1 +ATOM 493 C CA . SER A 1 62 ? 1.745 -8.999 10.832 1.00 4.77 ? 218 SER A CA 1 +ATOM 494 C C . SER A 1 62 ? 2.195 -10.396 11.228 1.00 5.72 ? 218 SER A C 1 +ATOM 495 O O . SER A 1 62 ? 2.578 -10.601 12.380 1.00 6.49 ? 218 SER A O 1 +ATOM 496 C CB . SER A 1 62 ? 0.446 -8.716 11.556 1.00 2.71 ? 218 SER A CB 1 +ATOM 497 O OG . SER A 1 62 ? -0.241 -7.647 10.933 1.00 7.22 ? 218 SER A OG 1 +ATOM 498 N N . ARG A 1 63 ? 2.123 -11.373 10.323 1.00 5.75 ? 219 ARG A N 1 +ATOM 499 C CA . ARG A 1 63 ? 2.567 -12.708 10.697 1.00 5.08 ? 219 ARG A CA 1 +ATOM 500 C C . ARG A 1 63 ? 4.062 -12.878 10.514 1.00 5.77 ? 219 ARG A C 1 +ATOM 501 O O . ARG A 1 63 ? 4.644 -13.777 11.117 1.00 5.21 ? 219 ARG A O 1 +ATOM 502 C CB . ARG A 1 63 ? 1.810 -13.825 9.946 1.00 5.85 ? 219 ARG A CB 1 +ATOM 503 C CG . ARG A 1 63 ? 0.985 -13.444 8.715 1.00 2.83 ? 219 ARG A CG 1 +ATOM 504 C CD . ARG A 1 63 ? -0.308 -12.740 9.108 1.00 5.94 ? 219 ARG A CD 1 +ATOM 505 N NE . ARG A 1 63 ? -1.207 -12.525 7.971 1.00 8.55 ? 219 ARG A NE 1 +ATOM 506 C CZ . ARG A 1 63 ? -2.166 -13.366 7.579 1.00 9.13 ? 219 ARG A CZ 1 +ATOM 507 N NH1 . ARG A 1 63 ? -2.927 -13.057 6.531 1.00 9.27 ? 219 ARG A NH1 1 +ATOM 508 N NH2 . ARG A 1 63 ? -2.373 -14.509 8.232 1.00 10.63 ? 219 ARG A NH2 1 +ATOM 509 N N . PHE A 1 64 ? 4.700 -12.035 9.698 1.00 6.38 ? 220 PHE A N 1 +ATOM 510 C CA . PHE A 1 64 ? 6.144 -12.184 9.550 1.00 5.73 ? 220 PHE A CA 1 +ATOM 511 C C . PHE A 1 64 ? 6.988 -11.081 10.161 1.00 5.28 ? 220 PHE A C 1 +ATOM 512 O O . PHE A 1 64 ? 6.697 -9.892 10.036 1.00 5.58 ? 220 PHE A O 1 +ATOM 513 C CB . PHE A 1 64 ? 6.601 -12.346 8.095 1.00 5.71 ? 220 PHE A CB 1 +ATOM 514 C CG . PHE A 1 64 ? 5.494 -12.526 7.092 1.00 6.62 ? 220 PHE A CG 1 +ATOM 515 C CD1 . PHE A 1 64 ? 4.636 -11.471 6.768 1.00 5.27 ? 220 PHE A CD1 1 +ATOM 516 C CD2 . PHE A 1 64 ? 5.385 -13.722 6.387 1.00 4.15 ? 220 PHE A CD2 1 +ATOM 517 C CE1 . PHE A 1 64 ? 3.696 -11.608 5.752 1.00 4.15 ? 220 PHE A CE1 1 +ATOM 518 C CE2 . PHE A 1 64 ? 4.453 -13.868 5.376 1.00 2.88 ? 220 PHE A CE2 1 +ATOM 519 C CZ . PHE A 1 64 ? 3.606 -12.813 5.051 1.00 2.95 ? 220 PHE A CZ 1 +ATOM 520 N N . MET A 1 65 ? 8.057 -11.533 10.821 1.00 3.52 ? 221 MET A N 1 +ATOM 521 C CA . MET A 1 65 ? 9.044 -10.675 11.461 1.00 1.41 ? 221 MET A CA 1 +ATOM 522 C C . MET A 1 65 ? 10.408 -11.217 11.029 1.00 0.60 ? 221 MET A C 1 +ATOM 523 O O . MET A 1 65 ? 10.545 -12.381 10.686 1.00 0.00 ? 221 MET A O 1 +ATOM 524 C CB . MET A 1 65 ? 8.912 -10.760 12.978 1.00 1.81 ? 221 MET A CB 1 +ATOM 525 C CG . MET A 1 65 ? 10.042 -10.098 13.760 1.00 3.06 ? 221 MET A CG 1 +ATOM 526 S SD . MET A 1 65 ? 9.898 -10.285 15.575 1.00 2.19 ? 221 MET A SD 1 +ATOM 527 C CE . MET A 1 65 ? 8.642 -9.079 15.964 1.00 0.00 ? 221 MET A CE 1 +ATOM 528 N N . ARG A 1 66 ? 11.424 -10.371 11.049 1.00 0.00 ? 222 ARG A N 1 +ATOM 529 C CA . ARG A 1 66 ? 12.753 -10.797 10.651 1.00 0.00 ? 222 ARG A CA 1 +ATOM 530 C C . ARG A 1 66 ? 13.718 -10.880 11.833 1.00 0.45 ? 222 ARG A C 1 +ATOM 531 O O . ARG A 1 66 ? 13.615 -10.113 12.793 1.00 0.00 ? 222 ARG A O 1 +ATOM 532 C CB . ARG A 1 66 ? 13.299 -9.839 9.592 1.00 0.00 ? 222 ARG A CB 1 +ATOM 533 C CG . ARG A 1 66 ? 14.431 -10.417 8.793 1.00 0.00 ? 222 ARG A CG 1 +ATOM 534 C CD . ARG A 1 66 ? 15.723 -9.806 9.225 1.00 0.00 ? 222 ARG A CD 1 +ATOM 535 N NE . ARG A 1 66 ? 16.194 -8.818 8.267 1.00 0.00 ? 222 ARG A NE 1 +ATOM 536 C CZ . ARG A 1 66 ? 16.909 -7.757 8.608 1.00 0.00 ? 222 ARG A CZ 1 +ATOM 537 N NH1 . ARG A 1 66 ? 17.309 -6.907 7.680 1.00 0.15 ? 222 ARG A NH1 1 +ATOM 538 N NH2 . ARG A 1 66 ? 17.207 -7.542 9.886 1.00 0.00 ? 222 ARG A NH2 1 +ATOM 539 N N . VAL A 1 67 ? 14.649 -11.826 11.753 1.00 3.65 ? 223 VAL A N 1 +ATOM 540 C CA . VAL A 1 67 ? 15.658 -12.029 12.791 1.00 7.76 ? 223 VAL A CA 1 +ATOM 541 C C . VAL A 1 67 ? 17.044 -12.253 12.150 1.00 11.44 ? 223 VAL A C 1 +ATOM 542 O O . VAL A 1 67 ? 17.199 -13.066 11.237 1.00 13.61 ? 223 VAL A O 1 +ATOM 543 C CB . VAL A 1 67 ? 15.277 -13.237 13.699 1.00 6.00 ? 223 VAL A CB 1 +ATOM 544 C CG1 . VAL A 1 67 ? 14.015 -12.916 14.485 1.00 3.52 ? 223 VAL A CG1 1 +ATOM 545 C CG2 . VAL A 1 67 ? 15.031 -14.469 12.864 1.00 7.25 ? 223 VAL A CG2 1 +ATOM 546 N N . GLN A 1 68 ? 18.040 -11.496 12.597 1.00 15.69 ? 224 GLN A N 1 +ATOM 547 C CA . GLN A 1 68 ? 19.391 -11.619 12.059 1.00 20.00 ? 224 GLN A CA 1 +ATOM 548 C C . GLN A 1 68 ? 20.254 -12.137 13.169 1.00 22.36 ? 224 GLN A C 1 +ATOM 549 O O . GLN A 1 68 ? 19.803 -12.281 14.297 1.00 23.97 ? 224 GLN A O 1 +ATOM 550 C CB . GLN A 1 68 ? 19.970 -10.260 11.624 1.00 21.50 ? 224 GLN A CB 1 +ATOM 551 C CG . GLN A 1 68 ? 19.569 -9.760 10.232 1.00 25.97 ? 224 GLN A CG 1 +ATOM 552 C CD . GLN A 1 68 ? 20.545 -10.166 9.119 1.00 29.62 ? 224 GLN A CD 1 +ATOM 553 O OE1 . GLN A 1 68 ? 20.124 -10.656 8.069 1.00 30.59 ? 224 GLN A OE1 1 +ATOM 554 N NE2 . GLN A 1 68 ? 21.847 -9.943 9.337 1.00 29.73 ? 224 GLN A NE2 1 +ATOM 555 N N . ASN A 1 69 ? 21.504 -12.419 12.839 1.00 27.64 ? 225 ASN A N 1 +ATOM 556 C CA . ASN A 1 69 ? 22.463 -12.865 13.832 1.00 31.10 ? 225 ASN A CA 1 +ATOM 557 C C . ASN A 1 69 ? 23.260 -11.613 14.168 1.00 31.88 ? 225 ASN A C 1 +ATOM 558 O O . ASN A 1 69 ? 23.614 -10.839 13.274 1.00 30.89 ? 225 ASN A O 1 +ATOM 559 C CB . ASN A 1 69 ? 23.387 -13.928 13.254 1.00 33.69 ? 225 ASN A CB 1 +ATOM 560 C CG . ASN A 1 69 ? 24.579 -14.183 14.128 1.00 35.16 ? 225 ASN A CG 1 +ATOM 561 O OD1 . ASN A 1 69 ? 24.457 -14.252 15.352 1.00 38.30 ? 225 ASN A OD1 1 +ATOM 562 N ND2 . ASN A 1 69 ? 25.747 -14.330 13.511 1.00 37.78 ? 225 ASN A ND2 1 +ATOM 563 N N . GLU A 1 70 ? 23.524 -11.411 15.455 1.00 34.08 ? 226 GLU A N 1 +ATOM 564 C CA . GLU A 1 70 ? 24.262 -10.239 15.917 1.00 36.39 ? 226 GLU A CA 1 +ATOM 565 C C . GLU A 1 70 ? 25.684 -10.193 15.329 1.00 35.88 ? 226 GLU A C 1 +ATOM 566 O O . GLU A 1 70 ? 26.246 -9.118 15.117 1.00 35.55 ? 226 GLU A O 1 +ATOM 567 C CB . GLU A 1 70 ? 24.316 -10.237 17.457 1.00 38.24 ? 226 GLU A CB 1 +ATOM 568 C CG . GLU A 1 70 ? 24.949 -8.986 18.066 1.00 41.11 ? 226 GLU A CG 1 +ATOM 569 C CD . GLU A 1 70 ? 25.107 -9.046 19.590 1.00 42.61 ? 226 GLU A CD 1 +ATOM 570 O OE1 . GLU A 1 70 ? 25.988 -8.342 20.130 1.00 44.17 ? 226 GLU A OE1 1 +ATOM 571 O OE2 . GLU A 1 70 ? 24.353 -9.774 20.262 1.00 42.20 ? 226 GLU A OE2 1 +ATOM 572 N N . GLY A 1 71 ? 26.236 -11.370 15.050 1.00 34.98 ? 227 GLY A N 1 +ATOM 573 C CA . GLY A 1 71 ? 27.581 -11.488 14.513 1.00 34.29 ? 227 GLY A CA 1 +ATOM 574 C C . GLY A 1 71 ? 27.950 -10.774 13.226 1.00 34.39 ? 227 GLY A C 1 +ATOM 575 O O . GLY A 1 71 ? 27.222 -9.914 12.728 1.00 34.17 ? 227 GLY A O 1 +ATOM 576 N N . THR A 1 72 ? 29.097 -11.172 12.684 1.00 32.43 ? 228 THR A N 1 +ATOM 577 C CA . THR A 1 72 ? 29.669 -10.600 11.469 1.00 30.64 ? 228 THR A CA 1 +ATOM 578 C C . THR A 1 72 ? 28.886 -10.771 10.156 1.00 30.72 ? 228 THR A C 1 +ATOM 579 O O . THR A 1 72 ? 28.942 -9.887 9.287 1.00 33.42 ? 228 THR A O 1 +ATOM 580 C CB . THR A 1 72 ? 31.097 -11.164 11.250 1.00 29.73 ? 228 THR A CB 1 +ATOM 581 O OG1 . THR A 1 72 ? 31.825 -10.321 10.345 1.00 29.36 ? 228 THR A OG1 1 +ATOM 582 C CG2 . THR A 1 72 ? 31.022 -12.574 10.679 1.00 29.50 ? 228 THR A CG2 1 +ATOM 583 N N . GLY A 1 73 ? 28.154 -11.883 10.016 1.00 28.22 ? 229 GLY A N 1 +ATOM 584 C CA . GLY A 1 73 ? 27.436 -12.159 8.773 1.00 23.76 ? 229 GLY A CA 1 +ATOM 585 C C . GLY A 1 73 ? 25.925 -12.355 8.692 1.00 21.88 ? 229 GLY A C 1 +ATOM 586 O O . GLY A 1 73 ? 25.205 -12.245 9.691 1.00 19.37 ? 229 GLY A O 1 +ATOM 587 N N . LYS A 1 74 ? 25.480 -12.719 7.479 1.00 19.70 ? 230 LYS A N 1 +ATOM 588 C CA . LYS A 1 74 ? 24.066 -12.868 7.091 1.00 17.87 ? 230 LYS A CA 1 +ATOM 589 C C . LYS A 1 74 ? 23.080 -13.979 7.481 1.00 17.04 ? 230 LYS A C 1 +ATOM 590 O O . LYS A 1 74 ? 22.662 -14.761 6.628 1.00 16.77 ? 230 LYS A O 1 +ATOM 591 C CB . LYS A 1 74 ? 23.954 -12.663 5.558 1.00 16.05 ? 230 LYS A CB 1 +ATOM 592 C CG . LYS A 1 74 ? 24.057 -13.905 4.632 1.00 16.00 ? 230 LYS A CG 1 +ATOM 593 C CD . LYS A 1 74 ? 23.805 -13.492 3.153 1.00 15.32 ? 230 LYS A CD 1 +ATOM 594 C CE . LYS A 1 74 ? 23.457 -14.653 2.212 1.00 13.40 ? 230 LYS A CE 1 +ATOM 595 N NZ . LYS A 1 74 ? 22.159 -14.418 1.512 1.00 10.24 ? 230 LYS A NZ 1 +ATOM 596 N N . SER A 1 75 ? 22.677 -14.049 8.742 1.00 18.23 ? 231 SER A N 1 +ATOM 597 C CA . SER A 1 75 ? 21.654 -15.027 9.084 1.00 19.82 ? 231 SER A CA 1 +ATOM 598 C C . SER A 1 75 ? 20.405 -14.188 9.335 1.00 17.31 ? 231 SER A C 1 +ATOM 599 O O . SER A 1 75 ? 20.254 -13.540 10.365 1.00 15.88 ? 231 SER A O 1 +ATOM 600 C CB . SER A 1 75 ? 22.016 -15.879 10.319 1.00 21.09 ? 231 SER A CB 1 +ATOM 601 O OG . SER A 1 75 ? 21.829 -15.192 11.541 1.00 22.10 ? 231 SER A OG 1 +ATOM 602 N N . SER A 1 76 ? 19.545 -14.149 8.329 1.00 16.17 ? 232 SER A N 1 +ATOM 603 C CA . SER A 1 76 ? 18.300 -13.418 8.427 1.00 17.08 ? 232 SER A CA 1 +ATOM 604 C C . SER A 1 76 ? 17.251 -14.481 8.212 1.00 16.19 ? 232 SER A C 1 +ATOM 605 O O . SER A 1 76 ? 17.116 -14.993 7.107 1.00 16.08 ? 232 SER A O 1 +ATOM 606 C CB . SER A 1 76 ? 18.194 -12.363 7.325 1.00 16.65 ? 232 SER A CB 1 +ATOM 607 O OG . SER A 1 76 ? 17.063 -11.529 7.521 1.00 15.78 ? 232 SER A OG 1 +ATOM 608 N N . TRP A 1 77 ? 16.543 -14.841 9.275 1.00 14.88 ? 233 TRP A N 1 +ATOM 609 C CA . TRP A 1 77 ? 15.510 -15.850 9.167 1.00 12.70 ? 233 TRP A CA 1 +ATOM 610 C C . TRP A 1 77 ? 14.184 -15.147 9.244 1.00 13.44 ? 233 TRP A C 1 +ATOM 611 O O . TRP A 1 77 ? 14.060 -14.111 9.896 1.00 12.78 ? 233 TRP A O 1 +ATOM 612 C CB . TRP A 1 77 ? 15.584 -16.847 10.317 1.00 12.40 ? 233 TRP A CB 1 +ATOM 613 C CG . TRP A 1 77 ? 16.948 -17.316 10.647 1.00 11.33 ? 233 TRP A CG 1 +ATOM 614 C CD1 . TRP A 1 77 ? 17.718 -16.908 11.694 1.00 9.67 ? 233 TRP A CD1 1 +ATOM 615 C CD2 . TRP A 1 77 ? 17.721 -18.284 9.929 1.00 12.45 ? 233 TRP A CD2 1 +ATOM 616 N NE1 . TRP A 1 77 ? 18.925 -17.563 11.675 1.00 11.03 ? 233 TRP A NE1 1 +ATOM 617 C CE2 . TRP A 1 77 ? 18.954 -18.411 10.599 1.00 11.34 ? 233 TRP A CE2 1 +ATOM 618 C CE3 . TRP A 1 77 ? 17.493 -19.055 8.775 1.00 13.33 ? 233 TRP A CE3 1 +ATOM 619 C CZ2 . TRP A 1 77 ? 19.959 -19.283 10.164 1.00 12.50 ? 233 TRP A CZ2 1 +ATOM 620 C CZ3 . TRP A 1 77 ? 18.498 -19.926 8.341 1.00 12.83 ? 233 TRP A CZ3 1 +ATOM 621 C CH2 . TRP A 1 77 ? 19.713 -20.027 9.034 1.00 12.98 ? 233 TRP A CH2 1 +ATOM 622 N N . TRP A 1 78 ? 13.193 -15.713 8.569 1.00 12.08 ? 234 TRP A N 1 +ATOM 623 C CA . TRP A 1 78 ? 11.854 -15.161 8.603 1.00 7.60 ? 234 TRP A CA 1 +ATOM 624 C C . TRP A 1 78 ? 11.035 -16.033 9.513 1.00 7.45 ? 234 TRP A C 1 +ATOM 625 O O . TRP A 1 78 ? 10.913 -17.222 9.279 1.00 7.79 ? 234 TRP A O 1 +ATOM 626 C CB . TRP A 1 78 ? 11.238 -15.138 7.203 1.00 6.13 ? 234 TRP A CB 1 +ATOM 627 C CG . TRP A 1 78 ? 11.728 -14.004 6.442 1.00 1.34 ? 234 TRP A CG 1 +ATOM 628 C CD1 . TRP A 1 78 ? 12.680 -14.013 5.457 1.00 1.24 ? 234 TRP A CD1 1 +ATOM 629 C CD2 . TRP A 1 78 ? 11.440 -12.633 6.713 1.00 1.42 ? 234 TRP A CD2 1 +ATOM 630 N NE1 . TRP A 1 78 ? 13.014 -12.716 5.106 1.00 0.00 ? 234 TRP A NE1 1 +ATOM 631 C CE2 . TRP A 1 78 ? 12.265 -11.852 5.864 1.00 0.00 ? 234 TRP A CE2 1 +ATOM 632 C CE3 . TRP A 1 78 ? 10.558 -11.978 7.596 1.00 0.00 ? 234 TRP A CE3 1 +ATOM 633 C CZ2 . TRP A 1 78 ? 12.240 -10.457 5.879 1.00 0.00 ? 234 TRP A CZ2 1 +ATOM 634 C CZ3 . TRP A 1 78 ? 10.531 -10.592 7.605 1.00 0.00 ? 234 TRP A CZ3 1 +ATOM 635 C CH2 . TRP A 1 78 ? 11.367 -9.846 6.749 1.00 0.00 ? 234 TRP A CH2 1 +ATOM 636 N N . ILE A 1 79 ? 10.508 -15.455 10.578 1.00 10.86 ? 235 ILE A N 1 +ATOM 637 C CA . ILE A 1 79 ? 9.671 -16.231 11.476 1.00 14.67 ? 235 ILE A CA 1 +ATOM 638 C C . ILE A 1 79 ? 8.290 -15.595 11.569 1.00 15.33 ? 235 ILE A C 1 +ATOM 639 O O . ILE A 1 79 ? 8.016 -14.567 10.953 1.00 14.27 ? 235 ILE A O 1 +ATOM 640 C CB . ILE A 1 79 ? 10.305 -16.384 12.901 1.00 16.53 ? 235 ILE A CB 1 +ATOM 641 C CG1 . ILE A 1 79 ? 10.272 -15.058 13.666 1.00 16.35 ? 235 ILE A CG1 1 +ATOM 642 C CG2 . ILE A 1 79 ? 11.734 -16.898 12.772 1.00 19.19 ? 235 ILE A CG2 1 +ATOM 643 C CD1 . ILE A 1 79 ? 11.133 -13.981 13.076 1.00 19.11 ? 235 ILE A CD1 1 +ATOM 644 N N . ILE A 1 80 ? 7.419 -16.229 12.333 1.00 17.95 ? 236 ILE A N 1 +ATOM 645 C CA . ILE A 1 80 ? 6.065 -15.750 12.511 1.00 20.74 ? 236 ILE A CA 1 +ATOM 646 C C . ILE A 1 80 ? 5.943 -15.126 13.901 1.00 22.46 ? 236 ILE A C 1 +ATOM 647 O O . ILE A 1 80 ? 6.689 -15.482 14.816 1.00 20.94 ? 236 ILE A O 1 +ATOM 648 C CB . ILE A 1 80 ? 5.075 -16.929 12.325 1.00 22.69 ? 236 ILE A CB 1 +ATOM 649 C CG1 . ILE A 1 80 ? 5.064 -17.381 10.857 1.00 22.88 ? 236 ILE A CG1 1 +ATOM 650 C CG2 . ILE A 1 80 ? 3.688 -16.536 12.775 1.00 25.66 ? 236 ILE A CG2 1 +ATOM 651 C CD1 . ILE A 1 80 ? 4.474 -16.356 9.891 1.00 22.62 ? 236 ILE A CD1 1 +ATOM 652 N N . ASN A 1 81 ? 5.034 -14.174 14.083 1.00 28.05 ? 237 ASN A N 1 +ATOM 653 C CA . ASN A 1 81 ? 4.833 -13.527 15.345 1.00 31.73 ? 237 ASN A CA 1 +ATOM 654 C C . ASN A 1 81 ? 3.421 -13.550 15.903 1.00 35.60 ? 237 ASN A C 1 +ATOM 655 O O . ASN A 1 81 ? 2.530 -14.019 15.194 1.00 36.61 ? 237 ASN A O 1 +ATOM 656 C CB . ASN A 1 81 ? 5.485 -12.111 15.337 1.00 31.86 ? 237 ASN A CB 1 +ATOM 657 C CG . ASN A 1 81 ? 5.025 -11.294 14.154 1.00 29.95 ? 237 ASN A CG 1 +ATOM 658 O OD1 . ASN A 1 81 ? 5.228 -11.671 13.003 1.00 30.36 ? 237 ASN A OD1 1 +ATOM 659 N ND2 . ASN A 1 81 ? 4.420 -10.152 14.434 1.00 29.65 ? 237 ASN A ND2 1 +ATOM 660 N N . PRO A 1 82 ? 3.162 -13.028 17.130 1.00 38.08 ? 238 PRO A N 1 +ATOM 661 C CA . PRO A 1 82 ? 1.822 -13.007 17.724 1.00 39.64 ? 238 PRO A CA 1 +ATOM 662 C C . PRO A 1 82 ? 0.770 -14.047 17.306 1.00 43.38 ? 238 PRO A C 1 +ATOM 663 O O . PRO A 1 82 ? 0.173 -13.960 16.230 1.00 41.28 ? 238 PRO A O 1 +ATOM 664 C CB . PRO A 1 82 ? 1.389 -11.567 17.477 1.00 38.07 ? 238 PRO A CB 1 +ATOM 665 C CG . PRO A 1 82 ? 2.701 -10.796 17.763 1.00 37.07 ? 238 PRO A CG 1 +ATOM 666 C CD . PRO A 1 82 ? 3.861 -11.824 17.616 1.00 37.88 ? 238 PRO A CD 1 +ATOM 667 N N . ASP A 1 83 ? 0.546 -15.024 18.186 1.00 45.47 ? 239 ASP A N 1 +ATOM 668 C CA . ASP A 1 83 ? -0.437 -16.079 17.952 1.00 47.17 ? 239 ASP A CA 1 +ATOM 669 C C . ASP A 1 83 ? -1.446 -16.148 19.089 1.00 48.73 ? 239 ASP A C 1 +ATOM 670 O O . ASP A 1 83 ? -2.642 -16.288 18.848 1.00 53.02 ? 239 ASP A O 1 +ATOM 671 C CB . ASP A 1 83 ? 0.236 -17.446 17.829 1.00 47.14 ? 239 ASP A CB 1 +ATOM 672 C CG . ASP A 1 83 ? -0.765 -18.570 17.599 1.00 45.30 ? 239 ASP A CG 1 +ATOM 673 O OD1 . ASP A 1 83 ? -0.492 -19.719 18.013 1.00 43.68 ? 239 ASP A OD1 1 +ATOM 674 O OD2 . ASP A 1 83 ? -1.821 -18.304 16.990 1.00 46.09 ? 239 ASP A OD2 1 +ATOM 675 N N . GLY A 1 84 ? -0.954 -16.060 20.324 1.00 49.81 ? 240 GLY A N 1 +ATOM 676 C CA . GLY A 1 84 ? -1.822 -16.127 21.497 1.00 49.14 ? 240 GLY A CA 1 +ATOM 677 C C . GLY A 1 84 ? -2.924 -15.088 21.469 1.00 50.76 ? 240 GLY A C 1 +ATOM 678 O O . GLY A 1 84 ? -4.100 -15.402 21.672 1.00 45.47 ? 240 GLY A O 1 +ATOM 679 N N . GLY A 1 85 ? -2.532 -13.843 21.225 1.00 52.66 ? 241 GLY A N 1 +ATOM 680 C CA . GLY A 1 85 ? -3.497 -12.765 21.133 1.00 58.10 ? 241 GLY A CA 1 +ATOM 681 C C . GLY A 1 85 ? -3.766 -12.574 19.655 1.00 59.37 ? 241 GLY A C 1 +ATOM 682 O O . GLY A 1 85 ? -2.937 -12.957 18.828 1.00 62.80 ? 241 GLY A O 1 +ATOM 683 N N . LYS A 1 86 ? -4.905 -11.989 19.307 1.00 60.33 ? 242 LYS A N 1 +ATOM 684 C CA . LYS A 1 86 ? -5.229 -11.791 17.900 1.00 60.59 ? 242 LYS A CA 1 +ATOM 685 C C . LYS A 1 86 ? -5.238 -10.331 17.446 1.00 59.64 ? 242 LYS A C 1 +ATOM 686 O O . LYS A 1 86 ? -4.388 -9.907 16.658 1.00 57.95 ? 242 LYS A O 1 +ATOM 687 C CB . LYS A 1 86 ? -6.596 -12.398 17.586 1.00 63.81 ? 242 LYS A CB 1 +ATOM 688 C CG . LYS A 1 86 ? -7.139 -13.344 18.636 1.00 63.36 ? 242 LYS A CG 1 +ATOM 689 C CD . LYS A 1 86 ? -8.602 -13.613 18.352 1.00 64.33 ? 242 LYS A CD 1 +ATOM 690 C CE . LYS A 1 86 ? -9.283 -14.346 19.484 1.00 66.04 ? 242 LYS A CE 1 +ATOM 691 N NZ . LYS A 1 86 ? -10.752 -14.368 19.251 1.00 66.45 ? 242 LYS A NZ 1 +ATOM 692 N N . SER A 1 87 ? -6.216 -9.583 17.950 1.00 57.64 ? 243 SER A N 1 +ATOM 693 C CA . SER A 1 87 ? -6.424 -8.177 17.603 1.00 58.64 ? 243 SER A CA 1 +ATOM 694 C C . SER A 1 87 ? -5.209 -7.267 17.413 1.00 56.97 ? 243 SER A C 1 +ATOM 695 O O . SER A 1 87 ? -4.210 -7.360 18.128 1.00 59.38 ? 243 SER A O 1 +ATOM 696 C CB . SER A 1 87 ? -7.375 -7.542 18.618 1.00 60.87 ? 243 SER A CB 1 +ATOM 697 O OG . SER A 1 87 ? -8.643 -8.173 18.571 1.00 68.04 ? 243 SER A OG 1 +ATOM 698 N N . GLY A 1 88 ? -5.441 -6.324 16.423 1.00 54.99 ? 244 GLY A N 1 +ATOM 699 C CA . GLY A 1 88 ? -4.417 -5.307 16.068 1.00 53.10 ? 244 GLY A CA 1 +ATOM 700 C C . GLY A 1 88 ? -4.534 -4.824 14.567 1.00 51.53 ? 244 GLY A C 1 +ATOM 701 O O . GLY A 1 88 ? -4.119 -5.517 13.647 1.00 48.87 ? 244 GLY A O 1 +ATOM 702 N N . LYS A 1 89 ? -5.377 -3.807 14.266 1.00 48.33 ? 245 LYS A N 1 +ATOM 703 C CA . LYS A 1 89 ? -5.596 -3.311 12.844 1.00 49.71 ? 245 LYS A CA 1 +ATOM 704 C C . LYS A 1 89 ? -4.189 -2.943 12.304 1.00 49.49 ? 245 LYS A C 1 +ATOM 705 O O . LYS A 1 89 ? -3.330 -2.346 13.062 1.00 51.14 ? 245 LYS A O 1 +ATOM 706 C CB . LYS A 1 89 ? -6.581 -2.016 12.718 1.00 48.61 ? 245 LYS A CB 1 +ATOM 707 C CG . LYS A 1 89 ? -8.262 -2.293 12.777 1.00 47.67 ? 245 LYS A CG 1 +ATOM 708 C CD . LYS A 1 89 ? -9.127 -1.509 11.771 1.00 48.40 ? 245 LYS A CD 1 +ATOM 709 C CE . LYS A 1 89 ? -10.277 -2.110 10.841 1.00 48.02 ? 245 LYS A CE 1 +ATOM 710 N NZ . LYS A 1 89 ? -10.797 -1.621 9.622 1.00 48.35 ? 245 LYS A NZ 1 +ATOM 711 N N . ALA A 1 90 ? -3.975 -3.201 11.005 1.00 49.07 ? 246 ALA A N 1 +ATOM 712 C CA . ALA A 1 90 ? -2.703 -2.847 10.386 1.00 49.32 ? 246 ALA A CA 1 +ATOM 713 C C . ALA A 1 90 ? -3.071 -1.693 9.452 1.00 50.71 ? 246 ALA A C 1 +ATOM 714 O O . ALA A 1 90 ? -3.872 -1.871 8.554 1.00 49.74 ? 246 ALA A O 1 +ATOM 715 C CB . ALA A 1 90 ? -2.147 -3.999 9.575 1.00 51.67 ? 246 ALA A CB 1 +ATOM 716 N N . PRO A 1 91 ? -2.557 -0.470 9.702 1.00 50.89 ? 247 PRO A N 1 +ATOM 717 C CA . PRO A 1 91 ? -2.833 0.721 8.883 1.00 53.10 ? 247 PRO A CA 1 +ATOM 718 C C . PRO A 1 91 ? -3.069 0.377 7.449 1.00 54.93 ? 247 PRO A C 1 +ATOM 719 O O . PRO A 1 91 ? -2.305 0.492 6.573 1.00 56.38 ? 247 PRO A O 1 +ATOM 720 C CB . PRO A 1 91 ? -1.578 1.526 8.989 1.00 52.54 ? 247 PRO A CB 1 +ATOM 721 C CG . PRO A 1 91 ? -1.155 1.279 10.396 1.00 51.11 ? 247 PRO A CG 1 +ATOM 722 C CD . PRO A 1 91 ? -1.371 -0.235 10.527 1.00 50.82 ? 247 PRO A CD 1 +ATOM 723 N N . ARG A 1 92 ? -4.178 0.059 7.316 1.00 59.14 ? 248 ARG A N 1 +ATOM 724 C CA . ARG A 1 92 ? -4.474 -0.334 5.938 1.00 58.44 ? 248 ARG A CA 1 +ATOM 725 C C . ARG A 1 92 ? -4.452 0.951 5.079 1.00 59.27 ? 248 ARG A C 1 +ATOM 726 O O . ARG A 1 92 ? -5.375 1.768 5.102 1.00 59.13 ? 248 ARG A O 1 +ATOM 727 C CB . ARG A 1 92 ? -5.828 -1.068 5.814 1.00 57.50 ? 248 ARG A CB 1 +ATOM 728 C CG . ARG A 1 92 ? -6.009 -2.363 6.670 1.00 56.83 ? 248 ARG A CG 1 +ATOM 729 C CD . ARG A 1 92 ? -4.770 -3.315 6.794 1.00 56.14 ? 248 ARG A CD 1 +ATOM 730 N NE . ARG A 1 92 ? -4.512 -4.236 5.676 1.00 55.47 ? 248 ARG A NE 1 +ATOM 731 C CZ . ARG A 1 92 ? -3.520 -5.131 5.659 1.00 56.02 ? 248 ARG A CZ 1 +ATOM 732 N NH1 . ARG A 1 92 ? -2.691 -5.236 6.695 1.00 56.35 ? 248 ARG A NH1 1 +ATOM 733 N NH2 . ARG A 1 92 ? -3.341 -5.916 4.604 1.00 54.93 ? 248 ARG A NH2 1 +ATOM 734 N N . ARG A 1 93 ? -3.341 1.093 4.358 1.00 60.08 ? 249 ARG A N 1 +ATOM 735 C CA . ARG A 1 93 ? -2.952 2.185 3.447 1.00 60.52 ? 249 ARG A CA 1 +ATOM 736 C C . ARG A 1 93 ? -3.880 3.282 2.897 1.00 59.72 ? 249 ARG A C 1 +ATOM 737 O O . ARG A 1 93 ? -5.106 3.141 2.824 1.00 58.39 ? 249 ARG A O 1 +ATOM 738 C CB . ARG A 1 93 ? -2.211 1.550 2.264 1.00 64.43 ? 249 ARG A CB 1 +ATOM 739 C CG . ARG A 1 93 ? -1.057 2.363 1.700 1.00 70.37 ? 249 ARG A CG 1 +ATOM 740 C CD . ARG A 1 93 ? -0.118 1.474 0.884 1.00 74.90 ? 249 ARG A CD 1 +ATOM 741 N NE . ARG A 1 93 ? 0.713 0.610 1.723 1.00 79.18 ? 249 ARG A NE 1 +ATOM 742 C CZ . ARG A 1 93 ? 1.812 1.011 2.359 1.00 81.00 ? 249 ARG A CZ 1 +ATOM 743 N NH1 . ARG A 1 93 ? 2.224 2.268 2.254 1.00 81.52 ? 249 ARG A NH1 1 +ATOM 744 N NH2 . ARG A 1 93 ? 2.504 0.153 3.099 1.00 81.92 ? 249 ARG A NH2 1 +ATOM 745 N N . ARG A 1 94 ? -3.226 4.376 2.499 1.00 58.34 ? 250 ARG A N 1 +ATOM 746 C CA . ARG A 1 94 ? -3.835 5.567 1.912 1.00 56.59 ? 250 ARG A CA 1 +ATOM 747 C C . ARG A 1 94 ? -4.335 6.654 2.883 1.00 56.65 ? 250 ARG A C 1 +ATOM 748 O O . ARG A 1 94 ? -5.496 6.639 3.294 1.00 56.63 ? 250 ARG A O 1 +ATOM 749 C CB . ARG A 1 94 ? -4.969 5.169 0.957 1.00 53.39 ? 250 ARG A CB 1 +ATOM 750 C CG . ARG A 1 94 ? -5.251 6.194 -0.144 1.00 49.48 ? 250 ARG A CG 1 +ATOM 751 C CD . ARG A 1 94 ? -4.272 6.055 -1.314 1.00 46.39 ? 250 ARG A CD 1 +ATOM 752 N NE . ARG A 1 94 ? -2.904 6.444 -0.965 1.00 43.73 ? 250 ARG A NE 1 +ATOM 753 C CZ . ARG A 1 94 ? -1.893 5.597 -0.786 1.00 43.37 ? 250 ARG A CZ 1 +ATOM 754 N NH1 . ARG A 1 94 ? -2.077 4.291 -0.917 1.00 43.11 ? 250 ARG A NH1 1 +ATOM 755 N NH2 . ARG A 1 94 ? -0.690 6.063 -0.485 1.00 41.97 ? 250 ARG A NH2 1 +ATOM 756 N N . ALA A 1 95 ? -3.438 7.555 3.239 1.00 69.10 ? 251 ALA A N 1 +ATOM 757 C CA . ALA A 1 95 ? -3.719 8.721 4.091 1.00 69.74 ? 251 ALA A CA 1 +ATOM 758 C C . ALA A 1 95 ? -3.300 9.672 2.995 1.00 69.48 ? 251 ALA A C 1 +ATOM 759 O O . ALA A 1 95 ? -4.114 10.408 2.427 1.00 70.11 ? 251 ALA A O 1 +ATOM 760 C CB . ALA A 1 95 ? -2.706 8.862 5.207 1.00 68.63 ? 251 ALA A CB 1 +ATOM 761 N N . VAL A 1 96 ? -2.038 9.684 2.807 1.00 67.88 ? 252 VAL A N 1 +ATOM 762 C CA . VAL A 1 96 ? -1.383 10.258 1.636 1.00 66.87 ? 252 VAL A CA 1 +ATOM 763 C C . VAL A 1 96 ? -0.089 10.814 1.778 1.00 67.75 ? 252 VAL A C 1 +ATOM 764 O O . VAL A 1 96 ? 0.480 10.494 2.800 1.00 67.51 ? 252 VAL A O 1 +ATOM 765 C CB . VAL A 1 96 ? -2.133 10.797 0.443 1.00 66.13 ? 252 VAL A CB 1 +ATOM 766 C CG1 . VAL A 1 96 ? -1.710 9.747 -0.623 1.00 65.21 ? 252 VAL A CG1 1 +ATOM 767 C CG2 . VAL A 1 96 ? -3.589 10.984 0.507 1.00 65.17 ? 252 VAL A CG2 1 +ATOM 768 N N . SER A 1 97 ? 0.403 11.303 0.598 1.00 67.14 ? 253 SER A N 1 +ATOM 769 C CA . SER A 1 97 ? 1.665 11.980 0.198 1.00 67.39 ? 253 SER A CA 1 +ATOM 770 C C . SER A 1 97 ? 2.045 13.470 0.510 1.00 67.99 ? 253 SER A C 1 +ATOM 771 O O . SER A 1 97 ? 1.596 14.137 1.467 1.00 69.63 ? 253 SER A O 1 +ATOM 772 C CB . SER A 1 97 ? 1.864 11.789 -1.289 1.00 67.42 ? 253 SER A CB 1 +ATOM 773 O OG . SER A 1 97 ? 2.227 10.438 -1.447 1.00 66.53 ? 253 SER A OG 1 +ATOM 774 O OXT . SER A 1 97 ? 2.953 13.913 -0.239 1.00 68.25 ? 253 SER A OXT 1 +ATOM 775 O "O5'" . DC B 2 1 ? -12.723 3.887 0.928 1.00 2.74 ? 1 DC B "O5'" 1 +ATOM 776 C "C5'" . DC B 2 1 ? -13.574 3.698 2.080 1.00 6.54 ? 1 DC B "C5'" 1 +ATOM 777 C "C4'" . DC B 2 1 ? -13.817 2.308 2.628 1.00 6.45 ? 1 DC B "C4'" 1 +ATOM 778 O "O4'" . DC B 2 1 ? -14.430 1.454 1.626 1.00 7.14 ? 1 DC B "O4'" 1 +ATOM 779 C "C3'" . DC B 2 1 ? -12.502 1.625 2.993 1.00 4.52 ? 1 DC B "C3'" 1 +ATOM 780 O "O3'" . DC B 2 1 ? -12.580 0.809 4.150 1.00 6.37 ? 1 DC B "O3'" 1 +ATOM 781 C "C2'" . DC B 2 1 ? -12.192 0.691 1.829 1.00 2.27 ? 1 DC B "C2'" 1 +ATOM 782 C "C1'" . DC B 2 1 ? -13.566 0.385 1.238 1.00 4.01 ? 1 DC B "C1'" 1 +ATOM 783 N N1 . DC B 2 1 ? -13.684 0.265 -0.233 1.00 0.82 ? 1 DC B N1 1 +ATOM 784 C C2 . DC B 2 1 ? -13.908 -0.999 -0.810 1.00 0.41 ? 1 DC B C2 1 +ATOM 785 O O2 . DC B 2 1 ? -14.041 -1.986 -0.068 1.00 0.79 ? 1 DC B O2 1 +ATOM 786 N N3 . DC B 2 1 ? -13.998 -1.102 -2.167 1.00 0.00 ? 1 DC B N3 1 +ATOM 787 C C4 . DC B 2 1 ? -13.883 -0.004 -2.932 1.00 0.25 ? 1 DC B C4 1 +ATOM 788 N N4 . DC B 2 1 ? -13.905 -0.146 -4.263 1.00 0.00 ? 1 DC B N4 1 +ATOM 789 C C5 . DC B 2 1 ? -13.715 1.290 -2.367 1.00 0.00 ? 1 DC B C5 1 +ATOM 790 C C6 . DC B 2 1 ? -13.608 1.379 -1.029 1.00 1.23 ? 1 DC B C6 1 +ATOM 791 P P . DT B 2 2 ? -11.288 0.105 5.069 1.00 10.29 ? 2 DT B P 1 +ATOM 792 O OP1 . DT B 2 2 ? -11.546 -0.377 6.459 1.00 11.47 ? 2 DT B OP1 1 +ATOM 793 O OP2 . DT B 2 2 ? -10.186 1.107 4.800 1.00 12.05 ? 2 DT B OP2 1 +ATOM 794 O "O5'" . DT B 2 2 ? -11.161 -1.344 4.393 1.00 12.34 ? 2 DT B "O5'" 1 +ATOM 795 C "C5'" . DT B 2 2 ? -12.119 -2.247 4.197 1.00 15.54 ? 2 DT B "C5'" 1 +ATOM 796 C "C4'" . DT B 2 2 ? -11.684 -3.544 3.556 1.00 16.48 ? 2 DT B "C4'" 1 +ATOM 797 O "O4'" . DT B 2 2 ? -11.937 -3.577 2.131 1.00 16.49 ? 2 DT B "O4'" 1 +ATOM 798 C "C3'" . DT B 2 2 ? -10.187 -3.865 3.712 1.00 18.83 ? 2 DT B "C3'" 1 +ATOM 799 O "O3'" . DT B 2 2 ? -10.110 -5.149 4.171 1.00 17.83 ? 2 DT B "O3'" 1 +ATOM 800 C "C2'" . DT B 2 2 ? -9.597 -3.667 2.311 1.00 19.18 ? 2 DT B "C2'" 1 +ATOM 801 C "C1'" . DT B 2 2 ? -10.778 -4.028 1.423 1.00 17.83 ? 2 DT B "C1'" 1 +ATOM 802 N N1 . DT B 2 2 ? -10.844 -3.461 0.051 1.00 17.58 ? 2 DT B N1 1 +ATOM 803 C C2 . DT B 2 2 ? -11.072 -4.344 -0.975 1.00 16.01 ? 2 DT B C2 1 +ATOM 804 O O2 . DT B 2 2 ? -11.209 -5.540 -0.786 1.00 16.59 ? 2 DT B O2 1 +ATOM 805 N N3 . DT B 2 2 ? -11.157 -3.772 -2.229 1.00 15.70 ? 2 DT B N3 1 +ATOM 806 C C4 . DT B 2 2 ? -11.049 -2.419 -2.541 1.00 18.65 ? 2 DT B C4 1 +ATOM 807 O O4 . DT B 2 2 ? -11.136 -2.034 -3.720 1.00 19.85 ? 2 DT B O4 1 +ATOM 808 C C5 . DT B 2 2 ? -10.826 -1.548 -1.404 1.00 19.34 ? 2 DT B C5 1 +ATOM 809 C C7 . DT B 2 2 ? -10.731 -0.073 -1.631 1.00 17.53 ? 2 DT B C7 1 +ATOM 810 C C6 . DT B 2 2 ? -10.719 -2.108 -0.187 1.00 18.52 ? 2 DT B C6 1 +ATOM 811 P P . DA B 2 3 ? -8.738 -5.667 4.618 1.00 14.32 ? 3 DA B P 1 +ATOM 812 O OP1 . DA B 2 3 ? -8.830 -6.195 6.002 1.00 15.22 ? 3 DA B OP1 1 +ATOM 813 O OP2 . DA B 2 3 ? -7.680 -4.683 4.265 1.00 17.73 ? 3 DA B OP2 1 +ATOM 814 O "O5'" . DA B 2 3 ? -8.352 -6.861 3.662 1.00 13.58 ? 3 DA B "O5'" 1 +ATOM 815 C "C5'" . DA B 2 3 ? -9.100 -7.938 3.286 1.00 14.20 ? 3 DA B "C5'" 1 +ATOM 816 C "C4'" . DA B 2 3 ? -8.528 -8.517 2.017 1.00 12.36 ? 3 DA B "C4'" 1 +ATOM 817 O "O4'" . DA B 2 3 ? -8.712 -7.628 0.889 1.00 11.09 ? 3 DA B "O4'" 1 +ATOM 818 C "C3'" . DA B 2 3 ? -7.052 -8.922 2.016 1.00 11.91 ? 3 DA B "C3'" 1 +ATOM 819 O "O3'" . DA B 2 3 ? -7.032 -10.254 1.488 1.00 13.74 ? 3 DA B "O3'" 1 +ATOM 820 C "C2'" . DA B 2 3 ? -6.402 -7.888 1.094 1.00 11.53 ? 3 DA B "C2'" 1 +ATOM 821 C "C1'" . DA B 2 3 ? -7.528 -7.585 0.109 1.00 8.74 ? 3 DA B "C1'" 1 +ATOM 822 N N9 . DA B 2 3 ? -7.495 -6.284 -0.577 1.00 5.64 ? 3 DA B N9 1 +ATOM 823 C C8 . DA B 2 3 ? -7.326 -5.037 -0.024 1.00 6.32 ? 3 DA B C8 1 +ATOM 824 N N7 . DA B 2 3 ? -7.398 -4.057 -0.894 1.00 5.59 ? 3 DA B N7 1 +ATOM 825 C C5 . DA B 2 3 ? -7.615 -4.700 -2.103 1.00 1.64 ? 3 DA B C5 1 +ATOM 826 C C6 . DA B 2 3 ? -7.779 -4.218 -3.413 1.00 0.57 ? 3 DA B C6 1 +ATOM 827 N N6 . DA B 2 3 ? -7.747 -2.937 -3.738 1.00 0.00 ? 3 DA B N6 1 +ATOM 828 N N1 . DA B 2 3 ? -7.972 -5.120 -4.398 1.00 0.00 ? 3 DA B N1 1 +ATOM 829 C C2 . DA B 2 3 ? -7.993 -6.423 -4.076 1.00 0.00 ? 3 DA B C2 1 +ATOM 830 N N3 . DA B 2 3 ? -7.849 -6.998 -2.880 1.00 0.00 ? 3 DA B N3 1 +ATOM 831 C C4 . DA B 2 3 ? -7.663 -6.070 -1.927 1.00 2.22 ? 3 DA B C4 1 +ATOM 832 P P . DT B 2 4 ? -5.716 -11.173 1.627 1.00 14.47 ? 4 DT B P 1 +ATOM 833 O OP1 . DT B 2 4 ? -6.093 -12.495 2.198 1.00 16.78 ? 4 DT B OP1 1 +ATOM 834 O OP2 . DT B 2 4 ? -4.642 -10.392 2.282 1.00 18.74 ? 4 DT B OP2 1 +ATOM 835 O "O5'" . DT B 2 4 ? -5.278 -11.342 0.104 1.00 14.84 ? 4 DT B "O5'" 1 +ATOM 836 C "C5'" . DT B 2 4 ? -5.820 -10.461 -0.877 1.00 12.29 ? 4 DT B "C5'" 1 +ATOM 837 C "C4'" . DT B 2 4 ? -5.455 -10.922 -2.261 1.00 11.00 ? 4 DT B "C4'" 1 +ATOM 838 O "O4'" . DT B 2 4 ? -5.724 -9.819 -3.158 1.00 10.00 ? 4 DT B "O4'" 1 +ATOM 839 C "C3'" . DT B 2 4 ? -3.965 -11.226 -2.384 1.00 12.33 ? 4 DT B "C3'" 1 +ATOM 840 O "O3'" . DT B 2 4 ? -3.728 -12.334 -3.244 1.00 14.33 ? 4 DT B "O3'" 1 +ATOM 841 C "C2'" . DT B 2 4 ? -3.368 -9.953 -2.945 1.00 10.60 ? 4 DT B "C2'" 1 +ATOM 842 C "C1'" . DT B 2 4 ? -4.516 -9.291 -3.690 1.00 6.74 ? 4 DT B "C1'" 1 +ATOM 843 N N1 . DT B 2 4 ? -4.534 -7.828 -3.481 1.00 2.17 ? 4 DT B N1 1 +ATOM 844 C C2 . DT B 2 4 ? -4.934 -7.016 -4.520 1.00 2.10 ? 4 DT B C2 1 +ATOM 845 O O2 . DT B 2 4 ? -5.328 -7.447 -5.599 1.00 2.35 ? 4 DT B O2 1 +ATOM 846 N N3 . DT B 2 4 ? -4.874 -5.671 -4.244 1.00 0.09 ? 4 DT B N3 1 +ATOM 847 C C4 . DT B 2 4 ? -4.493 -5.071 -3.055 1.00 0.58 ? 4 DT B C4 1 +ATOM 848 O O4 . DT B 2 4 ? -4.492 -3.834 -2.951 1.00 0.00 ? 4 DT B O4 1 +ATOM 849 C C5 . DT B 2 4 ? -4.122 -5.987 -2.004 1.00 0.00 ? 4 DT B C5 1 +ATOM 850 C C7 . DT B 2 4 ? -3.739 -5.432 -0.668 1.00 0.00 ? 4 DT B C7 1 +ATOM 851 C C6 . DT B 2 4 ? -4.149 -7.299 -2.269 1.00 0.00 ? 4 DT B C6 1 +ATOM 852 P P . DG B 2 5 ? -2.229 -12.670 -3.689 1.00 18.89 ? 5 DG B P 1 +ATOM 853 O OP1 . DG B 2 5 ? -2.226 -14.083 -4.154 1.00 18.31 ? 5 DG B OP1 1 +ATOM 854 O OP2 . DG B 2 5 ? -1.311 -12.246 -2.588 1.00 16.95 ? 5 DG B OP2 1 +ATOM 855 O "O5'" . DG B 2 5 ? -1.997 -11.717 -4.950 1.00 17.93 ? 5 DG B "O5'" 1 +ATOM 856 C "C5'" . DG B 2 5 ? -2.901 -11.759 -6.046 1.00 14.16 ? 5 DG B "C5'" 1 +ATOM 857 C "C4'" . DG B 2 5 ? -2.444 -10.841 -7.157 1.00 14.04 ? 5 DG B "C4'" 1 +ATOM 858 O "O4'" . DG B 2 5 ? -2.619 -9.457 -6.764 1.00 11.90 ? 5 DG B "O4'" 1 +ATOM 859 C "C3'" . DG B 2 5 ? -0.983 -10.983 -7.600 1.00 12.65 ? 5 DG B "C3'" 1 +ATOM 860 O "O3'" . DG B 2 5 ? -0.902 -10.961 -9.031 1.00 10.26 ? 5 DG B "O3'" 1 +ATOM 861 C "C2'" . DG B 2 5 ? -0.311 -9.748 -7.014 1.00 10.37 ? 5 DG B "C2'" 1 +ATOM 862 C "C1'" . DG B 2 5 ? -1.439 -8.735 -7.082 1.00 10.50 ? 5 DG B "C1'" 1 +ATOM 863 N N9 . DG B 2 5 ? -1.369 -7.541 -6.232 1.00 5.88 ? 5 DG B N9 1 +ATOM 864 C C8 . DG B 2 5 ? -1.360 -7.467 -4.860 1.00 3.91 ? 5 DG B C8 1 +ATOM 865 N N7 . DG B 2 5 ? -1.353 -6.236 -4.412 1.00 0.40 ? 5 DG B N7 1 +ATOM 866 C C5 . DG B 2 5 ? -1.343 -5.450 -5.554 1.00 1.15 ? 5 DG B C5 1 +ATOM 867 C C6 . DG B 2 5 ? -1.352 -4.036 -5.694 1.00 3.20 ? 5 DG B C6 1 +ATOM 868 O O6 . DG B 2 5 ? -1.378 -3.173 -4.798 1.00 4.57 ? 5 DG B O6 1 +ATOM 869 N N1 . DG B 2 5 ? -1.340 -3.653 -7.040 1.00 3.38 ? 5 DG B N1 1 +ATOM 870 C C2 . DG B 2 5 ? -1.325 -4.530 -8.112 1.00 6.12 ? 5 DG B C2 1 +ATOM 871 N N2 . DG B 2 5 ? -1.312 -3.987 -9.346 1.00 5.50 ? 5 DG B N2 1 +ATOM 872 N N3 . DG B 2 5 ? -1.324 -5.850 -7.984 1.00 4.97 ? 5 DG B N3 1 +ATOM 873 C C4 . DG B 2 5 ? -1.335 -6.237 -6.687 1.00 2.13 ? 5 DG B C4 1 +ATOM 874 P P . DT B 2 6 ? 0.313 -11.716 -9.783 1.00 11.05 ? 6 DT B P 1 +ATOM 875 O OP1 . DT B 2 6 ? -0.278 -12.363 -10.979 1.00 9.18 ? 6 DT B OP1 1 +ATOM 876 O OP2 . DT B 2 6 ? 1.106 -12.543 -8.820 1.00 7.69 ? 6 DT B OP2 1 +ATOM 877 O "O5'" . DT B 2 6 ? 1.247 -10.531 -10.292 1.00 13.76 ? 6 DT B "O5'" 1 +ATOM 878 C "C5'" . DT B 2 6 ? 1.434 -9.387 -9.484 1.00 11.55 ? 6 DT B "C5'" 1 +ATOM 879 C "C4'" . DT B 2 6 ? 1.544 -8.155 -10.343 1.00 10.38 ? 6 DT B "C4'" 1 +ATOM 880 O "O4'" . DT B 2 6 ? 1.127 -7.064 -9.508 1.00 9.39 ? 6 DT B "O4'" 1 +ATOM 881 C "C3'" . DT B 2 6 ? 2.945 -7.811 -10.844 1.00 9.56 ? 6 DT B "C3'" 1 +ATOM 882 O "O3'" . DT B 2 6 ? 2.899 -7.267 -12.165 1.00 10.98 ? 6 DT B "O3'" 1 +ATOM 883 C "C2'" . DT B 2 6 ? 3.420 -6.753 -9.870 1.00 7.97 ? 6 DT B "C2'" 1 +ATOM 884 C "C1'" . DT B 2 6 ? 2.145 -6.097 -9.387 1.00 6.23 ? 6 DT B "C1'" 1 +ATOM 885 N N1 . DT B 2 6 ? 2.158 -5.685 -7.977 1.00 1.60 ? 6 DT B N1 1 +ATOM 886 C C2 . DT B 2 6 ? 1.921 -4.365 -7.668 1.00 0.85 ? 6 DT B C2 1 +ATOM 887 O O2 . DT B 2 6 ? 1.749 -3.494 -8.508 1.00 1.77 ? 6 DT B O2 1 +ATOM 888 N N3 . DT B 2 6 ? 1.878 -4.103 -6.321 1.00 0.00 ? 6 DT B N3 1 +ATOM 889 C C4 . DT B 2 6 ? 2.031 -4.997 -5.287 1.00 0.00 ? 6 DT B C4 1 +ATOM 890 O O4 . DT B 2 6 ? 1.897 -4.621 -4.146 1.00 0.00 ? 6 DT B O4 1 +ATOM 891 C C5 . DT B 2 6 ? 2.320 -6.342 -5.676 1.00 0.00 ? 6 DT B C5 1 +ATOM 892 C C7 . DT B 2 6 ? 2.548 -7.368 -4.612 1.00 0.00 ? 6 DT B C7 1 +ATOM 893 C C6 . DT B 2 6 ? 2.372 -6.621 -6.987 1.00 1.53 ? 6 DT B C6 1 +ATOM 894 P P . DA B 2 7 ? 4.241 -7.212 -13.054 1.00 11.36 ? 7 DA B P 1 +ATOM 895 O OP1 . DA B 2 7 ? 3.850 -7.305 -14.478 1.00 12.40 ? 7 DA B OP1 1 +ATOM 896 O OP2 . DA B 2 7 ? 5.258 -8.152 -12.509 1.00 9.92 ? 7 DA B OP2 1 +ATOM 897 O "O5'" . DA B 2 7 ? 4.767 -5.738 -12.797 1.00 11.78 ? 7 DA B "O5'" 1 +ATOM 898 C "C5'" . DA B 2 7 ? 4.034 -4.625 -13.290 1.00 10.68 ? 7 DA B "C5'" 1 +ATOM 899 C "C4'" . DA B 2 7 ? 4.770 -3.337 -13.004 1.00 8.73 ? 7 DA B "C4'" 1 +ATOM 900 O "O4'" . DA B 2 7 ? 4.495 -2.888 -11.657 1.00 10.31 ? 7 DA B "O4'" 1 +ATOM 901 C "C3'" . DA B 2 7 ? 6.287 -3.429 -13.140 1.00 8.22 ? 7 DA B "C3'" 1 +ATOM 902 O "O3'" . DA B 2 7 ? 6.784 -2.334 -13.918 1.00 5.53 ? 7 DA B "O3'" 1 +ATOM 903 C "C2'" . DA B 2 7 ? 6.784 -3.410 -11.707 1.00 8.99 ? 7 DA B "C2'" 1 +ATOM 904 C "C1'" . DA B 2 7 ? 5.696 -2.686 -10.927 1.00 10.48 ? 7 DA B "C1'" 1 +ATOM 905 N N9 . DA B 2 7 ? 5.514 -3.263 -9.588 1.00 12.94 ? 7 DA B N9 1 +ATOM 906 C C8 . DA B 2 7 ? 5.575 -4.608 -9.301 1.00 12.89 ? 7 DA B C8 1 +ATOM 907 N N7 . DA B 2 7 ? 5.397 -4.895 -8.033 1.00 10.36 ? 7 DA B N7 1 +ATOM 908 C C5 . DA B 2 7 ? 5.204 -3.658 -7.432 1.00 11.24 ? 7 DA B C5 1 +ATOM 909 C C6 . DA B 2 7 ? 4.955 -3.284 -6.092 1.00 9.93 ? 7 DA B C6 1 +ATOM 910 N N6 . DA B 2 7 ? 4.864 -4.158 -5.081 1.00 9.68 ? 7 DA B N6 1 +ATOM 911 N N1 . DA B 2 7 ? 4.800 -1.968 -5.825 1.00 9.77 ? 7 DA B N1 1 +ATOM 912 C C2 . DA B 2 7 ? 4.888 -1.096 -6.837 1.00 11.04 ? 7 DA B C2 1 +ATOM 913 N N3 . DA B 2 7 ? 5.121 -1.320 -8.139 1.00 13.23 ? 7 DA B N3 1 +ATOM 914 C C4 . DA B 2 7 ? 5.271 -2.637 -8.377 1.00 13.29 ? 7 DA B C4 1 +ATOM 915 P P . DA B 2 8 ? 8.362 -2.215 -14.223 1.00 0.80 ? 8 DA B P 1 +ATOM 916 O OP1 . DA B 2 8 ? 8.531 -1.683 -15.604 1.00 2.76 ? 8 DA B OP1 1 +ATOM 917 O OP2 . DA B 2 8 ? 9.032 -3.490 -13.831 1.00 2.77 ? 8 DA B OP2 1 +ATOM 918 O "O5'" . DA B 2 8 ? 8.802 -1.077 -13.206 1.00 7.80 ? 8 DA B "O5'" 1 +ATOM 919 C "C5'" . DA B 2 8 ? 7.891 -0.034 -12.872 1.00 9.21 ? 8 DA B "C5'" 1 +ATOM 920 C "C4'" . DA B 2 8 ? 8.354 0.686 -11.630 1.00 9.47 ? 8 DA B "C4'" 1 +ATOM 921 O "O4'" . DA B 2 8 ? 7.855 0.045 -10.430 1.00 11.25 ? 8 DA B "O4'" 1 +ATOM 922 C "C3'" . DA B 2 8 ? 9.875 0.769 -11.481 1.00 11.07 ? 8 DA B "C3'" 1 +ATOM 923 O "O3'" . DA B 2 8 ? 10.255 2.090 -11.101 1.00 13.55 ? 8 DA B "O3'" 1 +ATOM 924 C "C2'" . DA B 2 8 ? 10.168 -0.185 -10.337 1.00 10.38 ? 8 DA B "C2'" 1 +ATOM 925 C "C1'" . DA B 2 8 ? 8.911 -0.055 -9.498 1.00 11.98 ? 8 DA B "C1'" 1 +ATOM 926 N N9 . DA B 2 8 ? 8.656 -1.205 -8.632 1.00 11.02 ? 8 DA B N9 1 +ATOM 927 C C8 . DA B 2 8 ? 8.544 -2.531 -8.980 1.00 9.80 ? 8 DA B C8 1 +ATOM 928 N N7 . DA B 2 8 ? 8.363 -3.330 -7.956 1.00 9.08 ? 8 DA B N7 1 +ATOM 929 C C5 . DA B 2 8 ? 8.349 -2.475 -6.862 1.00 8.81 ? 8 DA B C5 1 +ATOM 930 C C6 . DA B 2 8 ? 8.212 -2.710 -5.487 1.00 8.70 ? 8 DA B C6 1 +ATOM 931 N N6 . DA B 2 8 ? 8.085 -3.928 -4.964 1.00 9.24 ? 8 DA B N6 1 +ATOM 932 N N1 . DA B 2 8 ? 8.223 -1.641 -4.656 1.00 9.30 ? 8 DA B N1 1 +ATOM 933 C C2 . DA B 2 8 ? 8.380 -0.423 -5.189 1.00 13.37 ? 8 DA B C2 1 +ATOM 934 N N3 . DA B 2 8 ? 8.539 -0.075 -6.471 1.00 11.75 ? 8 DA B N3 1 +ATOM 935 C C4 . DA B 2 8 ? 8.512 -1.162 -7.264 1.00 9.73 ? 8 DA B C4 1 +ATOM 936 P P . DA B 2 9 ? 11.666 2.686 -11.596 1.00 15.30 ? 9 DA B P 1 +ATOM 937 O OP1 . DA B 2 9 ? 11.509 3.011 -13.035 1.00 12.23 ? 9 DA B OP1 1 +ATOM 938 O OP2 . DA B 2 9 ? 12.764 1.771 -11.161 1.00 12.62 ? 9 DA B OP2 1 +ATOM 939 O "O5'" . DA B 2 9 ? 11.796 4.050 -10.787 1.00 13.26 ? 9 DA B "O5'" 1 +ATOM 940 C "C5'" . DA B 2 9 ? 10.645 4.676 -10.241 1.00 17.05 ? 9 DA B "C5'" 1 +ATOM 941 C "C4'" . DA B 2 9 ? 10.851 4.954 -8.773 1.00 17.67 ? 9 DA B "C4'" 1 +ATOM 942 O "O4'" . DA B 2 9 ? 10.653 3.759 -7.979 1.00 19.21 ? 9 DA B "O4'" 1 +ATOM 943 C "C3'" . DA B 2 9 ? 12.224 5.506 -8.375 1.00 18.45 ? 9 DA B "C3'" 1 +ATOM 944 O "O3'" . DA B 2 9 ? 11.985 6.530 -7.400 1.00 17.90 ? 9 DA B "O3'" 1 +ATOM 945 C "C2'" . DA B 2 9 ? 12.921 4.290 -7.778 1.00 19.45 ? 9 DA B "C2'" 1 +ATOM 946 C "C1'" . DA B 2 9 ? 11.751 3.610 -7.086 1.00 20.07 ? 9 DA B "C1'" 1 +ATOM 947 N N9 . DA B 2 9 ? 11.891 2.188 -6.771 1.00 20.06 ? 9 DA B N9 1 +ATOM 948 C C8 . DA B 2 9 ? 12.303 1.164 -7.588 1.00 21.80 ? 9 DA B C8 1 +ATOM 949 N N7 . DA B 2 9 ? 12.263 -0.019 -7.013 1.00 21.01 ? 9 DA B N7 1 +ATOM 950 C C5 . DA B 2 9 ? 11.804 0.250 -5.731 1.00 18.59 ? 9 DA B C5 1 +ATOM 951 C C6 . DA B 2 9 ? 11.533 -0.579 -4.640 1.00 16.80 ? 9 DA B C6 1 +ATOM 952 N N6 . DA B 2 9 ? 11.670 -1.903 -4.670 1.00 15.82 ? 9 DA B N6 1 +ATOM 953 N N1 . DA B 2 9 ? 11.103 0.001 -3.499 1.00 17.29 ? 9 DA B N1 1 +ATOM 954 C C2 . DA B 2 9 ? 10.950 1.330 -3.477 1.00 17.60 ? 9 DA B C2 1 +ATOM 955 N N3 . DA B 2 9 ? 11.158 2.217 -4.448 1.00 18.51 ? 9 DA B N3 1 +ATOM 956 C C4 . DA B 2 9 ? 11.589 1.606 -5.562 1.00 19.52 ? 9 DA B C4 1 +ATOM 957 P P . DC B 2 10 ? 13.139 6.974 -6.380 1.00 16.16 ? 10 DC B P 1 +ATOM 958 O OP1 . DC B 2 10 ? 12.514 7.710 -5.245 1.00 15.60 ? 10 DC B OP1 1 +ATOM 959 O OP2 . DC B 2 10 ? 14.218 7.623 -7.181 1.00 18.37 ? 10 DC B OP2 1 +ATOM 960 O "O5'" . DC B 2 10 ? 13.672 5.611 -5.761 1.00 17.46 ? 10 DC B "O5'" 1 +ATOM 961 C "C5'" . DC B 2 10 ? 14.998 5.524 -5.278 1.00 16.15 ? 10 DC B "C5'" 1 +ATOM 962 C "C4'" . DC B 2 10 ? 15.000 5.079 -3.837 1.00 13.60 ? 10 DC B "C4'" 1 +ATOM 963 O "O4'" . DC B 2 10 ? 14.374 3.779 -3.721 1.00 11.53 ? 10 DC B "O4'" 1 +ATOM 964 C "C3'" . DC B 2 10 ? 16.417 4.909 -3.304 1.00 11.87 ? 10 DC B "C3'" 1 +ATOM 965 O "O3'" . DC B 2 10 ? 16.451 5.225 -1.924 1.00 12.05 ? 10 DC B "O3'" 1 +ATOM 966 C "C2'" . DC B 2 10 ? 16.697 3.436 -3.518 1.00 10.09 ? 10 DC B "C2'" 1 +ATOM 967 C "C1'" . DC B 2 10 ? 15.333 2.809 -3.304 1.00 9.63 ? 10 DC B "C1'" 1 +ATOM 968 N N1 . DC B 2 10 ? 15.141 1.583 -4.105 1.00 7.78 ? 10 DC B N1 1 +ATOM 969 C C2 . DC B 2 10 ? 14.658 0.452 -3.466 1.00 4.43 ? 10 DC B C2 1 +ATOM 970 O O2 . DC B 2 10 ? 14.342 0.536 -2.282 1.00 3.33 ? 10 DC B O2 1 +ATOM 971 N N3 . DC B 2 10 ? 14.536 -0.695 -4.151 1.00 4.72 ? 10 DC B N3 1 +ATOM 972 C C4 . DC B 2 10 ? 14.838 -0.734 -5.447 1.00 4.38 ? 10 DC B C4 1 +ATOM 973 N N4 . DC B 2 10 ? 14.659 -1.889 -6.085 1.00 5.69 ? 10 DC B N4 1 +ATOM 974 C C5 . DC B 2 10 ? 15.320 0.412 -6.143 1.00 3.07 ? 10 DC B C5 1 +ATOM 975 C C6 . DC B 2 10 ? 15.453 1.542 -5.440 1.00 6.20 ? 10 DC B C6 1 +ATOM 976 P P . DA B 2 11 ? 17.714 5.995 -1.331 1.00 14.64 ? 11 DA B P 1 +ATOM 977 O OP1 . DA B 2 11 ? 17.269 7.396 -1.104 1.00 13.71 ? 11 DA B OP1 1 +ATOM 978 O OP2 . DA B 2 11 ? 18.849 5.727 -2.251 1.00 13.91 ? 11 DA B OP2 1 +ATOM 979 O "O5'" . DA B 2 11 ? 17.973 5.285 0.074 1.00 12.23 ? 11 DA B "O5'" 1 +ATOM 980 C "C5'" . DA B 2 11 ? 17.230 5.655 1.240 1.00 18.20 ? 11 DA B "C5'" 1 +ATOM 981 C "C4'" . DA B 2 11 ? 17.574 4.721 2.378 1.00 21.13 ? 11 DA B "C4'" 1 +ATOM 982 O "O4'" . DA B 2 11 ? 17.222 3.379 1.968 1.00 22.88 ? 11 DA B "O4'" 1 +ATOM 983 C "C3'" . DA B 2 11 ? 19.071 4.669 2.659 1.00 22.35 ? 11 DA B "C3'" 1 +ATOM 984 O "O3'" . DA B 2 11 ? 19.335 4.266 4.004 1.00 21.56 ? 11 DA B "O3'" 1 +ATOM 985 C "C2'" . DA B 2 11 ? 19.549 3.607 1.693 1.00 22.82 ? 11 DA B "C2'" 1 +ATOM 986 C "C1'" . DA B 2 11 ? 18.398 2.624 1.723 1.00 22.23 ? 11 DA B "C1'" 1 +ATOM 987 N N9 . DA B 2 11 ? 18.199 1.889 0.481 1.00 20.50 ? 11 DA B N9 1 +ATOM 988 C C8 . DA B 2 11 ? 18.088 2.347 -0.809 1.00 21.04 ? 11 DA B C8 1 +ATOM 989 N N7 . DA B 2 11 ? 17.889 1.396 -1.692 1.00 20.27 ? 11 DA B N7 1 +ATOM 990 C C5 . DA B 2 11 ? 17.871 0.238 -0.929 1.00 20.88 ? 11 DA B C5 1 +ATOM 991 C C6 . DA B 2 11 ? 17.692 -1.115 -1.265 1.00 19.89 ? 11 DA B C6 1 +ATOM 992 N N6 . DA B 2 11 ? 17.471 -1.548 -2.507 1.00 20.90 ? 11 DA B N6 1 +ATOM 993 N N1 . DA B 2 11 ? 17.741 -2.023 -0.264 1.00 20.24 ? 11 DA B N1 1 +ATOM 994 C C2 . DA B 2 11 ? 17.951 -1.588 0.988 1.00 20.65 ? 11 DA B C2 1 +ATOM 995 N N3 . DA B 2 11 ? 18.125 -0.343 1.430 1.00 20.65 ? 11 DA B N3 1 +ATOM 996 C C4 . DA B 2 11 ? 18.072 0.529 0.409 1.00 21.43 ? 11 DA B C4 1 +ATOM 997 P P . DA B 2 12 ? 20.790 4.540 4.629 1.00 20.69 ? 12 DA B P 1 +ATOM 998 O OP1 . DA B 2 12 ? 20.612 5.031 6.025 1.00 18.89 ? 12 DA B OP1 1 +ATOM 999 O OP2 . DA B 2 12 ? 21.515 5.376 3.636 1.00 20.05 ? 12 DA B OP2 1 +ATOM 1000 O "O5'" . DA B 2 12 ? 21.478 3.109 4.706 1.00 17.31 ? 12 DA B "O5'" 1 +ATOM 1001 C "C5'" . DA B 2 12 ? 21.255 2.144 3.694 1.00 14.63 ? 12 DA B "C5'" 1 +ATOM 1002 C "C4'" . DA B 2 12 ? 21.572 0.764 4.214 1.00 12.75 ? 12 DA B "C4'" 1 +ATOM 1003 O "O4'" . DA B 2 12 ? 21.114 -0.205 3.243 1.00 10.30 ? 12 DA B "O4'" 1 +ATOM 1004 C "C3'" . DA B 2 12 ? 23.063 0.507 4.400 1.00 11.87 ? 12 DA B "C3'" 1 +ATOM 1005 O "O3'" . DA B 2 12 ? 23.293 -0.352 5.524 1.00 11.24 ? 12 DA B "O3'" 1 +ATOM 1006 C "C2'" . DA B 2 12 ? 23.473 -0.126 3.083 1.00 11.17 ? 12 DA B "C2'" 1 +ATOM 1007 C "C1'" . DA B 2 12 ? 22.211 -0.837 2.602 1.00 7.91 ? 12 DA B "C1'" 1 +ATOM 1008 N N9 . DA B 2 12 ? 22.000 -0.721 1.157 1.00 5.17 ? 12 DA B N9 1 +ATOM 1009 C C8 . DA B 2 12 ? 22.243 0.378 0.378 1.00 0.10 ? 12 DA B C8 1 +ATOM 1010 N N7 . DA B 2 12 ? 21.995 0.188 -0.890 1.00 0.55 ? 12 DA B N7 1 +ATOM 1011 C C5 . DA B 2 12 ? 21.554 -1.122 -0.954 1.00 0.71 ? 12 DA B C5 1 +ATOM 1012 C C6 . DA B 2 12 ? 21.146 -1.923 -2.030 1.00 0.83 ? 12 DA B C6 1 +ATOM 1013 N N6 . DA B 2 12 ? 21.156 -1.504 -3.304 1.00 0.00 ? 12 DA B N6 1 +ATOM 1014 N N1 . DA B 2 12 ? 20.735 -3.180 -1.755 1.00 0.00 ? 12 DA B N1 1 +ATOM 1015 C C2 . DA B 2 12 ? 20.754 -3.595 -0.484 1.00 0.00 ? 12 DA B C2 1 +ATOM 1016 N N3 . DA B 2 12 ? 21.139 -2.940 0.610 1.00 1.88 ? 12 DA B N3 1 +ATOM 1017 C C4 . DA B 2 12 ? 21.534 -1.691 0.301 1.00 2.26 ? 12 DA B C4 1 +ATOM 1018 P P . DC B 2 13 ? 24.708 -1.104 5.676 1.00 10.03 ? 13 DC B P 1 +ATOM 1019 O OP1 . DC B 2 13 ? 24.676 -1.892 6.946 1.00 8.82 ? 13 DC B OP1 1 +ATOM 1020 O OP2 . DC B 2 13 ? 25.783 -0.108 5.450 1.00 11.00 ? 13 DC B OP2 1 +ATOM 1021 O "O5'" . DC B 2 13 ? 24.724 -2.095 4.428 1.00 7.24 ? 13 DC B "O5'" 1 +ATOM 1022 C "C5'" . DC B 2 13 ? 25.731 -3.083 4.249 1.00 5.54 ? 13 DC B "C5'" 1 +ATOM 1023 C "C4'" . DC B 2 13 ? 25.177 -4.191 3.384 1.00 7.32 ? 13 DC B "C4'" 1 +ATOM 1024 O "O4'" . DC B 2 13 ? 24.470 -3.613 2.255 1.00 7.56 ? 13 DC B "O4'" 1 +ATOM 1025 C "C3'" . DC B 2 13 ? 26.204 -5.149 2.782 1.00 8.13 ? 13 DC B "C3'" 1 +ATOM 1026 O "O3'" . DC B 2 13 ? 25.533 -6.394 2.517 1.00 10.01 ? 13 DC B "O3'" 1 +ATOM 1027 C "C2'" . DC B 2 13 ? 26.438 -4.547 1.408 1.00 9.16 ? 13 DC B "C2'" 1 +ATOM 1028 C "C1'" . DC B 2 13 ? 25.023 -4.143 1.056 1.00 9.56 ? 13 DC B "C1'" 1 +ATOM 1029 N N1 . DC B 2 13 ? 24.889 -3.149 -0.027 1.00 8.16 ? 13 DC B N1 1 +ATOM 1030 C C2 . DC B 2 13 ? 24.561 -3.614 -1.299 1.00 7.35 ? 13 DC B C2 1 +ATOM 1031 O O2 . DC B 2 13 ? 24.413 -4.828 -1.467 1.00 6.29 ? 13 DC B O2 1 +ATOM 1032 N N3 . DC B 2 13 ? 24.411 -2.737 -2.312 1.00 5.98 ? 13 DC B N3 1 +ATOM 1033 C C4 . DC B 2 13 ? 24.570 -1.436 -2.092 1.00 6.48 ? 13 DC B C4 1 +ATOM 1034 N N4 . DC B 2 13 ? 24.373 -0.607 -3.117 1.00 2.85 ? 13 DC B N4 1 +ATOM 1035 C C5 . DC B 2 13 ? 24.924 -0.928 -0.808 1.00 9.46 ? 13 DC B C5 1 +ATOM 1036 C C6 . DC B 2 13 ? 25.070 -1.813 0.190 1.00 10.93 ? 13 DC B C6 1 +ATOM 1037 N N . MET C 1 1 ? 24.890 -30.544 39.374 1.00 24.43 ? 1157 MET C N 1 +ATOM 1038 C CA . MET C 1 1 ? 25.199 -30.671 37.912 1.00 28.55 ? 1157 MET C CA 1 +ATOM 1039 C C . MET C 1 1 ? 25.871 -32.016 37.604 1.00 30.50 ? 1157 MET C C 1 +ATOM 1040 O O . MET C 1 1 ? 27.073 -32.185 37.832 1.00 30.35 ? 1157 MET C O 1 +ATOM 1041 C CB . MET C 1 1 ? 26.094 -29.530 37.477 1.00 25.67 ? 1157 MET C CB 1 +ATOM 1042 N N . GLY C 1 2 ? 25.100 -32.964 37.066 1.00 32.06 ? 1158 GLY C N 1 +ATOM 1043 C CA . GLY C 1 2 ? 25.649 -34.282 36.785 1.00 33.65 ? 1158 GLY C CA 1 +ATOM 1044 C C . GLY C 1 2 ? 25.401 -34.900 35.425 1.00 33.68 ? 1158 GLY C C 1 +ATOM 1045 O O . GLY C 1 2 ? 25.786 -34.310 34.410 1.00 34.88 ? 1158 GLY C O 1 +ATOM 1046 N N . ASN C 1 3 ? 24.766 -36.078 35.386 1.00 34.65 ? 1159 ASN C N 1 +ATOM 1047 C CA . ASN C 1 3 ? 24.537 -36.704 34.092 1.00 34.67 ? 1159 ASN C CA 1 +ATOM 1048 C C . ASN C 1 3 ? 23.695 -35.854 33.160 1.00 34.41 ? 1159 ASN C C 1 +ATOM 1049 O O . ASN C 1 3 ? 22.523 -35.517 33.382 1.00 33.96 ? 1159 ASN C O 1 +ATOM 1050 C CB . ASN C 1 3 ? 24.047 -38.164 34.182 1.00 37.58 ? 1159 ASN C CB 1 +ATOM 1051 C CG . ASN C 1 3 ? 23.040 -38.413 35.285 1.00 37.74 ? 1159 ASN C CG 1 +ATOM 1052 O OD1 . ASN C 1 3 ? 22.683 -39.569 35.551 1.00 39.80 ? 1159 ASN C OD1 1 +ATOM 1053 N ND2 . ASN C 1 3 ? 22.572 -37.353 35.926 1.00 37.06 ? 1159 ASN C ND2 1 +ATOM 1054 N N . LEU C 1 4 ? 24.432 -35.517 32.108 1.00 33.67 ? 1160 LEU C N 1 +ATOM 1055 C CA . LEU C 1 4 ? 24.150 -34.635 30.995 1.00 32.77 ? 1160 LEU C CA 1 +ATOM 1056 C C . LEU C 1 4 ? 23.669 -33.281 31.446 1.00 30.74 ? 1160 LEU C C 1 +ATOM 1057 O O . LEU C 1 4 ? 22.604 -33.106 32.034 1.00 32.23 ? 1160 LEU C O 1 +ATOM 1058 C CB . LEU C 1 4 ? 23.360 -35.315 29.865 1.00 35.21 ? 1160 LEU C CB 1 +ATOM 1059 C CG . LEU C 1 4 ? 24.308 -36.165 28.958 1.00 35.26 ? 1160 LEU C CG 1 +ATOM 1060 C CD1 . LEU C 1 4 ? 23.962 -35.939 27.486 1.00 37.63 ? 1160 LEU C CD1 1 +ATOM 1061 C CD2 . LEU C 1 4 ? 25.786 -35.790 29.175 1.00 36.54 ? 1160 LEU C CD2 1 +ATOM 1062 N N . SER C 1 5 ? 24.598 -32.363 31.191 1.00 28.51 ? 1161 SER C N 1 +ATOM 1063 C CA . SER C 1 5 ? 24.620 -30.963 31.563 1.00 26.18 ? 1161 SER C CA 1 +ATOM 1064 C C . SER C 1 5 ? 23.781 -29.821 31.009 1.00 23.31 ? 1161 SER C C 1 +ATOM 1065 O O . SER C 1 5 ? 22.971 -29.965 30.097 1.00 23.81 ? 1161 SER C O 1 +ATOM 1066 C CB . SER C 1 5 ? 26.069 -30.538 31.464 1.00 29.30 ? 1161 SER C CB 1 +ATOM 1067 O OG . SER C 1 5 ? 26.232 -29.227 31.936 1.00 31.32 ? 1161 SER C OG 1 +ATOM 1068 N N . TYR C 1 6 ? 24.053 -28.660 31.601 1.00 19.82 ? 1162 TYR C N 1 +ATOM 1069 C CA . TYR C 1 6 ? 23.437 -27.389 31.275 1.00 19.02 ? 1162 TYR C CA 1 +ATOM 1070 C C . TYR C 1 6 ? 23.287 -27.217 29.773 1.00 19.26 ? 1162 TYR C C 1 +ATOM 1071 O O . TYR C 1 6 ? 22.174 -27.067 29.270 1.00 20.43 ? 1162 TYR C O 1 +ATOM 1072 C CB . TYR C 1 6 ? 24.275 -26.243 31.868 1.00 16.30 ? 1162 TYR C CB 1 +ATOM 1073 C CG . TYR C 1 6 ? 24.117 -26.068 33.372 1.00 14.06 ? 1162 TYR C CG 1 +ATOM 1074 C CD1 . TYR C 1 6 ? 24.702 -24.989 34.043 1.00 12.07 ? 1162 TYR C CD1 1 +ATOM 1075 C CD2 . TYR C 1 6 ? 23.359 -26.970 34.121 1.00 13.81 ? 1162 TYR C CD2 1 +ATOM 1076 C CE1 . TYR C 1 6 ? 24.529 -24.815 35.412 1.00 10.70 ? 1162 TYR C CE1 1 +ATOM 1077 C CE2 . TYR C 1 6 ? 23.184 -26.805 35.490 1.00 11.21 ? 1162 TYR C CE2 1 +ATOM 1078 C CZ . TYR C 1 6 ? 23.767 -25.729 36.127 1.00 11.69 ? 1162 TYR C CZ 1 +ATOM 1079 O OH . TYR C 1 6 ? 23.577 -25.564 37.479 1.00 12.74 ? 1162 TYR C OH 1 +ATOM 1080 N N . ALA C 1 7 ? 24.403 -27.232 29.055 1.00 19.18 ? 1163 ALA C N 1 +ATOM 1081 C CA . ALA C 1 7 ? 24.358 -27.108 27.602 1.00 18.34 ? 1163 ALA C CA 1 +ATOM 1082 C C . ALA C 1 7 ? 23.375 -28.144 27.055 1.00 17.84 ? 1163 ALA C C 1 +ATOM 1083 O O . ALA C 1 7 ? 22.467 -27.816 26.294 1.00 18.03 ? 1163 ALA C O 1 +ATOM 1084 C CB . ALA C 1 7 ? 25.731 -27.347 27.016 1.00 16.79 ? 1163 ALA C CB 1 +ATOM 1085 N N . ASP C 1 8 ? 23.567 -29.399 27.448 1.00 17.38 ? 1164 ASP C N 1 +ATOM 1086 C CA . ASP C 1 8 ? 22.697 -30.481 27.012 1.00 18.08 ? 1164 ASP C CA 1 +ATOM 1087 C C . ASP C 1 8 ? 21.252 -30.261 27.436 1.00 17.20 ? 1164 ASP C C 1 +ATOM 1088 O O . ASP C 1 8 ? 20.335 -30.781 26.811 1.00 15.31 ? 1164 ASP C O 1 +ATOM 1089 C CB . ASP C 1 8 ? 23.192 -31.816 27.572 1.00 19.62 ? 1164 ASP C CB 1 +ATOM 1090 C CG . ASP C 1 8 ? 24.075 -32.573 26.589 1.00 19.22 ? 1164 ASP C CG 1 +ATOM 1091 O OD1 . ASP C 1 8 ? 23.536 -33.349 25.763 1.00 15.00 ? 1164 ASP C OD1 1 +ATOM 1092 O OD2 . ASP C 1 8 ? 25.312 -32.381 26.637 1.00 21.57 ? 1164 ASP C OD2 1 +ATOM 1093 N N . LEU C 1 9 ? 21.052 -29.505 28.510 1.00 17.68 ? 1165 LEU C N 1 +ATOM 1094 C CA . LEU C 1 9 ? 19.704 -29.225 28.988 1.00 17.93 ? 1165 LEU C CA 1 +ATOM 1095 C C . LEU C 1 9 ? 19.062 -28.230 28.028 1.00 17.93 ? 1165 LEU C C 1 +ATOM 1096 O O . LEU C 1 9 ? 18.019 -28.515 27.429 1.00 18.86 ? 1165 LEU C O 1 +ATOM 1097 C CB . LEU C 1 9 ? 19.734 -28.617 30.391 1.00 17.34 ? 1165 LEU C CB 1 +ATOM 1098 C CG . LEU C 1 9 ? 20.503 -29.327 31.504 1.00 19.82 ? 1165 LEU C CG 1 +ATOM 1099 C CD1 . LEU C 1 9 ? 20.425 -28.448 32.744 1.00 22.72 ? 1165 LEU C CD1 1 +ATOM 1100 C CD2 . LEU C 1 9 ? 19.948 -30.721 31.790 1.00 18.74 ? 1165 LEU C CD2 1 +ATOM 1101 N N . ILE C 1 10 ? 19.690 -27.061 27.887 1.00 16.81 ? 1166 ILE C N 1 +ATOM 1102 C CA . ILE C 1 10 ? 19.180 -26.020 26.991 1.00 15.85 ? 1166 ILE C CA 1 +ATOM 1103 C C . ILE C 1 10 ? 18.624 -26.716 25.754 1.00 15.27 ? 1166 ILE C C 1 +ATOM 1104 O O . ILE C 1 10 ? 17.441 -26.608 25.437 1.00 12.99 ? 1166 ILE C O 1 +ATOM 1105 C CB . ILE C 1 10 ? 20.297 -25.050 26.513 1.00 15.54 ? 1166 ILE C CB 1 +ATOM 1106 C CG1 . ILE C 1 10 ? 21.260 -24.704 27.664 1.00 16.76 ? 1166 ILE C CG1 1 +ATOM 1107 C CG2 . ILE C 1 10 ? 19.667 -23.799 25.933 1.00 12.62 ? 1166 ILE C CG2 1 +ATOM 1108 C CD1 . ILE C 1 10 ? 20.636 -23.970 28.827 1.00 16.49 ? 1166 ILE C CD1 1 +ATOM 1109 N N . THR C 1 11 ? 19.511 -27.438 25.077 1.00 15.59 ? 1167 THR C N 1 +ATOM 1110 C CA . THR C 1 11 ? 19.198 -28.203 23.875 1.00 15.95 ? 1167 THR C CA 1 +ATOM 1111 C C . THR C 1 11 ? 17.884 -28.950 24.005 1.00 16.32 ? 1167 THR C C 1 +ATOM 1112 O O . THR C 1 11 ? 16.966 -28.755 23.205 1.00 14.94 ? 1167 THR C O 1 +ATOM 1113 C CB . THR C 1 11 ? 20.320 -29.215 23.588 1.00 16.30 ? 1167 THR C CB 1 +ATOM 1114 O OG1 . THR C 1 11 ? 21.459 -28.517 23.079 1.00 21.30 ? 1167 THR C OG1 1 +ATOM 1115 C CG2 . THR C 1 11 ? 19.878 -30.255 22.589 1.00 18.30 ? 1167 THR C CG2 1 +ATOM 1116 N N . ARG C 1 12 ? 17.812 -29.818 25.010 1.00 18.53 ? 1168 ARG C N 1 +ATOM 1117 C CA . ARG C 1 12 ? 16.617 -30.605 25.276 1.00 20.15 ? 1168 ARG C CA 1 +ATOM 1118 C C . ARG C 1 12 ? 15.417 -29.674 25.269 1.00 22.40 ? 1168 ARG C C 1 +ATOM 1119 O O . ARG C 1 12 ? 14.386 -29.957 24.656 1.00 21.53 ? 1168 ARG C O 1 +ATOM 1120 C CB . ARG C 1 12 ? 16.722 -31.262 26.644 1.00 18.15 ? 1168 ARG C CB 1 +ATOM 1121 C CG . ARG C 1 12 ? 17.803 -32.310 26.722 1.00 21.68 ? 1168 ARG C CG 1 +ATOM 1122 C CD . ARG C 1 12 ? 17.428 -33.538 25.921 1.00 21.32 ? 1168 ARG C CD 1 +ATOM 1123 N NE . ARG C 1 12 ? 18.536 -34.009 25.099 1.00 20.97 ? 1168 ARG C NE 1 +ATOM 1124 C CZ . ARG C 1 12 ? 18.594 -35.223 24.564 1.00 21.99 ? 1168 ARG C CZ 1 +ATOM 1125 N NH1 . ARG C 1 12 ? 19.635 -35.575 23.823 1.00 23.61 ? 1168 ARG C NH1 1 +ATOM 1126 N NH2 . ARG C 1 12 ? 17.613 -36.093 24.784 1.00 22.27 ? 1168 ARG C NH2 1 +ATOM 1127 N N . ALA C 1 13 ? 15.579 -28.552 25.957 1.00 24.78 ? 1169 ALA C N 1 +ATOM 1128 C CA . ALA C 1 13 ? 14.542 -27.544 26.072 1.00 24.55 ? 1169 ALA C CA 1 +ATOM 1129 C C . ALA C 1 13 ? 14.128 -26.944 24.726 1.00 25.51 ? 1169 ALA C C 1 +ATOM 1130 O O . ALA C 1 13 ? 12.973 -27.072 24.308 1.00 25.05 ? 1169 ALA C O 1 +ATOM 1131 C CB . ALA C 1 13 ? 15.020 -26.431 27.012 1.00 23.45 ? 1169 ALA C CB 1 +ATOM 1132 N N . ILE C 1 14 ? 15.072 -26.295 24.050 1.00 24.83 ? 1170 ILE C N 1 +ATOM 1133 C CA . ILE C 1 14 ? 14.786 -25.638 22.786 1.00 26.10 ? 1170 ILE C CA 1 +ATOM 1134 C C . ILE C 1 14 ? 13.951 -26.390 21.741 1.00 26.95 ? 1170 ILE C C 1 +ATOM 1135 O O . ILE C 1 14 ? 13.333 -25.750 20.889 1.00 27.67 ? 1170 ILE C O 1 +ATOM 1136 C CB . ILE C 1 14 ? 16.083 -25.136 22.145 1.00 26.57 ? 1170 ILE C CB 1 +ATOM 1137 C CG1 . ILE C 1 14 ? 16.865 -24.334 23.177 1.00 27.75 ? 1170 ILE C CG1 1 +ATOM 1138 C CG2 . ILE C 1 14 ? 15.775 -24.202 20.979 1.00 27.83 ? 1170 ILE C CG2 1 +ATOM 1139 C CD1 . ILE C 1 14 ? 16.066 -23.201 23.774 1.00 29.60 ? 1170 ILE C CD1 1 +ATOM 1140 N N . GLU C 1 15 ? 13.918 -27.721 21.771 1.00 26.41 ? 1171 GLU C N 1 +ATOM 1141 C CA . GLU C 1 15 ? 13.087 -28.413 20.789 1.00 27.32 ? 1171 GLU C CA 1 +ATOM 1142 C C . GLU C 1 15 ? 11.702 -28.548 21.384 1.00 26.33 ? 1171 GLU C C 1 +ATOM 1143 O O . GLU C 1 15 ? 10.702 -28.540 20.668 1.00 28.39 ? 1171 GLU C O 1 +ATOM 1144 C CB . GLU C 1 15 ? 13.596 -29.815 20.431 1.00 29.11 ? 1171 GLU C CB 1 +ATOM 1145 C CG . GLU C 1 15 ? 13.098 -30.261 19.030 1.00 31.62 ? 1171 GLU C CG 1 +ATOM 1146 C CD . GLU C 1 15 ? 12.627 -31.717 18.941 1.00 33.17 ? 1171 GLU C CD 1 +ATOM 1147 O OE1 . GLU C 1 15 ? 12.545 -32.237 17.806 1.00 31.94 ? 1171 GLU C OE1 1 +ATOM 1148 O OE2 . GLU C 1 15 ? 12.323 -32.334 19.985 1.00 34.41 ? 1171 GLU C OE2 1 +ATOM 1149 N N . SER C 1 16 ? 11.642 -28.662 22.705 1.00 23.62 ? 1172 SER C N 1 +ATOM 1150 C CA . SER C 1 16 ? 10.365 -28.802 23.374 1.00 20.59 ? 1172 SER C CA 1 +ATOM 1151 C C . SER C 1 16 ? 9.437 -27.643 23.004 1.00 20.59 ? 1172 SER C C 1 +ATOM 1152 O O . SER C 1 16 ? 8.239 -27.683 23.295 1.00 22.17 ? 1172 SER C O 1 +ATOM 1153 C CB . SER C 1 16 ? 10.565 -28.832 24.883 1.00 17.84 ? 1172 SER C CB 1 +ATOM 1154 O OG . SER C 1 16 ? 10.653 -27.520 25.392 1.00 14.09 ? 1172 SER C OG 1 +ATOM 1155 N N . SER C 1 17 ? 9.992 -26.624 22.351 1.00 18.68 ? 1173 SER C N 1 +ATOM 1156 C CA . SER C 1 17 ? 9.238 -25.433 21.955 1.00 16.34 ? 1173 SER C CA 1 +ATOM 1157 C C . SER C 1 17 ? 8.504 -25.581 20.629 1.00 14.45 ? 1173 SER C C 1 +ATOM 1158 O O . SER C 1 17 ? 8.971 -26.275 19.728 1.00 15.33 ? 1173 SER C O 1 +ATOM 1159 C CB . SER C 1 17 ? 10.184 -24.226 21.878 1.00 17.46 ? 1173 SER C CB 1 +ATOM 1160 O OG . SER C 1 17 ? 9.502 -23.049 21.472 1.00 14.52 ? 1173 SER C OG 1 +ATOM 1161 N N . PRO C 1 18 ? 7.345 -24.916 20.489 1.00 13.23 ? 1174 PRO C N 1 +ATOM 1162 C CA . PRO C 1 18 ? 6.546 -24.982 19.255 1.00 13.62 ? 1174 PRO C CA 1 +ATOM 1163 C C . PRO C 1 18 ? 7.269 -24.482 17.998 1.00 12.80 ? 1174 PRO C C 1 +ATOM 1164 O O . PRO C 1 18 ? 7.173 -25.097 16.930 1.00 11.12 ? 1174 PRO C O 1 +ATOM 1165 C CB . PRO C 1 18 ? 5.313 -24.144 19.593 1.00 12.38 ? 1174 PRO C CB 1 +ATOM 1166 C CG . PRO C 1 18 ? 5.161 -24.356 21.066 1.00 12.65 ? 1174 PRO C CG 1 +ATOM 1167 C CD . PRO C 1 18 ? 6.594 -24.231 21.556 1.00 12.94 ? 1174 PRO C CD 1 +ATOM 1168 N N . ASP C 1 19 ? 7.977 -23.365 18.112 1.00 11.85 ? 1175 ASP C N 1 +ATOM 1169 C CA . ASP C 1 19 ? 8.704 -22.859 16.962 1.00 12.22 ? 1175 ASP C CA 1 +ATOM 1170 C C . ASP C 1 19 ? 10.227 -22.922 17.134 1.00 11.01 ? 1175 ASP C C 1 +ATOM 1171 O O . ASP C 1 19 ? 10.988 -22.294 16.400 1.00 11.95 ? 1175 ASP C O 1 +ATOM 1172 C CB . ASP C 1 19 ? 8.211 -21.455 16.599 1.00 14.02 ? 1175 ASP C CB 1 +ATOM 1173 C CG . ASP C 1 19 ? 7.063 -21.498 15.594 1.00 15.23 ? 1175 ASP C CG 1 +ATOM 1174 O OD1 . ASP C 1 19 ? 6.458 -20.442 15.284 1.00 14.01 ? 1175 ASP C OD1 1 +ATOM 1175 O OD2 . ASP C 1 19 ? 6.781 -22.615 15.104 1.00 16.83 ? 1175 ASP C OD2 1 +ATOM 1176 N N . LYS C 1 20 ? 10.642 -23.717 18.115 1.00 9.71 ? 1176 LYS C N 1 +ATOM 1177 C CA . LYS C 1 20 ? 12.041 -24.010 18.432 1.00 9.40 ? 1176 LYS C CA 1 +ATOM 1178 C C . LYS C 1 20 ? 13.098 -22.892 18.658 1.00 10.73 ? 1176 LYS C C 1 +ATOM 1179 O O . LYS C 1 20 ? 14.198 -22.922 18.085 1.00 9.41 ? 1176 LYS C O 1 +ATOM 1180 C CB . LYS C 1 20 ? 12.551 -25.011 17.388 1.00 5.95 ? 1176 LYS C CB 1 +ATOM 1181 C CG . LYS C 1 20 ? 11.510 -25.421 16.349 1.00 5.44 ? 1176 LYS C CG 1 +ATOM 1182 C CD . LYS C 1 20 ? 10.934 -26.826 16.552 1.00 8.19 ? 1176 LYS C CD 1 +ATOM 1183 C CE . LYS C 1 20 ? 9.712 -27.049 15.641 1.00 10.86 ? 1176 LYS C CE 1 +ATOM 1184 N NZ . LYS C 1 20 ? 9.115 -28.416 15.689 1.00 9.52 ? 1176 LYS C NZ 1 +ATOM 1185 N N . ARG C 1 21 ? 12.772 -21.931 19.521 1.00 9.85 ? 1177 ARG C N 1 +ATOM 1186 C CA . ARG C 1 21 ? 13.677 -20.836 19.865 1.00 9.04 ? 1177 ARG C CA 1 +ATOM 1187 C C . ARG C 1 21 ? 13.118 -20.221 21.140 1.00 9.27 ? 1177 ARG C C 1 +ATOM 1188 O O . ARG C 1 21 ? 11.939 -20.366 21.426 1.00 8.89 ? 1177 ARG C O 1 +ATOM 1189 C CB . ARG C 1 21 ? 13.737 -19.775 18.758 1.00 7.41 ? 1177 ARG C CB 1 +ATOM 1190 C CG . ARG C 1 21 ? 12.426 -19.068 18.536 1.00 8.10 ? 1177 ARG C CG 1 +ATOM 1191 C CD . ARG C 1 21 ? 12.556 -17.754 17.778 1.00 6.56 ? 1177 ARG C CD 1 +ATOM 1192 N NE . ARG C 1 21 ? 11.299 -17.391 17.125 1.00 7.47 ? 1177 ARG C NE 1 +ATOM 1193 C CZ . ARG C 1 21 ? 10.092 -17.789 17.521 1.00 6.88 ? 1177 ARG C CZ 1 +ATOM 1194 N NH1 . ARG C 1 21 ? 9.018 -17.395 16.843 1.00 0.81 ? 1177 ARG C NH1 1 +ATOM 1195 N NH2 . ARG C 1 21 ? 9.957 -18.582 18.583 1.00 5.71 ? 1177 ARG C NH2 1 +ATOM 1196 N N . LEU C 1 22 ? 13.956 -19.536 21.910 1.00 12.03 ? 1178 LEU C N 1 +ATOM 1197 C CA . LEU C 1 22 ? 13.489 -18.940 23.162 1.00 13.62 ? 1178 LEU C CA 1 +ATOM 1198 C C . LEU C 1 22 ? 14.256 -17.699 23.561 1.00 14.24 ? 1178 LEU C C 1 +ATOM 1199 O O . LEU C 1 22 ? 15.247 -17.313 22.928 1.00 15.67 ? 1178 LEU C O 1 +ATOM 1200 C CB . LEU C 1 22 ? 13.636 -19.920 24.332 1.00 13.89 ? 1178 LEU C CB 1 +ATOM 1201 C CG . LEU C 1 22 ? 13.013 -21.315 24.394 1.00 13.64 ? 1178 LEU C CG 1 +ATOM 1202 C CD1 . LEU C 1 22 ? 13.273 -21.861 25.794 1.00 14.67 ? 1178 LEU C CD1 1 +ATOM 1203 C CD2 . LEU C 1 22 ? 11.514 -21.272 24.129 1.00 14.63 ? 1178 LEU C CD2 1 +ATOM 1204 N N . THR C 1 23 ? 13.778 -17.080 24.634 1.00 12.37 ? 1179 THR C N 1 +ATOM 1205 C CA . THR C 1 23 ? 14.436 -15.916 25.196 1.00 11.02 ? 1179 THR C CA 1 +ATOM 1206 C C . THR C 1 23 ? 15.068 -16.481 26.453 1.00 12.00 ? 1179 THR C C 1 +ATOM 1207 O O . THR C 1 23 ? 14.656 -17.543 26.927 1.00 15.88 ? 1179 THR C O 1 +ATOM 1208 C CB . THR C 1 23 ? 13.441 -14.844 25.599 1.00 8.05 ? 1179 THR C CB 1 +ATOM 1209 O OG1 . THR C 1 23 ? 12.328 -15.475 26.224 1.00 3.33 ? 1179 THR C OG1 1 +ATOM 1210 C CG2 . THR C 1 23 ? 12.980 -14.044 24.390 1.00 5.72 ? 1179 THR C CG2 1 +ATOM 1211 N N . LEU C 1 24 ? 16.059 -15.787 26.992 1.00 9.65 ? 1180 LEU C N 1 +ATOM 1212 C CA . LEU C 1 24 ? 16.730 -16.243 28.197 1.00 5.59 ? 1180 LEU C CA 1 +ATOM 1213 C C . LEU C 1 24 ? 15.696 -16.630 29.236 1.00 5.27 ? 1180 LEU C C 1 +ATOM 1214 O O . LEU C 1 24 ? 15.685 -17.751 29.727 1.00 4.26 ? 1180 LEU C O 1 +ATOM 1215 C CB . LEU C 1 24 ? 17.616 -15.124 28.737 1.00 2.41 ? 1180 LEU C CB 1 +ATOM 1216 C CG . LEU C 1 24 ? 18.912 -15.530 29.424 1.00 3.59 ? 1180 LEU C CG 1 +ATOM 1217 C CD1 . LEU C 1 24 ? 19.190 -17.004 29.226 1.00 3.08 ? 1180 LEU C CD1 1 +ATOM 1218 C CD2 . LEU C 1 24 ? 20.050 -14.701 28.850 1.00 5.44 ? 1180 LEU C CD2 1 +ATOM 1219 N N . SER C 1 25 ? 14.812 -15.687 29.540 1.00 6.17 ? 1181 SER C N 1 +ATOM 1220 C CA . SER C 1 25 ? 13.758 -15.866 30.532 1.00 5.92 ? 1181 SER C CA 1 +ATOM 1221 C C . SER C 1 25 ? 12.936 -17.165 30.406 1.00 8.16 ? 1181 SER C C 1 +ATOM 1222 O O . SER C 1 25 ? 12.887 -17.955 31.352 1.00 8.96 ? 1181 SER C O 1 +ATOM 1223 C CB . SER C 1 25 ? 12.825 -14.654 30.493 1.00 3.42 ? 1181 SER C CB 1 +ATOM 1224 O OG . SER C 1 25 ? 12.185 -14.467 31.737 1.00 0.64 ? 1181 SER C OG 1 +ATOM 1225 N N . GLN C 1 26 ? 12.292 -17.403 29.262 1.00 8.59 ? 1182 GLN C N 1 +ATOM 1226 C CA . GLN C 1 26 ? 11.484 -18.619 29.127 1.00 10.68 ? 1182 GLN C CA 1 +ATOM 1227 C C . GLN C 1 26 ? 12.362 -19.857 29.321 1.00 10.96 ? 1182 GLN C C 1 +ATOM 1228 O O . GLN C 1 26 ? 11.870 -20.967 29.574 1.00 10.57 ? 1182 GLN C O 1 +ATOM 1229 C CB . GLN C 1 26 ? 10.797 -18.689 27.753 1.00 9.37 ? 1182 GLN C CB 1 +ATOM 1230 C CG . GLN C 1 26 ? 10.503 -17.344 27.114 1.00 11.00 ? 1182 GLN C CG 1 +ATOM 1231 C CD . GLN C 1 26 ? 9.562 -16.462 27.923 1.00 12.96 ? 1182 GLN C CD 1 +ATOM 1232 O OE1 . GLN C 1 26 ? 9.456 -15.258 27.668 1.00 9.76 ? 1182 GLN C OE1 1 +ATOM 1233 N NE2 . GLN C 1 26 ? 8.860 -17.058 28.889 1.00 15.60 ? 1182 GLN C NE2 1 +ATOM 1234 N N . ILE C 1 27 ? 13.667 -19.667 29.179 1.00 9.61 ? 1183 ILE C N 1 +ATOM 1235 C CA . ILE C 1 27 ? 14.595 -20.782 29.354 1.00 9.79 ? 1183 ILE C CA 1 +ATOM 1236 C C . ILE C 1 27 ? 14.605 -21.139 30.838 1.00 10.71 ? 1183 ILE C C 1 +ATOM 1237 O O . ILE C 1 27 ? 14.286 -22.269 31.205 1.00 9.95 ? 1183 ILE C O 1 +ATOM 1238 C CB . ILE C 1 27 ? 16.041 -20.432 28.871 1.00 7.24 ? 1183 ILE C CB 1 +ATOM 1239 C CG1 . ILE C 1 27 ? 16.088 -20.328 27.345 1.00 5.29 ? 1183 ILE C CG1 1 +ATOM 1240 C CG2 . ILE C 1 27 ? 17.002 -21.514 29.281 1.00 7.90 ? 1183 ILE C CG2 1 +ATOM 1241 C CD1 . ILE C 1 27 ? 17.392 -19.778 26.810 1.00 2.65 ? 1183 ILE C CD1 1 +ATOM 1242 N N . TYR C 1 28 ? 14.955 -20.169 31.685 1.00 12.82 ? 1184 TYR C N 1 +ATOM 1243 C CA . TYR C 1 28 ? 14.967 -20.384 33.124 1.00 15.36 ? 1184 TYR C CA 1 +ATOM 1244 C C . TYR C 1 28 ? 13.716 -21.145 33.495 1.00 19.65 ? 1184 TYR C C 1 +ATOM 1245 O O . TYR C 1 28 ? 13.789 -22.255 34.024 1.00 22.68 ? 1184 TYR C O 1 +ATOM 1246 C CB . TYR C 1 28 ? 14.968 -19.055 33.879 1.00 12.30 ? 1184 TYR C CB 1 +ATOM 1247 C CG . TYR C 1 28 ? 16.229 -18.261 33.693 1.00 10.21 ? 1184 TYR C CG 1 +ATOM 1248 C CD1 . TYR C 1 28 ? 17.447 -18.903 33.453 1.00 7.91 ? 1184 TYR C CD1 1 +ATOM 1249 C CD2 . TYR C 1 28 ? 16.209 -16.871 33.718 1.00 6.94 ? 1184 TYR C CD2 1 +ATOM 1250 C CE1 . TYR C 1 28 ? 18.603 -18.185 33.232 1.00 5.86 ? 1184 TYR C CE1 1 +ATOM 1251 C CE2 . TYR C 1 28 ? 17.369 -16.142 33.503 1.00 6.09 ? 1184 TYR C CE2 1 +ATOM 1252 C CZ . TYR C 1 28 ? 18.560 -16.814 33.258 1.00 4.54 ? 1184 TYR C CZ 1 +ATOM 1253 O OH . TYR C 1 28 ? 19.719 -16.139 33.044 1.00 3.26 ? 1184 TYR C OH 1 +ATOM 1254 N N . GLU C 1 29 ? 12.573 -20.530 33.200 1.00 22.42 ? 1185 GLU C N 1 +ATOM 1255 C CA . GLU C 1 29 ? 11.256 -21.094 33.469 1.00 23.02 ? 1185 GLU C CA 1 +ATOM 1256 C C . GLU C 1 29 ? 11.150 -22.570 33.068 1.00 25.23 ? 1185 GLU C C 1 +ATOM 1257 O O . GLU C 1 29 ? 10.694 -23.393 33.852 1.00 28.28 ? 1185 GLU C O 1 +ATOM 1258 C CB . GLU C 1 29 ? 10.190 -20.255 32.741 1.00 25.35 ? 1185 GLU C CB 1 +ATOM 1259 C CG . GLU C 1 29 ? 10.299 -18.741 33.050 1.00 26.45 ? 1185 GLU C CG 1 +ATOM 1260 C CD . GLU C 1 29 ? 9.278 -17.870 32.326 1.00 29.78 ? 1185 GLU C CD 1 +ATOM 1261 O OE1 . GLU C 1 29 ? 9.537 -16.653 32.208 1.00 32.47 ? 1185 GLU C OE1 1 +ATOM 1262 O OE2 . GLU C 1 29 ? 8.219 -18.376 31.888 1.00 32.41 ? 1185 GLU C OE2 1 +ATOM 1263 N N . TRP C 1 30 ? 11.583 -22.924 31.864 1.00 27.17 ? 1186 TRP C N 1 +ATOM 1264 C CA . TRP C 1 30 ? 11.490 -24.319 31.432 1.00 27.00 ? 1186 TRP C CA 1 +ATOM 1265 C C . TRP C 1 30 ? 12.317 -25.240 32.321 1.00 26.26 ? 1186 TRP C C 1 +ATOM 1266 O O . TRP C 1 30 ? 11.950 -26.400 32.543 1.00 23.52 ? 1186 TRP C O 1 +ATOM 1267 C CB . TRP C 1 30 ? 11.962 -24.460 29.986 1.00 30.10 ? 1186 TRP C CB 1 +ATOM 1268 C CG . TRP C 1 30 ? 11.615 -25.783 29.339 1.00 31.35 ? 1186 TRP C CG 1 +ATOM 1269 C CD1 . TRP C 1 30 ? 10.519 -26.059 28.564 1.00 31.09 ? 1186 TRP C CD1 1 +ATOM 1270 C CD2 . TRP C 1 30 ? 12.402 -26.980 29.362 1.00 31.34 ? 1186 TRP C CD2 1 +ATOM 1271 N NE1 . TRP C 1 30 ? 10.584 -27.350 28.097 1.00 31.92 ? 1186 TRP C NE1 1 +ATOM 1272 C CE2 . TRP C 1 30 ? 11.730 -27.938 28.569 1.00 32.16 ? 1186 TRP C CE2 1 +ATOM 1273 C CE3 . TRP C 1 30 ? 13.614 -27.334 29.970 1.00 32.26 ? 1186 TRP C CE3 1 +ATOM 1274 C CZ2 . TRP C 1 30 ? 12.230 -29.231 28.365 1.00 32.82 ? 1186 TRP C CZ2 1 +ATOM 1275 C CZ3 . TRP C 1 30 ? 14.113 -28.617 29.768 1.00 34.26 ? 1186 TRP C CZ3 1 +ATOM 1276 C CH2 . TRP C 1 30 ? 13.420 -29.551 28.968 1.00 34.49 ? 1186 TRP C CH2 1 +ATOM 1277 N N . MET C 1 31 ? 13.436 -24.713 32.815 1.00 26.01 ? 1187 MET C N 1 +ATOM 1278 C CA . MET C 1 31 ? 14.343 -25.463 33.691 1.00 27.71 ? 1187 MET C CA 1 +ATOM 1279 C C . MET C 1 31 ? 13.688 -25.779 35.028 1.00 28.53 ? 1187 MET C C 1 +ATOM 1280 O O . MET C 1 31 ? 13.636 -26.942 35.447 1.00 29.67 ? 1187 MET C O 1 +ATOM 1281 C CB . MET C 1 31 ? 15.621 -24.669 33.972 1.00 24.63 ? 1187 MET C CB 1 +ATOM 1282 C CG . MET C 1 31 ? 16.608 -24.572 32.805 1.00 24.62 ? 1187 MET C CG 1 +ATOM 1283 S SD . MET C 1 31 ? 17.493 -26.084 32.396 1.00 18.15 ? 1187 MET C SD 1 +ATOM 1284 C CE . MET C 1 31 ? 18.357 -25.598 30.949 1.00 14.63 ? 1187 MET C CE 1 +ATOM 1285 N N . VAL C 1 32 ? 13.202 -24.739 35.704 1.00 26.63 ? 1188 VAL C N 1 +ATOM 1286 C CA . VAL C 1 32 ? 12.556 -24.918 36.991 1.00 24.82 ? 1188 VAL C CA 1 +ATOM 1287 C C . VAL C 1 32 ? 11.479 -25.987 36.857 1.00 25.00 ? 1188 VAL C C 1 +ATOM 1288 O O . VAL C 1 32 ? 11.112 -26.641 37.827 1.00 22.28 ? 1188 VAL C O 1 +ATOM 1289 C CB . VAL C 1 32 ? 11.942 -23.595 37.485 1.00 26.17 ? 1188 VAL C CB 1 +ATOM 1290 C CG1 . VAL C 1 32 ? 13.030 -22.539 37.605 1.00 27.64 ? 1188 VAL C CG1 1 +ATOM 1291 C CG2 . VAL C 1 32 ? 10.863 -23.124 36.530 1.00 26.40 ? 1188 VAL C CG2 1 +ATOM 1292 N N . ARG C 1 33 ? 11.006 -26.181 35.630 1.00 26.81 ? 1189 ARG C N 1 +ATOM 1293 C CA . ARG C 1 33 ? 9.968 -27.168 35.332 1.00 28.66 ? 1189 ARG C CA 1 +ATOM 1294 C C . ARG C 1 33 ? 10.503 -28.594 35.198 1.00 28.67 ? 1189 ARG C C 1 +ATOM 1295 O O . ARG C 1 33 ? 9.983 -29.514 35.835 1.00 29.81 ? 1189 ARG C O 1 +ATOM 1296 C CB . ARG C 1 33 ? 9.222 -26.780 34.038 1.00 28.47 ? 1189 ARG C CB 1 +ATOM 1297 C CG . ARG C 1 33 ? 8.177 -25.672 34.203 1.00 27.63 ? 1189 ARG C CG 1 +ATOM 1298 C CD . ARG C 1 33 ? 8.160 -24.680 33.043 1.00 26.69 ? 1189 ARG C CD 1 +ATOM 1299 N NE . ARG C 1 33 ? 8.060 -25.307 31.725 1.00 26.59 ? 1189 ARG C NE 1 +ATOM 1300 C CZ . ARG C 1 33 ? 7.785 -24.645 30.600 1.00 26.03 ? 1189 ARG C CZ 1 +ATOM 1301 N NH1 . ARG C 1 33 ? 7.721 -25.292 29.446 1.00 26.07 ? 1189 ARG C NH1 1 +ATOM 1302 N NH2 . ARG C 1 33 ? 7.556 -23.336 30.626 1.00 25.25 ? 1189 ARG C NH2 1 +ATOM 1303 N N . CYS C 1 34 ? 11.542 -28.781 34.386 1.00 29.63 ? 1190 CYS C N 1 +ATOM 1304 C CA . CYS C 1 34 ? 12.096 -30.121 34.164 1.00 30.30 ? 1190 CYS C CA 1 +ATOM 1305 C C . CYS C 1 34 ? 13.400 -30.450 34.881 1.00 30.86 ? 1190 CYS C C 1 +ATOM 1306 O O . CYS C 1 34 ? 13.767 -31.622 34.989 1.00 31.80 ? 1190 CYS C O 1 +ATOM 1307 C CB . CYS C 1 34 ? 12.299 -30.363 32.662 1.00 28.22 ? 1190 CYS C CB 1 +ATOM 1308 S SG . CYS C 1 34 ? 13.159 -31.911 32.248 1.00 25.37 ? 1190 CYS C SG 1 +ATOM 1309 N N . VAL C 1 35 ? 14.103 -29.439 35.372 1.00 30.51 ? 1191 VAL C N 1 +ATOM 1310 C CA . VAL C 1 35 ? 15.374 -29.690 36.037 1.00 30.15 ? 1191 VAL C CA 1 +ATOM 1311 C C . VAL C 1 35 ? 15.243 -30.321 37.414 1.00 31.89 ? 1191 VAL C C 1 +ATOM 1312 O O . VAL C 1 35 ? 14.353 -29.971 38.195 1.00 31.77 ? 1191 VAL C O 1 +ATOM 1313 C CB . VAL C 1 35 ? 16.191 -28.393 36.173 1.00 31.08 ? 1191 VAL C CB 1 +ATOM 1314 C CG1 . VAL C 1 35 ? 17.556 -28.683 36.777 1.00 28.83 ? 1191 VAL C CG1 1 +ATOM 1315 C CG2 . VAL C 1 35 ? 16.348 -27.753 34.816 1.00 30.94 ? 1191 VAL C CG2 1 +ATOM 1316 N N . PRO C 1 36 ? 16.136 -31.274 37.723 1.00 32.79 ? 1192 PRO C N 1 +ATOM 1317 C CA . PRO C 1 36 ? 16.129 -31.957 39.019 1.00 33.21 ? 1192 PRO C CA 1 +ATOM 1318 C C . PRO C 1 36 ? 16.362 -30.951 40.142 1.00 33.65 ? 1192 PRO C C 1 +ATOM 1319 O O . PRO C 1 36 ? 15.482 -30.696 40.965 1.00 35.20 ? 1192 PRO C O 1 +ATOM 1320 C CB . PRO C 1 36 ? 17.280 -32.958 38.885 1.00 34.00 ? 1192 PRO C CB 1 +ATOM 1321 C CG . PRO C 1 36 ? 18.206 -32.295 37.881 1.00 33.27 ? 1192 PRO C CG 1 +ATOM 1322 C CD . PRO C 1 36 ? 17.223 -31.783 36.866 1.00 33.40 ? 1192 PRO C CD 1 +ATOM 1323 N N . TYR C 1 37 ? 17.553 -30.364 40.132 1.00 33.04 ? 1193 TYR C N 1 +ATOM 1324 C CA . TYR C 1 37 ? 17.995 -29.395 41.122 1.00 33.18 ? 1193 TYR C CA 1 +ATOM 1325 C C . TYR C 1 37 ? 17.069 -28.291 41.618 1.00 33.10 ? 1193 TYR C C 1 +ATOM 1326 O O . TYR C 1 37 ? 16.852 -28.166 42.814 1.00 34.85 ? 1193 TYR C O 1 +ATOM 1327 C CB . TYR C 1 37 ? 19.284 -28.734 40.636 1.00 34.88 ? 1193 TYR C CB 1 +ATOM 1328 C CG . TYR C 1 37 ? 20.545 -29.239 41.299 1.00 37.86 ? 1193 TYR C CG 1 +ATOM 1329 C CD1 . TYR C 1 37 ? 21.782 -28.699 40.965 1.00 38.40 ? 1193 TYR C CD1 1 +ATOM 1330 C CD2 . TYR C 1 37 ? 20.506 -30.257 42.258 1.00 39.25 ? 1193 TYR C CD2 1 +ATOM 1331 C CE1 . TYR C 1 37 ? 22.951 -29.154 41.562 1.00 39.29 ? 1193 TYR C CE1 1 +ATOM 1332 C CE2 . TYR C 1 37 ? 21.674 -30.720 42.864 1.00 39.23 ? 1193 TYR C CE2 1 +ATOM 1333 C CZ . TYR C 1 37 ? 22.893 -30.162 42.507 1.00 39.35 ? 1193 TYR C CZ 1 +ATOM 1334 O OH . TYR C 1 37 ? 24.060 -30.609 43.082 1.00 37.97 ? 1193 TYR C OH 1 +ATOM 1335 N N . PHE C 1 38 ? 16.534 -27.481 40.717 1.00 31.82 ? 1194 PHE C N 1 +ATOM 1336 C CA . PHE C 1 38 ? 15.707 -26.350 41.124 1.00 32.17 ? 1194 PHE C CA 1 +ATOM 1337 C C . PHE C 1 38 ? 14.279 -26.614 41.574 1.00 34.89 ? 1194 PHE C C 1 +ATOM 1338 O O . PHE C 1 38 ? 13.560 -27.398 40.951 1.00 36.72 ? 1194 PHE C O 1 +ATOM 1339 C CB . PHE C 1 38 ? 15.599 -25.325 39.993 1.00 29.05 ? 1194 PHE C CB 1 +ATOM 1340 C CG . PHE C 1 38 ? 16.823 -25.198 39.141 1.00 26.31 ? 1194 PHE C CG 1 +ATOM 1341 C CD1 . PHE C 1 38 ? 16.694 -24.800 37.813 1.00 26.41 ? 1194 PHE C CD1 1 +ATOM 1342 C CD2 . PHE C 1 38 ? 18.092 -25.473 39.640 1.00 24.62 ? 1194 PHE C CD2 1 +ATOM 1343 C CE1 . PHE C 1 38 ? 17.807 -24.682 36.986 1.00 25.21 ? 1194 PHE C CE1 1 +ATOM 1344 C CE2 . PHE C 1 38 ? 19.217 -25.357 38.822 1.00 24.76 ? 1194 PHE C CE2 1 +ATOM 1345 C CZ . PHE C 1 38 ? 19.075 -24.963 37.490 1.00 24.11 ? 1194 PHE C CZ 1 +ATOM 1346 N N . LYS C 1 39 ? 13.862 -25.956 42.656 1.00 37.70 ? 1195 LYS C N 1 +ATOM 1347 C CA . LYS C 1 39 ? 12.466 -26.062 43.062 1.00 38.80 ? 1195 LYS C CA 1 +ATOM 1348 C C . LYS C 1 39 ? 11.863 -24.686 42.860 1.00 40.28 ? 1195 LYS C C 1 +ATOM 1349 O O . LYS C 1 39 ? 12.409 -23.651 43.241 1.00 40.53 ? 1195 LYS C O 1 +ATOM 1350 C CB . LYS C 1 39 ? 12.242 -26.579 44.490 1.00 36.96 ? 1195 LYS C CB 1 +ATOM 1351 C CG . LYS C 1 39 ? 13.050 -25.945 45.574 1.00 33.55 ? 1195 LYS C CG 1 +ATOM 1352 C CD . LYS C 1 39 ? 14.456 -26.457 45.497 1.00 29.11 ? 1195 LYS C CD 1 +ATOM 1353 C CE . LYS C 1 39 ? 14.915 -27.007 46.812 1.00 23.51 ? 1195 LYS C CE 1 +ATOM 1354 N NZ . LYS C 1 39 ? 16.288 -27.483 46.617 1.00 19.83 ? 1195 LYS C NZ 1 +ATOM 1355 N N . ASP C 1 40 ? 10.711 -24.745 42.222 1.00 42.30 ? 1196 ASP C N 1 +ATOM 1356 C CA . ASP C 1 40 ? 9.903 -23.646 41.751 1.00 44.83 ? 1196 ASP C CA 1 +ATOM 1357 C C . ASP C 1 40 ? 9.424 -22.317 42.299 1.00 46.30 ? 1196 ASP C C 1 +ATOM 1358 O O . ASP C 1 40 ? 9.194 -22.069 43.492 1.00 48.63 ? 1196 ASP C O 1 +ATOM 1359 C CB . ASP C 1 40 ? 8.673 -24.258 41.104 1.00 45.60 ? 1196 ASP C CB 1 +ATOM 1360 C CG . ASP C 1 40 ? 8.660 -24.047 39.619 1.00 44.80 ? 1196 ASP C CG 1 +ATOM 1361 O OD1 . ASP C 1 40 ? 7.679 -24.453 38.958 1.00 45.73 ? 1196 ASP C OD1 1 +ATOM 1362 O OD2 . ASP C 1 40 ? 9.645 -23.464 39.117 1.00 44.37 ? 1196 ASP C OD2 1 +ATOM 1363 N N . LYS C 1 41 ? 9.217 -21.517 41.260 1.00 47.54 ? 1197 LYS C N 1 +ATOM 1364 C CA . LYS C 1 41 ? 8.680 -20.177 41.178 1.00 48.44 ? 1197 LYS C CA 1 +ATOM 1365 C C . LYS C 1 41 ? 8.829 -18.964 42.076 1.00 50.38 ? 1197 LYS C C 1 +ATOM 1366 O O . LYS C 1 41 ? 8.254 -18.899 43.154 1.00 49.57 ? 1197 LYS C O 1 +ATOM 1367 C CB . LYS C 1 41 ? 7.197 -20.332 40.863 1.00 48.99 ? 1197 LYS C CB 1 +ATOM 1368 C CG . LYS C 1 41 ? 6.448 -21.279 41.784 1.00 48.13 ? 1197 LYS C CG 1 +ATOM 1369 C CD . LYS C 1 41 ? 5.622 -20.520 42.811 1.00 48.10 ? 1197 LYS C CD 1 +ATOM 1370 C CE . LYS C 1 41 ? 4.910 -21.461 43.765 1.00 49.64 ? 1197 LYS C CE 1 +ATOM 1371 N NZ . LYS C 1 41 ? 4.103 -20.736 44.791 1.00 48.17 ? 1197 LYS C NZ 1 +ATOM 1372 N N . GLY C 1 42 ? 9.573 -17.995 41.547 1.00 52.00 ? 1198 GLY C N 1 +ATOM 1373 C CA . GLY C 1 42 ? 9.779 -16.676 42.165 1.00 54.72 ? 1198 GLY C CA 1 +ATOM 1374 C C . GLY C 1 42 ? 11.137 -16.083 41.838 1.00 54.30 ? 1198 GLY C C 1 +ATOM 1375 O O . GLY C 1 42 ? 11.838 -16.719 41.042 1.00 58.66 ? 1198 GLY C O 1 +ATOM 1376 N N . ASP C 1 43 ? 11.397 -14.834 42.254 1.00 49.46 ? 1199 ASP C N 1 +ATOM 1377 C CA . ASP C 1 43 ? 12.773 -14.275 42.176 1.00 50.58 ? 1199 ASP C CA 1 +ATOM 1378 C C . ASP C 1 43 ? 13.196 -12.831 42.487 1.00 55.07 ? 1199 ASP C C 1 +ATOM 1379 O O . ASP C 1 43 ? 12.460 -11.844 42.367 1.00 55.38 ? 1199 ASP C O 1 +ATOM 1380 C CB . ASP C 1 43 ? 13.558 -14.768 40.922 1.00 53.14 ? 1199 ASP C CB 1 +ATOM 1381 C CG . ASP C 1 43 ? 13.024 -14.000 39.728 1.00 55.34 ? 1199 ASP C CG 1 +ATOM 1382 O OD1 . ASP C 1 43 ? 13.560 -12.911 39.432 1.00 53.55 ? 1199 ASP C OD1 1 +ATOM 1383 O OD2 . ASP C 1 43 ? 12.069 -14.486 39.087 1.00 54.50 ? 1199 ASP C OD2 1 +ATOM 1384 N N . SER C 1 44 ? 14.453 -12.883 43.005 1.00 56.23 ? 1200 SER C N 1 +ATOM 1385 C CA . SER C 1 44 ? 15.425 -11.817 43.459 1.00 57.84 ? 1200 SER C CA 1 +ATOM 1386 C C . SER C 1 44 ? 16.508 -12.394 44.433 1.00 57.93 ? 1200 SER C C 1 +ATOM 1387 O O . SER C 1 44 ? 17.676 -12.454 44.077 1.00 60.21 ? 1200 SER C O 1 +ATOM 1388 C CB . SER C 1 44 ? 14.768 -10.541 44.043 1.00 57.55 ? 1200 SER C CB 1 +ATOM 1389 O OG . SER C 1 44 ? 13.762 -10.771 45.008 1.00 59.25 ? 1200 SER C OG 1 +ATOM 1390 N N . ASN C 1 45 ? 16.112 -12.831 45.624 1.00 57.03 ? 1201 ASN C N 1 +ATOM 1391 C CA . ASN C 1 45 ? 17.021 -13.404 46.649 1.00 54.71 ? 1201 ASN C CA 1 +ATOM 1392 C C . ASN C 1 45 ? 16.796 -14.873 46.607 1.00 52.97 ? 1201 ASN C C 1 +ATOM 1393 O O . ASN C 1 45 ? 17.493 -15.716 47.178 1.00 51.62 ? 1201 ASN C O 1 +ATOM 1394 C CB . ASN C 1 45 ? 16.477 -13.038 47.988 1.00 56.51 ? 1201 ASN C CB 1 +ATOM 1395 C CG . ASN C 1 45 ? 14.981 -13.432 48.104 1.00 57.21 ? 1201 ASN C CG 1 +ATOM 1396 O OD1 . ASN C 1 45 ? 14.100 -12.590 47.939 1.00 58.54 ? 1201 ASN C OD1 1 +ATOM 1397 N ND2 . ASN C 1 45 ? 14.706 -14.720 48.341 1.00 57.91 ? 1201 ASN C ND2 1 +ATOM 1398 N N . SER C 1 46 ? 15.759 -15.153 45.871 1.00 49.96 ? 1202 SER C N 1 +ATOM 1399 C CA . SER C 1 46 ? 15.129 -16.399 45.840 1.00 48.48 ? 1202 SER C CA 1 +ATOM 1400 C C . SER C 1 46 ? 15.876 -17.679 45.598 1.00 46.60 ? 1202 SER C C 1 +ATOM 1401 O O . SER C 1 46 ? 15.402 -18.825 46.010 1.00 49.04 ? 1202 SER C O 1 +ATOM 1402 C CB . SER C 1 46 ? 13.841 -16.110 45.009 1.00 48.52 ? 1202 SER C CB 1 +ATOM 1403 O OG . SER C 1 46 ? 13.411 -17.096 44.112 1.00 47.41 ? 1202 SER C OG 1 +ATOM 1404 N N . SER C 1 47 ? 17.081 -17.745 45.193 1.00 43.98 ? 1203 SER C N 1 +ATOM 1405 C CA . SER C 1 47 ? 18.172 -18.514 44.644 1.00 38.53 ? 1203 SER C CA 1 +ATOM 1406 C C . SER C 1 47 ? 18.319 -18.596 43.098 1.00 36.35 ? 1203 SER C C 1 +ATOM 1407 O O . SER C 1 47 ? 17.632 -19.289 42.340 1.00 33.14 ? 1203 SER C O 1 +ATOM 1408 C CB . SER C 1 47 ? 17.736 -20.024 45.109 1.00 40.01 ? 1203 SER C CB 1 +ATOM 1409 O OG . SER C 1 47 ? 17.573 -20.055 46.509 1.00 35.05 ? 1203 SER C OG 1 +ATOM 1410 N N . ALA C 1 48 ? 19.206 -17.698 42.676 1.00 32.17 ? 1204 ALA C N 1 +ATOM 1411 C CA . ALA C 1 48 ? 19.561 -17.531 41.232 1.00 28.44 ? 1204 ALA C CA 1 +ATOM 1412 C C . ALA C 1 48 ? 21.088 -17.487 41.164 1.00 25.84 ? 1204 ALA C C 1 +ATOM 1413 O O . ALA C 1 48 ? 21.732 -16.718 41.884 1.00 26.26 ? 1204 ALA C O 1 +ATOM 1414 C CB . ALA C 1 48 ? 18.986 -16.247 40.704 1.00 27.77 ? 1204 ALA C CB 1 +ATOM 1415 N N . GLY C 1 49 ? 21.667 -18.320 40.311 1.00 21.95 ? 1205 GLY C N 1 +ATOM 1416 C CA . GLY C 1 49 ? 23.114 -18.372 40.183 1.00 16.73 ? 1205 GLY C CA 1 +ATOM 1417 C C . GLY C 1 49 ? 23.388 -19.416 39.128 1.00 15.47 ? 1205 GLY C C 1 +ATOM 1418 O O . GLY C 1 49 ? 24.275 -19.270 38.286 1.00 15.53 ? 1205 GLY C O 1 +ATOM 1419 N N . TRP C 1 50 ? 22.613 -20.492 39.183 1.00 13.03 ? 1206 TRP C N 1 +ATOM 1420 C CA . TRP C 1 50 ? 22.739 -21.524 38.193 1.00 11.07 ? 1206 TRP C CA 1 +ATOM 1421 C C . TRP C 1 50 ? 22.640 -20.770 36.873 1.00 11.64 ? 1206 TRP C C 1 +ATOM 1422 O O . TRP C 1 50 ? 23.495 -20.929 36.002 1.00 12.56 ? 1206 TRP C O 1 +ATOM 1423 C CB . TRP C 1 50 ? 21.603 -22.538 38.321 1.00 11.55 ? 1206 TRP C CB 1 +ATOM 1424 C CG . TRP C 1 50 ? 20.228 -21.960 38.537 1.00 14.30 ? 1206 TRP C CG 1 +ATOM 1425 C CD1 . TRP C 1 50 ? 19.642 -21.628 39.738 1.00 12.96 ? 1206 TRP C CD1 1 +ATOM 1426 C CD2 . TRP C 1 50 ? 19.238 -21.718 37.531 1.00 15.59 ? 1206 TRP C CD2 1 +ATOM 1427 N NE1 . TRP C 1 50 ? 18.350 -21.206 39.533 1.00 15.46 ? 1206 TRP C NE1 1 +ATOM 1428 C CE2 . TRP C 1 50 ? 18.076 -21.251 38.188 1.00 15.77 ? 1206 TRP C CE2 1 +ATOM 1429 C CE3 . TRP C 1 50 ? 19.219 -21.855 36.136 1.00 15.54 ? 1206 TRP C CE3 1 +ATOM 1430 C CZ2 . TRP C 1 50 ? 16.909 -20.925 37.494 1.00 15.42 ? 1206 TRP C CZ2 1 +ATOM 1431 C CZ3 . TRP C 1 50 ? 18.054 -21.530 35.450 1.00 15.83 ? 1206 TRP C CZ3 1 +ATOM 1432 C CH2 . TRP C 1 50 ? 16.919 -21.072 36.130 1.00 14.31 ? 1206 TRP C CH2 1 +ATOM 1433 N N . LYS C 1 51 ? 21.626 -19.911 36.751 1.00 9.03 ? 1207 LYS C N 1 +ATOM 1434 C CA . LYS C 1 51 ? 21.414 -19.132 35.533 1.00 8.80 ? 1207 LYS C CA 1 +ATOM 1435 C C . LYS C 1 51 ? 22.680 -18.479 34.983 1.00 9.01 ? 1207 LYS C C 1 +ATOM 1436 O O . LYS C 1 51 ? 22.999 -18.617 33.797 1.00 8.00 ? 1207 LYS C O 1 +ATOM 1437 C CB . LYS C 1 51 ? 20.351 -18.067 35.769 1.00 6.71 ? 1207 LYS C CB 1 +ATOM 1438 C CG . LYS C 1 51 ? 20.634 -17.112 36.895 1.00 7.09 ? 1207 LYS C CG 1 +ATOM 1439 C CD . LYS C 1 51 ? 19.497 -16.115 37.064 1.00 7.00 ? 1207 LYS C CD 1 +ATOM 1440 C CE . LYS C 1 51 ? 18.185 -16.800 37.404 1.00 6.55 ? 1207 LYS C CE 1 +ATOM 1441 N NZ . LYS C 1 51 ? 17.650 -17.626 36.280 1.00 8.81 ? 1207 LYS C NZ 1 +ATOM 1442 N N . ASN C 1 52 ? 23.391 -17.746 35.829 1.00 9.92 ? 1208 ASN C N 1 +ATOM 1443 C CA . ASN C 1 52 ? 24.630 -17.126 35.398 1.00 10.79 ? 1208 ASN C CA 1 +ATOM 1444 C C . ASN C 1 52 ? 25.410 -18.209 34.638 1.00 13.12 ? 1208 ASN C C 1 +ATOM 1445 O O . ASN C 1 52 ? 26.029 -17.956 33.610 1.00 10.36 ? 1208 ASN C O 1 +ATOM 1446 C CB . ASN C 1 52 ? 25.421 -16.684 36.622 1.00 13.57 ? 1208 ASN C CB 1 +ATOM 1447 C CG . ASN C 1 52 ? 26.730 -16.040 36.266 1.00 12.45 ? 1208 ASN C CG 1 +ATOM 1448 O OD1 . ASN C 1 52 ? 27.720 -16.196 36.981 1.00 13.97 ? 1208 ASN C OD1 1 +ATOM 1449 N ND2 . ASN C 1 52 ? 26.743 -15.292 35.169 1.00 13.83 ? 1208 ASN C ND2 1 +ATOM 1450 N N . SER C 1 53 ? 25.346 -19.433 35.150 1.00 17.63 ? 1209 SER C N 1 +ATOM 1451 C CA . SER C 1 53 ? 26.036 -20.565 34.536 1.00 19.17 ? 1209 SER C CA 1 +ATOM 1452 C C . SER C 1 53 ? 25.479 -20.889 33.139 1.00 19.39 ? 1209 SER C C 1 +ATOM 1453 O O . SER C 1 53 ? 26.223 -21.345 32.265 1.00 18.87 ? 1209 SER C O 1 +ATOM 1454 C CB . SER C 1 53 ? 25.935 -21.794 35.457 1.00 19.94 ? 1209 SER C CB 1 +ATOM 1455 O OG . SER C 1 53 ? 27.104 -22.590 35.391 1.00 18.04 ? 1209 SER C OG 1 +ATOM 1456 N N . ILE C 1 54 ? 24.183 -20.663 32.923 1.00 19.19 ? 1210 ILE C N 1 +ATOM 1457 C CA . ILE C 1 54 ? 23.601 -20.943 31.610 1.00 20.44 ? 1210 ILE C CA 1 +ATOM 1458 C C . ILE C 1 54 ? 23.632 -19.697 30.722 1.00 21.06 ? 1210 ILE C C 1 +ATOM 1459 O O . ILE C 1 54 ? 23.769 -19.805 29.505 1.00 22.62 ? 1210 ILE C O 1 +ATOM 1460 C CB . ILE C 1 54 ? 22.142 -21.452 31.702 1.00 20.70 ? 1210 ILE C CB 1 +ATOM 1461 C CG1 . ILE C 1 54 ? 21.163 -20.280 31.631 1.00 21.01 ? 1210 ILE C CG1 1 +ATOM 1462 C CG2 . ILE C 1 54 ? 21.940 -22.218 33.005 1.00 21.42 ? 1210 ILE C CG2 1 +ATOM 1463 C CD1 . ILE C 1 54 ? 19.750 -20.696 31.305 1.00 22.72 ? 1210 ILE C CD1 1 +ATOM 1464 N N . ARG C 1 55 ? 23.490 -18.519 31.325 1.00 18.83 ? 1211 ARG C N 1 +ATOM 1465 C CA . ARG C 1 55 ? 23.543 -17.272 30.566 1.00 17.66 ? 1211 ARG C CA 1 +ATOM 1466 C C . ARG C 1 55 ? 24.861 -17.311 29.791 1.00 15.83 ? 1211 ARG C C 1 +ATOM 1467 O O . ARG C 1 55 ? 24.936 -16.951 28.612 1.00 15.14 ? 1211 ARG C O 1 +ATOM 1468 C CB . ARG C 1 55 ? 23.552 -16.071 31.520 1.00 18.90 ? 1211 ARG C CB 1 +ATOM 1469 C CG . ARG C 1 55 ? 22.192 -15.601 31.991 1.00 19.07 ? 1211 ARG C CG 1 +ATOM 1470 C CD . ARG C 1 55 ? 22.276 -14.777 33.285 1.00 22.97 ? 1211 ARG C CD 1 +ATOM 1471 N NE . ARG C 1 55 ? 23.456 -13.916 33.348 1.00 27.34 ? 1211 ARG C NE 1 +ATOM 1472 C CZ . ARG C 1 55 ? 23.776 -13.162 34.399 1.00 29.03 ? 1211 ARG C CZ 1 +ATOM 1473 N NH1 . ARG C 1 55 ? 23.000 -13.155 35.478 1.00 29.03 ? 1211 ARG C NH1 1 +ATOM 1474 N NH2 . ARG C 1 55 ? 24.883 -12.426 34.384 1.00 28.02 ? 1211 ARG C NH2 1 +ATOM 1475 N N . HIS C 1 56 ? 25.887 -17.778 30.495 1.00 13.58 ? 1212 HIS C N 1 +ATOM 1476 C CA . HIS C 1 56 ? 27.247 -17.902 29.994 1.00 11.71 ? 1212 HIS C CA 1 +ATOM 1477 C C . HIS C 1 56 ? 27.462 -19.098 29.076 1.00 10.94 ? 1212 HIS C C 1 +ATOM 1478 O O . HIS C 1 56 ? 28.282 -19.035 28.150 1.00 8.97 ? 1212 HIS C O 1 +ATOM 1479 C CB . HIS C 1 56 ? 28.192 -17.962 31.196 1.00 12.57 ? 1212 HIS C CB 1 +ATOM 1480 C CG . HIS C 1 56 ? 29.512 -18.601 30.916 1.00 10.70 ? 1212 HIS C CG 1 +ATOM 1481 N ND1 . HIS C 1 56 ? 29.900 -19.777 31.516 1.00 11.91 ? 1212 HIS C ND1 1 +ATOM 1482 C CD2 . HIS C 1 56 ? 30.533 -18.236 30.107 1.00 11.46 ? 1212 HIS C CD2 1 +ATOM 1483 C CE1 . HIS C 1 56 ? 31.103 -20.113 31.086 1.00 13.75 ? 1212 HIS C CE1 1 +ATOM 1484 N NE2 . HIS C 1 56 ? 31.509 -19.194 30.230 1.00 12.44 ? 1212 HIS C NE2 1 +ATOM 1485 N N . ASN C 1 57 ? 26.731 -20.183 29.324 1.00 9.88 ? 1213 ASN C N 1 +ATOM 1486 C CA . ASN C 1 57 ? 26.855 -21.373 28.490 1.00 9.49 ? 1213 ASN C CA 1 +ATOM 1487 C C . ASN C 1 57 ? 26.408 -21.081 27.063 1.00 7.63 ? 1213 ASN C C 1 +ATOM 1488 O O . ASN C 1 57 ? 27.021 -21.553 26.094 1.00 6.52 ? 1213 ASN C O 1 +ATOM 1489 C CB . ASN C 1 57 ? 26.011 -22.514 29.052 1.00 11.20 ? 1213 ASN C CB 1 +ATOM 1490 C CG . ASN C 1 57 ? 26.850 -23.567 29.739 1.00 13.52 ? 1213 ASN C CG 1 +ATOM 1491 O OD1 . ASN C 1 57 ? 26.752 -24.761 29.429 1.00 11.92 ? 1213 ASN C OD1 1 +ATOM 1492 N ND2 . ASN C 1 57 ? 27.686 -23.132 30.681 1.00 14.95 ? 1213 ASN C ND2 1 +ATOM 1493 N N . LEU C 1 58 ? 25.340 -20.295 26.950 1.00 4.65 ? 1214 LEU C N 1 +ATOM 1494 C CA . LEU C 1 58 ? 24.755 -19.926 25.660 1.00 2.22 ? 1214 LEU C CA 1 +ATOM 1495 C C . LEU C 1 58 ? 25.641 -18.940 24.959 1.00 0.88 ? 1214 LEU C C 1 +ATOM 1496 O O . LEU C 1 58 ? 25.543 -18.752 23.744 1.00 0.00 ? 1214 LEU C O 1 +ATOM 1497 C CB . LEU C 1 58 ? 23.396 -19.271 25.866 1.00 0.81 ? 1214 LEU C CB 1 +ATOM 1498 C CG . LEU C 1 58 ? 22.485 -19.996 26.830 1.00 0.00 ? 1214 LEU C CG 1 +ATOM 1499 C CD1 . LEU C 1 58 ? 21.203 -19.242 26.936 1.00 0.00 ? 1214 LEU C CD1 1 +ATOM 1500 C CD2 . LEU C 1 58 ? 22.279 -21.403 26.348 1.00 0.00 ? 1214 LEU C CD2 1 +ATOM 1501 N N . SER C 1 59 ? 26.471 -18.279 25.751 1.00 0.00 ? 1215 SER C N 1 +ATOM 1502 C CA . SER C 1 59 ? 27.399 -17.300 25.236 1.00 0.23 ? 1215 SER C CA 1 +ATOM 1503 C C . SER C 1 59 ? 28.590 -18.152 24.850 1.00 2.99 ? 1215 SER C C 1 +ATOM 1504 O O . SER C 1 59 ? 29.186 -17.983 23.791 1.00 3.61 ? 1215 SER C O 1 +ATOM 1505 C CB . SER C 1 59 ? 27.845 -16.343 26.334 1.00 0.00 ? 1215 SER C CB 1 +ATOM 1506 O OG . SER C 1 59 ? 27.326 -15.066 26.098 1.00 1.28 ? 1215 SER C OG 1 +ATOM 1507 N N . LEU C 1 60 ? 28.890 -19.102 25.716 1.00 7.30 ? 1216 LEU C N 1 +ATOM 1508 C CA . LEU C 1 60 ? 30.059 -19.944 25.521 1.00 8.75 ? 1216 LEU C CA 1 +ATOM 1509 C C . LEU C 1 60 ? 30.118 -20.894 24.358 1.00 8.30 ? 1216 LEU C C 1 +ATOM 1510 O O . LEU C 1 60 ? 30.974 -20.669 23.476 1.00 9.76 ? 1216 LEU C O 1 +ATOM 1511 C CB . LEU C 1 60 ? 30.371 -20.726 26.798 1.00 9.19 ? 1216 LEU C CB 1 +ATOM 1512 C CG . LEU C 1 60 ? 31.606 -21.628 26.635 1.00 7.45 ? 1216 LEU C CG 1 +ATOM 1513 C CD1 . LEU C 1 60 ? 32.824 -20.854 26.148 1.00 4.47 ? 1216 LEU C CD1 1 +ATOM 1514 C CD2 . LEU C 1 60 ? 31.886 -22.280 27.964 1.00 9.86 ? 1216 LEU C CD2 1 +ATOM 1515 N N . HIS C 1 61 ? 29.277 -21.922 24.304 1.00 8.35 ? 1217 HIS C N 1 +ATOM 1516 C CA . HIS C 1 61 ? 29.427 -22.848 23.181 1.00 7.73 ? 1217 HIS C CA 1 +ATOM 1517 C C . HIS C 1 61 ? 28.699 -22.444 21.907 1.00 5.26 ? 1217 HIS C C 1 +ATOM 1518 O O . HIS C 1 61 ? 27.918 -21.499 21.893 1.00 3.59 ? 1217 HIS C O 1 +ATOM 1519 C CB . HIS C 1 61 ? 29.018 -24.252 23.569 1.00 8.17 ? 1217 HIS C CB 1 +ATOM 1520 C CG . HIS C 1 61 ? 29.033 -24.494 25.039 1.00 9.81 ? 1217 HIS C CG 1 +ATOM 1521 N ND1 . HIS C 1 61 ? 29.950 -23.907 25.887 1.00 9.81 ? 1217 HIS C ND1 1 +ATOM 1522 C CD2 . HIS C 1 61 ? 28.266 -25.296 25.813 1.00 11.00 ? 1217 HIS C CD2 1 +ATOM 1523 C CE1 . HIS C 1 61 ? 29.746 -24.340 27.118 1.00 9.34 ? 1217 HIS C CE1 1 +ATOM 1524 N NE2 . HIS C 1 61 ? 28.730 -25.184 27.101 1.00 10.38 ? 1217 HIS C NE2 1 +ATOM 1525 N N . SER C 1 62 ? 28.940 -23.205 20.848 1.00 6.48 ? 1218 SER C N 1 +ATOM 1526 C CA . SER C 1 62 ? 28.365 -22.955 19.527 1.00 10.34 ? 1218 SER C CA 1 +ATOM 1527 C C . SER C 1 62 ? 26.969 -23.471 19.265 1.00 11.07 ? 1218 SER C C 1 +ATOM 1528 O O . SER C 1 62 ? 26.212 -22.830 18.537 1.00 12.91 ? 1218 SER C O 1 +ATOM 1529 C CB . SER C 1 62 ? 29.277 -23.534 18.444 1.00 11.75 ? 1218 SER C CB 1 +ATOM 1530 O OG . SER C 1 62 ? 29.071 -24.937 18.309 1.00 12.96 ? 1218 SER C OG 1 +ATOM 1531 N N . ARG C 1 63 ? 26.635 -24.622 19.850 1.00 13.79 ? 1219 ARG C N 1 +ATOM 1532 C CA . ARG C 1 63 ? 25.302 -25.232 19.558 1.00 16.27 ? 1219 ARG C CA 1 +ATOM 1533 C C . ARG C 1 63 ? 24.324 -24.102 19.538 1.00 16.00 ? 1219 ARG C C 1 +ATOM 1534 O O . ARG C 1 63 ? 23.384 -24.113 18.727 1.00 17.26 ? 1219 ARG C O 1 +ATOM 1535 C CB . ARG C 1 63 ? 24.984 -26.188 20.710 1.00 18.62 ? 1219 ARG C CB 1 +ATOM 1536 C CG . ARG C 1 63 ? 24.216 -27.425 20.269 1.00 23.56 ? 1219 ARG C CG 1 +ATOM 1537 C CD . ARG C 1 63 ? 23.617 -28.084 21.495 1.00 26.38 ? 1219 ARG C CD 1 +ATOM 1538 N NE . ARG C 1 63 ? 23.146 -29.444 21.258 1.00 27.91 ? 1219 ARG C NE 1 +ATOM 1539 C CZ . ARG C 1 63 ? 23.703 -30.521 21.801 1.00 29.69 ? 1219 ARG C CZ 1 +ATOM 1540 N NH1 . ARG C 1 63 ? 24.752 -30.396 22.608 1.00 30.90 ? 1219 ARG C NH1 1 +ATOM 1541 N NH2 . ARG C 1 63 ? 23.202 -31.720 21.554 1.00 31.60 ? 1219 ARG C NH2 1 +ATOM 1542 N N . PHE C 1 64 ? 24.560 -23.096 20.365 1.00 16.80 ? 1220 PHE C N 1 +ATOM 1543 C CA . PHE C 1 64 ? 23.661 -21.956 20.481 1.00 17.27 ? 1220 PHE C CA 1 +ATOM 1544 C C . PHE C 1 64 ? 24.053 -20.653 19.791 1.00 14.67 ? 1220 PHE C C 1 +ATOM 1545 O O . PHE C 1 64 ? 25.200 -20.189 19.879 1.00 10.65 ? 1220 PHE C O 1 +ATOM 1546 C CB . PHE C 1 64 ? 23.415 -21.667 21.956 1.00 19.43 ? 1220 PHE C CB 1 +ATOM 1547 C CG . PHE C 1 64 ? 23.384 -22.902 22.809 1.00 23.80 ? 1220 PHE C CG 1 +ATOM 1548 C CD1 . PHE C 1 64 ? 24.567 -23.431 23.335 1.00 24.00 ? 1220 PHE C CD1 1 +ATOM 1549 C CD2 . PHE C 1 64 ? 22.179 -23.541 23.090 1.00 23.41 ? 1220 PHE C CD2 1 +ATOM 1550 C CE1 . PHE C 1 64 ? 24.548 -24.574 24.129 1.00 24.68 ? 1220 PHE C CE1 1 +ATOM 1551 C CE2 . PHE C 1 64 ? 22.152 -24.689 23.884 1.00 25.87 ? 1220 PHE C CE2 1 +ATOM 1552 C CZ . PHE C 1 64 ? 23.336 -25.204 24.407 1.00 25.09 ? 1220 PHE C CZ 1 +ATOM 1553 N N . MET C 1 65 ? 23.060 -20.072 19.117 1.00 12.36 ? 1221 MET C N 1 +ATOM 1554 C CA . MET C 1 65 ? 23.193 -18.799 18.413 1.00 10.46 ? 1221 MET C CA 1 +ATOM 1555 C C . MET C 1 65 ? 22.116 -17.845 18.938 1.00 7.74 ? 1221 MET C C 1 +ATOM 1556 O O . MET C 1 65 ? 21.205 -18.256 19.659 1.00 6.76 ? 1221 MET C O 1 +ATOM 1557 C CB . MET C 1 65 ? 22.992 -19.004 16.914 1.00 9.30 ? 1221 MET C CB 1 +ATOM 1558 C CG . MET C 1 65 ? 22.795 -17.730 16.137 1.00 5.79 ? 1221 MET C CG 1 +ATOM 1559 S SD . MET C 1 65 ? 21.952 -18.104 14.601 1.00 7.70 ? 1221 MET C SD 1 +ATOM 1560 C CE . MET C 1 65 ? 23.352 -18.515 13.608 1.00 5.89 ? 1221 MET C CE 1 +ATOM 1561 N N . ARG C 1 66 ? 22.216 -16.575 18.579 1.00 6.98 ? 1222 ARG C N 1 +ATOM 1562 C CA . ARG C 1 66 ? 21.225 -15.601 19.016 1.00 10.23 ? 1222 ARG C CA 1 +ATOM 1563 C C . ARG C 1 66 ? 20.667 -14.840 17.831 1.00 10.04 ? 1222 ARG C C 1 +ATOM 1564 O O . ARG C 1 66 ? 21.344 -14.629 16.828 1.00 11.52 ? 1222 ARG C O 1 +ATOM 1565 C CB . ARG C 1 66 ? 21.839 -14.603 20.000 1.00 9.27 ? 1222 ARG C CB 1 +ATOM 1566 C CG . ARG C 1 66 ? 23.000 -13.824 19.410 1.00 11.50 ? 1222 ARG C CG 1 +ATOM 1567 C CD . ARG C 1 66 ? 23.590 -12.855 20.406 1.00 8.32 ? 1222 ARG C CD 1 +ATOM 1568 N NE . ARG C 1 66 ? 23.153 -11.490 20.144 1.00 6.37 ? 1222 ARG C NE 1 +ATOM 1569 C CZ . ARG C 1 66 ? 21.963 -10.995 20.459 1.00 6.83 ? 1222 ARG C CZ 1 +ATOM 1570 N NH1 . ARG C 1 66 ? 21.678 -9.730 20.168 1.00 7.05 ? 1222 ARG C NH1 1 +ATOM 1571 N NH2 . ARG C 1 66 ? 21.063 -11.751 21.073 1.00 6.55 ? 1222 ARG C NH2 1 +ATOM 1572 N N . VAL C 1 67 ? 19.416 -14.435 17.947 1.00 11.06 ? 1223 VAL C N 1 +ATOM 1573 C CA . VAL C 1 67 ? 18.771 -13.671 16.891 1.00 13.96 ? 1223 VAL C CA 1 +ATOM 1574 C C . VAL C 1 67 ? 17.800 -12.713 17.554 1.00 15.90 ? 1223 VAL C C 1 +ATOM 1575 O O . VAL C 1 67 ? 17.138 -13.061 18.537 1.00 16.96 ? 1223 VAL C O 1 +ATOM 1576 C CB . VAL C 1 67 ? 17.991 -14.571 15.915 1.00 13.37 ? 1223 VAL C CB 1 +ATOM 1577 C CG1 . VAL C 1 67 ? 18.940 -15.530 15.210 1.00 13.57 ? 1223 VAL C CG1 1 +ATOM 1578 C CG2 . VAL C 1 67 ? 16.904 -15.322 16.668 1.00 14.93 ? 1223 VAL C CG2 1 +ATOM 1579 N N . GLN C 1 68 ? 17.722 -11.498 17.032 1.00 16.90 ? 1224 GLN C N 1 +ATOM 1580 C CA . GLN C 1 68 ? 16.824 -10.524 17.615 1.00 16.94 ? 1224 GLN C CA 1 +ATOM 1581 C C . GLN C 1 68 ? 16.048 -9.776 16.561 1.00 17.77 ? 1224 GLN C C 1 +ATOM 1582 O O . GLN C 1 68 ? 16.343 -9.877 15.370 1.00 16.61 ? 1224 GLN C O 1 +ATOM 1583 C CB . GLN C 1 68 ? 17.605 -9.539 18.504 1.00 16.46 ? 1224 GLN C CB 1 +ATOM 1584 C CG . GLN C 1 68 ? 18.867 -8.957 17.868 1.00 14.20 ? 1224 GLN C CG 1 +ATOM 1585 C CD . GLN C 1 68 ? 19.710 -8.169 18.852 1.00 10.79 ? 1224 GLN C CD 1 +ATOM 1586 O OE1 . GLN C 1 68 ? 20.840 -7.791 18.559 1.00 10.09 ? 1224 GLN C OE1 1 +ATOM 1587 N NE2 . GLN C 1 68 ? 19.161 -7.919 20.026 1.00 13.29 ? 1224 GLN C NE2 1 +ATOM 1588 N N . ASN C 1 69 ? 15.028 -9.053 17.010 1.00 19.04 ? 1225 ASN C N 1 +ATOM 1589 C CA . ASN C 1 69 ? 14.217 -8.255 16.114 1.00 19.86 ? 1225 ASN C CA 1 +ATOM 1590 C C . ASN C 1 69 ? 14.883 -6.883 16.105 1.00 19.84 ? 1225 ASN C C 1 +ATOM 1591 O O . ASN C 1 69 ? 14.643 -6.058 16.988 1.00 22.69 ? 1225 ASN C O 1 +ATOM 1592 C CB . ASN C 1 69 ? 12.794 -8.141 16.642 1.00 19.60 ? 1225 ASN C CB 1 +ATOM 1593 C CG . ASN C 1 69 ? 11.833 -7.595 15.601 1.00 22.43 ? 1225 ASN C CG 1 +ATOM 1594 O OD1 . ASN C 1 69 ? 10.726 -7.161 15.929 1.00 21.47 ? 1225 ASN C OD1 1 +ATOM 1595 N ND2 . ASN C 1 69 ? 12.250 -7.624 14.331 1.00 22.13 ? 1225 ASN C ND2 1 +ATOM 1596 N N . GLU C 1 70 ? 15.735 -6.652 15.116 1.00 18.38 ? 1226 GLU C N 1 +ATOM 1597 C CA . GLU C 1 70 ? 16.452 -5.391 15.010 1.00 19.60 ? 1226 GLU C CA 1 +ATOM 1598 C C . GLU C 1 70 ? 15.570 -4.149 14.818 1.00 20.18 ? 1226 GLU C C 1 +ATOM 1599 O O . GLU C 1 70 ? 16.060 -3.022 14.893 1.00 18.35 ? 1226 GLU C O 1 +ATOM 1600 C CB . GLU C 1 70 ? 17.499 -5.473 13.883 1.00 19.87 ? 1226 GLU C CB 1 +ATOM 1601 C CG . GLU C 1 70 ? 17.375 -6.680 12.946 1.00 21.26 ? 1226 GLU C CG 1 +ATOM 1602 C CD . GLU C 1 70 ? 18.537 -7.661 13.074 1.00 21.25 ? 1226 GLU C CD 1 +ATOM 1603 O OE1 . GLU C 1 70 ? 18.393 -8.692 13.764 1.00 22.04 ? 1226 GLU C OE1 1 +ATOM 1604 O OE2 . GLU C 1 70 ? 19.604 -7.395 12.488 1.00 23.35 ? 1226 GLU C OE2 1 +ATOM 1605 N N . GLY C 1 71 ? 14.275 -4.351 14.577 1.00 21.49 ? 1227 GLY C N 1 +ATOM 1606 C CA . GLY C 1 71 ? 13.365 -3.225 14.387 1.00 23.75 ? 1227 GLY C CA 1 +ATOM 1607 C C . GLY C 1 71 ? 12.639 -2.903 15.683 1.00 24.30 ? 1227 GLY C C 1 +ATOM 1608 O O . GLY C 1 71 ? 11.882 -3.746 16.178 1.00 22.92 ? 1227 GLY C O 1 +ATOM 1609 N N . THR C 1 72 ? 12.856 -1.698 16.225 1.00 23.74 ? 1228 THR C N 1 +ATOM 1610 C CA . THR C 1 72 ? 12.255 -1.283 17.505 1.00 21.82 ? 1228 THR C CA 1 +ATOM 1611 C C . THR C 1 72 ? 12.261 -2.513 18.398 1.00 21.94 ? 1228 THR C C 1 +ATOM 1612 O O . THR C 1 72 ? 11.392 -2.679 19.253 1.00 23.75 ? 1228 THR C O 1 +ATOM 1613 C CB . THR C 1 72 ? 10.786 -0.831 17.367 1.00 22.05 ? 1228 THR C CB 1 +ATOM 1614 O OG1 . THR C 1 72 ? 9.971 -1.953 17.007 1.00 19.57 ? 1228 THR C OG1 1 +ATOM 1615 C CG2 . THR C 1 72 ? 10.656 0.270 16.321 1.00 23.28 ? 1228 THR C CG2 1 +ATOM 1616 N N . GLY C 1 73 ? 13.263 -3.362 18.175 1.00 19.68 ? 1229 GLY C N 1 +ATOM 1617 C CA . GLY C 1 73 ? 13.409 -4.622 18.884 1.00 13.79 ? 1229 GLY C CA 1 +ATOM 1618 C C . GLY C 1 73 ? 13.487 -4.700 20.398 1.00 11.98 ? 1229 GLY C C 1 +ATOM 1619 O O . GLY C 1 73 ? 14.236 -3.996 21.044 1.00 8.45 ? 1229 GLY C O 1 +ATOM 1620 N N . LYS C 1 74 ? 12.675 -5.603 20.929 1.00 10.99 ? 1230 LYS C N 1 +ATOM 1621 C CA . LYS C 1 74 ? 12.622 -5.897 22.345 1.00 9.56 ? 1230 LYS C CA 1 +ATOM 1622 C C . LYS C 1 74 ? 12.787 -7.404 22.423 1.00 9.66 ? 1230 LYS C C 1 +ATOM 1623 O O . LYS C 1 74 ? 12.784 -7.980 23.510 1.00 10.62 ? 1230 LYS C O 1 +ATOM 1624 C CB . LYS C 1 74 ? 11.258 -5.490 22.932 1.00 9.24 ? 1230 LYS C CB 1 +ATOM 1625 C CG . LYS C 1 74 ? 11.308 -4.972 24.357 1.00 8.77 ? 1230 LYS C CG 1 +ATOM 1626 C CD . LYS C 1 74 ? 9.989 -5.188 25.100 1.00 7.78 ? 1230 LYS C CD 1 +ATOM 1627 C CE . LYS C 1 74 ? 9.798 -6.657 25.452 1.00 7.08 ? 1230 LYS C CE 1 +ATOM 1628 N NZ . LYS C 1 74 ? 11.048 -7.213 26.039 1.00 5.86 ? 1230 LYS C NZ 1 +ATOM 1629 N N . SER C 1 75 ? 12.933 -8.030 21.260 1.00 8.02 ? 1231 SER C N 1 +ATOM 1630 C CA . SER C 1 75 ? 13.057 -9.482 21.189 1.00 7.59 ? 1231 SER C CA 1 +ATOM 1631 C C . SER C 1 75 ? 14.363 -10.111 20.707 1.00 6.69 ? 1231 SER C C 1 +ATOM 1632 O O . SER C 1 75 ? 14.760 -9.967 19.547 1.00 5.56 ? 1231 SER C O 1 +ATOM 1633 C CB . SER C 1 75 ? 11.937 -10.054 20.322 1.00 9.51 ? 1231 SER C CB 1 +ATOM 1634 O OG . SER C 1 75 ? 12.250 -9.886 18.948 1.00 10.87 ? 1231 SER C OG 1 +ATOM 1635 N N . SER C 1 76 ? 15.004 -10.836 21.617 1.00 6.33 ? 1232 SER C N 1 +ATOM 1636 C CA . SER C 1 76 ? 16.240 -11.555 21.341 1.00 7.89 ? 1232 SER C CA 1 +ATOM 1637 C C . SER C 1 76 ? 15.934 -12.996 21.739 1.00 5.95 ? 1232 SER C C 1 +ATOM 1638 O O . SER C 1 76 ? 15.532 -13.257 22.872 1.00 4.22 ? 1232 SER C O 1 +ATOM 1639 C CB . SER C 1 76 ? 17.387 -11.010 22.191 1.00 9.97 ? 1232 SER C CB 1 +ATOM 1640 O OG . SER C 1 76 ? 18.553 -11.800 22.028 1.00 15.84 ? 1232 SER C OG 1 +ATOM 1641 N N . TRP C 1 77 ? 16.093 -13.921 20.798 1.00 4.83 ? 1233 TRP C N 1 +ATOM 1642 C CA . TRP C 1 77 ? 15.811 -15.329 21.059 1.00 3.66 ? 1233 TRP C CA 1 +ATOM 1643 C C . TRP C 1 77 ? 17.072 -16.139 20.880 1.00 4.76 ? 1233 TRP C C 1 +ATOM 1644 O O . TRP C 1 77 ? 18.046 -15.656 20.301 1.00 6.39 ? 1233 TRP C O 1 +ATOM 1645 C CB . TRP C 1 77 ? 14.787 -15.878 20.071 1.00 2.45 ? 1233 TRP C CB 1 +ATOM 1646 C CG . TRP C 1 77 ? 13.852 -14.876 19.487 1.00 2.64 ? 1233 TRP C CG 1 +ATOM 1647 C CD1 . TRP C 1 77 ? 14.115 -13.981 18.480 1.00 2.13 ? 1233 TRP C CD1 1 +ATOM 1648 C CD2 . TRP C 1 77 ? 12.470 -14.730 19.806 1.00 0.62 ? 1233 TRP C CD2 1 +ATOM 1649 N NE1 . TRP C 1 77 ? 12.962 -13.296 18.148 1.00 2.38 ? 1233 TRP C NE1 1 +ATOM 1650 C CE2 . TRP C 1 77 ? 11.940 -13.742 18.948 1.00 2.46 ? 1233 TRP C CE2 1 +ATOM 1651 C CE3 . TRP C 1 77 ? 11.624 -15.348 20.731 1.00 0.42 ? 1233 TRP C CE3 1 +ATOM 1652 C CZ2 . TRP C 1 77 ? 10.598 -13.360 18.988 1.00 2.10 ? 1233 TRP C CZ2 1 +ATOM 1653 C CZ3 . TRP C 1 77 ? 10.292 -14.972 20.771 1.00 4.21 ? 1233 TRP C CZ3 1 +ATOM 1654 C CH2 . TRP C 1 77 ? 9.791 -13.986 19.903 1.00 2.65 ? 1233 TRP C CH2 1 +ATOM 1655 N N . TRP C 1 78 ? 17.054 -17.375 21.369 1.00 4.50 ? 1234 TRP C N 1 +ATOM 1656 C CA . TRP C 1 78 ? 18.190 -18.270 21.200 1.00 4.43 ? 1234 TRP C CA 1 +ATOM 1657 C C . TRP C 1 78 ? 17.716 -19.430 20.330 1.00 5.53 ? 1234 TRP C C 1 +ATOM 1658 O O . TRP C 1 78 ? 16.664 -20.019 20.595 1.00 4.72 ? 1234 TRP C O 1 +ATOM 1659 C CB . TRP C 1 78 ? 18.683 -18.817 22.544 1.00 3.54 ? 1234 TRP C CB 1 +ATOM 1660 C CG . TRP C 1 78 ? 19.289 -17.796 23.434 1.00 1.48 ? 1234 TRP C CG 1 +ATOM 1661 C CD1 . TRP C 1 78 ? 18.675 -17.123 24.435 1.00 0.55 ? 1234 TRP C CD1 1 +ATOM 1662 C CD2 . TRP C 1 78 ? 20.629 -17.296 23.371 1.00 1.50 ? 1234 TRP C CD2 1 +ATOM 1663 N NE1 . TRP C 1 78 ? 19.544 -16.226 25.006 1.00 2.22 ? 1234 TRP C NE1 1 +ATOM 1664 C CE2 . TRP C 1 78 ? 20.752 -16.310 24.366 1.00 0.95 ? 1234 TRP C CE2 1 +ATOM 1665 C CE3 . TRP C 1 78 ? 21.737 -17.584 22.564 1.00 3.69 ? 1234 TRP C CE3 1 +ATOM 1666 C CZ2 . TRP C 1 78 ? 21.940 -15.608 24.583 1.00 1.47 ? 1234 TRP C CZ2 1 +ATOM 1667 C CZ3 . TRP C 1 78 ? 22.928 -16.884 22.781 1.00 2.93 ? 1234 TRP C CZ3 1 +ATOM 1668 C CH2 . TRP C 1 78 ? 23.015 -15.909 23.781 1.00 3.32 ? 1234 TRP C CH2 1 +ATOM 1669 N N . ILE C 1 79 ? 18.483 -19.753 19.294 1.00 6.60 ? 1235 ILE C N 1 +ATOM 1670 C CA . ILE C 1 79 ? 18.131 -20.861 18.414 1.00 7.62 ? 1235 ILE C CA 1 +ATOM 1671 C C . ILE C 1 79 ? 19.231 -21.939 18.305 1.00 7.09 ? 1235 ILE C C 1 +ATOM 1672 O O . ILE C 1 79 ? 20.338 -21.800 18.846 1.00 3.42 ? 1235 ILE C O 1 +ATOM 1673 C CB . ILE C 1 79 ? 17.766 -20.357 16.982 1.00 7.02 ? 1235 ILE C CB 1 +ATOM 1674 C CG1 . ILE C 1 79 ? 19.024 -19.951 16.207 1.00 8.39 ? 1235 ILE C CG1 1 +ATOM 1675 C CG2 . ILE C 1 79 ? 16.789 -19.196 17.074 1.00 9.25 ? 1235 ILE C CG2 1 +ATOM 1676 C CD1 . ILE C 1 79 ? 19.761 -18.782 16.798 1.00 12.00 ? 1235 ILE C CD1 1 +ATOM 1677 N N . ILE C 1 80 ? 18.900 -23.026 17.613 1.00 10.03 ? 1236 ILE C N 1 +ATOM 1678 C CA . ILE C 1 80 ? 19.828 -24.133 17.402 1.00 13.08 ? 1236 ILE C CA 1 +ATOM 1679 C C . ILE C 1 80 ? 20.132 -24.201 15.910 1.00 17.99 ? 1236 ILE C C 1 +ATOM 1680 O O . ILE C 1 80 ? 19.341 -24.716 15.105 1.00 19.23 ? 1236 ILE C O 1 +ATOM 1681 C CB . ILE C 1 80 ? 19.237 -25.511 17.816 1.00 11.88 ? 1236 ILE C CB 1 +ATOM 1682 C CG1 . ILE C 1 80 ? 18.552 -25.435 19.189 1.00 5.22 ? 1236 ILE C CG1 1 +ATOM 1683 C CG2 . ILE C 1 80 ? 20.358 -26.561 17.797 1.00 6.48 ? 1236 ILE C CG2 1 +ATOM 1684 C CD1 . ILE C 1 80 ? 19.473 -25.190 20.342 1.00 6.51 ? 1236 ILE C CD1 1 +ATOM 1685 N N . ASN C 1 81 ? 21.291 -23.660 15.568 1.00 23.55 ? 1237 ASN C N 1 +ATOM 1686 C CA . ASN C 1 81 ? 21.810 -23.592 14.211 1.00 29.41 ? 1237 ASN C CA 1 +ATOM 1687 C C . ASN C 1 81 ? 23.297 -23.455 14.498 1.00 32.14 ? 1237 ASN C C 1 +ATOM 1688 O O . ASN C 1 81 ? 23.700 -23.182 15.667 1.00 32.90 ? 1237 ASN C O 1 +ATOM 1689 C CB . ASN C 1 81 ? 21.216 -22.362 13.496 1.00 26.54 ? 1237 ASN C CB 1 +ATOM 1690 C CG . ASN C 1 81 ? 21.983 -21.957 12.247 1.00 25.78 ? 1237 ASN C CG 1 +ATOM 1691 O OD1 . ASN C 1 81 ? 21.870 -22.565 11.185 1.00 26.24 ? 1237 ASN C OD1 1 +ATOM 1692 N ND2 . ASN C 1 81 ? 22.765 -20.906 12.377 1.00 24.65 ? 1237 ASN C ND2 1 +ATOM 1693 N N . PRO C 1 82 ? 24.190 -23.748 13.542 1.00 33.87 ? 1238 PRO C N 1 +ATOM 1694 C CA . PRO C 1 82 ? 25.259 -24.026 12.604 1.00 34.30 ? 1238 PRO C CA 1 +ATOM 1695 C C . PRO C 1 82 ? 25.287 -25.541 12.593 1.00 35.03 ? 1238 PRO C C 1 +ATOM 1696 O O . PRO C 1 82 ? 25.301 -26.187 13.640 1.00 34.23 ? 1238 PRO C O 1 +ATOM 1697 C CB . PRO C 1 82 ? 26.438 -23.400 13.351 1.00 33.74 ? 1238 PRO C CB 1 +ATOM 1698 C CG . PRO C 1 82 ? 25.879 -22.087 13.648 1.00 34.01 ? 1238 PRO C CG 1 +ATOM 1699 C CD . PRO C 1 82 ? 24.377 -22.342 13.911 1.00 32.83 ? 1238 PRO C CD 1 +ATOM 1700 N N . ASP C 1 83 ? 25.214 -26.097 11.391 1.00 36.95 ? 1239 ASP C N 1 +ATOM 1701 C CA . ASP C 1 83 ? 25.193 -27.539 11.185 1.00 38.03 ? 1239 ASP C CA 1 +ATOM 1702 C C . ASP C 1 83 ? 26.468 -28.181 11.674 1.00 36.34 ? 1239 ASP C C 1 +ATOM 1703 O O . ASP C 1 83 ? 26.452 -29.092 12.504 1.00 38.49 ? 1239 ASP C O 1 +ATOM 1704 C CB . ASP C 1 83 ? 25.016 -27.826 9.698 1.00 38.83 ? 1239 ASP C CB 1 +ATOM 1705 C CG . ASP C 1 83 ? 23.687 -27.334 9.170 1.00 39.39 ? 1239 ASP C CG 1 +ATOM 1706 O OD1 . ASP C 1 83 ? 23.652 -26.823 8.030 1.00 40.94 ? 1239 ASP C OD1 1 +ATOM 1707 O OD2 . ASP C 1 83 ? 22.676 -27.469 9.895 1.00 39.47 ? 1239 ASP C OD2 1 +ATOM 1708 N N . GLY C 1 84 ? 27.572 -27.687 11.131 1.00 36.74 ? 1240 GLY C N 1 +ATOM 1709 C CA . GLY C 1 84 ? 28.891 -28.177 11.472 1.00 34.78 ? 1240 GLY C CA 1 +ATOM 1710 C C . GLY C 1 84 ? 29.827 -27.465 10.523 1.00 33.15 ? 1240 GLY C C 1 +ATOM 1711 O O . GLY C 1 84 ? 30.668 -26.671 10.940 1.00 34.90 ? 1240 GLY C O 1 +ATOM 1712 N N . GLY C 1 85 ? 29.643 -27.732 9.233 1.00 30.88 ? 1241 GLY C N 1 +ATOM 1713 C CA . GLY C 1 85 ? 30.455 -27.113 8.200 1.00 28.45 ? 1241 GLY C CA 1 +ATOM 1714 C C . GLY C 1 85 ? 30.774 -25.654 8.471 1.00 25.99 ? 1241 GLY C C 1 +ATOM 1715 O O . GLY C 1 85 ? 29.890 -24.799 8.459 1.00 24.32 ? 1241 GLY C O 1 +ATOM 1716 N N . LYS C 1 86 ? 32.052 -25.376 8.713 1.00 22.79 ? 1242 LYS C N 1 +ATOM 1717 C CA . LYS C 1 86 ? 32.489 -24.023 9.007 1.00 18.80 ? 1242 LYS C CA 1 +ATOM 1718 C C . LYS C 1 86 ? 33.860 -24.132 9.631 1.00 14.34 ? 1242 LYS C C 1 +ATOM 1719 O O . LYS C 1 86 ? 34.783 -23.400 9.279 1.00 13.24 ? 1242 LYS C O 1 +ATOM 1720 N N . SER C 1 87 ? 33.990 -25.062 10.567 1.00 10.71 ? 1243 SER C N 1 +ATOM 1721 C CA . SER C 1 87 ? 35.278 -25.276 11.194 1.00 6.57 ? 1243 SER C CA 1 +ATOM 1722 C C . SER C 1 87 ? 35.332 -25.090 12.689 1.00 4.14 ? 1243 SER C C 1 +ATOM 1723 O O . SER C 1 87 ? 34.354 -24.717 13.323 1.00 4.00 ? 1243 SER C O 1 +ATOM 1724 N N . GLY C 1 88 ? 36.498 -25.362 13.255 1.00 5.99 ? 1244 GLY C N 1 +ATOM 1725 C CA . GLY C 1 88 ? 36.677 -25.201 14.683 1.00 7.68 ? 1244 GLY C CA 1 +ATOM 1726 C C . GLY C 1 88 ? 37.512 -23.959 14.901 1.00 8.82 ? 1244 GLY C C 1 +ATOM 1727 O O . GLY C 1 88 ? 38.103 -23.447 13.958 1.00 5.44 ? 1244 GLY C O 1 +ATOM 1728 N N . LYS C 1 89 ? 37.558 -23.474 16.138 1.00 11.29 ? 1245 LYS C N 1 +ATOM 1729 C CA . LYS C 1 89 ? 38.332 -22.283 16.444 1.00 13.25 ? 1245 LYS C CA 1 +ATOM 1730 C C . LYS C 1 89 ? 39.737 -22.384 15.888 1.00 11.43 ? 1245 LYS C C 1 +ATOM 1731 O O . LYS C 1 89 ? 40.434 -21.383 15.726 1.00 12.40 ? 1245 LYS C O 1 +ATOM 1732 N N . ALA C 1 90 ? 40.138 -23.612 15.583 1.00 12.51 ? 1246 ALA C N 1 +ATOM 1733 C CA . ALA C 1 90 ? 41.464 -23.863 15.050 1.00 11.78 ? 1246 ALA C CA 1 +ATOM 1734 C C . ALA C 1 90 ? 42.299 -24.528 16.116 1.00 10.84 ? 1246 ALA C C 1 +ATOM 1735 O O . ALA C 1 90 ? 43.338 -24.003 16.535 1.00 8.78 ? 1246 ALA C O 1 +ATOM 1736 N N . PRO C 1 91 ? 41.815 -25.682 16.569 1.00 12.13 ? 1247 PRO C N 1 +ATOM 1737 C CA . PRO C 1 91 ? 42.500 -26.450 17.595 1.00 13.47 ? 1247 PRO C CA 1 +ATOM 1738 C C . PRO C 1 91 ? 42.185 -27.930 17.462 1.00 14.01 ? 1247 PRO C C 1 +ATOM 1739 O O . PRO C 1 91 ? 41.941 -28.389 16.323 1.00 13.75 ? 1247 PRO C O 1 +ATOM 1740 N N . ARG C 1 92 ? 42.183 -28.637 18.497 1.00 14.79 ? 1248 ARG C N 1 +ATOM 1741 O "O5'" . DC D 2 1 ? 48.482 -31.231 26.784 1.00 15.16 ? 1001 DC D "O5'" 1 +ATOM 1742 C "C5'" . DC D 2 1 ? 47.721 -32.313 27.368 1.00 20.22 ? 1001 DC D "C5'" 1 +ATOM 1743 C "C4'" . DC D 2 1 ? 46.397 -32.630 26.703 1.00 19.66 ? 1001 DC D "C4'" 1 +ATOM 1744 O "O4'" . DC D 2 1 ? 45.536 -33.324 27.643 1.00 18.39 ? 1001 DC D "O4'" 1 +ATOM 1745 C "C3'" . DC D 2 1 ? 45.604 -31.404 26.263 1.00 20.02 ? 1001 DC D "C3'" 1 +ATOM 1746 O "O3'" . DC D 2 1 ? 44.816 -31.727 25.128 1.00 23.35 ? 1001 DC D "O3'" 1 +ATOM 1747 C "C2'" . DC D 2 1 ? 44.688 -31.129 27.438 1.00 19.32 ? 1001 DC D "C2'" 1 +ATOM 1748 C "C1'" . DC D 2 1 ? 44.405 -32.518 27.981 1.00 17.59 ? 1001 DC D "C1'" 1 +ATOM 1749 N N1 . DC D 2 1 ? 44.266 -32.535 29.447 1.00 18.16 ? 1001 DC D N1 1 +ATOM 1750 C C2 . DC D 2 1 ? 43.075 -32.990 30.008 1.00 17.36 ? 1001 DC D C2 1 +ATOM 1751 O O2 . DC D 2 1 ? 42.148 -33.306 29.262 1.00 20.44 ? 1001 DC D O2 1 +ATOM 1752 N N3 . DC D 2 1 ? 42.964 -33.070 31.349 1.00 14.22 ? 1001 DC D N3 1 +ATOM 1753 C C4 . DC D 2 1 ? 43.980 -32.682 32.127 1.00 13.84 ? 1001 DC D C4 1 +ATOM 1754 N N4 . DC D 2 1 ? 43.828 -32.772 33.453 1.00 13.42 ? 1001 DC D N4 1 +ATOM 1755 C C5 . DC D 2 1 ? 45.196 -32.182 31.581 1.00 13.51 ? 1001 DC D C5 1 +ATOM 1756 C C6 . DC D 2 1 ? 45.295 -32.126 30.250 1.00 15.84 ? 1001 DC D C6 1 +ATOM 1757 P P . DT D 2 2 ? 43.831 -30.619 24.510 1.00 25.02 ? 1002 DT D P 1 +ATOM 1758 O OP1 . DT D 2 2 ? 43.924 -30.681 23.016 1.00 24.70 ? 1002 DT D OP1 1 +ATOM 1759 O OP2 . DT D 2 2 ? 44.093 -29.340 25.212 1.00 24.91 ? 1002 DT D OP2 1 +ATOM 1760 O "O5'" . DT D 2 2 ? 42.385 -31.082 24.962 1.00 22.66 ? 1002 DT D "O5'" 1 +ATOM 1761 C "C5'" . DT D 2 2 ? 41.336 -30.145 25.012 1.00 21.37 ? 1002 DT D "C5'" 1 +ATOM 1762 C "C4'" . DT D 2 2 ? 40.063 -30.833 25.422 1.00 23.04 ? 1002 DT D "C4'" 1 +ATOM 1763 O "O4'" . DT D 2 2 ? 40.260 -31.481 26.700 1.00 23.72 ? 1002 DT D "O4'" 1 +ATOM 1764 C "C3'" . DT D 2 2 ? 38.908 -29.858 25.614 1.00 24.29 ? 1002 DT D "C3'" 1 +ATOM 1765 O "O3'" . DT D 2 2 ? 37.693 -30.472 25.194 1.00 24.46 ? 1002 DT D "O3'" 1 +ATOM 1766 C "C2'" . DT D 2 2 ? 38.890 -29.635 27.110 1.00 23.86 ? 1002 DT D "C2'" 1 +ATOM 1767 C "C1'" . DT D 2 2 ? 39.298 -31.003 27.626 1.00 25.90 ? 1002 DT D "C1'" 1 +ATOM 1768 N N1 . DT D 2 2 ? 39.913 -30.975 28.967 1.00 27.47 ? 1002 DT D N1 1 +ATOM 1769 C C2 . DT D 2 2 ? 39.487 -31.885 29.909 1.00 29.65 ? 1002 DT D C2 1 +ATOM 1770 O O2 . DT D 2 2 ? 38.638 -32.737 29.691 1.00 30.17 ? 1002 DT D O2 1 +ATOM 1771 N N3 . DT D 2 2 ? 40.096 -31.755 31.133 1.00 31.73 ? 1002 DT D N3 1 +ATOM 1772 C C4 . DT D 2 2 ? 41.058 -30.827 31.506 1.00 31.09 ? 1002 DT D C4 1 +ATOM 1773 O O4 . DT D 2 2 ? 41.495 -30.822 32.656 1.00 30.10 ? 1002 DT D O4 1 +ATOM 1774 C C5 . DT D 2 2 ? 41.466 -29.917 30.469 1.00 30.05 ? 1002 DT D C5 1 +ATOM 1775 C C7 . DT D 2 2 ? 42.506 -28.885 30.779 1.00 28.87 ? 1002 DT D C7 1 +ATOM 1776 C C6 . DT D 2 2 ? 40.885 -30.038 29.265 1.00 28.53 ? 1002 DT D C6 1 +ATOM 1777 P P . DA D 2 3 ? 36.451 -29.554 24.770 1.00 24.94 ? 1003 DA D P 1 +ATOM 1778 O OP1 . DA D 2 3 ? 36.648 -29.133 23.359 1.00 23.77 ? 1003 DA D OP1 1 +ATOM 1779 O OP2 . DA D 2 3 ? 36.262 -28.519 25.828 1.00 24.20 ? 1003 DA D OP2 1 +ATOM 1780 O "O5'" . DA D 2 3 ? 35.212 -30.550 24.855 1.00 23.85 ? 1003 DA D "O5'" 1 +ATOM 1781 C "C5'" . DA D 2 3 ? 34.164 -30.310 25.790 1.00 24.17 ? 1003 DA D "C5'" 1 +ATOM 1782 C "C4'" . DA D 2 3 ? 34.035 -31.462 26.761 1.00 22.46 ? 1003 DA D "C4'" 1 +ATOM 1783 O "O4'" . DA D 2 3 ? 35.186 -31.555 27.640 1.00 22.20 ? 1003 DA D "O4'" 1 +ATOM 1784 C "C3'" . DA D 2 3 ? 32.828 -31.303 27.682 1.00 21.24 ? 1003 DA D "C3'" 1 +ATOM 1785 O "O3'" . DA D 2 3 ? 32.141 -32.543 27.828 1.00 18.86 ? 1003 DA D "O3'" 1 +ATOM 1786 C "C2'" . DA D 2 3 ? 33.412 -30.838 29.003 1.00 20.27 ? 1003 DA D "C2'" 1 +ATOM 1787 C "C1'" . DA D 2 3 ? 34.769 -31.507 29.009 1.00 23.08 ? 1003 DA D "C1'" 1 +ATOM 1788 N N9 . DA D 2 3 ? 35.798 -30.793 29.779 1.00 25.74 ? 1003 DA D N9 1 +ATOM 1789 C C8 . DA D 2 3 ? 36.872 -30.104 29.270 1.00 26.74 ? 1003 DA D C8 1 +ATOM 1790 N N7 . DA D 2 3 ? 37.664 -29.593 30.183 1.00 25.94 ? 1003 DA D N7 1 +ATOM 1791 C C5 . DA D 2 3 ? 37.068 -29.954 31.378 1.00 26.56 ? 1003 DA D C5 1 +ATOM 1792 C C6 . DA D 2 3 ? 37.418 -29.708 32.712 1.00 26.75 ? 1003 DA D C6 1 +ATOM 1793 N N6 . DA D 2 3 ? 38.502 -29.023 33.072 1.00 25.88 ? 1003 DA D N6 1 +ATOM 1794 N N1 . DA D 2 3 ? 36.606 -30.195 33.677 1.00 26.50 ? 1003 DA D N1 1 +ATOM 1795 C C2 . DA D 2 3 ? 35.515 -30.886 33.307 1.00 25.21 ? 1003 DA D C2 1 +ATOM 1796 N N3 . DA D 2 3 ? 35.080 -31.186 32.083 1.00 26.03 ? 1003 DA D N3 1 +ATOM 1797 C C4 . DA D 2 3 ? 35.910 -30.686 31.151 1.00 26.79 ? 1003 DA D C4 1 +ATOM 1798 P P . DT D 2 4 ? 30.559 -32.528 28.081 1.00 14.30 ? 1004 DT D P 1 +ATOM 1799 O OP1 . DT D 2 4 ? 29.998 -33.893 27.944 1.00 12.32 ? 1004 DT D OP1 1 +ATOM 1800 O OP2 . DT D 2 4 ? 30.000 -31.415 27.258 1.00 15.11 ? 1004 DT D OP2 1 +ATOM 1801 O "O5'" . DT D 2 4 ? 30.452 -32.085 29.604 1.00 14.49 ? 1004 DT D "O5'" 1 +ATOM 1802 C "C5'" . DT D 2 4 ? 29.917 -30.821 29.948 1.00 13.86 ? 1004 DT D "C5'" 1 +ATOM 1803 C "C4'" . DT D 2 4 ? 29.892 -30.659 31.447 1.00 13.61 ? 1004 DT D "C4'" 1 +ATOM 1804 O "O4'" . DT D 2 4 ? 31.242 -30.463 31.957 1.00 13.83 ? 1004 DT D "O4'" 1 +ATOM 1805 C "C3'" . DT D 2 4 ? 29.097 -29.426 31.863 1.00 13.58 ? 1004 DT D "C3'" 1 +ATOM 1806 O "O3'" . DT D 2 4 ? 28.268 -29.721 32.991 1.00 14.86 ? 1004 DT D "O3'" 1 +ATOM 1807 C "C2'" . DT D 2 4 ? 30.168 -28.413 32.207 1.00 13.23 ? 1004 DT D "C2'" 1 +ATOM 1808 C "C1'" . DT D 2 4 ? 31.267 -29.289 32.757 1.00 11.44 ? 1004 DT D "C1'" 1 +ATOM 1809 N N1 . DT D 2 4 ? 32.594 -28.658 32.654 1.00 11.48 ? 1004 DT D N1 1 +ATOM 1810 C C2 . DT D 2 4 ? 33.245 -28.347 33.824 1.00 10.54 ? 1004 DT D C2 1 +ATOM 1811 O O2 . DT D 2 4 ? 32.790 -28.620 34.926 1.00 14.52 ? 1004 DT D O2 1 +ATOM 1812 N N3 . DT D 2 4 ? 34.450 -27.702 33.658 1.00 9.53 ? 1004 DT D N3 1 +ATOM 1813 C C4 . DT D 2 4 ? 35.058 -27.361 32.458 1.00 7.84 ? 1004 DT D C4 1 +ATOM 1814 O O4 . DT D 2 4 ? 36.141 -26.770 32.452 1.00 5.19 ? 1004 DT D O4 1 +ATOM 1815 C C5 . DT D 2 4 ? 34.332 -27.746 31.278 1.00 8.54 ? 1004 DT D C5 1 +ATOM 1816 C C7 . DT D 2 4 ? 34.927 -27.447 29.942 1.00 10.47 ? 1004 DT D C7 1 +ATOM 1817 C C6 . DT D 2 4 ? 33.150 -28.364 31.430 1.00 11.14 ? 1004 DT D C6 1 +ATOM 1818 P P . DG D 2 5 ? 27.668 -28.521 33.874 1.00 13.80 ? 1005 DG D P 1 +ATOM 1819 O OP1 . DG D 2 5 ? 26.543 -29.088 34.656 1.00 14.60 ? 1005 DG D OP1 1 +ATOM 1820 O OP2 . DG D 2 5 ? 27.434 -27.331 33.012 1.00 15.86 ? 1005 DG D OP2 1 +ATOM 1821 O "O5'" . DG D 2 5 ? 28.871 -28.168 34.850 1.00 14.99 ? 1005 DG D "O5'" 1 +ATOM 1822 C "C5'" . DG D 2 5 ? 29.345 -29.126 35.781 1.00 16.74 ? 1005 DG D "C5'" 1 +ATOM 1823 C "C4'" . DG D 2 5 ? 29.501 -28.468 37.127 1.00 18.83 ? 1005 DG D "C4'" 1 +ATOM 1824 O "O4'" . DG D 2 5 ? 30.746 -27.730 37.145 1.00 20.49 ? 1005 DG D "O4'" 1 +ATOM 1825 C "C3'" . DG D 2 5 ? 28.397 -27.444 37.365 1.00 18.61 ? 1005 DG D "C3'" 1 +ATOM 1826 O "O3'" . DG D 2 5 ? 27.960 -27.462 38.734 1.00 22.45 ? 1005 DG D "O3'" 1 +ATOM 1827 C "C2'" . DG D 2 5 ? 29.007 -26.137 36.874 1.00 16.69 ? 1005 DG D "C2'" 1 +ATOM 1828 C "C1'" . DG D 2 5 ? 30.523 -26.340 36.966 1.00 15.38 ? 1005 DG D "C1'" 1 +ATOM 1829 N N9 . DG D 2 5 ? 31.222 -25.961 35.740 1.00 10.46 ? 1005 DG D N9 1 +ATOM 1830 C C8 . DG D 2 5 ? 30.843 -26.292 34.467 1.00 11.45 ? 1005 DG D C8 1 +ATOM 1831 N N7 . DG D 2 5 ? 31.637 -25.811 33.550 1.00 9.38 ? 1005 DG D N7 1 +ATOM 1832 C C5 . DG D 2 5 ? 32.598 -25.119 34.263 1.00 8.66 ? 1005 DG D C5 1 +ATOM 1833 C C6 . DG D 2 5 ? 33.700 -24.375 33.808 1.00 5.74 ? 1005 DG D C6 1 +ATOM 1834 O O6 . DG D 2 5 ? 34.052 -24.168 32.643 1.00 2.02 ? 1005 DG D O6 1 +ATOM 1835 N N1 . DG D 2 5 ? 34.425 -23.836 34.865 1.00 6.41 ? 1005 DG D N1 1 +ATOM 1836 C C2 . DG D 2 5 ? 34.119 -23.994 36.190 1.00 5.52 ? 1005 DG D C2 1 +ATOM 1837 N N2 . DG D 2 5 ? 34.941 -23.411 37.060 1.00 8.73 ? 1005 DG D N2 1 +ATOM 1838 N N3 . DG D 2 5 ? 33.081 -24.678 36.631 1.00 8.56 ? 1005 DG D N3 1 +ATOM 1839 C C4 . DG D 2 5 ? 32.366 -25.210 35.621 1.00 10.26 ? 1005 DG D C4 1 +ATOM 1840 P P . DT D 2 6 ? 27.414 -26.118 39.419 1.00 24.72 ? 1006 DT D P 1 +ATOM 1841 O OP1 . DT D 2 6 ? 27.239 -26.393 40.871 1.00 23.83 ? 1006 DT D OP1 1 +ATOM 1842 O OP2 . DT D 2 6 ? 26.252 -25.606 38.630 1.00 23.81 ? 1006 DT D OP2 1 +ATOM 1843 O "O5'" . DT D 2 6 ? 28.677 -25.153 39.237 1.00 24.30 ? 1006 DT D "O5'" 1 +ATOM 1844 C "C5'" . DT D 2 6 ? 28.571 -23.743 39.393 1.00 23.25 ? 1006 DT D "C5'" 1 +ATOM 1845 C "C4'" . DT D 2 6 ? 29.679 -23.237 40.287 1.00 20.30 ? 1006 DT D "C4'" 1 +ATOM 1846 O "O4'" . DT D 2 6 ? 30.943 -23.144 39.580 1.00 20.30 ? 1006 DT D "O4'" 1 +ATOM 1847 C "C3'" . DT D 2 6 ? 29.377 -21.839 40.800 1.00 18.76 ? 1006 DT D "C3'" 1 +ATOM 1848 O "O3'" . DT D 2 6 ? 29.658 -21.728 42.174 1.00 16.05 ? 1006 DT D "O3'" 1 +ATOM 1849 C "C2'" . DT D 2 6 ? 30.243 -20.908 39.981 1.00 18.88 ? 1006 DT D "C2'" 1 +ATOM 1850 C "C1'" . DT D 2 6 ? 31.359 -21.777 39.461 1.00 20.25 ? 1006 DT D "C1'" 1 +ATOM 1851 N N1 . DT D 2 6 ? 31.651 -21.525 38.069 1.00 18.84 ? 1006 DT D N1 1 +ATOM 1852 C C2 . DT D 2 6 ? 32.687 -20.728 37.708 1.00 18.70 ? 1006 DT D C2 1 +ATOM 1853 O O2 . DT D 2 6 ? 33.373 -20.132 38.525 1.00 20.25 ? 1006 DT D O2 1 +ATOM 1854 N N3 . DT D 2 6 ? 32.868 -20.625 36.343 1.00 19.31 ? 1006 DT D N3 1 +ATOM 1855 C C4 . DT D 2 6 ? 32.105 -21.225 35.341 1.00 17.49 ? 1006 DT D C4 1 +ATOM 1856 O O4 . DT D 2 6 ? 32.392 -21.047 34.144 1.00 13.77 ? 1006 DT D O4 1 +ATOM 1857 C C5 . DT D 2 6 ? 31.009 -22.016 35.809 1.00 17.03 ? 1006 DT D C5 1 +ATOM 1858 C C7 . DT D 2 6 ? 30.099 -22.650 34.795 1.00 15.89 ? 1006 DT D C7 1 +ATOM 1859 C C6 . DT D 2 6 ? 30.860 -22.140 37.142 1.00 17.81 ? 1006 DT D C6 1 +ATOM 1860 P P . DA D 2 7 ? 29.265 -20.380 42.917 1.00 16.09 ? 1007 DA D P 1 +ATOM 1861 O OP1 . DA D 2 7 ? 28.928 -20.610 44.346 1.00 15.04 ? 1007 DA D OP1 1 +ATOM 1862 O OP2 . DA D 2 7 ? 28.302 -19.674 42.028 1.00 17.63 ? 1007 DA D OP2 1 +ATOM 1863 O "O5'" . DA D 2 7 ? 30.599 -19.545 42.827 1.00 18.83 ? 1007 DA D "O5'" 1 +ATOM 1864 C "C5'" . DA D 2 7 ? 30.534 -18.189 42.480 1.00 16.00 ? 1007 DA D "C5'" 1 +ATOM 1865 C "C4'" . DA D 2 7 ? 31.920 -17.647 42.274 1.00 12.56 ? 1007 DA D "C4'" 1 +ATOM 1866 O "O4'" . DA D 2 7 ? 32.461 -18.102 41.006 1.00 9.76 ? 1007 DA D "O4'" 1 +ATOM 1867 C "C3'" . DA D 2 7 ? 31.855 -16.133 42.199 1.00 11.62 ? 1007 DA D "C3'" 1 +ATOM 1868 O "O3'" . DA D 2 7 ? 32.904 -15.583 42.982 1.00 12.74 ? 1007 DA D "O3'" 1 +ATOM 1869 C "C2'" . DA D 2 7 ? 31.942 -15.831 40.714 1.00 10.10 ? 1007 DA D "C2'" 1 +ATOM 1870 C "C1'" . DA D 2 7 ? 32.734 -16.994 40.158 1.00 10.94 ? 1007 DA D "C1'" 1 +ATOM 1871 N N9 . DA D 2 7 ? 32.337 -17.347 38.791 1.00 12.75 ? 1007 DA D N9 1 +ATOM 1872 C C8 . DA D 2 7 ? 31.224 -18.032 38.396 1.00 13.53 ? 1007 DA D C8 1 +ATOM 1873 N N7 . DA D 2 7 ? 31.151 -18.229 37.102 1.00 14.15 ? 1007 DA D N7 1 +ATOM 1874 C C5 . DA D 2 7 ? 32.293 -17.621 36.604 1.00 14.10 ? 1007 DA D C5 1 +ATOM 1875 C C6 . DA D 2 7 ? 32.819 -17.492 35.288 1.00 16.30 ? 1007 DA D C6 1 +ATOM 1876 N N6 . DA D 2 7 ? 32.222 -17.981 34.189 1.00 16.68 ? 1007 DA D N6 1 +ATOM 1877 N N1 . DA D 2 7 ? 33.991 -16.833 35.142 1.00 14.65 ? 1007 DA D N1 1 +ATOM 1878 C C2 . DA D 2 7 ? 34.580 -16.329 36.236 1.00 15.91 ? 1007 DA D C2 1 +ATOM 1879 N N3 . DA D 2 7 ? 34.187 -16.380 37.514 1.00 16.75 ? 1007 DA D N3 1 +ATOM 1880 C C4 . DA D 2 7 ? 33.027 -17.057 37.632 1.00 15.05 ? 1007 DA D C4 1 +ATOM 1881 P P . DA D 2 8 ? 32.775 -14.094 43.526 1.00 10.10 ? 1008 DA D P 1 +ATOM 1882 O OP1 . DA D 2 8 ? 33.236 -14.089 44.937 1.00 10.98 ? 1008 DA D OP1 1 +ATOM 1883 O OP2 . DA D 2 8 ? 31.415 -13.607 43.197 1.00 12.44 ? 1008 DA D OP2 1 +ATOM 1884 O "O5'" . DA D 2 8 ? 33.835 -13.368 42.602 1.00 9.86 ? 1008 DA D "O5'" 1 +ATOM 1885 C "C5'" . DA D 2 8 ? 34.196 -13.963 41.362 1.00 11.08 ? 1008 DA D "C5'" 1 +ATOM 1886 C "C4'" . DA D 2 8 ? 34.699 -12.906 40.416 1.00 12.03 ? 1008 DA D "C4'" 1 +ATOM 1887 O "O4'" . DA D 2 8 ? 34.427 -13.362 39.069 1.00 12.35 ? 1008 DA D "O4'" 1 +ATOM 1888 C "C3'" . DA D 2 8 ? 33.910 -11.619 40.597 1.00 13.54 ? 1008 DA D "C3'" 1 +ATOM 1889 O "O3'" . DA D 2 8 ? 34.740 -10.476 40.538 1.00 14.45 ? 1008 DA D "O3'" 1 +ATOM 1890 C "C2'" . DA D 2 8 ? 32.892 -11.627 39.481 1.00 11.66 ? 1008 DA D "C2'" 1 +ATOM 1891 C "C1'" . DA D 2 8 ? 33.556 -12.453 38.403 1.00 11.84 ? 1008 DA D "C1'" 1 +ATOM 1892 N N9 . DA D 2 8 ? 32.567 -13.223 37.644 1.00 9.61 ? 1008 DA D N9 1 +ATOM 1893 C C8 . DA D 2 8 ? 31.408 -13.781 38.125 1.00 5.90 ? 1008 DA D C8 1 +ATOM 1894 N N7 . DA D 2 8 ? 30.684 -14.365 37.205 1.00 5.83 ? 1008 DA D N7 1 +ATOM 1895 C C5 . DA D 2 8 ? 31.419 -14.198 36.041 1.00 5.34 ? 1008 DA D C5 1 +ATOM 1896 C C6 . DA D 2 8 ? 31.191 -14.602 34.717 1.00 5.40 ? 1008 DA D C6 1 +ATOM 1897 N N6 . DA D 2 8 ? 30.110 -15.287 34.333 1.00 3.10 ? 1008 DA D N6 1 +ATOM 1898 N N1 . DA D 2 8 ? 32.124 -14.281 33.790 1.00 6.80 ? 1008 DA D N1 1 +ATOM 1899 C C2 . DA D 2 8 ? 33.210 -13.598 34.185 1.00 8.81 ? 1008 DA D C2 1 +ATOM 1900 N N3 . DA D 2 8 ? 33.535 -13.161 35.404 1.00 7.21 ? 1008 DA D N3 1 +ATOM 1901 C C4 . DA D 2 8 ? 32.587 -13.501 36.296 1.00 6.40 ? 1008 DA D C4 1 +ATOM 1902 P P . DA D 2 9 ? 34.171 -9.084 41.081 1.00 17.67 ? 1009 DA D P 1 +ATOM 1903 O OP1 . DA D 2 9 ? 35.239 -8.071 40.869 1.00 19.89 ? 1009 DA D OP1 1 +ATOM 1904 O OP2 . DA D 2 9 ? 33.578 -9.253 42.435 1.00 15.27 ? 1009 DA D OP2 1 +ATOM 1905 O "O5'" . DA D 2 9 ? 32.983 -8.774 40.070 1.00 19.11 ? 1009 DA D "O5'" 1 +ATOM 1906 C "C5'" . DA D 2 9 ? 32.955 -7.556 39.341 1.00 20.05 ? 1009 DA D "C5'" 1 +ATOM 1907 C "C4'" . DA D 2 9 ? 34.201 -7.441 38.498 1.00 20.79 ? 1009 DA D "C4'" 1 +ATOM 1908 O "O4'" . DA D 2 9 ? 34.363 -8.646 37.711 1.00 21.50 ? 1009 DA D "O4'" 1 +ATOM 1909 C "C3'" . DA D 2 9 ? 34.185 -6.286 37.510 1.00 20.53 ? 1009 DA D "C3'" 1 +ATOM 1910 O "O3'" . DA D 2 9 ? 35.483 -5.696 37.453 1.00 20.03 ? 1009 DA D "O3'" 1 +ATOM 1911 C "C2'" . DA D 2 9 ? 33.744 -6.931 36.205 1.00 21.16 ? 1009 DA D "C2'" 1 +ATOM 1912 C "C1'" . DA D 2 9 ? 34.141 -8.391 36.328 1.00 19.33 ? 1009 DA D "C1'" 1 +ATOM 1913 N N9 . DA D 2 9 ? 33.052 -9.266 35.910 1.00 21.31 ? 1009 DA D N9 1 +ATOM 1914 C C8 . DA D 2 9 ? 32.066 -9.777 36.721 1.00 21.37 ? 1009 DA D C8 1 +ATOM 1915 N N7 . DA D 2 9 ? 31.210 -10.542 36.092 1.00 19.76 ? 1009 DA D N7 1 +ATOM 1916 C C5 . DA D 2 9 ? 31.660 -10.536 34.779 1.00 20.67 ? 1009 DA D C5 1 +ATOM 1917 C C6 . DA D 2 9 ? 31.184 -11.161 33.619 1.00 21.77 ? 1009 DA D C6 1 +ATOM 1918 N N6 . DA D 2 9 ? 30.096 -11.935 33.598 1.00 24.21 ? 1009 DA D N6 1 +ATOM 1919 N N1 . DA D 2 9 ? 31.865 -10.960 32.467 1.00 20.02 ? 1009 DA D N1 1 +ATOM 1920 C C2 . DA D 2 9 ? 32.937 -10.165 32.490 1.00 18.77 ? 1009 DA D C2 1 +ATOM 1921 N N3 . DA D 2 9 ? 33.478 -9.511 33.517 1.00 21.78 ? 1009 DA D N3 1 +ATOM 1922 C C4 . DA D 2 9 ? 32.788 -9.747 34.649 1.00 21.18 ? 1009 DA D C4 1 +ATOM 1923 P P . DC D 2 10 ? 36.338 -5.773 36.099 1.00 17.82 ? 1010 DC D P 1 +ATOM 1924 O OP1 . DC D 2 10 ? 36.567 -7.230 35.854 1.00 18.55 ? 1010 DC D OP1 1 +ATOM 1925 O OP2 . DC D 2 10 ? 37.498 -4.869 36.283 1.00 18.92 ? 1010 DC D OP2 1 +ATOM 1926 O "O5'" . DC D 2 10 ? 35.385 -5.165 34.963 1.00 18.53 ? 1010 DC D "O5'" 1 +ATOM 1927 C "C5'" . DC D 2 10 ? 35.767 -5.208 33.578 1.00 20.57 ? 1010 DC D "C5'" 1 +ATOM 1928 C "C4'" . DC D 2 10 ? 34.633 -4.755 32.680 1.00 18.25 ? 1010 DC D "C4'" 1 +ATOM 1929 O "O4'" . DC D 2 10 ? 33.583 -5.746 32.612 1.00 18.40 ? 1010 DC D "O4'" 1 +ATOM 1930 C "C3'" . DC D 2 10 ? 33.943 -3.443 33.060 1.00 18.91 ? 1010 DC D "C3'" 1 +ATOM 1931 O "O3'" . DC D 2 10 ? 33.538 -2.772 31.862 1.00 16.77 ? 1010 DC D "O3'" 1 +ATOM 1932 C "C2'" . DC D 2 10 ? 32.683 -3.927 33.753 1.00 19.30 ? 1010 DC D "C2'" 1 +ATOM 1933 C "C1'" . DC D 2 10 ? 32.335 -5.115 32.870 1.00 20.39 ? 1010 DC D "C1'" 1 +ATOM 1934 N N1 . DC D 2 10 ? 31.429 -6.114 33.468 1.00 22.17 ? 1010 DC D N1 1 +ATOM 1935 C C2 . DC D 2 10 ? 30.850 -7.096 32.644 1.00 21.12 ? 1010 DC D C2 1 +ATOM 1936 O O2 . DC D 2 10 ? 31.070 -7.077 31.422 1.00 20.57 ? 1010 DC D O2 1 +ATOM 1937 N N3 . DC D 2 10 ? 30.062 -8.038 33.201 1.00 20.48 ? 1010 DC D N3 1 +ATOM 1938 C C4 . DC D 2 10 ? 29.825 -8.026 34.513 1.00 20.06 ? 1010 DC D C4 1 +ATOM 1939 N N4 . DC D 2 10 ? 29.050 -8.993 35.013 1.00 19.49 ? 1010 DC D N4 1 +ATOM 1940 C C5 . DC D 2 10 ? 30.375 -7.028 35.368 1.00 21.59 ? 1010 DC D C5 1 +ATOM 1941 C C6 . DC D 2 10 ? 31.162 -6.098 34.807 1.00 22.63 ? 1010 DC D C6 1 +ATOM 1942 P P . DA D 2 11 ? 34.625 -2.021 30.955 1.00 14.63 ? 1011 DA D P 1 +ATOM 1943 O OP1 . DA D 2 11 ? 35.922 -2.725 31.099 1.00 16.62 ? 1011 DA D OP1 1 +ATOM 1944 O OP2 . DA D 2 11 ? 34.547 -0.568 31.249 1.00 16.42 ? 1011 DA D OP2 1 +ATOM 1945 O "O5'" . DA D 2 11 ? 34.115 -2.279 29.469 1.00 15.82 ? 1011 DA D "O5'" 1 +ATOM 1946 C "C5'" . DA D 2 11 ? 32.918 -1.671 28.975 1.00 17.92 ? 1011 DA D "C5'" 1 +ATOM 1947 C "C4'" . DA D 2 11 ? 32.338 -2.506 27.858 1.00 18.41 ? 1011 DA D "C4'" 1 +ATOM 1948 O "O4'" . DA D 2 11 ? 31.678 -3.665 28.424 1.00 17.41 ? 1011 DA D "O4'" 1 +ATOM 1949 C "C3'" . DA D 2 11 ? 31.280 -1.794 27.019 1.00 19.81 ? 1011 DA D "C3'" 1 +ATOM 1950 O "O3'" . DA D 2 11 ? 31.423 -2.155 25.642 1.00 23.58 ? 1011 DA D "O3'" 1 +ATOM 1951 C "C2'" . DA D 2 11 ? 29.970 -2.323 27.572 1.00 18.10 ? 1011 DA D "C2'" 1 +ATOM 1952 C "C1'" . DA D 2 11 ? 30.330 -3.733 27.974 1.00 15.85 ? 1011 DA D "C1'" 1 +ATOM 1953 N N9 . DA D 2 11 ? 29.509 -4.280 29.059 1.00 13.26 ? 1011 DA D N9 1 +ATOM 1954 C C8 . DA D 2 11 ? 29.658 -4.086 30.411 1.00 11.02 ? 1011 DA D C8 1 +ATOM 1955 N N7 . DA D 2 11 ? 28.782 -4.733 31.140 1.00 8.65 ? 1011 DA D N7 1 +ATOM 1956 C C5 . DA D 2 11 ? 27.996 -5.392 30.207 1.00 9.33 ? 1011 DA D C5 1 +ATOM 1957 C C6 . DA D 2 11 ? 26.895 -6.261 30.346 1.00 9.81 ? 1011 DA D C6 1 +ATOM 1958 N N6 . DA D 2 11 ? 26.400 -6.637 31.532 1.00 8.90 ? 1011 DA D N6 1 +ATOM 1959 N N1 . DA D 2 11 ? 26.326 -6.744 29.219 1.00 10.81 ? 1011 DA D N1 1 +ATOM 1960 C C2 . DA D 2 11 ? 26.851 -6.385 28.035 1.00 11.83 ? 1011 DA D C2 1 +ATOM 1961 N N3 . DA D 2 11 ? 27.896 -5.584 27.778 1.00 12.15 ? 1011 DA D N3 1 +ATOM 1962 C C4 . DA D 2 11 ? 28.427 -5.115 28.921 1.00 10.11 ? 1011 DA D C4 1 +ATOM 1963 P P . DA D 2 12 ? 30.505 -1.434 24.530 1.00 24.34 ? 1012 DA D P 1 +ATOM 1964 O OP1 . DA D 2 12 ? 30.908 -1.919 23.177 1.00 25.79 ? 1012 DA D OP1 1 +ATOM 1965 O OP2 . DA D 2 12 ? 30.554 0.029 24.835 1.00 21.11 ? 1012 DA D OP2 1 +ATOM 1966 O "O5'" . DA D 2 12 ? 29.029 -1.963 24.835 1.00 21.44 ? 1012 DA D "O5'" 1 +ATOM 1967 C "C5'" . DA D 2 12 ? 28.066 -1.069 25.378 1.00 19.34 ? 1012 DA D "C5'" 1 +ATOM 1968 C "C4'" . DA D 2 12 ? 26.681 -1.668 25.333 1.00 15.88 ? 1012 DA D "C4'" 1 +ATOM 1969 O "O4'" . DA D 2 12 ? 26.460 -2.464 26.531 1.00 13.80 ? 1012 DA D "O4'" 1 +ATOM 1970 C "C3'" . DA D 2 12 ? 25.605 -0.581 25.351 1.00 15.26 ? 1012 DA D "C3'" 1 +ATOM 1971 O "O3'" . DA D 2 12 ? 24.525 -0.931 24.494 1.00 16.36 ? 1012 DA D "O3'" 1 +ATOM 1972 C "C2'" . DA D 2 12 ? 25.138 -0.553 26.792 1.00 12.37 ? 1012 DA D "C2'" 1 +ATOM 1973 C "C1'" . DA D 2 12 ? 25.291 -2.003 27.196 1.00 9.58 ? 1012 DA D "C1'" 1 +ATOM 1974 N N9 . DA D 2 12 ? 25.449 -2.211 28.638 1.00 7.38 ? 1012 DA D N9 1 +ATOM 1975 C C8 . DA D 2 12 ? 26.153 -1.454 29.541 1.00 2.78 ? 1012 DA D C8 1 +ATOM 1976 N N7 . DA D 2 12 ? 26.061 -1.885 30.775 1.00 0.41 ? 1012 DA D N7 1 +ATOM 1977 C C5 . DA D 2 12 ? 25.252 -3.011 30.680 1.00 1.93 ? 1012 DA D C5 1 +ATOM 1978 C C6 . DA D 2 12 ? 24.769 -3.938 31.645 1.00 2.31 ? 1012 DA D C6 1 +ATOM 1979 N N6 . DA D 2 12 ? 25.033 -3.875 32.954 1.00 0.00 ? 1012 DA D N6 1 +ATOM 1980 N N1 . DA D 2 12 ? 23.990 -4.949 31.204 1.00 2.40 ? 1012 DA D N1 1 +ATOM 1981 C C2 . DA D 2 12 ? 23.712 -5.025 29.896 1.00 5.30 ? 1012 DA D C2 1 +ATOM 1982 N N3 . DA D 2 12 ? 24.094 -4.222 28.904 1.00 6.35 ? 1012 DA D N3 1 +ATOM 1983 C C4 . DA D 2 12 ? 24.872 -3.225 29.368 1.00 6.31 ? 1012 DA D C4 1 +ATOM 1984 P P . DC D 2 13 ? 23.966 0.152 23.462 1.00 16.84 ? 1013 DC D P 1 +ATOM 1985 O OP1 . DC D 2 13 ? 24.274 -0.383 22.110 1.00 17.64 ? 1013 DC D OP1 1 +ATOM 1986 O OP2 . DC D 2 13 ? 24.475 1.481 23.855 1.00 14.72 ? 1013 DC D OP2 1 +ATOM 1987 O "O5'" . DC D 2 13 ? 22.388 0.120 23.665 1.00 15.13 ? 1013 DC D "O5'" 1 +ATOM 1988 C "C5'" . DC D 2 13 ? 21.773 0.582 24.865 1.00 11.17 ? 1013 DC D "C5'" 1 +ATOM 1989 C "C4'" . DC D 2 13 ? 20.942 -0.530 25.463 1.00 11.89 ? 1013 DC D "C4'" 1 +ATOM 1990 O "O4'" . DC D 2 13 ? 21.661 -1.088 26.590 1.00 12.29 ? 1013 DC D "O4'" 1 +ATOM 1991 C "C3'" . DC D 2 13 ? 19.583 -0.111 26.023 1.00 10.43 ? 1013 DC D "C3'" 1 +ATOM 1992 O "O3'" . DC D 2 13 ? 18.772 -1.282 26.116 1.00 11.77 ? 1013 DC D "O3'" 1 +ATOM 1993 C "C2'" . DC D 2 13 ? 19.909 0.177 27.474 1.00 9.31 ? 1013 DC D "C2'" 1 +ATOM 1994 C "C1'" . DC D 2 13 ? 20.859 -0.969 27.754 1.00 7.90 ? 1013 DC D "C1'" 1 +ATOM 1995 N N1 . DC D 2 13 ? 21.744 -0.762 28.901 1.00 6.66 ? 1013 DC D N1 1 +ATOM 1996 C C2 . DC D 2 13 ? 21.794 -1.733 29.896 1.00 5.77 ? 1013 DC D C2 1 +ATOM 1997 O O2 . DC D 2 13 ? 21.147 -2.773 29.754 1.00 4.11 ? 1013 DC D O2 1 +ATOM 1998 N N3 . DC D 2 13 ? 22.545 -1.513 30.986 1.00 7.85 ? 1013 DC D N3 1 +ATOM 1999 C C4 . DC D 2 13 ? 23.232 -0.377 31.106 1.00 6.49 ? 1013 DC D C4 1 +ATOM 2000 N N4 . DC D 2 13 ? 23.920 -0.170 32.243 1.00 10.09 ? 1013 DC D N4 1 +ATOM 2001 C C5 . DC D 2 13 ? 23.238 0.606 30.083 1.00 3.29 ? 1013 DC D C5 1 +ATOM 2002 C C6 . DC D 2 13 ? 22.489 0.374 29.006 1.00 5.00 ? 1013 DC D C6 1 +ATOM 2003 O "O5'" . DG E 3 1 ? 23.806 -7.217 -11.493 1.00 0.00 ? 25 DG E "O5'" 1 +ATOM 2004 C "C5'" . DG E 3 1 ? 22.648 -7.881 -10.979 1.00 1.45 ? 25 DG E "C5'" 1 +ATOM 2005 C "C4'" . DG E 3 1 ? 22.862 -8.681 -9.714 1.00 1.96 ? 25 DG E "C4'" 1 +ATOM 2006 O "O4'" . DG E 3 1 ? 23.604 -7.879 -8.770 1.00 1.68 ? 25 DG E "O4'" 1 +ATOM 2007 C "C3'" . DG E 3 1 ? 21.584 -9.119 -8.987 1.00 3.45 ? 25 DG E "C3'" 1 +ATOM 2008 O "O3'" . DG E 3 1 ? 21.831 -10.436 -8.461 1.00 8.57 ? 25 DG E "O3'" 1 +ATOM 2009 C "C2'" . DG E 3 1 ? 21.434 -8.092 -7.873 1.00 0.91 ? 25 DG E "C2'" 1 +ATOM 2010 C "C1'" . DG E 3 1 ? 22.857 -7.663 -7.587 1.00 0.55 ? 25 DG E "C1'" 1 +ATOM 2011 N N9 . DG E 3 1 ? 22.995 -6.258 -7.208 1.00 2.98 ? 25 DG E N9 1 +ATOM 2012 C C8 . DG E 3 1 ? 23.029 -5.138 -8.015 1.00 3.40 ? 25 DG E C8 1 +ATOM 2013 N N7 . DG E 3 1 ? 23.168 -4.026 -7.340 1.00 3.53 ? 25 DG E N7 1 +ATOM 2014 C C5 . DG E 3 1 ? 23.247 -4.438 -6.015 1.00 2.07 ? 25 DG E C5 1 +ATOM 2015 C C6 . DG E 3 1 ? 23.444 -3.695 -4.823 1.00 3.15 ? 25 DG E C6 1 +ATOM 2016 O O6 . DG E 3 1 ? 23.658 -2.484 -4.683 1.00 3.69 ? 25 DG E O6 1 +ATOM 2017 N N1 . DG E 3 1 ? 23.411 -4.519 -3.703 1.00 5.45 ? 25 DG E N1 1 +ATOM 2018 C C2 . DG E 3 1 ? 23.255 -5.884 -3.728 1.00 4.94 ? 25 DG E C2 1 +ATOM 2019 N N2 . DG E 3 1 ? 23.235 -6.513 -2.550 1.00 6.36 ? 25 DG E N2 1 +ATOM 2020 N N3 . DG E 3 1 ? 23.124 -6.584 -4.826 1.00 6.58 ? 25 DG E N3 1 +ATOM 2021 C C4 . DG E 3 1 ? 23.123 -5.805 -5.925 1.00 4.11 ? 25 DG E C4 1 +ATOM 2022 P P . DT E 3 2 ? 20.642 -11.318 -7.797 1.00 7.73 ? 26 DT E P 1 +ATOM 2023 O OP1 . DT E 3 2 ? 21.212 -12.702 -7.779 1.00 9.40 ? 26 DT E OP1 1 +ATOM 2024 O OP2 . DT E 3 2 ? 19.335 -11.083 -8.454 1.00 7.69 ? 26 DT E OP2 1 +ATOM 2025 O "O5'" . DT E 3 2 ? 20.554 -10.899 -6.260 1.00 7.49 ? 26 DT E "O5'" 1 +ATOM 2026 C "C5'" . DT E 3 2 ? 21.482 -11.454 -5.351 1.00 6.39 ? 26 DT E "C5'" 1 +ATOM 2027 C "C4'" . DT E 3 2 ? 21.248 -10.958 -3.943 1.00 8.57 ? 26 DT E "C4'" 1 +ATOM 2028 O "O4'" . DT E 3 2 ? 21.493 -9.532 -3.814 1.00 7.03 ? 26 DT E "O4'" 1 +ATOM 2029 C "C3'" . DT E 3 2 ? 19.845 -11.214 -3.384 1.00 7.60 ? 26 DT E "C3'" 1 +ATOM 2030 O "O3'" . DT E 3 2 ? 19.956 -11.766 -2.062 1.00 10.51 ? 26 DT E "O3'" 1 +ATOM 2031 C "C2'" . DT E 3 2 ? 19.218 -9.828 -3.306 1.00 7.29 ? 26 DT E "C2'" 1 +ATOM 2032 C "C1'" . DT E 3 2 ? 20.434 -8.942 -3.079 1.00 8.52 ? 26 DT E "C1'" 1 +ATOM 2033 N N1 . DT E 3 2 ? 20.317 -7.532 -3.500 1.00 7.72 ? 26 DT E N1 1 +ATOM 2034 C C2 . DT E 3 2 ? 20.361 -6.581 -2.512 1.00 6.48 ? 26 DT E C2 1 +ATOM 2035 O O2 . DT E 3 2 ? 20.535 -6.854 -1.325 1.00 5.74 ? 26 DT E O2 1 +ATOM 2036 N N3 . DT E 3 2 ? 20.199 -5.289 -2.959 1.00 5.57 ? 26 DT E N3 1 +ATOM 2037 C C4 . DT E 3 2 ? 19.999 -4.864 -4.270 1.00 5.43 ? 26 DT E C4 1 +ATOM 2038 O O4 . DT E 3 2 ? 19.796 -3.667 -4.527 1.00 5.45 ? 26 DT E O4 1 +ATOM 2039 C C5 . DT E 3 2 ? 20.015 -5.908 -5.253 1.00 6.36 ? 26 DT E C5 1 +ATOM 2040 C C7 . DT E 3 2 ? 19.869 -5.529 -6.697 1.00 4.40 ? 26 DT E C7 1 +ATOM 2041 C C6 . DT E 3 2 ? 20.165 -7.180 -4.826 1.00 6.40 ? 26 DT E C6 1 +ATOM 2042 P P . DT E 3 3 ? 18.830 -12.760 -1.487 1.00 10.57 ? 27 DT E P 1 +ATOM 2043 O OP1 . DT E 3 3 ? 19.597 -13.805 -0.774 1.00 12.25 ? 27 DT E OP1 1 +ATOM 2044 O OP2 . DT E 3 3 ? 17.805 -13.161 -2.491 1.00 12.82 ? 27 DT E OP2 1 +ATOM 2045 O "O5'" . DT E 3 3 ? 18.192 -11.883 -0.329 1.00 10.60 ? 27 DT E "O5'" 1 +ATOM 2046 C "C5'" . DT E 3 3 ? 19.002 -11.434 0.746 1.00 8.88 ? 27 DT E "C5'" 1 +ATOM 2047 C "C4'" . DT E 3 3 ? 18.486 -10.117 1.288 1.00 8.05 ? 27 DT E "C4'" 1 +ATOM 2048 O "O4'" . DT E 3 3 ? 18.649 -9.028 0.341 1.00 8.57 ? 27 DT E "O4'" 1 +ATOM 2049 C "C3'" . DT E 3 3 ? 17.034 -9.996 1.790 1.00 7.30 ? 27 DT E "C3'" 1 +ATOM 2050 O "O3'" . DT E 3 3 ? 17.099 -9.309 3.042 1.00 6.48 ? 27 DT E "O3'" 1 +ATOM 2051 C "C2'" . DT E 3 3 ? 16.385 -9.055 0.777 1.00 7.83 ? 27 DT E "C2'" 1 +ATOM 2052 C "C1'" . DT E 3 3 ? 17.557 -8.142 0.525 1.00 6.73 ? 27 DT E "C1'" 1 +ATOM 2053 N N1 . DT E 3 3 ? 17.473 -7.219 -0.619 1.00 2.97 ? 27 DT E N1 1 +ATOM 2054 C C2 . DT E 3 3 ? 17.777 -5.902 -0.375 1.00 5.15 ? 27 DT E C2 1 +ATOM 2055 O O2 . DT E 3 3 ? 18.164 -5.501 0.716 1.00 4.70 ? 27 DT E O2 1 +ATOM 2056 N N3 . DT E 3 3 ? 17.625 -5.066 -1.453 1.00 3.87 ? 27 DT E N3 1 +ATOM 2057 C C4 . DT E 3 3 ? 17.230 -5.414 -2.727 1.00 1.29 ? 27 DT E C4 1 +ATOM 2058 O O4 . DT E 3 3 ? 17.113 -4.554 -3.590 1.00 1.76 ? 27 DT E O4 1 +ATOM 2059 C C5 . DT E 3 3 ? 16.976 -6.816 -2.925 1.00 2.59 ? 27 DT E C5 1 +ATOM 2060 C C7 . DT E 3 3 ? 16.597 -7.290 -4.292 1.00 2.33 ? 27 DT E C7 1 +ATOM 2061 C C6 . DT E 3 3 ? 17.097 -7.640 -1.869 1.00 3.23 ? 27 DT E C6 1 +ATOM 2062 P P . DG E 3 4 ? 16.105 -9.687 4.248 1.00 6.09 ? 28 DG E P 1 +ATOM 2063 O OP1 . DG E 3 4 ? 16.872 -10.268 5.425 1.00 3.09 ? 28 DG E OP1 1 +ATOM 2064 O OP2 . DG E 3 4 ? 14.889 -10.358 3.752 1.00 8.78 ? 28 DG E OP2 1 +ATOM 2065 O "O5'" . DG E 3 4 ? 15.591 -8.234 4.619 1.00 9.20 ? 28 DG E "O5'" 1 +ATOM 2066 C "C5'" . DG E 3 4 ? 15.756 -7.143 3.696 1.00 7.53 ? 28 DG E "C5'" 1 +ATOM 2067 C "C4'" . DG E 3 4 ? 15.125 -5.891 4.256 1.00 7.16 ? 28 DG E "C4'" 1 +ATOM 2068 O "O4'" . DG E 3 4 ? 14.960 -4.924 3.190 1.00 7.94 ? 28 DG E "O4'" 1 +ATOM 2069 C "C3'" . DG E 3 4 ? 13.720 -6.139 4.799 1.00 6.59 ? 28 DG E "C3'" 1 +ATOM 2070 O "O3'" . DG E 3 4 ? 13.485 -5.262 5.913 1.00 4.26 ? 28 DG E "O3'" 1 +ATOM 2071 C "C2'" . DG E 3 4 ? 12.837 -5.903 3.586 1.00 7.04 ? 28 DG E "C2'" 1 +ATOM 2072 C "C1'" . DG E 3 4 ? 13.619 -4.891 2.751 1.00 4.40 ? 28 DG E "C1'" 1 +ATOM 2073 N N9 . DG E 3 4 ? 13.646 -5.194 1.328 1.00 0.01 ? 28 DG E N9 1 +ATOM 2074 C C8 . DG E 3 4 ? 13.549 -6.420 0.731 1.00 1.06 ? 28 DG E C8 1 +ATOM 2075 N N7 . DG E 3 4 ? 13.577 -6.356 -0.573 1.00 4.16 ? 28 DG E N7 1 +ATOM 2076 C C5 . DG E 3 4 ? 13.709 -5.006 -0.845 1.00 1.55 ? 28 DG E C5 1 +ATOM 2077 C C6 . DG E 3 4 ? 13.790 -4.312 -2.087 1.00 0.00 ? 28 DG E C6 1 +ATOM 2078 O O6 . DG E 3 4 ? 13.748 -4.765 -3.232 1.00 3.38 ? 28 DG E O6 1 +ATOM 2079 N N1 . DG E 3 4 ? 13.945 -2.947 -1.898 1.00 1.91 ? 28 DG E N1 1 +ATOM 2080 C C2 . DG E 3 4 ? 14.032 -2.324 -0.674 1.00 2.09 ? 28 DG E C2 1 +ATOM 2081 N N2 . DG E 3 4 ? 14.260 -1.018 -0.682 1.00 2.70 ? 28 DG E N2 1 +ATOM 2082 N N3 . DG E 3 4 ? 13.925 -2.949 0.482 1.00 4.55 ? 28 DG E N3 1 +ATOM 2083 C C4 . DG E 3 4 ? 13.770 -4.279 0.322 1.00 2.78 ? 28 DG E C4 1 +ATOM 2084 P P . DT E 3 5 ? 12.020 -5.151 6.583 1.00 4.94 ? 29 DT E P 1 +ATOM 2085 O OP1 . DT E 3 5 ? 12.179 -5.143 8.064 1.00 2.39 ? 29 DT E OP1 1 +ATOM 2086 O OP2 . DT E 3 5 ? 11.082 -6.121 5.965 1.00 6.22 ? 29 DT E OP2 1 +ATOM 2087 O "O5'" . DT E 3 5 ? 11.556 -3.700 6.107 1.00 9.52 ? 29 DT E "O5'" 1 +ATOM 2088 C "C5'" . DT E 3 5 ? 11.670 -3.328 4.726 1.00 10.86 ? 29 DT E "C5'" 1 +ATOM 2089 C "C4'" . DT E 3 5 ? 11.559 -1.831 4.556 1.00 11.26 ? 29 DT E "C4'" 1 +ATOM 2090 O "O4'" . DT E 3 5 ? 11.867 -1.508 3.184 1.00 10.30 ? 29 DT E "O4'" 1 +ATOM 2091 C "C3'" . DT E 3 5 ? 10.167 -1.270 4.813 1.00 13.94 ? 29 DT E "C3'" 1 +ATOM 2092 O "O3'" . DT E 3 5 ? 10.293 0.010 5.445 1.00 19.15 ? 29 DT E "O3'" 1 +ATOM 2093 C "C2'" . DT E 3 5 ? 9.531 -1.241 3.428 1.00 11.83 ? 29 DT E "C2'" 1 +ATOM 2094 C "C1'" . DT E 3 5 ? 10.715 -1.062 2.477 1.00 9.80 ? 29 DT E "C1'" 1 +ATOM 2095 N N1 . DT E 3 5 ? 10.642 -1.861 1.207 1.00 8.44 ? 29 DT E N1 1 +ATOM 2096 C C2 . DT E 3 5 ? 10.956 -1.226 0.022 1.00 6.73 ? 29 DT E C2 1 +ATOM 2097 O O2 . DT E 3 5 ? 11.218 -0.043 -0.051 1.00 5.50 ? 29 DT E O2 1 +ATOM 2098 N N3 . DT E 3 5 ? 10.954 -2.042 -1.078 1.00 6.21 ? 29 DT E N3 1 +ATOM 2099 C C4 . DT E 3 5 ? 10.660 -3.390 -1.125 1.00 5.26 ? 29 DT E C4 1 +ATOM 2100 O O4 . DT E 3 5 ? 10.742 -3.988 -2.185 1.00 1.98 ? 29 DT E O4 1 +ATOM 2101 C C5 . DT E 3 5 ? 10.286 -3.987 0.133 1.00 3.89 ? 29 DT E C5 1 +ATOM 2102 C C7 . DT E 3 5 ? 9.902 -5.433 0.169 1.00 6.46 ? 29 DT E C7 1 +ATOM 2103 C C6 . DT E 3 5 ? 10.294 -3.208 1.222 1.00 6.80 ? 29 DT E C6 1 +ATOM 2104 P P . DT E 3 6 ? 9.016 0.703 6.133 1.00 19.07 ? 30 DT E P 1 +ATOM 2105 O OP1 . DT E 3 6 ? 9.513 1.681 7.148 1.00 15.72 ? 30 DT E OP1 1 +ATOM 2106 O OP2 . DT E 3 6 ? 8.077 -0.361 6.552 1.00 19.06 ? 30 DT E OP2 1 +ATOM 2107 O "O5'" . DT E 3 6 ? 8.340 1.492 4.921 1.00 20.93 ? 30 DT E "O5'" 1 +ATOM 2108 C "C5'" . DT E 3 6 ? 9.133 2.289 4.045 1.00 20.39 ? 30 DT E "C5'" 1 +ATOM 2109 C "C4'" . DT E 3 6 ? 8.377 2.618 2.778 1.00 21.36 ? 30 DT E "C4'" 1 +ATOM 2110 O "O4'" . DT E 3 6 ? 8.555 1.623 1.736 1.00 22.66 ? 30 DT E "O4'" 1 +ATOM 2111 C "C3'" . DT E 3 6 ? 6.870 2.848 2.916 1.00 22.58 ? 30 DT E "C3'" 1 +ATOM 2112 O "O3'" . DT E 3 6 ? 6.553 4.080 2.263 1.00 22.39 ? 30 DT E "O3'" 1 +ATOM 2113 C "C2'" . DT E 3 6 ? 6.258 1.678 2.154 1.00 23.53 ? 30 DT E "C2'" 1 +ATOM 2114 C "C1'" . DT E 3 6 ? 7.307 1.417 1.083 1.00 22.69 ? 30 DT E "C1'" 1 +ATOM 2115 N N1 . DT E 3 6 ? 7.291 0.050 0.508 1.00 24.90 ? 30 DT E N1 1 +ATOM 2116 C C2 . DT E 3 6 ? 7.474 -0.100 -0.849 1.00 25.59 ? 30 DT E C2 1 +ATOM 2117 O O2 . DT E 3 6 ? 7.564 0.839 -1.607 1.00 24.61 ? 30 DT E O2 1 +ATOM 2118 N N3 . DT E 3 6 ? 7.531 -1.404 -1.278 1.00 25.65 ? 30 DT E N3 1 +ATOM 2119 C C4 . DT E 3 6 ? 7.430 -2.544 -0.503 1.00 26.40 ? 30 DT E C4 1 +ATOM 2120 O O4 . DT E 3 6 ? 7.565 -3.646 -1.027 1.00 28.19 ? 30 DT E O4 1 +ATOM 2121 C C5 . DT E 3 6 ? 7.177 -2.321 0.907 1.00 27.09 ? 30 DT E C5 1 +ATOM 2122 C C7 . DT E 3 6 ? 6.981 -3.507 1.813 1.00 25.80 ? 30 DT E C7 1 +ATOM 2123 C C6 . DT E 3 6 ? 7.129 -1.046 1.334 1.00 26.22 ? 30 DT E C6 1 +ATOM 2124 P P . DT E 3 7 ? 5.313 4.988 2.771 1.00 21.66 ? 31 DT E P 1 +ATOM 2125 O OP1 . DT E 3 7 ? 5.857 6.153 3.539 1.00 22.12 ? 31 DT E OP1 1 +ATOM 2126 O OP2 . DT E 3 7 ? 4.297 4.117 3.404 1.00 22.07 ? 31 DT E OP2 1 +ATOM 2127 O "O5'" . DT E 3 7 ? 4.727 5.490 1.378 1.00 20.26 ? 31 DT E "O5'" 1 +ATOM 2128 C "C5'" . DT E 3 7 ? 4.950 4.683 0.226 1.00 18.57 ? 31 DT E "C5'" 1 +ATOM 2129 C "C4'" . DT E 3 7 ? 5.111 5.525 -1.018 1.00 17.87 ? 31 DT E "C4'" 1 +ATOM 2130 O "O4'" . DT E 3 7 ? 5.658 4.679 -2.055 1.00 17.71 ? 31 DT E "O4'" 1 +ATOM 2131 C "C3'" . DT E 3 7 ? 3.783 6.023 -1.568 1.00 17.60 ? 31 DT E "C3'" 1 +ATOM 2132 O "O3'" . DT E 3 7 ? 3.959 7.231 -2.311 1.00 14.26 ? 31 DT E "O3'" 1 +ATOM 2133 C "C2'" . DT E 3 7 ? 3.327 4.875 -2.450 1.00 17.54 ? 31 DT E "C2'" 1 +ATOM 2134 C "C1'" . DT E 3 7 ? 4.636 4.268 -2.954 1.00 20.33 ? 31 DT E "C1'" 1 +ATOM 2135 N N1 . DT E 3 7 ? 4.621 2.795 -2.951 1.00 21.02 ? 31 DT E N1 1 +ATOM 2136 C C2 . DT E 3 7 ? 4.870 2.114 -4.127 1.00 21.09 ? 31 DT E C2 1 +ATOM 2137 O O2 . DT E 3 7 ? 5.138 2.672 -5.184 1.00 24.49 ? 31 DT E O2 1 +ATOM 2138 N N3 . DT E 3 7 ? 4.790 0.747 -4.020 1.00 19.92 ? 31 DT E N3 1 +ATOM 2139 C C4 . DT E 3 7 ? 4.496 0.014 -2.889 1.00 20.87 ? 31 DT E C4 1 +ATOM 2140 O O4 . DT E 3 7 ? 4.434 -1.207 -2.958 1.00 22.58 ? 31 DT E O4 1 +ATOM 2141 C C5 . DT E 3 7 ? 4.270 0.794 -1.688 1.00 19.82 ? 31 DT E C5 1 +ATOM 2142 C C7 . DT E 3 7 ? 3.962 0.093 -0.402 1.00 20.38 ? 31 DT E C7 1 +ATOM 2143 C C6 . DT E 3 7 ? 4.347 2.123 -1.781 1.00 19.04 ? 31 DT E C6 1 +ATOM 2144 P P . DA E 3 8 ? 2.678 7.948 -2.956 1.00 15.69 ? 32 DA E P 1 +ATOM 2145 O OP1 . DA E 3 8 ? 3.138 9.155 -3.683 1.00 13.06 ? 32 DA E OP1 1 +ATOM 2146 O OP2 . DA E 3 8 ? 1.633 8.078 -1.909 1.00 15.24 ? 32 DA E OP2 1 +ATOM 2147 O "O5'" . DA E 3 8 ? 2.157 6.886 -4.021 1.00 16.30 ? 32 DA E "O5'" 1 +ATOM 2148 C "C5'" . DA E 3 8 ? 2.876 6.666 -5.225 1.00 18.72 ? 32 DA E "C5'" 1 +ATOM 2149 C "C4'" . DA E 3 8 ? 2.131 5.706 -6.124 1.00 21.27 ? 32 DA E "C4'" 1 +ATOM 2150 O "O4'" . DA E 3 8 ? 2.434 4.316 -5.833 1.00 22.06 ? 32 DA E "O4'" 1 +ATOM 2151 C "C3'" . DA E 3 8 ? 0.605 5.826 -6.141 1.00 21.86 ? 32 DA E "C3'" 1 +ATOM 2152 O "O3'" . DA E 3 8 ? 0.170 5.818 -7.504 1.00 23.77 ? 32 DA E "O3'" 1 +ATOM 2153 C "C2'" . DA E 3 8 ? 0.150 4.543 -5.466 1.00 23.05 ? 32 DA E "C2'" 1 +ATOM 2154 C "C1'" . DA E 3 8 ? 1.232 3.576 -5.920 1.00 24.51 ? 32 DA E "C1'" 1 +ATOM 2155 N N9 . DA E 3 8 ? 1.374 2.349 -5.128 1.00 25.78 ? 32 DA E N9 1 +ATOM 2156 C C8 . DA E 3 8 ? 1.410 2.215 -3.759 1.00 26.12 ? 32 DA E C8 1 +ATOM 2157 N N7 . DA E 3 8 ? 1.475 0.967 -3.348 1.00 25.75 ? 32 DA E N7 1 +ATOM 2158 C C5 . DA E 3 8 ? 1.500 0.230 -4.526 1.00 25.84 ? 32 DA E C5 1 +ATOM 2159 C C6 . DA E 3 8 ? 1.564 -1.156 -4.780 1.00 25.65 ? 32 DA E C6 1 +ATOM 2160 N N6 . DA E 3 8 ? 1.591 -2.085 -3.817 1.00 26.78 ? 32 DA E N6 1 +ATOM 2161 N N1 . DA E 3 8 ? 1.595 -1.560 -6.070 1.00 24.26 ? 32 DA E N1 1 +ATOM 2162 C C2 . DA E 3 8 ? 1.558 -0.636 -7.029 1.00 25.24 ? 32 DA E C2 1 +ATOM 2163 N N3 . DA E 3 8 ? 1.486 0.695 -6.921 1.00 27.38 ? 32 DA E N3 1 +ATOM 2164 C C4 . DA E 3 8 ? 1.459 1.068 -5.629 1.00 26.44 ? 32 DA E C4 1 +ATOM 2165 P P . DC E 3 9 ? -1.254 6.450 -7.905 1.00 23.09 ? 33 DC E P 1 +ATOM 2166 O OP1 . DC E 3 9 ? -0.985 7.611 -8.792 1.00 25.23 ? 33 DC E OP1 1 +ATOM 2167 O OP2 . DC E 3 9 ? -2.085 6.628 -6.686 1.00 23.39 ? 33 DC E OP2 1 +ATOM 2168 O "O5'" . DC E 3 9 ? -1.897 5.310 -8.800 1.00 24.04 ? 33 DC E "O5'" 1 +ATOM 2169 C "C5'" . DC E 3 9 ? -1.137 4.738 -9.849 1.00 23.64 ? 33 DC E "C5'" 1 +ATOM 2170 C "C4'" . DC E 3 9 ? -1.681 3.381 -10.221 1.00 23.02 ? 33 DC E "C4'" 1 +ATOM 2171 O "O4'" . DC E 3 9 ? -1.297 2.366 -9.253 1.00 22.47 ? 33 DC E "O4'" 1 +ATOM 2172 C "C3'" . DC E 3 9 ? -3.203 3.328 -10.350 1.00 22.83 ? 33 DC E "C3'" 1 +ATOM 2173 O "O3'" . DC E 3 9 ? -3.555 2.902 -11.661 1.00 22.40 ? 33 DC E "O3'" 1 +ATOM 2174 C "C2'" . DC E 3 9 ? -3.639 2.339 -9.279 1.00 22.31 ? 33 DC E "C2'" 1 +ATOM 2175 C "C1'" . DC E 3 9 ? -2.396 1.499 -9.014 1.00 22.29 ? 33 DC E "C1'" 1 +ATOM 2176 N N1 . DC E 3 9 ? -2.288 0.976 -7.630 1.00 22.21 ? 33 DC E N1 1 +ATOM 2177 C C2 . DC E 3 9 ? -1.881 -0.353 -7.437 1.00 24.13 ? 33 DC E C2 1 +ATOM 2178 O O2 . DC E 3 9 ? -1.593 -1.050 -8.430 1.00 26.79 ? 33 DC E O2 1 +ATOM 2179 N N3 . DC E 3 9 ? -1.803 -0.849 -6.173 1.00 22.58 ? 33 DC E N3 1 +ATOM 2180 C C4 . DC E 3 9 ? -2.096 -0.066 -5.130 1.00 20.75 ? 33 DC E C4 1 +ATOM 2181 N N4 . DC E 3 9 ? -1.986 -0.592 -3.900 1.00 18.29 ? 33 DC E N4 1 +ATOM 2182 C C5 . DC E 3 9 ? -2.507 1.290 -5.298 1.00 20.49 ? 33 DC E C5 1 +ATOM 2183 C C6 . DC E 3 9 ? -2.588 1.763 -6.551 1.00 21.89 ? 33 DC E C6 1 +ATOM 2184 P P . DA E 3 10 ? -5.075 2.522 -12.004 1.00 22.76 ? 34 DA E P 1 +ATOM 2185 O OP1 . DA E 3 10 ? -5.287 2.916 -13.424 1.00 22.10 ? 34 DA E OP1 1 +ATOM 2186 O OP2 . DA E 3 10 ? -5.982 3.032 -10.953 1.00 20.50 ? 34 DA E OP2 1 +ATOM 2187 O "O5'" . DA E 3 10 ? -5.032 0.937 -11.928 1.00 21.02 ? 34 DA E "O5'" 1 +ATOM 2188 C "C5'" . DA E 3 10 ? -3.933 0.244 -12.517 1.00 19.39 ? 34 DA E "C5'" 1 +ATOM 2189 C "C4'" . DA E 3 10 ? -4.136 -1.246 -12.416 1.00 18.90 ? 34 DA E "C4'" 1 +ATOM 2190 O "O4'" . DA E 3 10 ? -3.829 -1.686 -11.074 1.00 18.35 ? 34 DA E "O4'" 1 +ATOM 2191 C "C3'" . DA E 3 10 ? -5.576 -1.653 -12.688 1.00 18.27 ? 34 DA E "C3'" 1 +ATOM 2192 O "O3'" . DA E 3 10 ? -5.625 -2.845 -13.451 1.00 17.91 ? 34 DA E "O3'" 1 +ATOM 2193 C "C2'" . DA E 3 10 ? -6.151 -1.870 -11.304 1.00 16.61 ? 34 DA E "C2'" 1 +ATOM 2194 C "C1'" . DA E 3 10 ? -4.952 -2.324 -10.499 1.00 15.91 ? 34 DA E "C1'" 1 +ATOM 2195 N N9 . DA E 3 10 ? -5.025 -1.906 -9.103 1.00 13.94 ? 34 DA E N9 1 +ATOM 2196 C C8 . DA E 3 10 ? -5.181 -0.635 -8.627 1.00 11.56 ? 34 DA E C8 1 +ATOM 2197 N N7 . DA E 3 10 ? -5.262 -0.564 -7.323 1.00 11.85 ? 34 DA E N7 1 +ATOM 2198 C C5 . DA E 3 10 ? -5.138 -1.883 -6.911 1.00 10.42 ? 34 DA E C5 1 +ATOM 2199 C C6 . DA E 3 10 ? -5.163 -2.494 -5.639 1.00 9.32 ? 34 DA E C6 1 +ATOM 2200 N N6 . DA E 3 10 ? -5.280 -1.828 -4.486 1.00 3.65 ? 34 DA E N6 1 +ATOM 2201 N N1 . DA E 3 10 ? -5.052 -3.837 -5.595 1.00 8.07 ? 34 DA E N1 1 +ATOM 2202 C C2 . DA E 3 10 ? -4.896 -4.510 -6.741 1.00 8.74 ? 34 DA E C2 1 +ATOM 2203 N N3 . DA E 3 10 ? -4.837 -4.052 -7.984 1.00 6.34 ? 34 DA E N3 1 +ATOM 2204 C C4 . DA E 3 10 ? -4.977 -2.718 -8.001 1.00 10.48 ? 34 DA E C4 1 +ATOM 2205 P P . DT E 3 11 ? -7.052 -3.489 -13.807 1.00 20.17 ? 35 DT E P 1 +ATOM 2206 O OP1 . DT E 3 11 ? -6.998 -4.857 -13.203 1.00 18.48 ? 35 DT E OP1 1 +ATOM 2207 O OP2 . DT E 3 11 ? -7.350 -3.336 -15.253 1.00 20.01 ? 35 DT E OP2 1 +ATOM 2208 O "O5'" . DT E 3 11 ? -8.108 -2.573 -13.038 1.00 20.87 ? 35 DT E "O5'" 1 +ATOM 2209 C "C5'" . DT E 3 11 ? -9.381 -3.095 -12.710 1.00 21.08 ? 35 DT E "C5'" 1 +ATOM 2210 C "C4'" . DT E 3 11 ? -9.202 -4.501 -12.202 1.00 20.72 ? 35 DT E "C4'" 1 +ATOM 2211 O "O4'" . DT E 3 11 ? -8.388 -4.485 -11.004 1.00 21.14 ? 35 DT E "O4'" 1 +ATOM 2212 C "C3'" . DT E 3 11 ? -10.466 -5.267 -11.868 1.00 20.60 ? 35 DT E "C3'" 1 +ATOM 2213 O "O3'" . DT E 3 11 ? -10.266 -6.616 -12.267 1.00 21.48 ? 35 DT E "O3'" 1 +ATOM 2214 C "C2'" . DT E 3 11 ? -10.566 -5.130 -10.364 1.00 22.08 ? 35 DT E "C2'" 1 +ATOM 2215 C "C1'" . DT E 3 11 ? -9.122 -4.987 -9.896 1.00 20.27 ? 35 DT E "C1'" 1 +ATOM 2216 N N1 . DT E 3 11 ? -8.981 -4.014 -8.797 1.00 16.79 ? 35 DT E N1 1 +ATOM 2217 C C2 . DT E 3 11 ? -8.829 -4.484 -7.521 1.00 14.58 ? 35 DT E C2 1 +ATOM 2218 O O2 . DT E 3 11 ? -8.827 -5.679 -7.254 1.00 12.53 ? 35 DT E O2 1 +ATOM 2219 N N3 . DT E 3 11 ? -8.695 -3.497 -6.558 1.00 13.42 ? 35 DT E N3 1 +ATOM 2220 C C4 . DT E 3 11 ? -8.725 -2.126 -6.762 1.00 13.49 ? 35 DT E C4 1 +ATOM 2221 O O4 . DT E 3 11 ? -8.624 -1.350 -5.812 1.00 12.38 ? 35 DT E O4 1 +ATOM 2222 C C5 . DT E 3 11 ? -8.892 -1.716 -8.126 1.00 13.14 ? 35 DT E C5 1 +ATOM 2223 C C7 . DT E 3 11 ? -8.931 -0.254 -8.436 1.00 13.26 ? 35 DT E C7 1 +ATOM 2224 C C6 . DT E 3 11 ? -9.007 -2.663 -9.062 1.00 15.38 ? 35 DT E C6 1 +ATOM 2225 P P . DA E 3 12 ? -11.525 -7.524 -12.659 1.00 22.74 ? 36 DA E P 1 +ATOM 2226 O OP1 . DA E 3 12 ? -11.055 -8.528 -13.663 1.00 21.13 ? 36 DA E OP1 1 +ATOM 2227 O OP2 . DA E 3 12 ? -12.681 -6.635 -12.993 1.00 20.40 ? 36 DA E OP2 1 +ATOM 2228 O "O5'" . DA E 3 12 ? -11.828 -8.289 -11.292 1.00 21.14 ? 36 DA E "O5'" 1 +ATOM 2229 C "C5'" . DA E 3 12 ? -10.918 -9.272 -10.798 1.00 17.15 ? 36 DA E "C5'" 1 +ATOM 2230 C "C4'" . DA E 3 12 ? -11.360 -9.747 -9.437 1.00 15.40 ? 36 DA E "C4'" 1 +ATOM 2231 O "O4'" . DA E 3 12 ? -11.144 -8.688 -8.474 1.00 15.15 ? 36 DA E "O4'" 1 +ATOM 2232 C "C3'" . DA E 3 12 ? -12.849 -10.085 -9.370 1.00 16.67 ? 36 DA E "C3'" 1 +ATOM 2233 O "O3'" . DA E 3 12 ? -13.110 -11.304 -8.656 1.00 15.63 ? 36 DA E "O3'" 1 +ATOM 2234 C "C2'" . DA E 3 12 ? -13.460 -8.824 -8.775 1.00 16.25 ? 36 DA E "C2'" 1 +ATOM 2235 C "C1'" . DA E 3 12 ? -12.367 -8.347 -7.833 1.00 13.70 ? 36 DA E "C1'" 1 +ATOM 2236 N N9 . DA E 3 12 ? -12.355 -6.905 -7.599 1.00 9.37 ? 36 DA E N9 1 +ATOM 2237 C C8 . DA E 3 12 ? -12.518 -5.927 -8.538 1.00 6.44 ? 36 DA E C8 1 +ATOM 2238 N N7 . DA E 3 12 ? -12.385 -4.707 -8.071 1.00 7.67 ? 36 DA E N7 1 +ATOM 2239 C C5 . DA E 3 12 ? -12.142 -4.894 -6.718 1.00 9.41 ? 36 DA E C5 1 +ATOM 2240 C C6 . DA E 3 12 ? -11.919 -3.988 -5.647 1.00 7.25 ? 36 DA E C6 1 +ATOM 2241 N N6 . DA E 3 12 ? -11.885 -2.662 -5.785 1.00 3.98 ? 36 DA E N6 1 +ATOM 2242 N N1 . DA E 3 12 ? -11.731 -4.507 -4.415 1.00 5.63 ? 36 DA E N1 1 +ATOM 2243 C C2 . DA E 3 12 ? -11.762 -5.837 -4.268 1.00 9.59 ? 36 DA E C2 1 +ATOM 2244 N N3 . DA E 3 12 ? -11.957 -6.791 -5.190 1.00 12.25 ? 36 DA E N3 1 +ATOM 2245 C C4 . DA E 3 12 ? -12.141 -6.247 -6.408 1.00 10.55 ? 36 DA E C4 1 +ATOM 2246 P P . DG E 3 13 ? -14.596 -11.742 -8.368 1.00 16.44 ? 37 DG E P 1 +ATOM 2247 O OP1 . DG E 3 13 ? -14.630 -13.182 -8.120 1.00 20.14 ? 37 DG E OP1 1 +ATOM 2248 O OP2 . DG E 3 13 ? -15.485 -11.225 -9.436 1.00 14.40 ? 37 DG E OP2 1 +ATOM 2249 O "O5'" . DG E 3 13 ? -14.829 -11.048 -7.047 1.00 8.91 ? 37 DG E "O5'" 1 +ATOM 2250 C "C5'" . DG E 3 13 ? -14.190 -11.451 -5.835 1.00 7.96 ? 37 DG E "C5'" 1 +ATOM 2251 C "C4'" . DG E 3 13 ? -14.936 -10.936 -4.625 1.00 6.43 ? 37 DG E "C4'" 1 +ATOM 2252 O "O4'" . DG E 3 13 ? -14.667 -9.524 -4.485 1.00 6.58 ? 37 DG E "O4'" 1 +ATOM 2253 C "C3'" . DG E 3 13 ? -16.462 -11.080 -4.676 1.00 5.43 ? 37 DG E "C3'" 1 +ATOM 2254 O "O3'" . DG E 3 13 ? -17.059 -11.515 -3.415 1.00 4.29 ? 37 DG E "O3'" 1 +ATOM 2255 C "C2'" . DG E 3 13 ? -16.920 -9.692 -5.086 1.00 4.14 ? 37 DG E "C2'" 1 +ATOM 2256 C "C1'" . DG E 3 13 ? -15.886 -8.806 -4.415 1.00 4.44 ? 37 DG E "C1'" 1 +ATOM 2257 N N9 . DG E 3 13 ? -15.682 -7.512 -5.060 1.00 2.64 ? 37 DG E N9 1 +ATOM 2258 C C8 . DG E 3 13 ? -15.883 -7.214 -6.386 1.00 0.29 ? 37 DG E C8 1 +ATOM 2259 N N7 . DG E 3 13 ? -15.679 -5.959 -6.664 1.00 1.20 ? 37 DG E N7 1 +ATOM 2260 C C5 . DG E 3 13 ? -15.300 -5.392 -5.454 1.00 2.09 ? 37 DG E C5 1 +ATOM 2261 C C6 . DG E 3 13 ? -14.947 -4.050 -5.136 1.00 2.58 ? 37 DG E C6 1 +ATOM 2262 O O6 . DG E 3 13 ? -14.900 -3.069 -5.892 1.00 4.27 ? 37 DG E O6 1 +ATOM 2263 N N1 . DG E 3 13 ? -14.622 -3.908 -3.783 1.00 1.77 ? 37 DG E N1 1 +ATOM 2264 C C2 . DG E 3 13 ? -14.634 -4.930 -2.854 1.00 1.07 ? 37 DG E C2 1 +ATOM 2265 N N2 . DG E 3 13 ? -14.302 -4.594 -1.584 1.00 2.45 ? 37 DG E N2 1 +ATOM 2266 N N3 . DG E 3 13 ? -14.955 -6.187 -3.145 1.00 0.00 ? 37 DG E N3 1 +ATOM 2267 C C4 . DG E 3 13 ? -15.279 -6.341 -4.454 1.00 2.07 ? 37 DG E C4 1 +ATOM 2268 O "O5'" . DG F 3 1 ? 19.312 -5.127 40.878 1.00 9.33 ? 1025 DG F "O5'" 1 +ATOM 2269 C "C5'" . DG F 3 1 ? 17.894 -5.344 40.826 1.00 9.72 ? 1025 DG F "C5'" 1 +ATOM 2270 C "C4'" . DG F 3 1 ? 17.335 -5.852 39.514 1.00 9.62 ? 1025 DG F "C4'" 1 +ATOM 2271 O "O4'" . DG F 3 1 ? 17.414 -4.807 38.508 1.00 9.60 ? 1025 DG F "O4'" 1 +ATOM 2272 C "C3'" . DG F 3 1 ? 18.076 -7.067 38.951 1.00 10.05 ? 1025 DG F "C3'" 1 +ATOM 2273 O "O3'" . DG F 3 1 ? 17.254 -8.239 38.808 1.00 11.10 ? 1025 DG F "O3'" 1 +ATOM 2274 C "C2'" . DG F 3 1 ? 18.762 -6.587 37.688 1.00 8.81 ? 1025 DG F "C2'" 1 +ATOM 2275 C "C1'" . DG F 3 1 ? 18.169 -5.224 37.370 1.00 10.51 ? 1025 DG F "C1'" 1 +ATOM 2276 N N9 . DG F 3 1 ? 19.283 -4.294 37.184 1.00 10.31 ? 1025 DG F N9 1 +ATOM 2277 C C8 . DG F 3 1 ? 20.091 -3.768 38.170 1.00 10.26 ? 1025 DG F C8 1 +ATOM 2278 N N7 . DG F 3 1 ? 21.102 -3.086 37.697 1.00 10.49 ? 1025 DG F N7 1 +ATOM 2279 C C5 . DG F 3 1 ? 20.934 -3.126 36.318 1.00 10.38 ? 1025 DG F C5 1 +ATOM 2280 C C6 . DG F 3 1 ? 21.731 -2.564 35.274 1.00 9.47 ? 1025 DG F C6 1 +ATOM 2281 O O6 . DG F 3 1 ? 22.778 -1.893 35.371 1.00 7.36 ? 1025 DG F O6 1 +ATOM 2282 N N1 . DG F 3 1 ? 21.205 -2.855 34.016 1.00 6.56 ? 1025 DG F N1 1 +ATOM 2283 C C2 . DG F 3 1 ? 20.066 -3.587 33.783 1.00 7.06 ? 1025 DG F C2 1 +ATOM 2284 N N2 . DG F 3 1 ? 19.748 -3.766 32.490 1.00 5.94 ? 1025 DG F N2 1 +ATOM 2285 N N3 . DG F 3 1 ? 19.302 -4.109 34.747 1.00 7.78 ? 1025 DG F N3 1 +ATOM 2286 C C4 . DG F 3 1 ? 19.797 -3.844 35.980 1.00 9.32 ? 1025 DG F C4 1 +ATOM 2287 P P . DT F 3 2 ? 16.198 -8.362 37.613 1.00 12.40 ? 1026 DT F P 1 +ATOM 2288 O OP1 . DT F 3 2 ? 15.242 -7.241 37.784 1.00 9.98 ? 1026 DT F OP1 1 +ATOM 2289 O OP2 . DT F 3 2 ? 15.709 -9.771 37.638 1.00 12.43 ? 1026 DT F OP2 1 +ATOM 2290 O "O5'" . DT F 3 2 ? 16.993 -8.129 36.246 1.00 12.59 ? 1026 DT F "O5'" 1 +ATOM 2291 C "C5'" . DT F 3 2 ? 16.331 -7.484 35.158 1.00 12.72 ? 1026 DT F "C5'" 1 +ATOM 2292 C "C4'" . DT F 3 2 ? 17.018 -7.757 33.839 1.00 10.14 ? 1026 DT F "C4'" 1 +ATOM 2293 O "O4'" . DT F 3 2 ? 18.168 -6.904 33.602 1.00 10.95 ? 1026 DT F "O4'" 1 +ATOM 2294 C "C3'" . DT F 3 2 ? 17.475 -9.191 33.582 1.00 10.44 ? 1026 DT F "C3'" 1 +ATOM 2295 O "O3'" . DT F 3 2 ? 17.045 -9.558 32.269 1.00 6.85 ? 1026 DT F "O3'" 1 +ATOM 2296 C "C2'" . DT F 3 2 ? 18.993 -9.092 33.646 1.00 9.64 ? 1026 DT F "C2'" 1 +ATOM 2297 C "C1'" . DT F 3 2 ? 19.240 -7.695 33.100 1.00 9.06 ? 1026 DT F "C1'" 1 +ATOM 2298 N N1 . DT F 3 2 ? 20.509 -7.067 33.525 1.00 6.45 ? 1026 DT F N1 1 +ATOM 2299 C C2 . DT F 3 2 ? 21.312 -6.498 32.557 1.00 6.89 ? 1026 DT F C2 1 +ATOM 2300 O O2 . DT F 3 2 ? 21.037 -6.509 31.363 1.00 2.66 ? 1026 DT F O2 1 +ATOM 2301 N N3 . DT F 3 2 ? 22.462 -5.914 33.040 1.00 5.94 ? 1026 DT F N3 1 +ATOM 2302 C C4 . DT F 3 2 ? 22.887 -5.852 34.361 1.00 5.32 ? 1026 DT F C4 1 +ATOM 2303 O O4 . DT F 3 2 ? 23.960 -5.282 34.641 1.00 2.05 ? 1026 DT F O4 1 +ATOM 2304 C C5 . DT F 3 2 ? 21.990 -6.490 35.322 1.00 4.06 ? 1026 DT F C5 1 +ATOM 2305 C C7 . DT F 3 2 ? 22.350 -6.502 36.776 1.00 6.62 ? 1026 DT F C7 1 +ATOM 2306 C C6 . DT F 3 2 ? 20.867 -7.049 34.856 1.00 5.58 ? 1026 DT F C6 1 +ATOM 2307 P P . DT F 3 3 ? 17.037 -11.099 31.825 1.00 5.96 ? 1027 DT F P 1 +ATOM 2308 O OP1 . DT F 3 3 ? 15.675 -11.393 31.319 1.00 3.30 ? 1027 DT F OP1 1 +ATOM 2309 O OP2 . DT F 3 3 ? 17.630 -11.962 32.887 1.00 4.03 ? 1027 DT F OP2 1 +ATOM 2310 O "O5'" . DT F 3 3 ? 18.040 -11.115 30.585 1.00 7.95 ? 1027 DT F "O5'" 1 +ATOM 2311 C "C5'" . DT F 3 3 ? 17.749 -10.354 29.423 1.00 8.24 ? 1027 DT F "C5'" 1 +ATOM 2312 C "C4'" . DT F 3 3 ? 19.001 -10.088 28.620 1.00 5.55 ? 1027 DT F "C4'" 1 +ATOM 2313 O "O4'" . DT F 3 3 ? 19.985 -9.395 29.427 1.00 5.74 ? 1027 DT F "O4'" 1 +ATOM 2314 C "C3'" . DT F 3 3 ? 19.721 -11.297 28.016 1.00 7.97 ? 1027 DT F "C3'" 1 +ATOM 2315 O "O3'" . DT F 3 3 ? 20.074 -10.972 26.663 1.00 11.50 ? 1027 DT F "O3'" 1 +ATOM 2316 C "C2'" . DT F 3 3 ? 20.986 -11.398 28.857 1.00 7.31 ? 1027 DT F "C2'" 1 +ATOM 2317 C "C1'" . DT F 3 3 ? 21.256 -9.935 29.121 1.00 5.57 ? 1027 DT F "C1'" 1 +ATOM 2318 N N1 . DT F 3 3 ? 22.199 -9.600 30.211 1.00 2.74 ? 1027 DT F N1 1 +ATOM 2319 C C2 . DT F 3 3 ? 23.316 -8.843 29.888 1.00 2.57 ? 1027 DT F C2 1 +ATOM 2320 O O2 . DT F 3 3 ? 23.535 -8.413 28.771 1.00 1.88 ? 1027 DT F O2 1 +ATOM 2321 N N3 . DT F 3 3 ? 24.163 -8.596 30.931 1.00 0.00 ? 1027 DT F N3 1 +ATOM 2322 C C4 . DT F 3 3 ? 24.007 -8.990 32.241 1.00 0.92 ? 1027 DT F C4 1 +ATOM 2323 O O4 . DT F 3 3 ? 24.859 -8.684 33.075 1.00 2.28 ? 1027 DT F O4 1 +ATOM 2324 C C5 . DT F 3 3 ? 22.807 -9.760 32.518 1.00 0.11 ? 1027 DT F C5 1 +ATOM 2325 C C7 . DT F 3 3 ? 22.546 -10.220 33.922 1.00 0.00 ? 1027 DT F C7 1 +ATOM 2326 C C6 . DT F 3 3 ? 21.979 -10.027 31.498 1.00 1.85 ? 1027 DT F C6 1 +ATOM 2327 P P . DG F 3 4 ? 20.189 -12.130 25.552 1.00 13.74 ? 1028 DG F P 1 +ATOM 2328 O OP1 . DG F 3 4 ? 19.342 -11.669 24.422 1.00 15.35 ? 1028 DG F OP1 1 +ATOM 2329 O OP2 . DG F 3 4 ? 19.905 -13.436 26.183 1.00 11.14 ? 1028 DG F OP2 1 +ATOM 2330 O "O5'" . DG F 3 4 ? 21.727 -12.096 25.112 1.00 17.16 ? 1028 DG F "O5'" 1 +ATOM 2331 C "C5'" . DG F 3 4 ? 22.730 -11.770 26.074 1.00 20.42 ? 1028 DG F "C5'" 1 +ATOM 2332 C "C4'" . DG F 3 4 ? 23.909 -11.069 25.436 1.00 21.56 ? 1028 DG F "C4'" 1 +ATOM 2333 O "O4'" . DG F 3 4 ? 24.567 -10.327 26.489 1.00 20.88 ? 1028 DG F "O4'" 1 +ATOM 2334 C "C3'" . DG F 3 4 ? 24.979 -11.996 24.861 1.00 22.50 ? 1028 DG F "C3'" 1 +ATOM 2335 O "O3'" . DG F 3 4 ? 25.726 -11.330 23.824 1.00 25.60 ? 1028 DG F "O3'" 1 +ATOM 2336 C "C2'" . DG F 3 4 ? 25.861 -12.251 26.067 1.00 21.05 ? 1028 DG F "C2'" 1 +ATOM 2337 C "C1'" . DG F 3 4 ? 25.808 -10.931 26.823 1.00 18.93 ? 1028 DG F "C1'" 1 +ATOM 2338 N N9 . DG F 3 4 ? 25.831 -11.126 28.272 1.00 16.92 ? 1028 DG F N9 1 +ATOM 2339 C C8 . DG F 3 4 ? 25.007 -11.952 28.993 1.00 14.72 ? 1028 DG F C8 1 +ATOM 2340 N N7 . DG F 3 4 ? 25.279 -11.961 30.270 1.00 15.43 ? 1028 DG F N7 1 +ATOM 2341 C C5 . DG F 3 4 ? 26.338 -11.082 30.404 1.00 14.83 ? 1028 DG F C5 1 +ATOM 2342 C C6 . DG F 3 4 ? 27.072 -10.707 31.558 1.00 15.40 ? 1028 DG F C6 1 +ATOM 2343 O O6 . DG F 3 4 ? 26.929 -11.100 32.725 1.00 12.95 ? 1028 DG F O6 1 +ATOM 2344 N N1 . DG F 3 4 ? 28.074 -9.790 31.251 1.00 16.26 ? 1028 DG F N1 1 +ATOM 2345 C C2 . DG F 3 4 ? 28.345 -9.306 29.993 1.00 14.24 ? 1028 DG F C2 1 +ATOM 2346 N N2 . DG F 3 4 ? 29.352 -8.424 29.914 1.00 12.97 ? 1028 DG F N2 1 +ATOM 2347 N N3 . DG F 3 4 ? 27.676 -9.659 28.900 1.00 12.87 ? 1028 DG F N3 1 +ATOM 2348 C C4 . DG F 3 4 ? 26.692 -10.543 29.179 1.00 15.55 ? 1028 DG F C4 1 +ATOM 2349 P P . DT F 3 5 ? 26.423 -12.192 22.638 1.00 26.73 ? 1029 DT F P 1 +ATOM 2350 O OP1 . DT F 3 5 ? 26.448 -11.299 21.444 1.00 24.68 ? 1029 DT F OP1 1 +ATOM 2351 O OP2 . DT F 3 5 ? 25.794 -13.540 22.535 1.00 27.90 ? 1029 DT F OP2 1 +ATOM 2352 O "O5'" . DT F 3 5 ? 27.927 -12.410 23.123 1.00 27.02 ? 1029 DT F "O5'" 1 +ATOM 2353 C "C5'" . DT F 3 5 ? 28.238 -12.538 24.503 1.00 24.46 ? 1029 DT F "C5'" 1 +ATOM 2354 C "C4'" . DT F 3 5 ? 29.427 -11.677 24.855 1.00 25.47 ? 1029 DT F "C4'" 1 +ATOM 2355 O "O4'" . DT F 3 5 ? 29.354 -11.296 26.249 1.00 25.36 ? 1029 DT F "O4'" 1 +ATOM 2356 C "C3'" . DT F 3 5 ? 30.797 -12.330 24.655 1.00 24.94 ? 1029 DT F "C3'" 1 +ATOM 2357 O "O3'" . DT F 3 5 ? 31.729 -11.347 24.153 1.00 23.20 ? 1029 DT F "O3'" 1 +ATOM 2358 C "C2'" . DT F 3 5 ? 31.149 -12.799 26.060 1.00 25.51 ? 1029 DT F "C2'" 1 +ATOM 2359 C "C1'" . DT F 3 5 ? 30.516 -11.727 26.938 1.00 24.89 ? 1029 DT F "C1'" 1 +ATOM 2360 N N1 . DT F 3 5 ? 30.091 -12.157 28.279 1.00 26.28 ? 1029 DT F N1 1 +ATOM 2361 C C2 . DT F 3 5 ? 30.790 -11.694 29.369 1.00 26.75 ? 1029 DT F C2 1 +ATOM 2362 O O2 . DT F 3 5 ? 31.776 -10.983 29.270 1.00 27.26 ? 1029 DT F O2 1 +ATOM 2363 N N3 . DT F 3 5 ? 30.291 -12.099 30.584 1.00 25.20 ? 1029 DT F N3 1 +ATOM 2364 C C4 . DT F 3 5 ? 29.192 -12.906 30.803 1.00 25.94 ? 1029 DT F C4 1 +ATOM 2365 O O4 . DT F 3 5 ? 28.844 -13.170 31.947 1.00 28.75 ? 1029 DT F O4 1 +ATOM 2366 C C5 . DT F 3 5 ? 28.525 -13.374 29.617 1.00 26.70 ? 1029 DT F C5 1 +ATOM 2367 C C7 . DT F 3 5 ? 27.338 -14.265 29.763 1.00 26.28 ? 1029 DT F C7 1 +ATOM 2368 C C6 . DT F 3 5 ? 28.999 -12.984 28.430 1.00 27.16 ? 1029 DT F C6 1 +ATOM 2369 P P . DT F 3 6 ? 33.103 -11.811 23.443 1.00 20.13 ? 1030 DT F P 1 +ATOM 2370 O OP1 . DT F 3 6 ? 33.254 -11.052 22.178 1.00 20.95 ? 1030 DT F OP1 1 +ATOM 2371 O OP2 . DT F 3 6 ? 33.158 -13.299 23.410 1.00 20.64 ? 1030 DT F OP2 1 +ATOM 2372 O "O5'" . DT F 3 6 ? 34.207 -11.281 24.458 1.00 22.37 ? 1030 DT F "O5'" 1 +ATOM 2373 C "C5'" . DT F 3 6 ? 33.903 -11.232 25.846 1.00 21.40 ? 1030 DT F "C5'" 1 +ATOM 2374 C "C4'" . DT F 3 6 ? 35.157 -11.297 26.681 1.00 19.02 ? 1030 DT F "C4'" 1 +ATOM 2375 O "O4'" . DT F 3 6 ? 34.734 -11.574 28.039 1.00 16.71 ? 1030 DT F "O4'" 1 +ATOM 2376 C "C3'" . DT F 3 6 ? 36.127 -12.418 26.318 1.00 18.67 ? 1030 DT F "C3'" 1 +ATOM 2377 O "O3'" . DT F 3 6 ? 37.452 -11.971 26.646 1.00 21.94 ? 1030 DT F "O3'" 1 +ATOM 2378 C "C2'" . DT F 3 6 ? 35.662 -13.564 27.197 1.00 17.20 ? 1030 DT F "C2'" 1 +ATOM 2379 C "C1'" . DT F 3 6 ? 35.183 -12.853 28.453 1.00 15.46 ? 1030 DT F "C1'" 1 +ATOM 2380 N N1 . DT F 3 6 ? 34.056 -13.523 29.126 1.00 13.78 ? 1030 DT F N1 1 +ATOM 2381 C C2 . DT F 3 6 ? 33.977 -13.470 30.497 1.00 11.05 ? 1030 DT F C2 1 +ATOM 2382 O O2 . DT F 3 6 ? 34.809 -12.914 31.183 1.00 13.65 ? 1030 DT F O2 1 +ATOM 2383 N N3 . DT F 3 6 ? 32.881 -14.103 31.036 1.00 10.41 ? 1030 DT F N3 1 +ATOM 2384 C C4 . DT F 3 6 ? 31.878 -14.775 30.347 1.00 11.21 ? 1030 DT F C4 1 +ATOM 2385 O O4 . DT F 3 6 ? 30.939 -15.290 30.963 1.00 10.33 ? 1030 DT F O4 1 +ATOM 2386 C C5 . DT F 3 6 ? 32.040 -14.802 28.905 1.00 11.27 ? 1030 DT F C5 1 +ATOM 2387 C C7 . DT F 3 6 ? 31.028 -15.511 28.061 1.00 10.52 ? 1030 DT F C7 1 +ATOM 2388 C C6 . DT F 3 6 ? 33.105 -14.181 28.381 1.00 13.11 ? 1030 DT F C6 1 +ATOM 2389 P P . DT F 3 7 ? 38.727 -12.893 26.326 1.00 21.24 ? 1031 DT F P 1 +ATOM 2390 O OP1 . DT F 3 7 ? 39.818 -12.007 25.868 1.00 22.24 ? 1031 DT F OP1 1 +ATOM 2391 O OP2 . DT F 3 7 ? 38.292 -14.040 25.481 1.00 24.16 ? 1031 DT F OP2 1 +ATOM 2392 O "O5'" . DT F 3 7 ? 39.155 -13.451 27.748 1.00 23.74 ? 1031 DT F "O5'" 1 +ATOM 2393 C "C5'" . DT F 3 7 ? 38.172 -13.763 28.723 1.00 23.99 ? 1031 DT F "C5'" 1 +ATOM 2394 C "C4'" . DT F 3 7 ? 38.730 -13.540 30.105 1.00 26.93 ? 1031 DT F "C4'" 1 +ATOM 2395 O "O4'" . DT F 3 7 ? 37.684 -13.784 31.069 1.00 26.62 ? 1031 DT F "O4'" 1 +ATOM 2396 C "C3'" . DT F 3 7 ? 39.866 -14.492 30.455 1.00 26.23 ? 1031 DT F "C3'" 1 +ATOM 2397 O "O3'" . DT F 3 7 ? 40.850 -13.813 31.240 1.00 30.05 ? 1031 DT F "O3'" 1 +ATOM 2398 C "C2'" . DT F 3 7 ? 39.174 -15.622 31.198 1.00 26.02 ? 1031 DT F "C2'" 1 +ATOM 2399 C "C1'" . DT F 3 7 ? 37.902 -14.999 31.773 1.00 26.72 ? 1031 DT F "C1'" 1 +ATOM 2400 N N1 . DT F 3 7 ? 36.697 -15.829 31.556 1.00 25.91 ? 1031 DT F N1 1 +ATOM 2401 C C2 . DT F 3 7 ? 35.998 -16.357 32.631 1.00 26.96 ? 1031 DT F C2 1 +ATOM 2402 O O2 . DT F 3 7 ? 36.324 -16.205 33.795 1.00 25.91 ? 1031 DT F O2 1 +ATOM 2403 N N3 . DT F 3 7 ? 34.886 -17.076 32.284 1.00 27.01 ? 1031 DT F N3 1 +ATOM 2404 C C4 . DT F 3 7 ? 34.411 -17.315 31.008 1.00 27.20 ? 1031 DT F C4 1 +ATOM 2405 O O4 . DT F 3 7 ? 33.389 -17.971 30.849 1.00 31.56 ? 1031 DT F O4 1 +ATOM 2406 C C5 . DT F 3 7 ? 35.194 -16.746 29.941 1.00 25.68 ? 1031 DT F C5 1 +ATOM 2407 C C7 . DT F 3 7 ? 34.758 -16.963 28.526 1.00 25.42 ? 1031 DT F C7 1 +ATOM 2408 C C6 . DT F 3 7 ? 36.282 -16.046 30.265 1.00 25.19 ? 1031 DT F C6 1 +ATOM 2409 P P . DA F 3 8 ? 42.147 -14.608 31.765 1.00 31.54 ? 1032 DA F P 1 +ATOM 2410 O OP1 . DA F 3 8 ? 43.329 -13.693 31.810 1.00 29.64 ? 1032 DA F OP1 1 +ATOM 2411 O OP2 . DA F 3 8 ? 42.224 -15.879 30.973 1.00 32.23 ? 1032 DA F OP2 1 +ATOM 2412 O "O5'" . DA F 3 8 ? 41.758 -14.948 33.268 1.00 28.23 ? 1032 DA F "O5'" 1 +ATOM 2413 C "C5'" . DA F 3 8 ? 42.278 -16.095 33.912 1.00 25.46 ? 1032 DA F "C5'" 1 +ATOM 2414 C "C4'" . DA F 3 8 ? 41.767 -16.152 35.328 1.00 22.75 ? 1032 DA F "C4'" 1 +ATOM 2415 O "O4'" . DA F 3 8 ? 40.320 -16.262 35.298 1.00 21.90 ? 1032 DA F "O4'" 1 +ATOM 2416 C "C3'" . DA F 3 8 ? 42.276 -17.344 36.135 1.00 21.22 ? 1032 DA F "C3'" 1 +ATOM 2417 O "O3'" . DA F 3 8 ? 42.632 -16.908 37.461 1.00 20.75 ? 1032 DA F "O3'" 1 +ATOM 2418 C "C2'" . DA F 3 8 ? 41.105 -18.311 36.101 1.00 19.18 ? 1032 DA F "C2'" 1 +ATOM 2419 C "C1'" . DA F 3 8 ? 39.907 -17.381 36.059 1.00 20.54 ? 1032 DA F "C1'" 1 +ATOM 2420 N N9 . DA F 3 8 ? 38.725 -17.969 35.424 1.00 20.41 ? 1032 DA F N9 1 +ATOM 2421 C C8 . DA F 3 8 ? 38.506 -18.233 34.093 1.00 20.19 ? 1032 DA F C8 1 +ATOM 2422 N N7 . DA F 3 8 ? 37.362 -18.832 33.854 1.00 19.60 ? 1032 DA F N7 1 +ATOM 2423 C C5 . DA F 3 8 ? 36.786 -18.964 35.111 1.00 19.97 ? 1032 DA F C5 1 +ATOM 2424 C C6 . DA F 3 8 ? 35.585 -19.551 35.547 1.00 18.63 ? 1032 DA F C6 1 +ATOM 2425 N N6 . DA F 3 8 ? 34.722 -20.152 34.737 1.00 19.78 ? 1032 DA F N6 1 +ATOM 2426 N N1 . DA F 3 8 ? 35.306 -19.507 36.867 1.00 17.78 ? 1032 DA F N1 1 +ATOM 2427 C C2 . DA F 3 8 ? 36.186 -18.919 37.692 1.00 19.06 ? 1032 DA F C2 1 +ATOM 2428 N N3 . DA F 3 8 ? 37.354 -18.349 37.407 1.00 19.74 ? 1032 DA F N3 1 +ATOM 2429 C C4 . DA F 3 8 ? 37.602 -18.411 36.084 1.00 20.38 ? 1032 DA F C4 1 +ATOM 2430 P P . DC F 3 9 ? 42.633 -17.955 38.683 1.00 21.98 ? 1033 DC F P 1 +ATOM 2431 O OP1 . DC F 3 9 ? 42.741 -17.171 39.940 1.00 19.82 ? 1033 DC F OP1 1 +ATOM 2432 O OP2 . DC F 3 9 ? 43.642 -18.999 38.379 1.00 20.20 ? 1033 DC F OP2 1 +ATOM 2433 O "O5'" . DC F 3 9 ? 41.168 -18.580 38.606 1.00 17.61 ? 1033 DC F "O5'" 1 +ATOM 2434 C "C5'" . DC F 3 9 ? 40.717 -19.542 39.544 1.00 15.43 ? 1033 DC F "C5'" 1 +ATOM 2435 C "C4'" . DC F 3 9 ? 40.802 -20.926 38.946 1.00 16.92 ? 1033 DC F "C4'" 1 +ATOM 2436 O "O4'" . DC F 3 9 ? 39.684 -21.211 38.066 1.00 15.83 ? 1033 DC F "O4'" 1 +ATOM 2437 C "C3'" . DC F 3 9 ? 42.076 -21.189 38.127 1.00 17.44 ? 1033 DC F "C3'" 1 +ATOM 2438 O "O3'" . DC F 3 9 ? 42.664 -22.445 38.474 1.00 15.98 ? 1033 DC F "O3'" 1 +ATOM 2439 C "C2'" . DC F 3 9 ? 41.546 -21.314 36.708 1.00 17.43 ? 1033 DC F "C2'" 1 +ATOM 2440 C "C1'" . DC F 3 9 ? 40.209 -21.962 36.992 1.00 14.71 ? 1033 DC F "C1'" 1 +ATOM 2441 N N1 . DC F 3 9 ? 39.231 -22.013 35.897 1.00 13.86 ? 1033 DC F N1 1 +ATOM 2442 C C2 . DC F 3 9 ? 37.866 -22.168 36.201 1.00 15.31 ? 1033 DC F C2 1 +ATOM 2443 O O2 . DC F 3 9 ? 37.508 -22.219 37.394 1.00 17.01 ? 1033 DC F O2 1 +ATOM 2444 N N3 . DC F 3 9 ? 36.972 -22.262 35.186 1.00 12.20 ? 1033 DC F N3 1 +ATOM 2445 C C4 . DC F 3 9 ? 37.390 -22.204 33.921 1.00 11.12 ? 1033 DC F C4 1 +ATOM 2446 N N4 . DC F 3 9 ? 36.477 -22.318 32.956 1.00 11.64 ? 1033 DC F N4 1 +ATOM 2447 C C5 . DC F 3 9 ? 38.766 -22.031 33.589 1.00 12.61 ? 1033 DC F C5 1 +ATOM 2448 C C6 . DC F 3 9 ? 39.640 -21.938 34.597 1.00 14.34 ? 1033 DC F C6 1 +ATOM 2449 P P . DA F 3 10 ? 42.569 -22.965 39.978 1.00 17.60 ? 1034 DA F P 1 +ATOM 2450 O OP1 . DA F 3 10 ? 42.905 -21.819 40.870 1.00 19.17 ? 1034 DA F OP1 1 +ATOM 2451 O OP2 . DA F 3 10 ? 43.347 -24.229 40.078 1.00 18.93 ? 1034 DA F OP2 1 +ATOM 2452 O "O5'" . DA F 3 10 ? 41.021 -23.319 40.113 1.00 18.85 ? 1034 DA F "O5'" 1 +ATOM 2453 C "C5'" . DA F 3 10 ? 40.297 -23.121 41.320 1.00 17.39 ? 1034 DA F "C5'" 1 +ATOM 2454 C "C4'" . DA F 3 10 ? 39.362 -24.287 41.519 1.00 17.39 ? 1034 DA F "C4'" 1 +ATOM 2455 O "O4'" . DA F 3 10 ? 38.632 -24.462 40.282 1.00 16.55 ? 1034 DA F "O4'" 1 +ATOM 2456 C "C3'" . DA F 3 10 ? 40.117 -25.595 41.733 1.00 17.84 ? 1034 DA F "C3'" 1 +ATOM 2457 O "O3'" . DA F 3 10 ? 39.353 -26.501 42.520 1.00 20.05 ? 1034 DA F "O3'" 1 +ATOM 2458 C "C2'" . DA F 3 10 ? 40.267 -26.142 40.333 1.00 17.11 ? 1034 DA F "C2'" 1 +ATOM 2459 C "C1'" . DA F 3 10 ? 38.976 -25.699 39.678 1.00 17.20 ? 1034 DA F "C1'" 1 +ATOM 2460 N N9 . DA F 3 10 ? 39.131 -25.476 38.242 1.00 17.84 ? 1034 DA F N9 1 +ATOM 2461 C C8 . DA F 3 10 ? 40.185 -24.874 37.609 1.00 20.03 ? 1034 DA F C8 1 +ATOM 2462 N N7 . DA F 3 10 ? 40.077 -24.854 36.299 1.00 20.72 ? 1034 DA F N7 1 +ATOM 2463 C C5 . DA F 3 10 ? 38.864 -25.489 36.054 1.00 19.77 ? 1034 DA F C5 1 +ATOM 2464 C C6 . DA F 3 10 ? 38.175 -25.822 34.858 1.00 18.68 ? 1034 DA F C6 1 +ATOM 2465 N N6 . DA F 3 10 ? 38.639 -25.581 33.630 1.00 19.44 ? 1034 DA F N6 1 +ATOM 2466 N N1 . DA F 3 10 ? 36.983 -26.434 34.975 1.00 17.57 ? 1034 DA F N1 1 +ATOM 2467 C C2 . DA F 3 10 ? 36.524 -26.717 36.199 1.00 19.83 ? 1034 DA F C2 1 +ATOM 2468 N N3 . DA F 3 10 ? 37.080 -26.483 37.387 1.00 19.09 ? 1034 DA F N3 1 +ATOM 2469 C C4 . DA F 3 10 ? 38.260 -25.859 37.246 1.00 18.49 ? 1034 DA F C4 1 +ATOM 2470 P P . DT F 3 11 ? 40.064 -27.799 43.137 1.00 19.51 ? 1035 DT F P 1 +ATOM 2471 O OP1 . DT F 3 11 ? 40.276 -27.544 44.588 1.00 17.64 ? 1035 DT F OP1 1 +ATOM 2472 O OP2 . DT F 3 11 ? 41.216 -28.149 42.271 1.00 17.84 ? 1035 DT F OP2 1 +ATOM 2473 O "O5'" . DT F 3 11 ? 38.950 -28.926 42.999 1.00 21.58 ? 1035 DT F "O5'" 1 +ATOM 2474 C "C5'" . DT F 3 11 ? 39.309 -30.291 42.883 1.00 20.91 ? 1035 DT F "C5'" 1 +ATOM 2475 C "C4'" . DT F 3 11 ? 38.123 -31.101 42.421 1.00 20.96 ? 1035 DT F "C4'" 1 +ATOM 2476 O "O4'" . DT F 3 11 ? 37.578 -30.500 41.218 1.00 20.94 ? 1035 DT F "O4'" 1 +ATOM 2477 C "C3'" . DT F 3 11 ? 38.511 -32.530 42.046 1.00 22.21 ? 1035 DT F "C3'" 1 +ATOM 2478 O "O3'" . DT F 3 11 ? 37.481 -33.455 42.415 1.00 23.32 ? 1035 DT F "O3'" 1 +ATOM 2479 C "C2'" . DT F 3 11 ? 38.678 -32.454 40.542 1.00 20.73 ? 1035 DT F "C2'" 1 +ATOM 2480 C "C1'" . DT F 3 11 ? 37.612 -31.446 40.158 1.00 21.93 ? 1035 DT F "C1'" 1 +ATOM 2481 N N1 . DT F 3 11 ? 37.907 -30.733 38.898 1.00 24.05 ? 1035 DT F N1 1 +ATOM 2482 C C2 . DT F 3 11 ? 36.979 -30.800 37.880 1.00 23.92 ? 1035 DT F C2 1 +ATOM 2483 O O2 . DT F 3 11 ? 35.924 -31.409 37.974 1.00 24.29 ? 1035 DT F O2 1 +ATOM 2484 N N3 . DT F 3 11 ? 37.339 -30.130 36.738 1.00 23.19 ? 1035 DT F N3 1 +ATOM 2485 C C4 . DT F 3 11 ? 38.502 -29.410 36.519 1.00 22.35 ? 1035 DT F C4 1 +ATOM 2486 O O4 . DT F 3 11 ? 38.681 -28.854 35.437 1.00 21.00 ? 1035 DT F O4 1 +ATOM 2487 C C5 . DT F 3 11 ? 39.428 -29.377 37.631 1.00 21.64 ? 1035 DT F C5 1 +ATOM 2488 C C7 . DT F 3 11 ? 40.709 -28.615 37.490 1.00 21.06 ? 1035 DT F C7 1 +ATOM 2489 C C6 . DT F 3 11 ? 39.089 -30.033 38.746 1.00 24.22 ? 1035 DT F C6 1 +ATOM 2490 P P . DA F 3 12 ? 37.493 -34.941 41.809 1.00 21.88 ? 1036 DA F P 1 +ATOM 2491 O OP1 . DA F 3 12 ? 36.278 -35.639 42.299 1.00 23.17 ? 1036 DA F OP1 1 +ATOM 2492 O OP2 . DA F 3 12 ? 38.834 -35.525 42.078 1.00 20.34 ? 1036 DA F OP2 1 +ATOM 2493 O "O5'" . DA F 3 12 ? 37.315 -34.691 40.245 1.00 20.78 ? 1036 DA F "O5'" 1 +ATOM 2494 C "C5'" . DA F 3 12 ? 37.188 -35.778 39.337 1.00 23.96 ? 1036 DA F "C5'" 1 +ATOM 2495 C "C4'" . DA F 3 12 ? 35.942 -35.610 38.500 1.00 23.44 ? 1036 DA F "C4'" 1 +ATOM 2496 O "O4'" . DA F 3 12 ? 35.956 -34.301 37.894 1.00 24.14 ? 1036 DA F "O4'" 1 +ATOM 2497 C "C3'" . DA F 3 12 ? 35.846 -36.605 37.352 1.00 23.32 ? 1036 DA F "C3'" 1 +ATOM 2498 O "O3'" . DA F 3 12 ? 34.490 -36.974 37.123 1.00 24.97 ? 1036 DA F "O3'" 1 +ATOM 2499 C "C2'" . DA F 3 12 ? 36.471 -35.870 36.181 1.00 22.38 ? 1036 DA F "C2'" 1 +ATOM 2500 C "C1'" . DA F 3 12 ? 36.360 -34.387 36.532 1.00 20.74 ? 1036 DA F "C1'" 1 +ATOM 2501 N N9 . DA F 3 12 ? 37.654 -33.701 36.421 1.00 17.29 ? 1036 DA F N9 1 +ATOM 2502 C C8 . DA F 3 12 ? 38.457 -33.270 37.449 1.00 14.33 ? 1036 DA F C8 1 +ATOM 2503 N N7 . DA F 3 12 ? 39.564 -32.699 37.052 1.00 10.16 ? 1036 DA F N7 1 +ATOM 2504 C C5 . DA F 3 12 ? 39.493 -32.764 35.669 1.00 9.51 ? 1036 DA F C5 1 +ATOM 2505 C C6 . DA F 3 12 ? 40.371 -32.351 34.652 1.00 8.89 ? 1036 DA F C6 1 +ATOM 2506 N N6 . DA F 3 12 ? 41.542 -31.733 34.866 1.00 7.93 ? 1036 DA F N6 1 +ATOM 2507 N N1 . DA F 3 12 ? 40.002 -32.591 33.381 1.00 7.31 ? 1036 DA F N1 1 +ATOM 2508 C C2 . DA F 3 12 ? 38.830 -33.189 33.151 1.00 7.49 ? 1036 DA F C2 1 +ATOM 2509 N N3 . DA F 3 12 ? 37.926 -33.614 34.011 1.00 9.20 ? 1036 DA F N3 1 +ATOM 2510 C C4 . DA F 3 12 ? 38.321 -33.374 35.268 1.00 11.23 ? 1036 DA F C4 1 +ATOM 2511 P P . DG F 3 13 ? 34.041 -38.505 37.346 1.00 28.42 ? 1037 DG F P 1 +ATOM 2512 O OP1 . DG F 3 13 ? 32.554 -38.498 37.403 1.00 28.29 ? 1037 DG F OP1 1 +ATOM 2513 O OP2 . DG F 3 13 ? 34.822 -39.032 38.498 1.00 28.62 ? 1037 DG F OP2 1 +ATOM 2514 O "O5'" . DG F 3 13 ? 34.518 -39.265 36.027 1.00 26.07 ? 1037 DG F "O5'" 1 +ATOM 2515 C "C5'" . DG F 3 13 ? 33.640 -39.386 34.915 1.00 26.14 ? 1037 DG F "C5'" 1 +ATOM 2516 C "C4'" . DG F 3 13 ? 34.345 -40.047 33.756 1.00 24.80 ? 1037 DG F "C4'" 1 +ATOM 2517 O "O4'" . DG F 3 13 ? 35.388 -39.174 33.260 1.00 25.18 ? 1037 DG F "O4'" 1 +ATOM 2518 C "C3'" . DG F 3 13 ? 35.035 -41.363 34.103 1.00 23.81 ? 1037 DG F "C3'" 1 +ATOM 2519 O "O3'" . DG F 3 13 ? 35.152 -42.149 32.918 1.00 24.99 ? 1037 DG F "O3'" 1 +ATOM 2520 C "C2'" . DG F 3 13 ? 36.446 -40.914 34.422 1.00 24.02 ? 1037 DG F "C2'" 1 +ATOM 2521 C "C1'" . DG F 3 13 ? 36.649 -39.819 33.388 1.00 22.73 ? 1037 DG F "C1'" 1 +ATOM 2522 N N9 . DG F 3 13 ? 37.640 -38.814 33.762 1.00 20.14 ? 1037 DG F N9 1 +ATOM 2523 C C8 . DG F 3 13 ? 38.102 -38.541 35.027 1.00 19.63 ? 1037 DG F C8 1 +ATOM 2524 N N7 . DG F 3 13 ? 39.018 -37.614 35.051 1.00 17.11 ? 1037 DG F N7 1 +ATOM 2525 C C5 . DG F 3 13 ? 39.167 -37.245 33.724 1.00 17.62 ? 1037 DG F C5 1 +ATOM 2526 C C6 . DG F 3 13 ? 40.033 -36.297 33.133 1.00 17.67 ? 1037 DG F C6 1 +ATOM 2527 O O6 . DG F 3 13 ? 40.865 -35.568 33.681 1.00 16.66 ? 1037 DG F O6 1 +ATOM 2528 N N1 . DG F 3 13 ? 39.867 -36.242 31.754 1.00 17.65 ? 1037 DG F N1 1 +ATOM 2529 C C2 . DG F 3 13 ? 38.975 -37.002 31.032 1.00 19.50 ? 1037 DG F C2 1 +ATOM 2530 N N2 . DG F 3 13 ? 38.962 -36.808 29.700 1.00 16.85 ? 1037 DG F N2 1 +ATOM 2531 N N3 . DG F 3 13 ? 38.156 -37.893 31.575 1.00 18.88 ? 1037 DG F N3 1 +ATOM 2532 C C4 . DG F 3 13 ? 38.312 -37.966 32.915 1.00 18.67 ? 1037 DG F C4 1 +HETATM 2533 O O . HOH G 4 . ? -3.485 -24.226 -6.548 1.00 29.30 ? 2001 HOH A O 1 +HETATM 2534 O O . HOH G 4 . ? -10.501 -18.169 -2.622 1.00 16.31 ? 2002 HOH A O 1 +HETATM 2535 O O . HOH G 4 . ? -9.200 -15.915 -3.936 1.00 0.00 ? 2003 HOH A O 1 +HETATM 2536 O O . HOH G 4 . ? -5.244 -27.278 3.942 1.00 31.63 ? 2004 HOH A O 1 +HETATM 2537 O O . HOH G 4 . ? 1.738 -27.259 -0.016 1.00 7.60 ? 2005 HOH A O 1 +HETATM 2538 O O . HOH G 4 . ? 5.228 -30.289 9.206 1.00 18.43 ? 2006 HOH A O 1 +HETATM 2539 O O . HOH G 4 . ? 15.720 -25.761 7.893 1.00 18.26 ? 2007 HOH A O 1 +HETATM 2540 O O . HOH G 4 . ? 3.937 -21.953 -3.964 1.00 26.86 ? 2008 HOH A O 1 +HETATM 2541 O O . HOH G 4 . ? 6.117 -16.649 -13.111 1.00 22.00 ? 2009 HOH A O 1 +HETATM 2542 O O . HOH G 4 . ? 19.249 -25.740 -7.444 1.00 29.13 ? 2010 HOH A O 1 +HETATM 2543 O O . HOH G 4 . ? 22.272 -21.954 -7.899 1.00 0.89 ? 2011 HOH A O 1 +HETATM 2544 O O . HOH G 4 . ? 21.802 -24.429 -14.105 1.00 0.42 ? 2012 HOH A O 1 +HETATM 2545 O O . HOH G 4 . ? 10.501 -30.315 -11.848 1.00 4.23 ? 2013 HOH A O 1 +HETATM 2546 O O . HOH G 4 . ? 12.101 -19.371 -17.538 1.00 41.02 ? 2014 HOH A O 1 +HETATM 2547 O O . HOH G 4 . ? 15.132 -5.924 -6.314 1.00 23.06 ? 2015 HOH A O 1 +HETATM 2548 O O . HOH G 4 . ? -11.821 -14.392 -3.932 1.00 0.00 ? 2016 HOH A O 1 +HETATM 2549 O O . HOH G 4 . ? 7.418 -3.780 10.526 1.00 14.85 ? 2017 HOH A O 1 +HETATM 2550 O O . HOH G 4 . ? 3.638 -3.201 7.793 1.00 0.00 ? 2018 HOH A O 1 +HETATM 2551 O O . HOH G 4 . ? 4.696 -6.792 12.856 1.00 2.36 ? 2019 HOH A O 1 +HETATM 2552 O O . HOH G 4 . ? 17.922 -4.991 6.566 1.00 9.06 ? 2020 HOH A O 1 +HETATM 2553 O O . HOH G 4 . ? 29.721 -15.152 14.465 1.00 9.20 ? 2021 HOH A O 1 +HETATM 2554 O O . HOH G 4 . ? 16.605 -7.564 -9.190 1.00 0.00 ? 2022 HOH A O 1 +HETATM 2555 O O . HOH G 4 . ? 34.975 -12.111 9.201 1.00 20.30 ? 2023 HOH A O 1 +HETATM 2556 O O . HOH G 4 . ? 27.979 -16.656 9.198 1.00 0.00 ? 2024 HOH A O 1 +HETATM 2557 O O . HOH G 4 . ? 4.741 -3.067 15.344 1.00 0.64 ? 2025 HOH A O 1 +HETATM 2558 O O . HOH G 4 . ? 15.755 -6.070 -11.838 1.00 0.00 ? 2026 HOH A O 1 +HETATM 2559 O O . HOH G 4 . ? 31.895 -17.412 6.586 1.00 12.19 ? 2027 HOH A O 1 +HETATM 2560 O O . HOH G 4 . ? 13.546 -6.819 -14.440 1.00 35.49 ? 2028 HOH A O 1 +HETATM 2561 O O . HOH G 4 . ? -5.238 -22.584 25.271 1.00 26.57 ? 2029 HOH A O 1 +HETATM 2562 O O . HOH G 4 . ? 10.039 14.386 2.607 1.00 18.66 ? 2030 HOH A O 1 +HETATM 2563 O O . HOH G 4 . ? 6.126 -12.117 19.695 1.00 16.57 ? 2031 HOH A O 1 +HETATM 2564 O O . HOH G 4 . ? -14.757 -17.757 15.591 1.00 19.66 ? 2032 HOH A O 1 +HETATM 2565 O O . HOH G 4 . ? -3.510 -16.653 14.465 1.00 0.00 ? 2033 HOH A O 1 +HETATM 2566 O O . HOH G 4 . ? 0.007 -22.706 21.003 1.00 31.03 ? 2034 HOH A O 1 +HETATM 2567 O O . HOH G 4 . ? -4.383 -19.680 22.344 1.00 14.84 ? 2035 HOH A O 1 +HETATM 2568 O O . HOH G 4 . ? -13.113 -15.146 18.411 1.00 0.00 ? 2036 HOH A O 1 +HETATM 2569 O O . HOH G 4 . ? -5.683 -9.844 21.035 1.00 6.35 ? 2037 HOH A O 1 +HETATM 2570 O O . HOH G 4 . ? 6.983 13.622 2.634 1.00 16.22 ? 2038 HOH A O 1 +HETATM 2571 O O . HOH G 4 . ? 5.689 17.416 3.945 1.00 13.49 ? 2039 HOH A O 1 +HETATM 2572 O O . HOH G 4 . ? -8.739 -16.643 15.766 1.00 3.21 ? 2040 HOH A O 1 +HETATM 2573 O O . HOH G 4 . ? -10.499 -4.562 19.713 1.00 17.20 ? 2041 HOH A O 1 +HETATM 2574 O O . HOH G 4 . ? -9.536 -6.067 22.751 1.00 27.25 ? 2042 HOH A O 1 +HETATM 2575 O O . HOH G 4 . ? -13.114 -0.016 11.836 1.00 4.10 ? 2043 HOH A O 1 +HETATM 2576 O O . HOH G 4 . ? -2.632 -1.522 2.623 1.00 17.27 ? 2044 HOH A O 1 +HETATM 2577 O O . HOH G 4 . ? 0.886 4.553 2.611 1.00 20.75 ? 2045 HOH A O 1 +HETATM 2578 O O . HOH G 4 . ? 3.931 15.155 3.944 1.00 0.00 ? 2046 HOH A O 1 +HETATM 2579 O O . HOH H 4 . ? -5.378 -2.718 0.015 1.00 36.05 ? 2001 HOH B O 1 +HETATM 2580 O O . HOH H 4 . ? -10.920 -11.360 2.636 1.00 28.19 ? 2002 HOH B O 1 +HETATM 2581 O O . HOH H 4 . ? -5.223 -15.150 2.632 1.00 12.31 ? 2003 HOH B O 1 +HETATM 2582 O O . HOH H 4 . ? -0.851 -4.539 -1.320 1.00 0.00 ? 2004 HOH B O 1 +HETATM 2583 O O . HOH H 4 . ? -4.925 -10.789 -10.444 1.00 0.00 ? 2005 HOH B O 1 +HETATM 2584 O O . HOH H 4 . ? 4.678 -4.979 -17.064 1.00 0.00 ? 2006 HOH B O 1 +HETATM 2585 O O . HOH H 4 . ? 11.688 -5.415 -15.709 1.00 12.25 ? 2007 HOH B O 1 +HETATM 2586 O O . HOH H 4 . ? 12.666 -2.264 -14.431 1.00 42.58 ? 2008 HOH B O 1 +HETATM 2587 O O . HOH H 4 . ? 9.184 3.773 -15.795 1.00 2.39 ? 2009 HOH B O 1 +HETATM 2588 O O . HOH H 4 . ? 8.740 9.075 -9.176 1.00 17.03 ? 2010 HOH B O 1 +HETATM 2589 O O . HOH H 4 . ? 14.472 -3.847 -9.004 1.00 5.00 ? 2011 HOH B O 1 +HETATM 2590 O O . HOH H 4 . ? 17.068 8.127 -7.677 1.00 37.56 ? 2012 HOH B O 1 +HETATM 2591 O O . HOH H 4 . ? 16.601 10.590 -1.319 1.00 19.66 ? 2013 HOH B O 1 +HETATM 2592 O O . HOH H 4 . ? 17.931 -2.255 3.948 1.00 0.00 ? 2014 HOH B O 1 +HETATM 2593 O O . HOH H 4 . ? -12.687 -12.869 -1.303 1.00 12.43 ? 2015 HOH B O 1 +HETATM 2594 O O . HOH I 4 . ? 18.798 -40.135 32.857 1.00 16.36 ? 2001 HOH C O 1 +HETATM 2595 O O . HOH I 4 . ? 22.718 -37.851 23.647 1.00 16.39 ? 2002 HOH C O 1 +HETATM 2596 O O . HOH I 4 . ? 4.797 -29.520 35.500 1.00 0.00 ? 2003 HOH C O 1 +HETATM 2597 O O . HOH I 4 . ? 4.813 -29.525 38.104 1.00 14.29 ? 2004 HOH C O 1 +HETATM 2598 O O . HOH I 4 . ? 27.541 -32.558 23.675 1.00 14.84 ? 2005 HOH C O 1 +HETATM 2599 O O . HOH I 4 . ? 41.514 -17.425 10.509 1.00 3.55 ? 2006 HOH C O 1 +HETATM 2600 O O . HOH I 4 . ? 7.799 -11.082 22.614 1.00 56.79 ? 2007 HOH C O 1 +HETATM 2601 O O . HOH I 4 . ? 9.774 -34.124 35.771 1.00 46.07 ? 2008 HOH C O 1 +HETATM 2602 O O . HOH I 4 . ? 29.722 -33.308 19.704 1.00 26.65 ? 2009 HOH C O 1 +HETATM 2603 O O . HOH I 4 . ? 21.413 -5.308 7.901 1.00 24.87 ? 2010 HOH C O 1 +HETATM 2604 O O . HOH I 4 . ? 24.040 -20.478 7.430 1.00 36.03 ? 2011 HOH C O 1 +HETATM 2605 O O . HOH I 4 . ? 24.041 -29.515 17.082 1.00 0.00 ? 2012 HOH C O 1 +HETATM 2606 O O . HOH I 4 . ? 39.298 -21.128 10.255 1.00 27.65 ? 2013 HOH C O 1 +HETATM 2607 O O . HOH I 4 . ? 4.385 -33.299 39.437 1.00 24.11 ? 2014 HOH C O 1 +HETATM 2608 O O . HOH I 4 . ? 24.902 -2.254 13.149 1.00 25.77 ? 2015 HOH C O 1 +HETATM 2609 O O . HOH I 4 . ? 17.910 -34.077 17.736 1.00 29.14 ? 2016 HOH C O 1 +HETATM 2610 O O . HOH I 4 . ? 1.307 -21.964 30.230 1.00 22.86 ? 2017 HOH C O 1 +HETATM 2611 O O . HOH I 4 . ? 18.799 -31.030 15.783 1.00 38.09 ? 2018 HOH C O 1 +HETATM 2612 O O . HOH I 4 . ? 22.287 -37.098 15.769 1.00 31.26 ? 2019 HOH C O 1 +HETATM 2613 O O . HOH I 4 . ? 14.421 -34.068 13.121 1.00 8.21 ? 2020 HOH C O 1 +HETATM 2614 O O . HOH I 4 . ? 26.244 -12.123 42.060 1.00 23.25 ? 2021 HOH C O 1 +HETATM 2615 O O . HOH I 4 . ? 5.240 -9.082 30.221 1.00 7.08 ? 2022 HOH C O 1 +HETATM 2616 O O . HOH I 4 . ? 18.370 -31.797 11.827 1.00 5.17 ? 2023 HOH C O 1 +HETATM 2617 O O . HOH I 4 . ? 28.562 -34.372 38.121 1.00 19.53 ? 2024 HOH C O 1 +HETATM 2618 O O . HOH I 4 . ? 19.664 -38.604 35.494 1.00 41.91 ? 2025 HOH C O 1 +HETATM 2619 O O . HOH I 4 . ? 19.663 -35.589 34.175 1.00 12.20 ? 2026 HOH C O 1 +HETATM 2620 O O . HOH I 4 . ? 20.115 -34.828 38.123 1.00 23.62 ? 2027 HOH C O 1 +HETATM 2621 O O . HOH I 4 . ? 24.052 -35.575 23.633 1.00 21.62 ? 2028 HOH C O 1 +HETATM 2622 O O . HOH I 4 . ? 16.608 -31.808 21.017 1.00 0.00 ? 2029 HOH C O 1 +HETATM 2623 O O . HOH I 4 . ? 17.234 -29.220 18.743 1.00 31.55 ? 2030 HOH C O 1 +HETATM 2624 O O . HOH I 4 . ? 14.857 -36.353 22.337 1.00 0.00 ? 2031 HOH C O 1 +HETATM 2625 O O . HOH I 4 . ? 17.227 -37.282 20.073 1.00 19.92 ? 2032 HOH C O 1 +HETATM 2626 O O . HOH I 4 . ? 12.247 -34.825 14.445 1.00 17.25 ? 2033 HOH C O 1 +HETATM 2627 O O . HOH I 4 . ? 6.554 -23.465 24.982 1.00 19.14 ? 2034 HOH C O 1 +HETATM 2628 O O . HOH I 4 . ? 6.985 -27.259 13.140 1.00 15.56 ? 2035 HOH C O 1 +HETATM 2629 O O . HOH I 4 . ? 7.420 -12.877 26.278 1.00 35.62 ? 2036 HOH C O 1 +HETATM 2630 O O . HOH I 4 . ? 11.785 -17.414 35.483 1.00 17.39 ? 2037 HOH C O 1 +HETATM 2631 O O . HOH I 4 . ? 6.549 -14.384 34.161 1.00 27.61 ? 2038 HOH C O 1 +HETATM 2632 O O . HOH I 4 . ? 7.862 -16.652 36.795 1.00 18.17 ? 2039 HOH C O 1 +HETATM 2633 O O . HOH I 4 . ? 5.238 -18.160 35.497 1.00 2.61 ? 2040 HOH C O 1 +HETATM 2634 O O . HOH I 4 . ? 6.574 -28.007 32.829 1.00 17.32 ? 2041 HOH C O 1 +HETATM 2635 O O . HOH I 4 . ? 7.447 -31.045 36.801 1.00 20.02 ? 2042 HOH C O 1 +HETATM 2636 O O . HOH I 4 . ? 3.946 -24.985 30.221 1.00 18.28 ? 2043 HOH C O 1 +HETATM 2637 O O . HOH I 4 . ? 9.632 -28.784 31.529 1.00 21.72 ? 2044 HOH C O 1 +HETATM 2638 O O . HOH I 4 . ? 6.561 -26.479 38.126 1.00 0.00 ? 2045 HOH C O 1 +HETATM 2639 O O . HOH I 4 . ? 2.186 -23.480 45.984 1.00 26.84 ? 2046 HOH C O 1 +HETATM 2640 O O . HOH I 4 . ? 9.188 -11.368 40.738 1.00 0.00 ? 2047 HOH C O 1 +HETATM 2641 O O . HOH I 4 . ? 9.165 -11.346 45.996 1.00 17.86 ? 2048 HOH C O 1 +HETATM 2642 O O . HOH I 4 . ? 10.045 -11.361 36.794 1.00 31.29 ? 2049 HOH C O 1 +HETATM 2643 O O . HOH I 4 . ? 13.253 -8.351 45.720 1.00 16.14 ? 2050 HOH C O 1 +HETATM 2644 O O . HOH I 4 . ? 11.365 -15.131 47.300 1.00 0.00 ? 2051 HOH C O 1 +HETATM 2645 O O . HOH I 4 . ? 20.112 -15.141 43.362 1.00 9.11 ? 2052 HOH C O 1 +HETATM 2646 O O . HOH I 4 . ? 24.896 -11.371 39.429 1.00 6.10 ? 2053 HOH C O 1 +HETATM 2647 O O . HOH I 4 . ? 30.078 -19.685 20.647 1.00 14.45 ? 2054 HOH C O 1 +HETATM 2648 O O . HOH I 4 . ? 32.786 -26.505 26.287 1.00 0.00 ? 2055 HOH C O 1 +HETATM 2649 O O . HOH I 4 . ? 26.252 -33.313 21.028 1.00 4.67 ? 2056 HOH C O 1 +HETATM 2650 O O . HOH I 4 . ? 21.856 -33.311 18.389 1.00 28.78 ? 2057 HOH C O 1 +HETATM 2651 O O . HOH I 4 . ? 27.117 -18.175 21.034 1.00 3.46 ? 2058 HOH C O 1 +HETATM 2652 O O . HOH I 4 . ? 20.968 -4.535 11.829 1.00 16.85 ? 2059 HOH C O 1 +HETATM 2653 O O . HOH I 4 . ? 10.052 0.739 21.033 1.00 0.00 ? 2060 HOH C O 1 +HETATM 2654 O O . HOH I 4 . ? 7.857 -1.499 22.342 1.00 0.00 ? 2061 HOH C O 1 +HETATM 2655 O O . HOH I 4 . ? 7.427 -6.815 28.930 1.00 1.58 ? 2062 HOH C O 1 +HETATM 2656 O O . HOH I 4 . ? 19.667 -28.029 7.893 1.00 15.65 ? 2063 HOH C O 1 +HETATM 2657 O O . HOH I 4 . ? 24.035 -29.527 13.132 1.00 20.49 ? 2064 HOH C O 1 +HETATM 2658 O O . HOH I 4 . ? 25.099 -24.184 7.729 1.00 18.45 ? 2065 HOH C O 1 +HETATM 2659 O O . HOH I 4 . ? 26.755 -33.657 11.520 1.00 20.59 ? 2066 HOH C O 1 +HETATM 2660 O O . HOH I 4 . ? 34.070 -22.718 5.251 1.00 1.20 ? 2067 HOH C O 1 +HETATM 2661 O O . HOH I 4 . ? 37.590 -21.196 7.898 1.00 34.47 ? 2068 HOH C O 1 +HETATM 2662 O O . HOH I 4 . ? 34.538 -26.487 17.074 1.00 0.97 ? 2069 HOH C O 1 +HETATM 2663 O O . HOH I 4 . ? 41.967 -19.694 13.161 1.00 0.00 ? 2070 HOH C O 1 +HETATM 2664 O O . HOH I 4 . ? 33.236 -21.186 17.086 1.00 28.11 ? 2071 HOH C O 1 +HETATM 2665 O O . HOH I 4 . ? 38.509 -30.297 14.995 1.00 22.47 ? 2072 HOH C O 1 +HETATM 2666 O O . HOH J 4 . ? 48.083 -28.775 28.920 1.00 5.36 ? 2001 HOH D O 1 +HETATM 2667 O O . HOH J 4 . ? 37.136 -34.076 24.964 1.00 36.62 ? 2002 HOH D O 1 +HETATM 2668 O O . HOH J 4 . ? 32.352 -33.319 23.667 1.00 19.69 ? 2003 HOH D O 1 +HETATM 2669 O O . HOH J 4 . ? 33.230 -36.349 27.575 1.00 11.10 ? 2004 HOH D O 1 +HETATM 2670 O O . HOH J 4 . ? 31.049 -29.544 24.968 1.00 0.00 ? 2005 HOH D O 1 +HETATM 2671 O O . HOH J 4 . ? 29.285 -37.105 30.240 1.00 9.10 ? 2006 HOH D O 1 +HETATM 2672 O O . HOH J 4 . ? 31.612 -23.627 44.623 1.00 36.28 ? 2007 HOH D O 1 +HETATM 2673 O O . HOH J 4 . ? 34.970 -22.730 42.085 1.00 0.00 ? 2008 HOH D O 1 +HETATM 2674 O O . HOH J 4 . ? 26.683 -20.432 46.021 1.00 34.42 ? 2009 HOH D O 1 +HETATM 2675 O O . HOH J 4 . ? 34.538 -20.424 44.689 1.00 17.87 ? 2010 HOH D O 1 +HETATM 2676 O O . HOH J 4 . ? 32.341 -13.620 48.618 1.00 18.51 ? 2011 HOH D O 1 +HETATM 2677 O O . HOH J 4 . ? 38.474 -15.130 40.736 1.00 8.02 ? 2012 HOH D O 1 +HETATM 2678 O O . HOH J 4 . ? 27.558 -11.342 39.432 1.00 9.06 ? 2013 HOH D O 1 +HETATM 2679 O O . HOH J 4 . ? 36.183 -6.160 42.355 1.00 25.56 ? 2014 HOH D O 1 +HETATM 2680 O O . HOH J 4 . ? 36.716 -1.518 34.163 1.00 3.09 ? 2015 HOH D O 1 +HETATM 2681 O O . HOH J 4 . ? 34.981 -4.542 26.287 1.00 12.42 ? 2016 HOH D O 1 +HETATM 2682 O O . HOH J 4 . ? 31.767 -7.187 26.544 1.00 7.31 ? 2017 HOH D O 1 +HETATM 2683 O O . HOH J 4 . ? 27.977 -3.035 35.504 1.00 0.00 ? 2018 HOH D O 1 +HETATM 2684 O O . HOH J 4 . ? 24.917 0.768 19.712 1.00 31.19 ? 2019 HOH D O 1 +HETATM 2685 O O . HOH J 4 . ? 24.918 -3.794 22.340 1.00 25.26 ? 2020 HOH D O 1 +HETATM 2686 O O . HOH J 4 . ? 15.333 -2.759 26.196 1.00 25.62 ? 2021 HOH D O 1 +HETATM 2687 O O . HOH J 4 . ? 26.666 2.273 31.537 1.00 21.78 ? 2022 HOH D O 1 +HETATM 2688 O O . HOH J 4 . ? 31.480 -27.251 22.363 1.00 13.52 ? 2023 HOH D O 1 +HETATM 2689 O O . HOH J 4 . ? 26.240 -18.171 47.319 1.00 13.99 ? 2024 HOH D O 1 +HETATM 2690 O O . HOH J 4 . ? 36.709 1.511 35.496 1.00 22.25 ? 2025 HOH D O 1 +HETATM 2691 O O . HOH J 4 . ? 24.916 2.282 17.065 1.00 24.12 ? 2026 HOH D O 1 +HETATM 2692 O O . HOH J 4 . ? 27.539 -6.445 23.608 1.00 22.39 ? 2027 HOH D O 1 +HETATM 2693 O O . HOH J 4 . ? 30.580 -0.009 38.102 1.00 21.16 ? 2028 HOH D O 1 +HETATM 2694 O O . HOH J 4 . ? 22.788 -18.612 47.488 1.00 29.28 ? 2029 HOH D O 1 +HETATM 2695 O O . HOH J 4 . ? 37.595 3.050 32.863 1.00 23.12 ? 2030 HOH D O 1 +HETATM 2696 O O . HOH J 4 . ? 28.852 -16.671 49.943 1.00 0.00 ? 2031 HOH D O 1 +HETATM 2697 O O . HOH J 4 . ? 27.547 3.791 14.456 1.00 43.88 ? 2032 HOH D O 1 +HETATM 2698 O O . HOH J 4 . ? 29.730 -19.685 49.935 1.00 0.00 ? 2033 HOH D O 1 +HETATM 2699 O O . HOH K 4 . ? 21.421 -8.333 -14.452 1.00 0.97 ? 2001 HOH E O 1 +HETATM 2700 O O . HOH K 4 . ? 22.018 -1.349 -10.352 1.00 0.00 ? 2002 HOH E O 1 +HETATM 2701 O O . HOH K 4 . ? 21.870 -16.651 -9.204 1.00 29.98 ? 2003 HOH E O 1 +HETATM 2702 O O . HOH K 4 . ? 15.449 -3.085 7.832 1.00 16.24 ? 2004 HOH E O 1 +HETATM 2703 O O . HOH K 4 . ? 9.664 4.528 10.243 1.00 28.09 ? 2005 HOH E O 1 +HETATM 2704 O O . HOH K 4 . ? 6.129 4.510 -6.393 1.00 17.51 ? 2006 HOH E O 1 +HETATM 2705 O O . HOH K 4 . ? 8.748 7.569 5.278 1.00 4.48 ? 2007 HOH E O 1 +HETATM 2706 O O . HOH K 4 . ? 5.252 10.593 -3.945 1.00 30.60 ? 2008 HOH E O 1 +HETATM 2707 O O . HOH K 4 . ? 1.321 0.770 -10.517 1.00 11.20 ? 2009 HOH E O 1 +HETATM 2708 O O . HOH K 4 . ? -4.822 -8.324 -11.819 1.00 3.73 ? 2010 HOH E O 1 +HETATM 2709 O O . HOH K 4 . ? -13.555 -2.271 -10.514 1.00 8.30 ? 2011 HOH E O 1 +HETATM 2710 O O . HOH K 4 . ? -10.914 -14.386 -6.575 1.00 6.71 ? 2012 HOH E O 1 +HETATM 2711 O O . HOH K 4 . ? 1.693 3.270 -12.682 1.00 3.98 ? 2013 HOH E O 1 +HETATM 2712 O O . HOH K 4 . ? 5.666 9.833 -7.912 1.00 10.87 ? 2014 HOH E O 1 +HETATM 2713 O O . HOH K 4 . ? 4.337 13.455 -6.524 1.00 10.82 ? 2015 HOH E O 1 +HETATM 2714 O O . HOH K 4 . ? 12.686 8.351 2.645 1.00 2.22 ? 2016 HOH E O 1 +HETATM 2715 O O . HOH K 4 . ? 10.489 9.224 0.993 1.00 41.72 ? 2017 HOH E O 1 +HETATM 2716 O O . HOH K 4 . ? -12.681 0.769 -9.194 1.00 8.08 ? 2018 HOH E O 1 +HETATM 2717 O O . HOH K 4 . ? 2.186 5.309 -11.843 1.00 21.81 ? 2019 HOH E O 1 +HETATM 2718 O O . HOH K 4 . ? -14.422 2.273 -7.900 1.00 15.38 ? 2020 HOH E O 1 +HETATM 2719 O O . HOH K 4 . ? 2.122 1.613 -16.251 1.00 20.48 ? 2021 HOH E O 1 +HETATM 2720 O O . HOH K 4 . ? -17.056 0.762 -7.876 1.00 15.85 ? 2022 HOH E O 1 +HETATM 2721 O O . HOH L 4 . ? 19.677 -6.806 43.348 1.00 39.91 ? 2001 HOH F O 1 +HETATM 2722 O O . HOH L 4 . ? 20.540 -9.835 39.427 1.00 13.31 ? 2002 HOH F O 1 +HETATM 2723 O O . HOH L 4 . ? 25.896 -5.968 36.936 1.00 11.71 ? 2003 HOH F O 1 +HETATM 2724 O O . HOH L 4 . ? 15.083 -11.650 35.721 1.00 26.45 ? 2004 HOH F O 1 +HETATM 2725 O O . HOH L 4 . ? 18.360 -9.067 24.967 1.00 17.19 ? 2005 HOH F O 1 +HETATM 2726 O O . HOH L 4 . ? 34.516 -15.904 23.642 1.00 33.34 ? 2006 HOH F O 1 +HETATM 2727 O O . HOH L 4 . ? 34.988 -7.585 24.969 1.00 14.69 ? 2007 HOH F O 1 +HETATM 2728 O O . HOH L 4 . ? 41.536 -17.404 26.265 1.00 11.56 ? 2008 HOH F O 1 +HETATM 2729 O O . HOH L 4 . ? 46.235 -14.974 37.362 1.00 31.73 ? 2009 HOH F O 1 +HETATM 2730 O O . HOH L 4 . ? 40.219 -12.116 36.807 1.00 28.34 ? 2010 HOH F O 1 +HETATM 2731 O O . HOH L 4 . ? 46.339 -22.711 39.416 1.00 38.32 ? 2011 HOH F O 1 +HETATM 2732 O O . HOH L 4 . ? 45.894 -24.983 38.115 1.00 25.97 ? 2012 HOH F O 1 +HETATM 2733 O O . HOH L 4 . ? 41.976 -25.743 30.233 1.00 40.02 ? 2013 HOH F O 1 +HETATM 2734 O O . HOH L 4 . ? 15.773 -10.587 26.294 1.00 14.28 ? 2014 HOH F O 1 +HETATM 2735 O O . HOH L 4 . ? 21.407 -6.845 25.259 1.00 17.08 ? 2015 HOH F O 1 +HETATM 2736 O O . HOH L 4 . ? 32.345 -33.320 42.060 1.00 13.02 ? 2016 HOH F O 1 +HETATM 2737 O O . HOH L 4 . ? 38.279 -20.199 27.833 1.00 16.72 ? 2017 HOH F O 1 +HETATM 2738 O O . HOH L 4 . ? 31.037 -41.633 38.121 1.00 0.00 ? 2018 HOH F O 1 +HETATM 2739 O O . HOH L 4 . ? 31.042 -38.613 40.736 1.00 20.86 ? 2019 HOH F O 1 +HETATM 2740 O O . HOH L 4 . ? 30.595 -39.361 32.866 1.00 2.07 ? 2020 HOH F O 1 +HETATM 2741 O O . HOH L 4 . ? 33.663 -38.614 28.919 1.00 0.00 ? 2021 HOH F O 1 +# +loop_ +_pdbx_poly_seq_scheme.asym_id +_pdbx_poly_seq_scheme.entity_id +_pdbx_poly_seq_scheme.seq_id +_pdbx_poly_seq_scheme.mon_id +_pdbx_poly_seq_scheme.ndb_seq_num +_pdbx_poly_seq_scheme.pdb_seq_num +_pdbx_poly_seq_scheme.auth_seq_num +_pdbx_poly_seq_scheme.pdb_mon_id +_pdbx_poly_seq_scheme.auth_mon_id +_pdbx_poly_seq_scheme.pdb_strand_id +_pdbx_poly_seq_scheme.pdb_ins_code +_pdbx_poly_seq_scheme.hetero +A 1 1 MET 1 157 157 MET MET A . n +A 1 2 GLY 2 158 158 GLY GLY A . n +A 1 3 ASN 3 159 159 ASN ASN A . n +A 1 4 LEU 4 160 160 LEU LEU A . n +A 1 5 SER 5 161 161 SER SER A . n +A 1 6 TYR 6 162 162 TYR TYR A . n +A 1 7 ALA 7 163 163 ALA ALA A . n +A 1 8 ASP 8 164 164 ASP ASP A . n +A 1 9 LEU 9 165 165 LEU LEU A . n +A 1 10 ILE 10 166 166 ILE ILE A . n +A 1 11 THR 11 167 167 THR THR A . n +A 1 12 ARG 12 168 168 ARG ARG A . n +A 1 13 ALA 13 169 169 ALA ALA A . n +A 1 14 ILE 14 170 170 ILE ILE A . n +A 1 15 GLU 15 171 171 GLU GLU A . n +A 1 16 SER 16 172 172 SER SER A . n +A 1 17 SER 17 173 173 SER SER A . n +A 1 18 PRO 18 174 174 PRO PRO A . n +A 1 19 ASP 19 175 175 ASP ASP A . n +A 1 20 LYS 20 176 176 LYS LYS A . n +A 1 21 ARG 21 177 177 ARG ARG A . n +A 1 22 LEU 22 178 178 LEU LEU A . n +A 1 23 THR 23 179 179 THR THR A . n +A 1 24 LEU 24 180 180 LEU LEU A . n +A 1 25 SER 25 181 181 SER SER A . n +A 1 26 GLN 26 182 182 GLN GLN A . n +A 1 27 ILE 27 183 183 ILE ILE A . n +A 1 28 TYR 28 184 184 TYR TYR A . n +A 1 29 GLU 29 185 185 GLU GLU A . n +A 1 30 TRP 30 186 186 TRP TRP A . n +A 1 31 MET 31 187 187 MET MET A . n +A 1 32 VAL 32 188 188 VAL VAL A . n +A 1 33 ARG 33 189 189 ARG ARG A . n +A 1 34 CYS 34 190 190 CYS CYS A . n +A 1 35 VAL 35 191 191 VAL VAL A . n +A 1 36 PRO 36 192 192 PRO PRO A . n +A 1 37 TYR 37 193 193 TYR TYR A . n +A 1 38 PHE 38 194 194 PHE PHE A . n +A 1 39 LYS 39 195 195 LYS LYS A . n +A 1 40 ASP 40 196 196 ASP ASP A . n +A 1 41 LYS 41 197 197 LYS LYS A . n +A 1 42 GLY 42 198 198 GLY GLY A . n +A 1 43 ASP 43 199 199 ASP ASP A . n +A 1 44 SER 44 200 200 SER SER A . n +A 1 45 ASN 45 201 201 ASN ASN A . n +A 1 46 SER 46 202 202 SER SER A . n +A 1 47 SER 47 203 203 SER SER A . n +A 1 48 ALA 48 204 204 ALA ALA A . n +A 1 49 GLY 49 205 205 GLY GLY A . n +A 1 50 TRP 50 206 206 TRP TRP A . n +A 1 51 LYS 51 207 207 LYS LYS A . n +A 1 52 ASN 52 208 208 ASN ASN A . n +A 1 53 SER 53 209 209 SER SER A . n +A 1 54 ILE 54 210 210 ILE ILE A . n +A 1 55 ARG 55 211 211 ARG ARG A . n +A 1 56 HIS 56 212 212 HIS HIS A . n +A 1 57 ASN 57 213 213 ASN ASN A . n +A 1 58 LEU 58 214 214 LEU LEU A . n +A 1 59 SER 59 215 215 SER SER A . n +A 1 60 LEU 60 216 216 LEU LEU A . n +A 1 61 HIS 61 217 217 HIS HIS A . n +A 1 62 SER 62 218 218 SER SER A . n +A 1 63 ARG 63 219 219 ARG ARG A . n +A 1 64 PHE 64 220 220 PHE PHE A . n +A 1 65 MET 65 221 221 MET MET A . n +A 1 66 ARG 66 222 222 ARG ARG A . n +A 1 67 VAL 67 223 223 VAL VAL A . n +A 1 68 GLN 68 224 224 GLN GLN A . n +A 1 69 ASN 69 225 225 ASN ASN A . n +A 1 70 GLU 70 226 226 GLU GLU A . n +A 1 71 GLY 71 227 227 GLY GLY A . n +A 1 72 THR 72 228 228 THR THR A . n +A 1 73 GLY 73 229 229 GLY GLY A . n +A 1 74 LYS 74 230 230 LYS LYS A . n +A 1 75 SER 75 231 231 SER SER A . n +A 1 76 SER 76 232 232 SER SER A . n +A 1 77 TRP 77 233 233 TRP TRP A . n +A 1 78 TRP 78 234 234 TRP TRP A . n +A 1 79 ILE 79 235 235 ILE ILE A . n +A 1 80 ILE 80 236 236 ILE ILE A . n +A 1 81 ASN 81 237 237 ASN ASN A . n +A 1 82 PRO 82 238 238 PRO PRO A . n +A 1 83 ASP 83 239 239 ASP ASP A . n +A 1 84 GLY 84 240 240 GLY GLY A . n +A 1 85 GLY 85 241 241 GLY GLY A . n +A 1 86 LYS 86 242 242 LYS LYS A . n +A 1 87 SER 87 243 243 SER SER A . n +A 1 88 GLY 88 244 244 GLY GLY A . n +A 1 89 LYS 89 245 245 LYS LYS A . n +A 1 90 ALA 90 246 246 ALA ALA A . n +A 1 91 PRO 91 247 247 PRO PRO A . n +A 1 92 ARG 92 248 248 ARG ARG A . n +A 1 93 ARG 93 249 249 ARG ARG A . n +A 1 94 ARG 94 250 250 ARG ARG A . n +A 1 95 ALA 95 251 251 ALA ALA A . n +A 1 96 VAL 96 252 252 VAL VAL A . n +A 1 97 SER 97 253 253 SER SER A . n +B 2 1 DC 1 1 1 DC DC B . n +B 2 2 DT 2 2 2 DT DT B . n +B 2 3 DA 3 3 3 DA DA B . n +B 2 4 DT 4 4 4 DT DT B . n +B 2 5 DG 5 5 5 DG DG B . n +B 2 6 DT 6 6 6 DT DT B . n +B 2 7 DA 7 7 7 DA DA B . n +B 2 8 DA 8 8 8 DA DA B . n +B 2 9 DA 9 9 9 DA DA B . n +B 2 10 DC 10 10 10 DC DC B . n +B 2 11 DA 11 11 11 DA DA B . n +B 2 12 DA 12 12 12 DA DA B . n +B 2 13 DC 13 13 13 DC DC B . n +C 1 1 MET 1 1157 1157 MET MET C . n +C 1 2 GLY 2 1158 1158 GLY GLY C . n +C 1 3 ASN 3 1159 1159 ASN ASN C . n +C 1 4 LEU 4 1160 1160 LEU LEU C . n +C 1 5 SER 5 1161 1161 SER SER C . n +C 1 6 TYR 6 1162 1162 TYR TYR C . n +C 1 7 ALA 7 1163 1163 ALA ALA C . n +C 1 8 ASP 8 1164 1164 ASP ASP C . n +C 1 9 LEU 9 1165 1165 LEU LEU C . n +C 1 10 ILE 10 1166 1166 ILE ILE C . n +C 1 11 THR 11 1167 1167 THR THR C . n +C 1 12 ARG 12 1168 1168 ARG ARG C . n +C 1 13 ALA 13 1169 1169 ALA ALA C . n +C 1 14 ILE 14 1170 1170 ILE ILE C . n +C 1 15 GLU 15 1171 1171 GLU GLU C . n +C 1 16 SER 16 1172 1172 SER SER C . n +C 1 17 SER 17 1173 1173 SER SER C . n +C 1 18 PRO 18 1174 1174 PRO PRO C . n +C 1 19 ASP 19 1175 1175 ASP ASP C . n +C 1 20 LYS 20 1176 1176 LYS LYS C . n +C 1 21 ARG 21 1177 1177 ARG ARG C . n +C 1 22 LEU 22 1178 1178 LEU LEU C . n +C 1 23 THR 23 1179 1179 THR THR C . n +C 1 24 LEU 24 1180 1180 LEU LEU C . n +C 1 25 SER 25 1181 1181 SER SER C . n +C 1 26 GLN 26 1182 1182 GLN GLN C . n +C 1 27 ILE 27 1183 1183 ILE ILE C . n +C 1 28 TYR 28 1184 1184 TYR TYR C . n +C 1 29 GLU 29 1185 1185 GLU GLU C . n +C 1 30 TRP 30 1186 1186 TRP TRP C . n +C 1 31 MET 31 1187 1187 MET MET C . n +C 1 32 VAL 32 1188 1188 VAL VAL C . n +C 1 33 ARG 33 1189 1189 ARG ARG C . n +C 1 34 CYS 34 1190 1190 CYS CYS C . n +C 1 35 VAL 35 1191 1191 VAL VAL C . n +C 1 36 PRO 36 1192 1192 PRO PRO C . n +C 1 37 TYR 37 1193 1193 TYR TYR C . n +C 1 38 PHE 38 1194 1194 PHE PHE C . n +C 1 39 LYS 39 1195 1195 LYS LYS C . n +C 1 40 ASP 40 1196 1196 ASP ASP C . n +C 1 41 LYS 41 1197 1197 LYS LYS C . n +C 1 42 GLY 42 1198 1198 GLY GLY C . n +C 1 43 ASP 43 1199 1199 ASP ASP C . n +C 1 44 SER 44 1200 1200 SER SER C . n +C 1 45 ASN 45 1201 1201 ASN ASN C . n +C 1 46 SER 46 1202 1202 SER SER C . n +C 1 47 SER 47 1203 1203 SER SER C . n +C 1 48 ALA 48 1204 1204 ALA ALA C . n +C 1 49 GLY 49 1205 1205 GLY GLY C . n +C 1 50 TRP 50 1206 1206 TRP TRP C . n +C 1 51 LYS 51 1207 1207 LYS LYS C . n +C 1 52 ASN 52 1208 1208 ASN ASN C . n +C 1 53 SER 53 1209 1209 SER SER C . n +C 1 54 ILE 54 1210 1210 ILE ILE C . n +C 1 55 ARG 55 1211 1211 ARG ARG C . n +C 1 56 HIS 56 1212 1212 HIS HIS C . n +C 1 57 ASN 57 1213 1213 ASN ASN C . n +C 1 58 LEU 58 1214 1214 LEU LEU C . n +C 1 59 SER 59 1215 1215 SER SER C . n +C 1 60 LEU 60 1216 1216 LEU LEU C . n +C 1 61 HIS 61 1217 1217 HIS HIS C . n +C 1 62 SER 62 1218 1218 SER SER C . n +C 1 63 ARG 63 1219 1219 ARG ARG C . n +C 1 64 PHE 64 1220 1220 PHE PHE C . n +C 1 65 MET 65 1221 1221 MET MET C . n +C 1 66 ARG 66 1222 1222 ARG ARG C . n +C 1 67 VAL 67 1223 1223 VAL VAL C . n +C 1 68 GLN 68 1224 1224 GLN GLN C . n +C 1 69 ASN 69 1225 1225 ASN ASN C . n +C 1 70 GLU 70 1226 1226 GLU GLU C . n +C 1 71 GLY 71 1227 1227 GLY GLY C . n +C 1 72 THR 72 1228 1228 THR THR C . n +C 1 73 GLY 73 1229 1229 GLY GLY C . n +C 1 74 LYS 74 1230 1230 LYS LYS C . n +C 1 75 SER 75 1231 1231 SER SER C . n +C 1 76 SER 76 1232 1232 SER SER C . n +C 1 77 TRP 77 1233 1233 TRP TRP C . n +C 1 78 TRP 78 1234 1234 TRP TRP C . n +C 1 79 ILE 79 1235 1235 ILE ILE C . n +C 1 80 ILE 80 1236 1236 ILE ILE C . n +C 1 81 ASN 81 1237 1237 ASN ASN C . n +C 1 82 PRO 82 1238 1238 PRO PRO C . n +C 1 83 ASP 83 1239 1239 ASP ASP C . n +C 1 84 GLY 84 1240 1240 GLY GLY C . n +C 1 85 GLY 85 1241 1241 GLY GLY C . n +C 1 86 LYS 86 1242 1242 LYS LYS C . n +C 1 87 SER 87 1243 1243 SER SER C . n +C 1 88 GLY 88 1244 1244 GLY GLY C . n +C 1 89 LYS 89 1245 1245 LYS LYS C . n +C 1 90 ALA 90 1246 1246 ALA ALA C . n +C 1 91 PRO 91 1247 1247 PRO PRO C . n +C 1 92 ARG 92 1248 1248 ARG ARG C . n +C 1 93 ARG 93 1249 ? ? ? C . n +C 1 94 ARG 94 1250 ? ? ? C . n +C 1 95 ALA 95 1251 ? ? ? C . n +C 1 96 VAL 96 1252 ? ? ? C . n +C 1 97 SER 97 1253 ? ? ? C . n +D 2 1 DC 1 1001 1001 DC DC D . n +D 2 2 DT 2 1002 1002 DT DT D . n +D 2 3 DA 3 1003 1003 DA DA D . n +D 2 4 DT 4 1004 1004 DT DT D . n +D 2 5 DG 5 1005 1005 DG DG D . n +D 2 6 DT 6 1006 1006 DT DT D . n +D 2 7 DA 7 1007 1007 DA DA D . n +D 2 8 DA 8 1008 1008 DA DA D . n +D 2 9 DA 9 1009 1009 DA DA D . n +D 2 10 DC 10 1010 1010 DC DC D . n +D 2 11 DA 11 1011 1011 DA DA D . n +D 2 12 DA 12 1012 1012 DA DA D . n +D 2 13 DC 13 1013 1013 DC DC D . n +E 3 1 DG 1 25 25 DG DG E . n +E 3 2 DT 2 26 26 DT DT E . n +E 3 3 DT 3 27 27 DT DT E . n +E 3 4 DG 4 28 28 DG DG E . n +E 3 5 DT 5 29 29 DT DT E . n +E 3 6 DT 6 30 30 DT DT E . n +E 3 7 DT 7 31 31 DT DT E . n +E 3 8 DA 8 32 32 DA DA E . n +E 3 9 DC 9 33 33 DC DC E . n +E 3 10 DA 10 34 34 DA DA E . n +E 3 11 DT 11 35 35 DT DT E . n +E 3 12 DA 12 36 36 DA DA E . n +E 3 13 DG 13 37 37 DG DG E . n +F 3 1 DG 1 1025 1025 DG DG F . n +F 3 2 DT 2 1026 1026 DT DT F . n +F 3 3 DT 3 1027 1027 DT DT F . n +F 3 4 DG 4 1028 1028 DG DG F . n +F 3 5 DT 5 1029 1029 DT DT F . n +F 3 6 DT 6 1030 1030 DT DT F . n +F 3 7 DT 7 1031 1031 DT DT F . n +F 3 8 DA 8 1032 1032 DA DA F . n +F 3 9 DC 9 1033 1033 DC DC F . n +F 3 10 DA 10 1034 1034 DA DA F . n +F 3 11 DT 11 1035 1035 DT DT F . n +F 3 12 DA 12 1036 1036 DA DA F . n +F 3 13 DG 13 1037 1037 DG DG F . n +# +loop_ +_pdbx_nonpoly_scheme.asym_id +_pdbx_nonpoly_scheme.entity_id +_pdbx_nonpoly_scheme.mon_id +_pdbx_nonpoly_scheme.ndb_seq_num +_pdbx_nonpoly_scheme.pdb_seq_num +_pdbx_nonpoly_scheme.auth_seq_num +_pdbx_nonpoly_scheme.pdb_mon_id +_pdbx_nonpoly_scheme.auth_mon_id +_pdbx_nonpoly_scheme.pdb_strand_id +_pdbx_nonpoly_scheme.pdb_ins_code +G 4 HOH 1 2001 2001 HOH HOH A . +G 4 HOH 2 2002 2002 HOH HOH A . +G 4 HOH 3 2003 2003 HOH HOH A . +G 4 HOH 4 2004 2004 HOH HOH A . +G 4 HOH 5 2005 2005 HOH HOH A . +G 4 HOH 6 2006 2006 HOH HOH A . +G 4 HOH 7 2007 2007 HOH HOH A . +G 4 HOH 8 2008 2008 HOH HOH A . +G 4 HOH 9 2009 2009 HOH HOH A . +G 4 HOH 10 2010 2010 HOH HOH A . +G 4 HOH 11 2011 2011 HOH HOH A . +G 4 HOH 12 2012 2012 HOH HOH A . +G 4 HOH 13 2013 2013 HOH HOH A . +G 4 HOH 14 2014 2014 HOH HOH A . +G 4 HOH 15 2015 2015 HOH HOH A . +G 4 HOH 16 2016 2016 HOH HOH A . +G 4 HOH 17 2017 2017 HOH HOH A . +G 4 HOH 18 2018 2018 HOH HOH A . +G 4 HOH 19 2019 2019 HOH HOH A . +G 4 HOH 20 2020 2020 HOH HOH A . +G 4 HOH 21 2021 2021 HOH HOH A . +G 4 HOH 22 2022 2022 HOH HOH A . +G 4 HOH 23 2023 2023 HOH HOH A . +G 4 HOH 24 2024 2024 HOH HOH A . +G 4 HOH 25 2025 2025 HOH HOH A . +G 4 HOH 26 2026 2026 HOH HOH A . +G 4 HOH 27 2027 2027 HOH HOH A . +G 4 HOH 28 2028 2028 HOH HOH A . +G 4 HOH 29 2029 2029 HOH HOH A . +G 4 HOH 30 2030 2030 HOH HOH A . +G 4 HOH 31 2031 2031 HOH HOH A . +G 4 HOH 32 2032 2032 HOH HOH A . +G 4 HOH 33 2033 2033 HOH HOH A . +G 4 HOH 34 2034 2034 HOH HOH A . +G 4 HOH 35 2035 2035 HOH HOH A . +G 4 HOH 36 2036 2036 HOH HOH A . +G 4 HOH 37 2037 2037 HOH HOH A . +G 4 HOH 38 2038 2038 HOH HOH A . +G 4 HOH 39 2039 2039 HOH HOH A . +G 4 HOH 40 2040 2040 HOH HOH A . +G 4 HOH 41 2041 2041 HOH HOH A . +G 4 HOH 42 2042 2042 HOH HOH A . +G 4 HOH 43 2043 2043 HOH HOH A . +G 4 HOH 44 2044 2044 HOH HOH A . +G 4 HOH 45 2045 2045 HOH HOH A . +G 4 HOH 46 2046 2046 HOH HOH A . +H 4 HOH 1 2001 2001 HOH HOH B . +H 4 HOH 2 2002 2002 HOH HOH B . +H 4 HOH 3 2003 2003 HOH HOH B . +H 4 HOH 4 2004 2004 HOH HOH B . +H 4 HOH 5 2005 2005 HOH HOH B . +H 4 HOH 6 2006 2006 HOH HOH B . +H 4 HOH 7 2007 2007 HOH HOH B . +H 4 HOH 8 2008 2008 HOH HOH B . +H 4 HOH 9 2009 2009 HOH HOH B . +H 4 HOH 10 2010 2010 HOH HOH B . +H 4 HOH 11 2011 2011 HOH HOH B . +H 4 HOH 12 2012 2012 HOH HOH B . +H 4 HOH 13 2013 2013 HOH HOH B . +H 4 HOH 14 2014 2014 HOH HOH B . +H 4 HOH 15 2015 2015 HOH HOH B . +I 4 HOH 1 2001 2001 HOH HOH C . +I 4 HOH 2 2002 2002 HOH HOH C . +I 4 HOH 3 2003 2003 HOH HOH C . +I 4 HOH 4 2004 2004 HOH HOH C . +I 4 HOH 5 2005 2005 HOH HOH C . +I 4 HOH 6 2006 2006 HOH HOH C . +I 4 HOH 7 2007 2007 HOH HOH C . +I 4 HOH 8 2008 2008 HOH HOH C . +I 4 HOH 9 2009 2009 HOH HOH C . +I 4 HOH 10 2010 2010 HOH HOH C . +I 4 HOH 11 2011 2011 HOH HOH C . +I 4 HOH 12 2012 2012 HOH HOH C . +I 4 HOH 13 2013 2013 HOH HOH C . +I 4 HOH 14 2014 2014 HOH HOH C . +I 4 HOH 15 2015 2015 HOH HOH C . +I 4 HOH 16 2016 2016 HOH HOH C . +I 4 HOH 17 2017 2017 HOH HOH C . +I 4 HOH 18 2018 2018 HOH HOH C . +I 4 HOH 19 2019 2019 HOH HOH C . +I 4 HOH 20 2020 2020 HOH HOH C . +I 4 HOH 21 2021 2021 HOH HOH C . +I 4 HOH 22 2022 2022 HOH HOH C . +I 4 HOH 23 2023 2023 HOH HOH C . +I 4 HOH 24 2024 2024 HOH HOH C . +I 4 HOH 25 2025 2025 HOH HOH C . +I 4 HOH 26 2026 2026 HOH HOH C . +I 4 HOH 27 2027 2027 HOH HOH C . +I 4 HOH 28 2028 2028 HOH HOH C . +I 4 HOH 29 2029 2029 HOH HOH C . +I 4 HOH 30 2030 2030 HOH HOH C . +I 4 HOH 31 2031 2031 HOH HOH C . +I 4 HOH 32 2032 2032 HOH HOH C . +I 4 HOH 33 2033 2033 HOH HOH C . +I 4 HOH 34 2034 2034 HOH HOH C . +I 4 HOH 35 2035 2035 HOH HOH C . +I 4 HOH 36 2036 2036 HOH HOH C . +I 4 HOH 37 2037 2037 HOH HOH C . +I 4 HOH 38 2038 2038 HOH HOH C . +I 4 HOH 39 2039 2039 HOH HOH C . +I 4 HOH 40 2040 2040 HOH HOH C . +I 4 HOH 41 2041 2041 HOH HOH C . +I 4 HOH 42 2042 2042 HOH HOH C . +I 4 HOH 43 2043 2043 HOH HOH C . +I 4 HOH 44 2044 2044 HOH HOH C . +I 4 HOH 45 2045 2045 HOH HOH C . +I 4 HOH 46 2046 2046 HOH HOH C . +I 4 HOH 47 2047 2047 HOH HOH C . +I 4 HOH 48 2048 2048 HOH HOH C . +I 4 HOH 49 2049 2049 HOH HOH C . +I 4 HOH 50 2050 2050 HOH HOH C . +I 4 HOH 51 2051 2051 HOH HOH C . +I 4 HOH 52 2052 2052 HOH HOH C . +I 4 HOH 53 2053 2053 HOH HOH C . +I 4 HOH 54 2054 2054 HOH HOH C . +I 4 HOH 55 2055 2055 HOH HOH C . +I 4 HOH 56 2056 2056 HOH HOH C . +I 4 HOH 57 2057 2057 HOH HOH C . +I 4 HOH 58 2058 2058 HOH HOH C . +I 4 HOH 59 2059 2059 HOH HOH C . +I 4 HOH 60 2060 2060 HOH HOH C . +I 4 HOH 61 2061 2061 HOH HOH C . +I 4 HOH 62 2062 2062 HOH HOH C . +I 4 HOH 63 2063 2063 HOH HOH C . +I 4 HOH 64 2064 2064 HOH HOH C . +I 4 HOH 65 2065 2065 HOH HOH C . +I 4 HOH 66 2066 2066 HOH HOH C . +I 4 HOH 67 2067 2067 HOH HOH C . +I 4 HOH 68 2068 2068 HOH HOH C . +I 4 HOH 69 2069 2069 HOH HOH C . +I 4 HOH 70 2070 2070 HOH HOH C . +I 4 HOH 71 2071 2071 HOH HOH C . +I 4 HOH 72 2072 2072 HOH HOH C . +J 4 HOH 1 2001 2001 HOH HOH D . +J 4 HOH 2 2002 2002 HOH HOH D . +J 4 HOH 3 2003 2003 HOH HOH D . +J 4 HOH 4 2004 2004 HOH HOH D . +J 4 HOH 5 2005 2005 HOH HOH D . +J 4 HOH 6 2006 2006 HOH HOH D . +J 4 HOH 7 2007 2007 HOH HOH D . +J 4 HOH 8 2008 2008 HOH HOH D . +J 4 HOH 9 2009 2009 HOH HOH D . +J 4 HOH 10 2010 2010 HOH HOH D . +J 4 HOH 11 2011 2011 HOH HOH D . +J 4 HOH 12 2012 2012 HOH HOH D . +J 4 HOH 13 2013 2013 HOH HOH D . +J 4 HOH 14 2014 2014 HOH HOH D . +J 4 HOH 15 2015 2015 HOH HOH D . +J 4 HOH 16 2016 2016 HOH HOH D . +J 4 HOH 17 2017 2017 HOH HOH D . +J 4 HOH 18 2018 2018 HOH HOH D . +J 4 HOH 19 2019 2019 HOH HOH D . +J 4 HOH 20 2020 2020 HOH HOH D . +J 4 HOH 21 2021 2021 HOH HOH D . +J 4 HOH 22 2022 2022 HOH HOH D . +J 4 HOH 23 2023 2023 HOH HOH D . +J 4 HOH 24 2024 2024 HOH HOH D . +J 4 HOH 25 2025 2025 HOH HOH D . +J 4 HOH 26 2026 2026 HOH HOH D . +J 4 HOH 27 2027 2027 HOH HOH D . +J 4 HOH 28 2028 2028 HOH HOH D . +J 4 HOH 29 2029 2029 HOH HOH D . +J 4 HOH 30 2030 2030 HOH HOH D . +J 4 HOH 31 2031 2031 HOH HOH D . +J 4 HOH 32 2032 2032 HOH HOH D . +J 4 HOH 33 2033 2033 HOH HOH D . +K 4 HOH 1 2001 2001 HOH HOH E . +K 4 HOH 2 2002 2002 HOH HOH E . +K 4 HOH 3 2003 2003 HOH HOH E . +K 4 HOH 4 2004 2004 HOH HOH E . +K 4 HOH 5 2005 2005 HOH HOH E . +K 4 HOH 6 2006 2006 HOH HOH E . +K 4 HOH 7 2007 2007 HOH HOH E . +K 4 HOH 8 2008 2008 HOH HOH E . +K 4 HOH 9 2009 2009 HOH HOH E . +K 4 HOH 10 2010 2010 HOH HOH E . +K 4 HOH 11 2011 2011 HOH HOH E . +K 4 HOH 12 2012 2012 HOH HOH E . +K 4 HOH 13 2013 2013 HOH HOH E . +K 4 HOH 14 2014 2014 HOH HOH E . +K 4 HOH 15 2015 2015 HOH HOH E . +K 4 HOH 16 2016 2016 HOH HOH E . +K 4 HOH 17 2017 2017 HOH HOH E . +K 4 HOH 18 2018 2018 HOH HOH E . +K 4 HOH 19 2019 2019 HOH HOH E . +K 4 HOH 20 2020 2020 HOH HOH E . +K 4 HOH 21 2021 2021 HOH HOH E . +K 4 HOH 22 2022 2022 HOH HOH E . +L 4 HOH 1 2001 2001 HOH HOH F . +L 4 HOH 2 2002 2002 HOH HOH F . +L 4 HOH 3 2003 2003 HOH HOH F . +L 4 HOH 4 2004 2004 HOH HOH F . +L 4 HOH 5 2005 2005 HOH HOH F . +L 4 HOH 6 2006 2006 HOH HOH F . +L 4 HOH 7 2007 2007 HOH HOH F . +L 4 HOH 8 2008 2008 HOH HOH F . +L 4 HOH 9 2009 2009 HOH HOH F . +L 4 HOH 10 2010 2010 HOH HOH F . +L 4 HOH 11 2011 2011 HOH HOH F . +L 4 HOH 12 2012 2012 HOH HOH F . +L 4 HOH 13 2013 2013 HOH HOH F . +L 4 HOH 14 2014 2014 HOH HOH F . +L 4 HOH 15 2015 2015 HOH HOH F . +L 4 HOH 16 2016 2016 HOH HOH F . +L 4 HOH 17 2017 2017 HOH HOH F . +L 4 HOH 18 2018 2018 HOH HOH F . +L 4 HOH 19 2019 2019 HOH HOH F . +L 4 HOH 20 2020 2020 HOH HOH F . +L 4 HOH 21 2021 2021 HOH HOH F . +# +loop_ +_pdbx_struct_assembly.id +_pdbx_struct_assembly.details +_pdbx_struct_assembly.method_details +_pdbx_struct_assembly.oligomeric_details +_pdbx_struct_assembly.oligomeric_count +1 author_and_software_defined_assembly PISA trimeric 3 +2 author_and_software_defined_assembly PISA trimeric 3 +# +loop_ +_pdbx_struct_assembly_gen.assembly_id +_pdbx_struct_assembly_gen.oper_expression +_pdbx_struct_assembly_gen.asym_id_list +1 1 A,B,E,G,H,K +2 1 C,D,F,I,J,L +# +loop_ +_pdbx_struct_assembly_prop.biol_id +_pdbx_struct_assembly_prop.type +_pdbx_struct_assembly_prop.value +_pdbx_struct_assembly_prop.details +1 'ABSA (A^2)' 3180 ? +1 MORE -23.2 ? +1 'SSA (A^2)' 10450 ? +2 'ABSA (A^2)' 2580 ? +2 MORE -17.4 ? +2 'SSA (A^2)' 10210 ? +# +_pdbx_struct_oper_list.id 1 +_pdbx_struct_oper_list.type 'identity operation' +_pdbx_struct_oper_list.name 1_555 +_pdbx_struct_oper_list.symmetry_operation x,y,z +_pdbx_struct_oper_list.matrix[1][1] 1.0000000000 +_pdbx_struct_oper_list.matrix[1][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[1][3] 0.0000000000 +_pdbx_struct_oper_list.vector[1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[2][2] 1.0000000000 +_pdbx_struct_oper_list.matrix[2][3] 0.0000000000 +_pdbx_struct_oper_list.vector[2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][1] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][2] 0.0000000000 +_pdbx_struct_oper_list.matrix[3][3] 1.0000000000 +_pdbx_struct_oper_list.vector[3] 0.0000000000 +# +loop_ +_pdbx_audit_revision_history.ordinal +_pdbx_audit_revision_history.data_content_type +_pdbx_audit_revision_history.major_revision +_pdbx_audit_revision_history.minor_revision +_pdbx_audit_revision_history.revision_date +1 'Structure model' 1 0 2008-05-13 +2 'Structure model' 1 1 2013-05-22 +3 'Structure model' 1 2 2023-12-13 +# +_pdbx_audit_revision_details.ordinal 1 +_pdbx_audit_revision_details.revision_ordinal 1 +_pdbx_audit_revision_details.data_content_type 'Structure model' +_pdbx_audit_revision_details.provider repository +_pdbx_audit_revision_details.type 'Initial release' +_pdbx_audit_revision_details.description ? +_pdbx_audit_revision_details.details ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Database references' +2 2 'Structure model' 'Derived calculations' +3 2 'Structure model' 'Non-polymer description' +4 2 'Structure model' Other +5 2 'Structure model' 'Refinement description' +6 2 'Structure model' 'Source and taxonomy' +7 2 'Structure model' 'Structure summary' +8 2 'Structure model' 'Version format compliance' +9 3 'Structure model' 'Data collection' +10 3 'Structure model' 'Database references' +11 3 'Structure model' Other +12 3 'Structure model' 'Refinement description' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 3 'Structure model' chem_comp_atom +2 3 'Structure model' chem_comp_bond +3 3 'Structure model' database_2 +4 3 'Structure model' pdbx_database_status +5 3 'Structure model' pdbx_initial_refinement_model +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 3 'Structure model' '_database_2.pdbx_DOI' +2 3 'Structure model' '_database_2.pdbx_database_accession' +3 3 'Structure model' '_pdbx_database_status.status_code_sf' +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +CNS refinement 1.1 ? 1 +HKL-2000 'data reduction' . ? 2 +HKL-2000 'data scaling' . ? 3 +MOLREP phasing . ? 4 +# +loop_ +_pdbx_validate_close_contact.id +_pdbx_validate_close_contact.PDB_model_num +_pdbx_validate_close_contact.auth_atom_id_1 +_pdbx_validate_close_contact.auth_asym_id_1 +_pdbx_validate_close_contact.auth_comp_id_1 +_pdbx_validate_close_contact.auth_seq_id_1 +_pdbx_validate_close_contact.PDB_ins_code_1 +_pdbx_validate_close_contact.label_alt_id_1 +_pdbx_validate_close_contact.auth_atom_id_2 +_pdbx_validate_close_contact.auth_asym_id_2 +_pdbx_validate_close_contact.auth_comp_id_2 +_pdbx_validate_close_contact.auth_seq_id_2 +_pdbx_validate_close_contact.PDB_ins_code_2 +_pdbx_validate_close_contact.label_alt_id_2 +_pdbx_validate_close_contact.dist +1 1 C C ASN 1237 ? ? CD C PRO 1238 ? ? 1.66 +2 1 OE2 A GLU 226 ? ? NE C ARG 1222 ? ? 2.10 +3 1 OD2 A ASP 196 ? ? NE1 A TRP 206 ? ? 2.15 +# +loop_ +_pdbx_validate_rmsd_bond.id +_pdbx_validate_rmsd_bond.PDB_model_num +_pdbx_validate_rmsd_bond.auth_atom_id_1 +_pdbx_validate_rmsd_bond.auth_asym_id_1 +_pdbx_validate_rmsd_bond.auth_comp_id_1 +_pdbx_validate_rmsd_bond.auth_seq_id_1 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 +_pdbx_validate_rmsd_bond.label_alt_id_1 +_pdbx_validate_rmsd_bond.auth_atom_id_2 +_pdbx_validate_rmsd_bond.auth_asym_id_2 +_pdbx_validate_rmsd_bond.auth_comp_id_2 +_pdbx_validate_rmsd_bond.auth_seq_id_2 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 +_pdbx_validate_rmsd_bond.label_alt_id_2 +_pdbx_validate_rmsd_bond.bond_value +_pdbx_validate_rmsd_bond.bond_target_value +_pdbx_validate_rmsd_bond.bond_deviation +_pdbx_validate_rmsd_bond.bond_standard_deviation +_pdbx_validate_rmsd_bond.linker_flag +1 1 CB A LYS 245 ? ? CG A LYS 245 ? ? 1.705 1.521 0.184 0.027 N +2 1 C A PRO 247 ? ? N A ARG 248 ? ? 1.161 1.336 -0.175 0.023 Y +3 1 "O3'" B DC 1 ? ? P B DT 2 ? ? 1.735 1.607 0.128 0.012 Y +4 1 "O3'" B DT 2 ? ? "C3'" B DT 2 ? ? 1.366 1.419 -0.053 0.006 N +5 1 "O3'" B DT 2 ? ? P B DA 3 ? ? 1.533 1.607 -0.074 0.012 Y +6 1 CA C SER 1203 ? ? CB C SER 1203 ? ? 1.639 1.525 0.114 0.015 N +7 1 P E DG 37 ? ? "O5'" E DG 37 ? ? 1.510 1.593 -0.083 0.010 N +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 N A ASN 201 ? ? CA A ASN 201 ? ? C A ASN 201 ? ? 128.32 111.00 17.32 2.70 N +2 1 N A SER 202 ? ? CA A SER 202 ? ? C A SER 202 ? ? 129.41 111.00 18.41 2.70 N +3 1 N A GLY 205 ? ? CA A GLY 205 ? ? C A GLY 205 ? ? 129.18 113.10 16.08 2.50 N +4 1 N A LYS 230 ? ? CA A LYS 230 ? ? C A LYS 230 ? ? 128.48 111.00 17.48 2.70 N +5 1 CD A LYS 245 ? ? CE A LYS 245 ? ? NZ A LYS 245 ? ? 129.61 111.70 17.91 2.30 N +6 1 N A ALA 251 ? ? CA A ALA 251 ? ? C A ALA 251 ? ? 91.48 111.00 -19.52 2.70 N +7 1 CA A VAL 252 ? ? CB A VAL 252 ? ? CG1 A VAL 252 ? ? 99.53 110.90 -11.37 1.50 N +8 1 CA A VAL 252 ? ? CB A VAL 252 ? ? CG2 A VAL 252 ? ? 120.24 110.90 9.34 1.50 N +9 1 "C3'" B DC 1 ? ? "O3'" B DC 1 ? ? P B DT 2 ? ? 128.67 119.70 8.97 1.20 Y +10 1 "O3'" B DC 1 ? ? P B DT 2 ? ? OP1 B DT 2 ? ? 119.69 110.50 9.19 1.10 Y +11 1 "O5'" B DT 2 ? ? P B DT 2 ? ? OP1 B DT 2 ? ? 96.57 105.70 -9.13 0.90 N +12 1 N C SER 1161 ? ? CA C SER 1161 ? ? C C SER 1161 ? ? 128.57 111.00 17.57 2.70 N +13 1 N C ASP 1196 ? ? CA C ASP 1196 ? ? C C ASP 1196 ? ? 136.63 111.00 25.63 2.70 N +14 1 N C LYS 1197 ? ? CA C LYS 1197 ? ? C C LYS 1197 ? ? 132.16 111.00 21.16 2.70 N +15 1 C C SER 1202 ? ? N C SER 1203 ? ? CA C SER 1203 ? ? 149.79 121.70 28.09 2.50 Y +16 1 N C SER 1203 ? ? CA C SER 1203 ? ? CB C SER 1203 ? ? 100.48 110.50 -10.02 1.50 N +17 1 C C ASN 1237 ? ? N C PRO 1238 ? ? CA C PRO 1238 ? ? 174.22 119.30 54.92 1.50 Y +18 1 C C ASN 1237 ? ? N C PRO 1238 ? ? CD C PRO 1238 ? ? 72.29 128.40 -56.11 2.10 Y +# +loop_ +_pdbx_validate_torsion.id +_pdbx_validate_torsion.PDB_model_num +_pdbx_validate_torsion.auth_comp_id +_pdbx_validate_torsion.auth_asym_id +_pdbx_validate_torsion.auth_seq_id +_pdbx_validate_torsion.PDB_ins_code +_pdbx_validate_torsion.label_alt_id +_pdbx_validate_torsion.phi +_pdbx_validate_torsion.psi +1 1 VAL A 191 ? ? 43.83 105.81 +2 1 PRO A 192 ? ? -29.48 -39.45 +3 1 SER A 200 ? ? -110.32 -162.72 +4 1 SER A 202 ? ? 75.71 108.97 +5 1 ALA A 204 ? ? -54.15 -142.70 +6 1 HIS A 217 ? ? -72.32 -130.31 +7 1 PRO A 238 ? ? 25.74 104.31 +8 1 SER A 243 ? ? -38.60 145.47 +9 1 PRO A 247 ? ? -31.09 83.37 +10 1 ARG A 249 ? ? -13.63 157.86 +11 1 ARG A 250 ? ? 87.17 87.70 +12 1 ALA A 251 ? ? -119.70 -72.52 +13 1 VAL A 252 ? ? 149.10 179.48 +14 1 LEU C 1160 ? ? 51.47 110.35 +15 1 ASP C 1196 ? ? -44.97 153.52 +16 1 LYS C 1197 ? ? 37.70 108.90 +17 1 ASP C 1199 ? ? 173.83 147.19 +18 1 SER C 1200 ? ? 159.44 -66.25 +19 1 SER C 1203 ? ? 89.44 97.04 +20 1 THR C 1228 ? ? 37.53 30.59 +21 1 PRO C 1238 ? ? 105.87 127.37 +22 1 LYS C 1242 ? ? 163.02 -45.42 +23 1 SER C 1243 ? ? 120.69 176.38 +24 1 LYS C 1245 ? ? -49.47 -18.35 +25 1 ALA C 1246 ? ? 107.63 58.91 +26 1 PRO C 1247 ? ? -152.28 -149.92 +# +_pdbx_validate_polymer_linkage.id 1 +_pdbx_validate_polymer_linkage.PDB_model_num 1 +_pdbx_validate_polymer_linkage.auth_atom_id_1 C +_pdbx_validate_polymer_linkage.auth_asym_id_1 A +_pdbx_validate_polymer_linkage.auth_comp_id_1 PRO +_pdbx_validate_polymer_linkage.auth_seq_id_1 247 +_pdbx_validate_polymer_linkage.PDB_ins_code_1 ? +_pdbx_validate_polymer_linkage.label_alt_id_1 ? +_pdbx_validate_polymer_linkage.auth_atom_id_2 N +_pdbx_validate_polymer_linkage.auth_asym_id_2 A +_pdbx_validate_polymer_linkage.auth_comp_id_2 ARG +_pdbx_validate_polymer_linkage.auth_seq_id_2 248 +_pdbx_validate_polymer_linkage.PDB_ins_code_2 ? +_pdbx_validate_polymer_linkage.label_alt_id_2 ? +_pdbx_validate_polymer_linkage.dist 1.16 +# +loop_ +_pdbx_distant_solvent_atoms.id +_pdbx_distant_solvent_atoms.PDB_model_num +_pdbx_distant_solvent_atoms.auth_atom_id +_pdbx_distant_solvent_atoms.label_alt_id +_pdbx_distant_solvent_atoms.auth_asym_id +_pdbx_distant_solvent_atoms.auth_comp_id +_pdbx_distant_solvent_atoms.auth_seq_id +_pdbx_distant_solvent_atoms.PDB_ins_code +_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance +_pdbx_distant_solvent_atoms.neighbor_ligand_distance +1 1 O ? A HOH 2026 ? 6.57 . +2 1 O ? A HOH 2027 ? 7.17 . +3 1 O ? A HOH 2029 ? 8.11 . +4 1 O ? A HOH 2030 ? 7.65 . +5 1 O ? A HOH 2032 ? 6.40 . +6 1 O ? C HOH 2006 ? 6.64 . +7 1 O ? C HOH 2007 ? 5.89 . +8 1 O ? C HOH 2009 ? 6.45 . +9 1 O ? C HOH 2014 ? 7.66 . +10 1 O ? C HOH 2015 ? 6.22 . +11 1 O ? C HOH 2017 ? 6.41 . +12 1 O ? C HOH 2019 ? 7.95 . +13 1 O ? C HOH 2022 ? 7.40 . +14 1 O ? D HOH 2028 ? 7.44 . +15 1 O ? D HOH 2031 ? 6.84 . +16 1 O ? D HOH 2032 ? 9.31 . +17 1 O ? E HOH 2016 ? 6.00 . +18 1 O ? E HOH 2017 ? 6.11 . +19 1 O ? E HOH 2021 ? 6.54 . +20 1 O ? F HOH 2017 ? 5.83 . +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 1 C MET 1157 ? CG ? C MET 1 CG +2 1 Y 1 C MET 1157 ? SD ? C MET 1 SD +3 1 Y 1 C MET 1157 ? CE ? C MET 1 CE +4 1 Y 1 C LYS 1242 ? CB ? C LYS 86 CB +5 1 Y 1 C LYS 1242 ? CG ? C LYS 86 CG +6 1 Y 1 C LYS 1242 ? CD ? C LYS 86 CD +7 1 Y 1 C LYS 1242 ? CE ? C LYS 86 CE +8 1 Y 1 C LYS 1242 ? NZ ? C LYS 86 NZ +9 1 Y 1 C SER 1243 ? CB ? C SER 87 CB +10 1 Y 1 C SER 1243 ? OG ? C SER 87 OG +11 1 Y 1 C LYS 1245 ? CB ? C LYS 89 CB +12 1 Y 1 C LYS 1245 ? CG ? C LYS 89 CG +13 1 Y 1 C LYS 1245 ? CD ? C LYS 89 CD +14 1 Y 1 C LYS 1245 ? CE ? C LYS 89 CE +15 1 Y 1 C LYS 1245 ? NZ ? C LYS 89 NZ +16 1 Y 1 C ALA 1246 ? CB ? C ALA 90 CB +17 1 Y 1 C PRO 1247 ? CB ? C PRO 91 CB +18 1 Y 1 C PRO 1247 ? CG ? C PRO 91 CG +19 1 Y 1 C PRO 1247 ? CD ? C PRO 91 CD +20 1 Y 1 C ARG 1248 ? CA ? C ARG 92 CA +21 1 Y 1 C ARG 1248 ? C ? C ARG 92 C +22 1 Y 1 C ARG 1248 ? O ? C ARG 92 O +23 1 Y 1 C ARG 1248 ? CB ? C ARG 92 CB +24 1 Y 1 C ARG 1248 ? CG ? C ARG 92 CG +25 1 Y 1 C ARG 1248 ? CD ? C ARG 92 CD +26 1 Y 1 C ARG 1248 ? NE ? C ARG 92 NE +27 1 Y 1 C ARG 1248 ? CZ ? C ARG 92 CZ +28 1 Y 1 C ARG 1248 ? NH1 ? C ARG 92 NH1 +29 1 Y 1 C ARG 1248 ? NH2 ? C ARG 92 NH2 +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 C ARG 1249 ? C ARG 93 +2 1 Y 1 C ARG 1250 ? C ARG 94 +3 1 Y 1 C ALA 1251 ? C ALA 95 +4 1 Y 1 C VAL 1252 ? C VAL 96 +5 1 Y 1 C SER 1253 ? C SER 97 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +DA OP3 O N N 88 +DA P P N N 89 +DA OP1 O N N 90 +DA OP2 O N N 91 +DA "O5'" O N N 92 +DA "C5'" C N N 93 +DA "C4'" C N R 94 +DA "O4'" O N N 95 +DA "C3'" C N S 96 +DA "O3'" O N N 97 +DA "C2'" C N N 98 +DA "C1'" C N R 99 +DA N9 N Y N 100 +DA C8 C Y N 101 +DA N7 N Y N 102 +DA C5 C Y N 103 +DA C6 C Y N 104 +DA N6 N N N 105 +DA N1 N Y N 106 +DA C2 C Y N 107 +DA N3 N Y N 108 +DA C4 C Y N 109 +DA HOP3 H N N 110 +DA HOP2 H N N 111 +DA "H5'" H N N 112 +DA "H5''" H N N 113 +DA "H4'" H N N 114 +DA "H3'" H N N 115 +DA "HO3'" H N N 116 +DA "H2'" H N N 117 +DA "H2''" H N N 118 +DA "H1'" H N N 119 +DA H8 H N N 120 +DA H61 H N N 121 +DA H62 H N N 122 +DA H2 H N N 123 +DC OP3 O N N 124 +DC P P N N 125 +DC OP1 O N N 126 +DC OP2 O N N 127 +DC "O5'" O N N 128 +DC "C5'" C N N 129 +DC "C4'" C N R 130 +DC "O4'" O N N 131 +DC "C3'" C N S 132 +DC "O3'" O N N 133 +DC "C2'" C N N 134 +DC "C1'" C N R 135 +DC N1 N N N 136 +DC C2 C N N 137 +DC O2 O N N 138 +DC N3 N N N 139 +DC C4 C N N 140 +DC N4 N N N 141 +DC C5 C N N 142 +DC C6 C N N 143 +DC HOP3 H N N 144 +DC HOP2 H N N 145 +DC "H5'" H N N 146 +DC "H5''" H N N 147 +DC "H4'" H N N 148 +DC "H3'" H N N 149 +DC "HO3'" H N N 150 +DC "H2'" H N N 151 +DC "H2''" H N N 152 +DC "H1'" H N N 153 +DC H41 H N N 154 +DC H42 H N N 155 +DC H5 H N N 156 +DC H6 H N N 157 +DG OP3 O N N 158 +DG P P N N 159 +DG OP1 O N N 160 +DG OP2 O N N 161 +DG "O5'" O N N 162 +DG "C5'" C N N 163 +DG "C4'" C N R 164 +DG "O4'" O N N 165 +DG "C3'" C N S 166 +DG "O3'" O N N 167 +DG "C2'" C N N 168 +DG "C1'" C N R 169 +DG N9 N Y N 170 +DG C8 C Y N 171 +DG N7 N Y N 172 +DG C5 C Y N 173 +DG C6 C N N 174 +DG O6 O N N 175 +DG N1 N N N 176 +DG C2 C N N 177 +DG N2 N N N 178 +DG N3 N N N 179 +DG C4 C Y N 180 +DG HOP3 H N N 181 +DG HOP2 H N N 182 +DG "H5'" H N N 183 +DG "H5''" H N N 184 +DG "H4'" H N N 185 +DG "H3'" H N N 186 +DG "HO3'" H N N 187 +DG "H2'" H N N 188 +DG "H2''" H N N 189 +DG "H1'" H N N 190 +DG H8 H N N 191 +DG H1 H N N 192 +DG H21 H N N 193 +DG H22 H N N 194 +DT OP3 O N N 195 +DT P P N N 196 +DT OP1 O N N 197 +DT OP2 O N N 198 +DT "O5'" O N N 199 +DT "C5'" C N N 200 +DT "C4'" C N R 201 +DT "O4'" O N N 202 +DT "C3'" C N S 203 +DT "O3'" O N N 204 +DT "C2'" C N N 205 +DT "C1'" C N R 206 +DT N1 N N N 207 +DT C2 C N N 208 +DT O2 O N N 209 +DT N3 N N N 210 +DT C4 C N N 211 +DT O4 O N N 212 +DT C5 C N N 213 +DT C7 C N N 214 +DT C6 C N N 215 +DT HOP3 H N N 216 +DT HOP2 H N N 217 +DT "H5'" H N N 218 +DT "H5''" H N N 219 +DT "H4'" H N N 220 +DT "H3'" H N N 221 +DT "HO3'" H N N 222 +DT "H2'" H N N 223 +DT "H2''" H N N 224 +DT "H1'" H N N 225 +DT H3 H N N 226 +DT H71 H N N 227 +DT H72 H N N 228 +DT H73 H N N 229 +DT H6 H N N 230 +GLN N N N N 231 +GLN CA C N S 232 +GLN C C N N 233 +GLN O O N N 234 +GLN CB C N N 235 +GLN CG C N N 236 +GLN CD C N N 237 +GLN OE1 O N N 238 +GLN NE2 N N N 239 +GLN OXT O N N 240 +GLN H H N N 241 +GLN H2 H N N 242 +GLN HA H N N 243 +GLN HB2 H N N 244 +GLN HB3 H N N 245 +GLN HG2 H N N 246 +GLN HG3 H N N 247 +GLN HE21 H N N 248 +GLN HE22 H N N 249 +GLN HXT H N N 250 +GLU N N N N 251 +GLU CA C N S 252 +GLU C C N N 253 +GLU O O N N 254 +GLU CB C N N 255 +GLU CG C N N 256 +GLU CD C N N 257 +GLU OE1 O N N 258 +GLU OE2 O N N 259 +GLU OXT O N N 260 +GLU H H N N 261 +GLU H2 H N N 262 +GLU HA H N N 263 +GLU HB2 H N N 264 +GLU HB3 H N N 265 +GLU HG2 H N N 266 +GLU HG3 H N N 267 +GLU HE2 H N N 268 +GLU HXT H N N 269 +GLY N N N N 270 +GLY CA C N N 271 +GLY C C N N 272 +GLY O O N N 273 +GLY OXT O N N 274 +GLY H H N N 275 +GLY H2 H N N 276 +GLY HA2 H N N 277 +GLY HA3 H N N 278 +GLY HXT H N N 279 +HIS N N N N 280 +HIS CA C N S 281 +HIS C C N N 282 +HIS O O N N 283 +HIS CB C N N 284 +HIS CG C Y N 285 +HIS ND1 N Y N 286 +HIS CD2 C Y N 287 +HIS CE1 C Y N 288 +HIS NE2 N Y N 289 +HIS OXT O N N 290 +HIS H H N N 291 +HIS H2 H N N 292 +HIS HA H N N 293 +HIS HB2 H N N 294 +HIS HB3 H N N 295 +HIS HD1 H N N 296 +HIS HD2 H N N 297 +HIS HE1 H N N 298 +HIS HE2 H N N 299 +HIS HXT H N N 300 +HOH O O N N 301 +HOH H1 H N N 302 +HOH H2 H N N 303 +ILE N N N N 304 +ILE CA C N S 305 +ILE C C N N 306 +ILE O O N N 307 +ILE CB C N S 308 +ILE CG1 C N N 309 +ILE CG2 C N N 310 +ILE CD1 C N N 311 +ILE OXT O N N 312 +ILE H H N N 313 +ILE H2 H N N 314 +ILE HA H N N 315 +ILE HB H N N 316 +ILE HG12 H N N 317 +ILE HG13 H N N 318 +ILE HG21 H N N 319 +ILE HG22 H N N 320 +ILE HG23 H N N 321 +ILE HD11 H N N 322 +ILE HD12 H N N 323 +ILE HD13 H N N 324 +ILE HXT H N N 325 +LEU N N N N 326 +LEU CA C N S 327 +LEU C C N N 328 +LEU O O N N 329 +LEU CB C N N 330 +LEU CG C N N 331 +LEU CD1 C N N 332 +LEU CD2 C N N 333 +LEU OXT O N N 334 +LEU H H N N 335 +LEU H2 H N N 336 +LEU HA H N N 337 +LEU HB2 H N N 338 +LEU HB3 H N N 339 +LEU HG H N N 340 +LEU HD11 H N N 341 +LEU HD12 H N N 342 +LEU HD13 H N N 343 +LEU HD21 H N N 344 +LEU HD22 H N N 345 +LEU HD23 H N N 346 +LEU HXT H N N 347 +LYS N N N N 348 +LYS CA C N S 349 +LYS C C N N 350 +LYS O O N N 351 +LYS CB C N N 352 +LYS CG C N N 353 +LYS CD C N N 354 +LYS CE C N N 355 +LYS NZ N N N 356 +LYS OXT O N N 357 +LYS H H N N 358 +LYS H2 H N N 359 +LYS HA H N N 360 +LYS HB2 H N N 361 +LYS HB3 H N N 362 +LYS HG2 H N N 363 +LYS HG3 H N N 364 +LYS HD2 H N N 365 +LYS HD3 H N N 366 +LYS HE2 H N N 367 +LYS HE3 H N N 368 +LYS HZ1 H N N 369 +LYS HZ2 H N N 370 +LYS HZ3 H N N 371 +LYS HXT H N N 372 +MET N N N N 373 +MET CA C N S 374 +MET C C N N 375 +MET O O N N 376 +MET CB C N N 377 +MET CG C N N 378 +MET SD S N N 379 +MET CE C N N 380 +MET OXT O N N 381 +MET H H N N 382 +MET H2 H N N 383 +MET HA H N N 384 +MET HB2 H N N 385 +MET HB3 H N N 386 +MET HG2 H N N 387 +MET HG3 H N N 388 +MET HE1 H N N 389 +MET HE2 H N N 390 +MET HE3 H N N 391 +MET HXT H N N 392 +PHE N N N N 393 +PHE CA C N S 394 +PHE C C N N 395 +PHE O O N N 396 +PHE CB C N N 397 +PHE CG C Y N 398 +PHE CD1 C Y N 399 +PHE CD2 C Y N 400 +PHE CE1 C Y N 401 +PHE CE2 C Y N 402 +PHE CZ C Y N 403 +PHE OXT O N N 404 +PHE H H N N 405 +PHE H2 H N N 406 +PHE HA H N N 407 +PHE HB2 H N N 408 +PHE HB3 H N N 409 +PHE HD1 H N N 410 +PHE HD2 H N N 411 +PHE HE1 H N N 412 +PHE HE2 H N N 413 +PHE HZ H N N 414 +PHE HXT H N N 415 +PRO N N N N 416 +PRO CA C N S 417 +PRO C C N N 418 +PRO O O N N 419 +PRO CB C N N 420 +PRO CG C N N 421 +PRO CD C N N 422 +PRO OXT O N N 423 +PRO H H N N 424 +PRO HA H N N 425 +PRO HB2 H N N 426 +PRO HB3 H N N 427 +PRO HG2 H N N 428 +PRO HG3 H N N 429 +PRO HD2 H N N 430 +PRO HD3 H N N 431 +PRO HXT H N N 432 +SER N N N N 433 +SER CA C N S 434 +SER C C N N 435 +SER O O N N 436 +SER CB C N N 437 +SER OG O N N 438 +SER OXT O N N 439 +SER H H N N 440 +SER H2 H N N 441 +SER HA H N N 442 +SER HB2 H N N 443 +SER HB3 H N N 444 +SER HG H N N 445 +SER HXT H N N 446 +THR N N N N 447 +THR CA C N S 448 +THR C C N N 449 +THR O O N N 450 +THR CB C N R 451 +THR OG1 O N N 452 +THR CG2 C N N 453 +THR OXT O N N 454 +THR H H N N 455 +THR H2 H N N 456 +THR HA H N N 457 +THR HB H N N 458 +THR HG1 H N N 459 +THR HG21 H N N 460 +THR HG22 H N N 461 +THR HG23 H N N 462 +THR HXT H N N 463 +TRP N N N N 464 +TRP CA C N S 465 +TRP C C N N 466 +TRP O O N N 467 +TRP CB C N N 468 +TRP CG C Y N 469 +TRP CD1 C Y N 470 +TRP CD2 C Y N 471 +TRP NE1 N Y N 472 +TRP CE2 C Y N 473 +TRP CE3 C Y N 474 +TRP CZ2 C Y N 475 +TRP CZ3 C Y N 476 +TRP CH2 C Y N 477 +TRP OXT O N N 478 +TRP H H N N 479 +TRP H2 H N N 480 +TRP HA H N N 481 +TRP HB2 H N N 482 +TRP HB3 H N N 483 +TRP HD1 H N N 484 +TRP HE1 H N N 485 +TRP HE3 H N N 486 +TRP HZ2 H N N 487 +TRP HZ3 H N N 488 +TRP HH2 H N N 489 +TRP HXT H N N 490 +TYR N N N N 491 +TYR CA C N S 492 +TYR C C N N 493 +TYR O O N N 494 +TYR CB C N N 495 +TYR CG C Y N 496 +TYR CD1 C Y N 497 +TYR CD2 C Y N 498 +TYR CE1 C Y N 499 +TYR CE2 C Y N 500 +TYR CZ C Y N 501 +TYR OH O N N 502 +TYR OXT O N N 503 +TYR H H N N 504 +TYR H2 H N N 505 +TYR HA H N N 506 +TYR HB2 H N N 507 +TYR HB3 H N N 508 +TYR HD1 H N N 509 +TYR HD2 H N N 510 +TYR HE1 H N N 511 +TYR HE2 H N N 512 +TYR HH H N N 513 +TYR HXT H N N 514 +VAL N N N N 515 +VAL CA C N S 516 +VAL C C N N 517 +VAL O O N N 518 +VAL CB C N N 519 +VAL CG1 C N N 520 +VAL CG2 C N N 521 +VAL OXT O N N 522 +VAL H H N N 523 +VAL H2 H N N 524 +VAL HA H N N 525 +VAL HB H N N 526 +VAL HG11 H N N 527 +VAL HG12 H N N 528 +VAL HG13 H N N 529 +VAL HG21 H N N 530 +VAL HG22 H N N 531 +VAL HG23 H N N 532 +VAL HXT H N N 533 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +DA OP3 P sing N N 83 +DA OP3 HOP3 sing N N 84 +DA P OP1 doub N N 85 +DA P OP2 sing N N 86 +DA P "O5'" sing N N 87 +DA OP2 HOP2 sing N N 88 +DA "O5'" "C5'" sing N N 89 +DA "C5'" "C4'" sing N N 90 +DA "C5'" "H5'" sing N N 91 +DA "C5'" "H5''" sing N N 92 +DA "C4'" "O4'" sing N N 93 +DA "C4'" "C3'" sing N N 94 +DA "C4'" "H4'" sing N N 95 +DA "O4'" "C1'" sing N N 96 +DA "C3'" "O3'" sing N N 97 +DA "C3'" "C2'" sing N N 98 +DA "C3'" "H3'" sing N N 99 +DA "O3'" "HO3'" sing N N 100 +DA "C2'" "C1'" sing N N 101 +DA "C2'" "H2'" sing N N 102 +DA "C2'" "H2''" sing N N 103 +DA "C1'" N9 sing N N 104 +DA "C1'" "H1'" sing N N 105 +DA N9 C8 sing Y N 106 +DA N9 C4 sing Y N 107 +DA C8 N7 doub Y N 108 +DA C8 H8 sing N N 109 +DA N7 C5 sing Y N 110 +DA C5 C6 sing Y N 111 +DA C5 C4 doub Y N 112 +DA C6 N6 sing N N 113 +DA C6 N1 doub Y N 114 +DA N6 H61 sing N N 115 +DA N6 H62 sing N N 116 +DA N1 C2 sing Y N 117 +DA C2 N3 doub Y N 118 +DA C2 H2 sing N N 119 +DA N3 C4 sing Y N 120 +DC OP3 P sing N N 121 +DC OP3 HOP3 sing N N 122 +DC P OP1 doub N N 123 +DC P OP2 sing N N 124 +DC P "O5'" sing N N 125 +DC OP2 HOP2 sing N N 126 +DC "O5'" "C5'" sing N N 127 +DC "C5'" "C4'" sing N N 128 +DC "C5'" "H5'" sing N N 129 +DC "C5'" "H5''" sing N N 130 +DC "C4'" "O4'" sing N N 131 +DC "C4'" "C3'" sing N N 132 +DC "C4'" "H4'" sing N N 133 +DC "O4'" "C1'" sing N N 134 +DC "C3'" "O3'" sing N N 135 +DC "C3'" "C2'" sing N N 136 +DC "C3'" "H3'" sing N N 137 +DC "O3'" "HO3'" sing N N 138 +DC "C2'" "C1'" sing N N 139 +DC "C2'" "H2'" sing N N 140 +DC "C2'" "H2''" sing N N 141 +DC "C1'" N1 sing N N 142 +DC "C1'" "H1'" sing N N 143 +DC N1 C2 sing N N 144 +DC N1 C6 sing N N 145 +DC C2 O2 doub N N 146 +DC C2 N3 sing N N 147 +DC N3 C4 doub N N 148 +DC C4 N4 sing N N 149 +DC C4 C5 sing N N 150 +DC N4 H41 sing N N 151 +DC N4 H42 sing N N 152 +DC C5 C6 doub N N 153 +DC C5 H5 sing N N 154 +DC C6 H6 sing N N 155 +DG OP3 P sing N N 156 +DG OP3 HOP3 sing N N 157 +DG P OP1 doub N N 158 +DG P OP2 sing N N 159 +DG P "O5'" sing N N 160 +DG OP2 HOP2 sing N N 161 +DG "O5'" "C5'" sing N N 162 +DG "C5'" "C4'" sing N N 163 +DG "C5'" "H5'" sing N N 164 +DG "C5'" "H5''" sing N N 165 +DG "C4'" "O4'" sing N N 166 +DG "C4'" "C3'" sing N N 167 +DG "C4'" "H4'" sing N N 168 +DG "O4'" "C1'" sing N N 169 +DG "C3'" "O3'" sing N N 170 +DG "C3'" "C2'" sing N N 171 +DG "C3'" "H3'" sing N N 172 +DG "O3'" "HO3'" sing N N 173 +DG "C2'" "C1'" sing N N 174 +DG "C2'" "H2'" sing N N 175 +DG "C2'" "H2''" sing N N 176 +DG "C1'" N9 sing N N 177 +DG "C1'" "H1'" sing N N 178 +DG N9 C8 sing Y N 179 +DG N9 C4 sing Y N 180 +DG C8 N7 doub Y N 181 +DG C8 H8 sing N N 182 +DG N7 C5 sing Y N 183 +DG C5 C6 sing N N 184 +DG C5 C4 doub Y N 185 +DG C6 O6 doub N N 186 +DG C6 N1 sing N N 187 +DG N1 C2 sing N N 188 +DG N1 H1 sing N N 189 +DG C2 N2 sing N N 190 +DG C2 N3 doub N N 191 +DG N2 H21 sing N N 192 +DG N2 H22 sing N N 193 +DG N3 C4 sing N N 194 +DT OP3 P sing N N 195 +DT OP3 HOP3 sing N N 196 +DT P OP1 doub N N 197 +DT P OP2 sing N N 198 +DT P "O5'" sing N N 199 +DT OP2 HOP2 sing N N 200 +DT "O5'" "C5'" sing N N 201 +DT "C5'" "C4'" sing N N 202 +DT "C5'" "H5'" sing N N 203 +DT "C5'" "H5''" sing N N 204 +DT "C4'" "O4'" sing N N 205 +DT "C4'" "C3'" sing N N 206 +DT "C4'" "H4'" sing N N 207 +DT "O4'" "C1'" sing N N 208 +DT "C3'" "O3'" sing N N 209 +DT "C3'" "C2'" sing N N 210 +DT "C3'" "H3'" sing N N 211 +DT "O3'" "HO3'" sing N N 212 +DT "C2'" "C1'" sing N N 213 +DT "C2'" "H2'" sing N N 214 +DT "C2'" "H2''" sing N N 215 +DT "C1'" N1 sing N N 216 +DT "C1'" "H1'" sing N N 217 +DT N1 C2 sing N N 218 +DT N1 C6 sing N N 219 +DT C2 O2 doub N N 220 +DT C2 N3 sing N N 221 +DT N3 C4 sing N N 222 +DT N3 H3 sing N N 223 +DT C4 O4 doub N N 224 +DT C4 C5 sing N N 225 +DT C5 C7 sing N N 226 +DT C5 C6 doub N N 227 +DT C7 H71 sing N N 228 +DT C7 H72 sing N N 229 +DT C7 H73 sing N N 230 +DT C6 H6 sing N N 231 +GLN N CA sing N N 232 +GLN N H sing N N 233 +GLN N H2 sing N N 234 +GLN CA C sing N N 235 +GLN CA CB sing N N 236 +GLN CA HA sing N N 237 +GLN C O doub N N 238 +GLN C OXT sing N N 239 +GLN CB CG sing N N 240 +GLN CB HB2 sing N N 241 +GLN CB HB3 sing N N 242 +GLN CG CD sing N N 243 +GLN CG HG2 sing N N 244 +GLN CG HG3 sing N N 245 +GLN CD OE1 doub N N 246 +GLN CD NE2 sing N N 247 +GLN NE2 HE21 sing N N 248 +GLN NE2 HE22 sing N N 249 +GLN OXT HXT sing N N 250 +GLU N CA sing N N 251 +GLU N H sing N N 252 +GLU N H2 sing N N 253 +GLU CA C sing N N 254 +GLU CA CB sing N N 255 +GLU CA HA sing N N 256 +GLU C O doub N N 257 +GLU C OXT sing N N 258 +GLU CB CG sing N N 259 +GLU CB HB2 sing N N 260 +GLU CB HB3 sing N N 261 +GLU CG CD sing N N 262 +GLU CG HG2 sing N N 263 +GLU CG HG3 sing N N 264 +GLU CD OE1 doub N N 265 +GLU CD OE2 sing N N 266 +GLU OE2 HE2 sing N N 267 +GLU OXT HXT sing N N 268 +GLY N CA sing N N 269 +GLY N H sing N N 270 +GLY N H2 sing N N 271 +GLY CA C sing N N 272 +GLY CA HA2 sing N N 273 +GLY CA HA3 sing N N 274 +GLY C O doub N N 275 +GLY C OXT sing N N 276 +GLY OXT HXT sing N N 277 +HIS N CA sing N N 278 +HIS N H sing N N 279 +HIS N H2 sing N N 280 +HIS CA C sing N N 281 +HIS CA CB sing N N 282 +HIS CA HA sing N N 283 +HIS C O doub N N 284 +HIS C OXT sing N N 285 +HIS CB CG sing N N 286 +HIS CB HB2 sing N N 287 +HIS CB HB3 sing N N 288 +HIS CG ND1 sing Y N 289 +HIS CG CD2 doub Y N 290 +HIS ND1 CE1 doub Y N 291 +HIS ND1 HD1 sing N N 292 +HIS CD2 NE2 sing Y N 293 +HIS CD2 HD2 sing N N 294 +HIS CE1 NE2 sing Y N 295 +HIS CE1 HE1 sing N N 296 +HIS NE2 HE2 sing N N 297 +HIS OXT HXT sing N N 298 +HOH O H1 sing N N 299 +HOH O H2 sing N N 300 +ILE N CA sing N N 301 +ILE N H sing N N 302 +ILE N H2 sing N N 303 +ILE CA C sing N N 304 +ILE CA CB sing N N 305 +ILE CA HA sing N N 306 +ILE C O doub N N 307 +ILE C OXT sing N N 308 +ILE CB CG1 sing N N 309 +ILE CB CG2 sing N N 310 +ILE CB HB sing N N 311 +ILE CG1 CD1 sing N N 312 +ILE CG1 HG12 sing N N 313 +ILE CG1 HG13 sing N N 314 +ILE CG2 HG21 sing N N 315 +ILE CG2 HG22 sing N N 316 +ILE CG2 HG23 sing N N 317 +ILE CD1 HD11 sing N N 318 +ILE CD1 HD12 sing N N 319 +ILE CD1 HD13 sing N N 320 +ILE OXT HXT sing N N 321 +LEU N CA sing N N 322 +LEU N H sing N N 323 +LEU N H2 sing N N 324 +LEU CA C sing N N 325 +LEU CA CB sing N N 326 +LEU CA HA sing N N 327 +LEU C O doub N N 328 +LEU C OXT sing N N 329 +LEU CB CG sing N N 330 +LEU CB HB2 sing N N 331 +LEU CB HB3 sing N N 332 +LEU CG CD1 sing N N 333 +LEU CG CD2 sing N N 334 +LEU CG HG sing N N 335 +LEU CD1 HD11 sing N N 336 +LEU CD1 HD12 sing N N 337 +LEU CD1 HD13 sing N N 338 +LEU CD2 HD21 sing N N 339 +LEU CD2 HD22 sing N N 340 +LEU CD2 HD23 sing N N 341 +LEU OXT HXT sing N N 342 +LYS N CA sing N N 343 +LYS N H sing N N 344 +LYS N H2 sing N N 345 +LYS CA C sing N N 346 +LYS CA CB sing N N 347 +LYS CA HA sing N N 348 +LYS C O doub N N 349 +LYS C OXT sing N N 350 +LYS CB CG sing N N 351 +LYS CB HB2 sing N N 352 +LYS CB HB3 sing N N 353 +LYS CG CD sing N N 354 +LYS CG HG2 sing N N 355 +LYS CG HG3 sing N N 356 +LYS CD CE sing N N 357 +LYS CD HD2 sing N N 358 +LYS CD HD3 sing N N 359 +LYS CE NZ sing N N 360 +LYS CE HE2 sing N N 361 +LYS CE HE3 sing N N 362 +LYS NZ HZ1 sing N N 363 +LYS NZ HZ2 sing N N 364 +LYS NZ HZ3 sing N N 365 +LYS OXT HXT sing N N 366 +MET N CA sing N N 367 +MET N H sing N N 368 +MET N H2 sing N N 369 +MET CA C sing N N 370 +MET CA CB sing N N 371 +MET CA HA sing N N 372 +MET C O doub N N 373 +MET C OXT sing N N 374 +MET CB CG sing N N 375 +MET CB HB2 sing N N 376 +MET CB HB3 sing N N 377 +MET CG SD sing N N 378 +MET CG HG2 sing N N 379 +MET CG HG3 sing N N 380 +MET SD CE sing N N 381 +MET CE HE1 sing N N 382 +MET CE HE2 sing N N 383 +MET CE HE3 sing N N 384 +MET OXT HXT sing N N 385 +PHE N CA sing N N 386 +PHE N H sing N N 387 +PHE N H2 sing N N 388 +PHE CA C sing N N 389 +PHE CA CB sing N N 390 +PHE CA HA sing N N 391 +PHE C O doub N N 392 +PHE C OXT sing N N 393 +PHE CB CG sing N N 394 +PHE CB HB2 sing N N 395 +PHE CB HB3 sing N N 396 +PHE CG CD1 doub Y N 397 +PHE CG CD2 sing Y N 398 +PHE CD1 CE1 sing Y N 399 +PHE CD1 HD1 sing N N 400 +PHE CD2 CE2 doub Y N 401 +PHE CD2 HD2 sing N N 402 +PHE CE1 CZ doub Y N 403 +PHE CE1 HE1 sing N N 404 +PHE CE2 CZ sing Y N 405 +PHE CE2 HE2 sing N N 406 +PHE CZ HZ sing N N 407 +PHE OXT HXT sing N N 408 +PRO N CA sing N N 409 +PRO N CD sing N N 410 +PRO N H sing N N 411 +PRO CA C sing N N 412 +PRO CA CB sing N N 413 +PRO CA HA sing N N 414 +PRO C O doub N N 415 +PRO C OXT sing N N 416 +PRO CB CG sing N N 417 +PRO CB HB2 sing N N 418 +PRO CB HB3 sing N N 419 +PRO CG CD sing N N 420 +PRO CG HG2 sing N N 421 +PRO CG HG3 sing N N 422 +PRO CD HD2 sing N N 423 +PRO CD HD3 sing N N 424 +PRO OXT HXT sing N N 425 +SER N CA sing N N 426 +SER N H sing N N 427 +SER N H2 sing N N 428 +SER CA C sing N N 429 +SER CA CB sing N N 430 +SER CA HA sing N N 431 +SER C O doub N N 432 +SER C OXT sing N N 433 +SER CB OG sing N N 434 +SER CB HB2 sing N N 435 +SER CB HB3 sing N N 436 +SER OG HG sing N N 437 +SER OXT HXT sing N N 438 +THR N CA sing N N 439 +THR N H sing N N 440 +THR N H2 sing N N 441 +THR CA C sing N N 442 +THR CA CB sing N N 443 +THR CA HA sing N N 444 +THR C O doub N N 445 +THR C OXT sing N N 446 +THR CB OG1 sing N N 447 +THR CB CG2 sing N N 448 +THR CB HB sing N N 449 +THR OG1 HG1 sing N N 450 +THR CG2 HG21 sing N N 451 +THR CG2 HG22 sing N N 452 +THR CG2 HG23 sing N N 453 +THR OXT HXT sing N N 454 +TRP N CA sing N N 455 +TRP N H sing N N 456 +TRP N H2 sing N N 457 +TRP CA C sing N N 458 +TRP CA CB sing N N 459 +TRP CA HA sing N N 460 +TRP C O doub N N 461 +TRP C OXT sing N N 462 +TRP CB CG sing N N 463 +TRP CB HB2 sing N N 464 +TRP CB HB3 sing N N 465 +TRP CG CD1 doub Y N 466 +TRP CG CD2 sing Y N 467 +TRP CD1 NE1 sing Y N 468 +TRP CD1 HD1 sing N N 469 +TRP CD2 CE2 doub Y N 470 +TRP CD2 CE3 sing Y N 471 +TRP NE1 CE2 sing Y N 472 +TRP NE1 HE1 sing N N 473 +TRP CE2 CZ2 sing Y N 474 +TRP CE3 CZ3 doub Y N 475 +TRP CE3 HE3 sing N N 476 +TRP CZ2 CH2 doub Y N 477 +TRP CZ2 HZ2 sing N N 478 +TRP CZ3 CH2 sing Y N 479 +TRP CZ3 HZ3 sing N N 480 +TRP CH2 HH2 sing N N 481 +TRP OXT HXT sing N N 482 +TYR N CA sing N N 483 +TYR N H sing N N 484 +TYR N H2 sing N N 485 +TYR CA C sing N N 486 +TYR CA CB sing N N 487 +TYR CA HA sing N N 488 +TYR C O doub N N 489 +TYR C OXT sing N N 490 +TYR CB CG sing N N 491 +TYR CB HB2 sing N N 492 +TYR CB HB3 sing N N 493 +TYR CG CD1 doub Y N 494 +TYR CG CD2 sing Y N 495 +TYR CD1 CE1 sing Y N 496 +TYR CD1 HD1 sing N N 497 +TYR CD2 CE2 doub Y N 498 +TYR CD2 HD2 sing N N 499 +TYR CE1 CZ doub Y N 500 +TYR CE1 HE1 sing N N 501 +TYR CE2 CZ sing Y N 502 +TYR CE2 HE2 sing N N 503 +TYR CZ OH sing N N 504 +TYR OH HH sing N N 505 +TYR OXT HXT sing N N 506 +VAL N CA sing N N 507 +VAL N H sing N N 508 +VAL N H2 sing N N 509 +VAL CA C sing N N 510 +VAL CA CB sing N N 511 +VAL CA HA sing N N 512 +VAL C O doub N N 513 +VAL C OXT sing N N 514 +VAL CB CG1 sing N N 515 +VAL CB CG2 sing N N 516 +VAL CB HB sing N N 517 +VAL CG1 HG11 sing N N 518 +VAL CG1 HG12 sing N N 519 +VAL CG1 HG13 sing N N 520 +VAL CG2 HG21 sing N N 521 +VAL CG2 HG22 sing N N 522 +VAL CG2 HG23 sing N N 523 +VAL OXT HXT sing N N 524 +# +loop_ +_ndb_struct_conf_na.entry_id +_ndb_struct_conf_na.feature +2UZK 'double helix' +2UZK 'b-form double helix' +# +loop_ +_ndb_struct_na_base_pair.model_number +_ndb_struct_na_base_pair.i_label_asym_id +_ndb_struct_na_base_pair.i_label_comp_id +_ndb_struct_na_base_pair.i_label_seq_id +_ndb_struct_na_base_pair.i_symmetry +_ndb_struct_na_base_pair.j_label_asym_id +_ndb_struct_na_base_pair.j_label_comp_id +_ndb_struct_na_base_pair.j_label_seq_id +_ndb_struct_na_base_pair.j_symmetry +_ndb_struct_na_base_pair.shear +_ndb_struct_na_base_pair.stretch +_ndb_struct_na_base_pair.stagger +_ndb_struct_na_base_pair.buckle +_ndb_struct_na_base_pair.propeller +_ndb_struct_na_base_pair.opening +_ndb_struct_na_base_pair.pair_number +_ndb_struct_na_base_pair.pair_name +_ndb_struct_na_base_pair.i_auth_asym_id +_ndb_struct_na_base_pair.i_auth_seq_id +_ndb_struct_na_base_pair.i_PDB_ins_code +_ndb_struct_na_base_pair.j_auth_asym_id +_ndb_struct_na_base_pair.j_auth_seq_id +_ndb_struct_na_base_pair.j_PDB_ins_code +_ndb_struct_na_base_pair.hbond_type_28 +_ndb_struct_na_base_pair.hbond_type_12 +1 B DC 1 1_555 E DG 13 1_555 -0.229 0.370 0.103 -8.330 -5.036 3.669 1 B_DC1:DG37_E B 1 ? E 37 ? 19 1 +1 B DT 2 1_555 E DA 12 1_555 -0.937 -0.645 0.231 -0.380 -4.960 -5.146 2 B_DT2:DA36_E B 2 ? E 36 ? 20 1 +1 B DA 3 1_555 E DT 11 1_555 -0.745 -0.485 0.518 0.591 -3.155 -4.610 3 B_DA3:DT35_E B 3 ? E 35 ? 20 1 +1 B DT 4 1_555 E DA 10 1_555 -0.726 -0.629 -0.212 14.313 -17.568 7.353 4 B_DT4:DA34_E B 4 ? E 34 ? 20 1 +1 B DG 5 1_555 E DC 9 1_555 -1.324 -0.548 -0.148 -15.759 -7.691 -5.313 5 B_DG5:DC33_E B 5 ? E 33 ? 19 1 +1 B DT 6 1_555 E DA 8 1_555 0.293 -0.478 -0.143 7.567 -3.197 -2.013 6 B_DT6:DA32_E B 6 ? E 32 ? 20 1 +1 B DA 7 1_555 E DT 7 1_555 1.551 0.108 -0.288 0.789 -7.717 9.420 7 B_DA7:DT31_E B 7 ? E 31 ? 20 1 +1 B DA 8 1_555 E DT 6 1_555 -0.077 0.608 0.150 -4.137 4.390 10.809 8 B_DA8:DT30_E B 8 ? E 30 ? ? ? +1 B DA 9 1_555 E DT 5 1_555 -0.671 0.062 -0.343 0.498 -21.400 4.143 9 B_DA9:DT29_E B 9 ? E 29 ? 20 1 +1 B DC 10 1_555 E DG 4 1_555 0.641 0.508 -0.263 14.396 -5.750 24.181 10 B_DC10:DG28_E B 10 ? E 28 ? 22 1 +1 B DA 11 1_555 E DT 3 1_555 -0.562 0.124 -0.504 -4.138 -6.622 -2.461 11 B_DA11:DT27_E B 11 ? E 27 ? 20 1 +1 B DA 12 1_555 E DT 2 1_555 0.753 -0.435 0.577 19.491 -13.760 1.938 12 B_DA12:DT26_E B 12 ? E 26 ? 20 1 +1 B DC 13 1_555 E DG 1 1_555 1.147 -0.991 0.447 8.209 2.804 4.737 13 B_DC13:DG25_E B 13 ? E 25 ? 19 1 +1 D DT 2 1_555 F DA 12 1_555 -1.170 -0.645 -0.075 26.512 -7.479 -2.453 14 D_DT1002:DA1036_F D 1002 ? F 1036 ? 20 1 +1 D DA 3 1_555 F DT 11 1_555 1.061 0.105 -0.544 -21.452 2.849 -24.429 15 D_DA1003:DT1035_F D 1003 ? F 1035 ? 20 1 +1 D DT 4 1_555 F DA 10 1_555 -1.694 -0.105 0.034 -1.394 1.057 -5.491 16 D_DT1004:DA1034_F D 1004 ? F 1034 ? 20 1 +1 D DG 5 1_555 F DC 9 1_555 0.886 -0.017 -1.026 -27.138 5.030 -0.824 17 D_DG1005:DC1033_F D 1005 ? F 1033 ? 19 1 +1 D DT 6 1_555 F DA 8 1_555 1.162 -0.842 0.574 -11.681 -1.242 -7.399 18 D_DT1006:DA1032_F D 1006 ? F 1032 ? 20 1 +1 D DA 7 1_555 F DT 7 1_555 -1.219 -0.177 0.703 8.693 3.394 13.184 19 D_DA1007:DT1031_F D 1007 ? F 1031 ? 20 1 +1 D DA 8 1_555 F DT 6 1_555 0.765 -0.004 0.021 6.483 -2.502 13.488 20 D_DA1008:DT1030_F D 1008 ? F 1030 ? 20 1 +1 D DA 9 1_555 F DT 5 1_555 -0.423 -0.474 0.053 11.184 -5.766 -9.790 21 D_DA1009:DT1029_F D 1009 ? F 1029 ? 20 1 +1 D DC 10 1_555 F DG 4 1_555 -0.038 0.472 -0.513 20.996 -6.500 12.262 22 D_DC1010:DG1028_F D 1010 ? F 1028 ? 19 1 +1 D DA 11 1_555 F DT 3 1_555 -1.165 -0.190 0.348 7.168 -13.331 -12.748 23 D_DA1011:DT1027_F D 1011 ? F 1027 ? 20 1 +1 D DA 12 1_555 F DT 2 1_555 -0.020 -0.425 -0.087 21.977 -13.195 -2.643 24 D_DA1012:DT1026_F D 1012 ? F 1026 ? 20 1 +1 D DC 13 1_555 F DG 1 1_555 0.222 0.673 -1.172 33.355 -11.851 7.270 25 D_DC1013:DG1025_F D 1013 ? F 1025 ? 19 1 +# +loop_ +_ndb_struct_na_base_pair_step.model_number +_ndb_struct_na_base_pair_step.i_label_asym_id_1 +_ndb_struct_na_base_pair_step.i_label_comp_id_1 +_ndb_struct_na_base_pair_step.i_label_seq_id_1 +_ndb_struct_na_base_pair_step.i_symmetry_1 +_ndb_struct_na_base_pair_step.j_label_asym_id_1 +_ndb_struct_na_base_pair_step.j_label_comp_id_1 +_ndb_struct_na_base_pair_step.j_label_seq_id_1 +_ndb_struct_na_base_pair_step.j_symmetry_1 +_ndb_struct_na_base_pair_step.i_label_asym_id_2 +_ndb_struct_na_base_pair_step.i_label_comp_id_2 +_ndb_struct_na_base_pair_step.i_label_seq_id_2 +_ndb_struct_na_base_pair_step.i_symmetry_2 +_ndb_struct_na_base_pair_step.j_label_asym_id_2 +_ndb_struct_na_base_pair_step.j_label_comp_id_2 +_ndb_struct_na_base_pair_step.j_label_seq_id_2 +_ndb_struct_na_base_pair_step.j_symmetry_2 +_ndb_struct_na_base_pair_step.shift +_ndb_struct_na_base_pair_step.slide +_ndb_struct_na_base_pair_step.rise +_ndb_struct_na_base_pair_step.tilt +_ndb_struct_na_base_pair_step.roll +_ndb_struct_na_base_pair_step.twist +_ndb_struct_na_base_pair_step.x_displacement +_ndb_struct_na_base_pair_step.y_displacement +_ndb_struct_na_base_pair_step.helical_rise +_ndb_struct_na_base_pair_step.inclination +_ndb_struct_na_base_pair_step.tip +_ndb_struct_na_base_pair_step.helical_twist +_ndb_struct_na_base_pair_step.step_number +_ndb_struct_na_base_pair_step.step_name +_ndb_struct_na_base_pair_step.i_auth_asym_id_1 +_ndb_struct_na_base_pair_step.i_auth_seq_id_1 +_ndb_struct_na_base_pair_step.i_PDB_ins_code_1 +_ndb_struct_na_base_pair_step.j_auth_asym_id_1 +_ndb_struct_na_base_pair_step.j_auth_seq_id_1 +_ndb_struct_na_base_pair_step.j_PDB_ins_code_1 +_ndb_struct_na_base_pair_step.i_auth_asym_id_2 +_ndb_struct_na_base_pair_step.i_auth_seq_id_2 +_ndb_struct_na_base_pair_step.i_PDB_ins_code_2 +_ndb_struct_na_base_pair_step.j_auth_asym_id_2 +_ndb_struct_na_base_pair_step.j_auth_seq_id_2 +_ndb_struct_na_base_pair_step.j_PDB_ins_code_2 +1 B DC 1 1_555 E DG 13 1_555 B DT 2 1_555 E DA 12 1_555 -0.686 -0.676 2.963 -3.384 4.291 28.346 -2.219 0.697 2.892 8.661 +6.830 28.857 1 BB_DC1DT2:DA36DG37_EE B 1 ? E 37 ? B 2 ? E 36 ? +1 B DT 2 1_555 E DA 12 1_555 B DA 3 1_555 E DT 11 1_555 0.301 0.364 3.388 -1.248 2.227 40.469 0.268 -0.578 3.392 3.215 +1.802 40.546 2 BB_DT2DA3:DT35DA36_EE B 2 ? E 36 ? B 3 ? E 35 ? +1 B DA 3 1_555 E DT 11 1_555 B DT 4 1_555 E DA 10 1_555 0.113 -0.420 3.004 2.314 5.274 30.428 -1.713 0.194 2.893 9.937 +-4.360 30.956 3 BB_DA3DT4:DA34DT35_EE B 3 ? E 35 ? B 4 ? E 34 ? +1 B DT 4 1_555 E DA 10 1_555 B DG 5 1_555 E DC 9 1_555 -0.167 -0.591 4.094 -1.360 10.074 30.836 -3.232 0.006 3.725 18.332 +2.475 32.430 4 BB_DT4DG5:DC33DA34_EE B 4 ? E 34 ? B 5 ? E 33 ? +1 B DG 5 1_555 E DC 9 1_555 B DT 6 1_555 E DA 8 1_555 0.412 -0.349 2.895 -1.483 -1.744 39.218 -0.336 -0.769 2.891 -2.595 +2.208 39.282 5 BB_DG5DT6:DA32DC33_EE B 5 ? E 33 ? B 6 ? E 32 ? +1 B DT 6 1_555 E DA 8 1_555 B DA 7 1_555 E DT 7 1_555 -0.396 -0.027 3.377 2.441 12.161 35.491 -1.680 0.944 3.166 19.239 +-3.862 37.530 6 BB_DT6DA7:DT31DA32_EE B 6 ? E 32 ? B 7 ? E 31 ? +1 B DA 7 1_555 E DT 7 1_555 B DA 8 1_555 E DT 6 1_555 0.933 -0.807 3.312 -4.904 2.607 24.079 -2.659 -3.633 2.963 6.144 +11.559 24.702 7 BB_DA7DA8:DT30DT31_EE B 7 ? E 31 ? B 8 ? E 30 ? +1 B DA 8 1_555 E DT 6 1_555 B DA 9 1_555 E DT 5 1_555 -1.276 0.279 3.270 6.567 -0.364 30.681 0.581 3.546 2.937 -0.679 +-12.234 31.361 8 BB_DA8DA9:DT29DT30_EE B 8 ? E 30 ? B 9 ? E 29 ? +1 B DA 9 1_555 E DT 5 1_555 B DC 10 1_555 E DG 4 1_555 1.424 -0.598 2.754 -0.598 9.671 31.768 -2.368 -2.575 2.445 17.174 +1.063 33.176 9 BB_DA9DC10:DG28DT29_EE B 9 ? E 29 ? B 10 ? E 28 ? +1 B DC 10 1_555 E DG 4 1_555 B DA 11 1_555 E DT 3 1_555 -2.305 0.365 3.739 -8.038 16.281 36.601 -1.720 2.205 3.955 24.185 +11.940 40.719 10 BB_DC10DA11:DT27DG28_EE B 10 ? E 28 ? B 11 ? E 27 ? +1 B DA 11 1_555 E DT 3 1_555 B DA 12 1_555 E DT 2 1_555 0.332 -0.410 2.748 -1.726 -3.502 35.885 -0.243 -0.742 2.756 -5.664 +2.791 36.090 11 BB_DA11DA12:DT26DT27_EE B 11 ? E 27 ? B 12 ? E 26 ? +1 B DA 12 1_555 E DT 2 1_555 B DC 13 1_555 E DG 1 1_555 1.002 -0.975 3.514 0.643 2.116 35.407 -1.932 -1.545 3.469 3.475 +-1.056 35.474 12 BB_DA12DC13:DG25DT26_EE B 12 ? E 26 ? B 13 ? E 25 ? +1 D DT 2 1_555 F DA 12 1_555 D DA 3 1_555 F DT 11 1_555 -1.351 -0.709 4.425 1.023 7.221 50.011 -1.515 1.680 4.264 8.489 +-1.202 50.506 13 DD_DT1002DA1003:DT1035DA1036_FF D 1002 ? F 1036 ? D 1003 ? F 1035 ? +1 D DA 3 1_555 F DT 11 1_555 D DT 4 1_555 F DA 10 1_555 1.232 -0.771 2.908 -5.889 6.402 23.774 -3.278 -4.208 2.260 14.916 +13.721 25.294 14 DD_DA1003DT1004:DA1034DT1035_FF D 1003 ? F 1035 ? D 1004 ? F 1034 ? +1 D DT 4 1_555 F DA 10 1_555 D DG 5 1_555 F DC 9 1_555 0.136 0.199 3.994 5.895 4.743 52.472 -0.150 0.312 3.989 5.333 +-6.628 52.977 15 DD_DT1004DG1005:DC1033DA1034_FF D 1004 ? F 1034 ? D 1005 ? F 1033 ? +1 D DG 5 1_555 F DC 9 1_555 D DT 6 1_555 F DA 8 1_555 -1.707 -0.903 3.085 -10.463 6.085 22.173 -3.890 0.773 3.201 14.513 +24.957 25.225 16 DD_DG1005DT1006:DA1032DC1033_FF D 1005 ? F 1033 ? D 1006 ? F 1032 ? +1 D DT 6 1_555 F DA 8 1_555 D DA 7 1_555 F DT 7 1_555 1.200 -1.199 2.342 -1.082 -1.616 23.067 -2.583 -3.262 2.361 -4.031 +2.701 23.148 17 DD_DT1006DA1007:DT1031DA1032_FF D 1006 ? F 1032 ? D 1007 ? F 1031 ? +1 D DA 7 1_555 F DT 7 1_555 D DA 8 1_555 F DT 6 1_555 -0.032 -0.458 3.563 5.479 0.427 37.594 -0.763 0.810 3.519 0.659 +-8.447 37.979 18 DD_DA1007DA1008:DT1030DT1031_FF D 1007 ? F 1031 ? D 1008 ? F 1030 ? +1 D DA 8 1_555 F DT 6 1_555 D DA 9 1_555 F DT 5 1_555 -1.116 -0.309 2.962 -1.203 6.126 27.091 -1.972 2.063 2.870 12.861 +2.526 27.788 19 DD_DA1008DA1009:DT1029DT1030_FF D 1008 ? F 1030 ? D 1009 ? F 1029 ? +1 D DA 9 1_555 F DT 5 1_555 D DC 10 1_555 F DG 4 1_555 0.644 -0.631 2.984 3.509 11.247 29.070 -3.061 -0.602 2.623 21.335 +-6.656 31.319 20 DD_DA1009DC1010:DG1028DT1029_FF D 1009 ? F 1029 ? D 1010 ? F 1028 ? +1 D DC 10 1_555 F DG 4 1_555 D DA 11 1_555 F DT 3 1_555 -1.928 -0.750 3.559 -13.543 0.721 34.540 -1.296 0.855 3.997 1.161 +21.797 37.032 21 DD_DC1010DA1011:DT1027DG1028_FF D 1010 ? F 1028 ? D 1011 ? F 1027 ? +1 D DA 11 1_555 F DT 3 1_555 D DA 12 1_555 F DT 2 1_555 1.146 -0.445 3.134 8.145 0.646 35.408 -0.804 -0.705 3.300 1.045 +-13.175 36.309 22 DD_DA1011DA1012:DT1026DT1027_FF D 1011 ? F 1027 ? D 1012 ? F 1026 ? +1 D DA 12 1_555 F DT 2 1_555 D DC 13 1_555 F DG 1 1_555 0.966 -0.322 3.109 7.932 1.832 29.604 -0.964 -0.286 3.228 3.503 +-15.165 30.679 23 DD_DA1012DC1013:DG1025DT1026_FF D 1012 ? F 1026 ? D 1013 ? F 1025 ? +# +_pdbx_entity_nonpoly.entity_id 4 +_pdbx_entity_nonpoly.name water +_pdbx_entity_nonpoly.comp_id HOH +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 2C6Y +_pdbx_initial_refinement_model.details 'PDB ENTRY 2C6Y' +#