# By using this file you agree to the legally binding terms of use found at alphafoldserver.com/output-terms data_1e2543e020292cc0 # _entry.id 1e2543e020292cc0 # loop_ _atom_type.symbol C N O S # loop_ _audit_author.name _audit_author.pdbx_ordinal "Google DeepMind" 1 "Isomorphic Labs" 2 # _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 # loop_ _chem_comp.formula _chem_comp.formula_weight _chem_comp.id _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_smiles _chem_comp.pdbx_synonyms _chem_comp.type "C3 H7 N O2" 89.093 ALA y ALANINE C[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE N[C@@H](CCCNC(N)=[NH2+])C(O)=O ? "L-PEPTIDE LINKING" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE N[C@@H](CC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" N[C@@H](CC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE N[C@@H](CS)C(O)=O ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE N[C@@H](CCC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" N[C@@H](CCC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE NCC(O)=O ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE N[C@@H](Cc1c[nH]c[nH+]1)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE N[C@@H](CCCC[NH3+])C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE N[C@@H](Cc1ccccc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE OC(=O)[C@@H]1CCCN1 ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE N[C@@H](CO)C(O)=O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@@H](O)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE N[C@@H](Cc1ccc(O)cc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" # _citation.book_publisher ? _citation.country UK _citation.id primary _citation.journal_full Nature _citation.journal_id_ASTM NATUAS _citation.journal_id_CSD 0006 _citation.journal_id_ISSN 0028-0836 _citation.journal_volume 630 _citation.page_first 493 _citation.page_last 500 _citation.pdbx_database_id_DOI 10.1038/s41586-024-07487-w _citation.pdbx_database_id_PubMed 38718835 _citation.title "Accurate structure prediction of biomolecular interactions with AlphaFold 3" _citation.year 2024 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary "Google DeepMind" 1 primary "Isomorphic Labs" 2 # _entity.id 1 _entity.pdbx_description . _entity.type polymer # _entity_poly.entity_id 1 _entity_poly.pdbx_strand_id A _entity_poly.type polypeptide(L) # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 1 n MET 1 1 n ALA 2 1 n LYS 3 1 n ILE 4 1 n LEU 5 1 n MET 6 1 n ALA 7 1 n CYS 8 1 n GLU 9 1 n LEU 10 1 n LEU 11 1 n VAL 12 1 n GLY 13 1 n ASP 14 1 n GLU 15 1 n ILE 16 1 n LEU 17 1 n THR 18 1 n HIS 19 1 n VAL 20 1 n ASP 21 1 n VAL 22 1 n ASN 23 1 n ASP 24 1 n PRO 25 1 n VAL 26 1 n ARG 27 1 n ARG 28 1 n ARG 29 1 n ALA 30 1 n ILE 31 1 n VAL 32 1 n LEU 33 1 n ARG 34 1 n SER 35 1 n GLY 36 1 n ALA 37 1 n ALA 38 1 n PRO 39 1 n HIS 40 1 n SER 41 1 n LYS 42 1 n VAL 43 1 n SER 44 1 n ILE 45 1 n GLU 46 1 n VAL 47 1 n SER 48 1 n ALA 49 1 n LEU 50 1 n ILE 51 1 n GLY 52 1 n ALA 53 1 n ASP 54 1 n TRP 55 1 n VAL 56 1 n ASP 57 1 n PHE 58 1 n LYS 59 1 n LEU 60 1 n LYS 61 1 n LEU 62 1 n ALA 63 1 n GLY 64 1 n THR 65 1 n ILE 66 1 n LEU 67 1 n PRO 68 1 n SER 69 1 n ALA 70 1 n TYR 71 1 n MET 72 1 n THR 73 1 n SER 74 1 n THR 75 1 n ARG 76 1 n SER 77 1 n ALA 78 1 n LEU 79 1 n ALA 80 1 n ALA 81 1 n LEU 82 1 n PRO 83 1 n ASN 84 1 n ARG 85 1 n ARG 86 1 n THR 87 1 n PRO 88 1 n TRP 89 1 n GLN 90 1 n LYS 91 1 n LEU 92 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (8a86c86b-cd0c-4cd5-baf1-242c30a5bfc7 @ 2025-07-28 00:25:57)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 45.55 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # _ma_target_entity.data_id 1 _ma_target_entity.entity_id 1 _ma_target_entity.origin . # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.details . _ma_target_entity_instance.entity_id 1 # loop_ _pdbx_data_usage.details _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.url ;NON-COMMERCIAL USE ONLY, BY USING THIS FILE YOU AGREE TO THE TERMS OF USE FOUND AT alphafoldserver.com/output-terms. ; 1 license ? ;THE INFORMATION IS NOT INTENDED FOR, HAS NOT BEEN VALIDATED FOR, AND IS NOT APPROVED FOR CLINICAL USE. IT SHOULD NOT BE USED FOR CLINICAL PURPOSE OR RELIED ON FOR MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION SHALL NOT INFRINGE THE RIGHTS OF ANY THIRD PARTY. ; 2 disclaimer ? # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.hetero _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.seq_id A 1 1 n MET . 1 A 1 A 2 1 n ALA . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n ILE . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n MET . 6 A 6 A 7 1 n ALA . 7 A 7 A 8 1 n CYS . 8 A 8 A 9 1 n GLU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n GLY . 13 A 13 A 14 1 n ASP . 14 A 14 A 15 1 n GLU . 15 A 15 A 16 1 n ILE . 16 A 16 A 17 1 n LEU . 17 A 17 A 18 1 n THR . 18 A 18 A 19 1 n HIS . 19 A 19 A 20 1 n VAL . 20 A 20 A 21 1 n ASP . 21 A 21 A 22 1 n VAL . 22 A 22 A 23 1 n ASN . 23 A 23 A 24 1 n ASP . 24 A 24 A 25 1 n PRO . 25 A 25 A 26 1 n VAL . 26 A 26 A 27 1 n ARG . 27 A 27 A 28 1 n ARG . 28 A 28 A 29 1 n ARG . 29 A 29 A 30 1 n ALA . 30 A 30 A 31 1 n ILE . 31 A 31 A 32 1 n VAL . 32 A 32 A 33 1 n LEU . 33 A 33 A 34 1 n ARG . 34 A 34 A 35 1 n SER . 35 A 35 A 36 1 n GLY . 36 A 36 A 37 1 n ALA . 37 A 37 A 38 1 n ALA . 38 A 38 A 39 1 n PRO . 39 A 39 A 40 1 n HIS . 40 A 40 A 41 1 n SER . 41 A 41 A 42 1 n LYS . 42 A 42 A 43 1 n VAL . 43 A 43 A 44 1 n SER . 44 A 44 A 45 1 n ILE . 45 A 45 A 46 1 n GLU . 46 A 46 A 47 1 n VAL . 47 A 47 A 48 1 n SER . 48 A 48 A 49 1 n ALA . 49 A 49 A 50 1 n LEU . 50 A 50 A 51 1 n ILE . 51 A 51 A 52 1 n GLY . 52 A 52 A 53 1 n ALA . 53 A 53 A 54 1 n ASP . 54 A 54 A 55 1 n TRP . 55 A 55 A 56 1 n VAL . 56 A 56 A 57 1 n ASP . 57 A 57 A 58 1 n PHE . 58 A 58 A 59 1 n LYS . 59 A 59 A 60 1 n LEU . 60 A 60 A 61 1 n LYS . 61 A 61 A 62 1 n LEU . 62 A 62 A 63 1 n ALA . 63 A 63 A 64 1 n GLY . 64 A 64 A 65 1 n THR . 65 A 65 A 66 1 n ILE . 66 A 66 A 67 1 n LEU . 67 A 67 A 68 1 n PRO . 68 A 68 A 69 1 n SER . 69 A 69 A 70 1 n ALA . 70 A 70 A 71 1 n TYR . 71 A 71 A 72 1 n MET . 72 A 72 A 73 1 n THR . 73 A 73 A 74 1 n SER . 74 A 74 A 75 1 n THR . 75 A 75 A 76 1 n ARG . 76 A 76 A 77 1 n SER . 77 A 77 A 78 1 n ALA . 78 A 78 A 79 1 n LEU . 79 A 79 A 80 1 n ALA . 80 A 80 A 81 1 n ALA . 81 A 81 A 82 1 n LEU . 82 A 82 A 83 1 n PRO . 83 A 83 A 84 1 n ASN . 84 A 84 A 85 1 n ARG . 85 A 85 A 86 1 n ARG . 86 A 86 A 87 1 n THR . 87 A 87 A 88 1 n PRO . 88 A 88 A 89 1 n TRP . 89 A 89 A 90 1 n GLN . 90 A 90 A 91 1 n LYS . 91 A 91 A 92 1 n LEU . 92 A 92 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (8a86c86b-cd0c-4cd5-baf1-242c30a5bfc7 @ 2025-07-28 00:25:57)" # _struct_asym.entity_id 1 _struct_asym.id A # 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.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? 13.271 -3.604 20.016 1.00 30.70 1 A 1 ATOM 2 C CA . MET A 1 1 ? 12.962 -4.037 18.639 1.00 39.21 1 A 1 ATOM 3 C C . MET A 1 1 ? 11.662 -3.370 18.210 1.00 39.48 1 A 1 ATOM 4 O O . MET A 1 1 ? 10.615 -3.719 18.730 1.00 39.04 1 A 1 ATOM 5 C CB . MET A 1 1 ? 12.832 -5.569 18.552 1.00 38.38 1 A 1 ATOM 6 C CG . MET A 1 1 ? 14.189 -6.267 18.604 1.00 32.92 1 A 1 ATOM 7 S SD . MET A 1 1 ? 14.023 -8.079 18.530 1.00 30.62 1 A 1 ATOM 8 C CE . MET A 1 1 ? 15.753 -8.556 18.272 1.00 27.52 1 A 1 ATOM 9 N N . ALA A 1 2 ? 11.734 -2.370 17.344 1.00 34.41 2 A 1 ATOM 10 C CA . ALA A 1 2 ? 10.543 -1.676 16.865 1.00 37.83 2 A 1 ATOM 11 C C . ALA A 1 2 ? 9.921 -2.491 15.721 1.00 37.99 2 A 1 ATOM 12 O O . ALA A 1 2 ? 10.552 -2.689 14.687 1.00 36.46 2 A 1 ATOM 13 C CB . ALA A 1 2 ? 10.922 -0.250 16.437 1.00 37.46 2 A 1 ATOM 14 N N . LYS A 1 3 ? 8.699 -2.993 15.915 1.00 30.66 3 A 1 ATOM 15 C CA . LYS A 1 3 ? 7.896 -3.562 14.838 1.00 34.53 3 A 1 ATOM 16 C C . LYS A 1 3 ? 7.367 -2.404 13.992 1.00 34.54 3 A 1 ATOM 17 O O . LYS A 1 3 ? 6.447 -1.709 14.417 1.00 34.03 3 A 1 ATOM 18 C CB . LYS A 1 3 ? 6.741 -4.414 15.401 1.00 35.39 3 A 1 ATOM 19 C CG . LYS A 1 3 ? 7.184 -5.817 15.848 1.00 32.60 3 A 1 ATOM 20 C CD . LYS A 1 3 ? 5.989 -6.609 16.406 1.00 31.18 3 A 1 ATOM 21 C CE . LYS A 1 3 ? 6.398 -8.042 16.776 1.00 29.06 3 A 1 ATOM 22 N NZ . LYS A 1 3 ? 5.270 -8.809 17.366 1.00 26.78 3 A 1 ATOM 23 N N . ILE A 1 4 ? 7.965 -2.188 12.827 1.00 31.98 4 A 1 ATOM 24 C CA . ILE A 1 4 ? 7.426 -1.253 11.839 1.00 33.42 4 A 1 ATOM 25 C C . ILE A 1 4 ? 6.247 -1.952 11.172 1.00 34.30 4 A 1 ATOM 26 O O . ILE A 1 4 ? 6.419 -2.845 10.348 1.00 33.86 4 A 1 ATOM 27 C CB . ILE A 1 4 ? 8.514 -0.795 10.841 1.00 33.22 4 A 1 ATOM 28 C CG1 . ILE A 1 4 ? 9.677 -0.098 11.592 1.00 30.63 4 A 1 ATOM 29 C CG2 . ILE A 1 4 ? 7.901 0.154 9.791 1.00 31.61 4 A 1 ATOM 30 C CD1 . ILE A 1 4 ? 10.870 0.286 10.707 1.00 29.50 4 A 1 ATOM 31 N N . LEU A 1 5 ? 5.030 -1.588 11.584 1.00 31.01 5 A 1 ATOM 32 C CA . LEU A 1 5 ? 3.793 -2.021 10.944 1.00 32.01 5 A 1 ATOM 33 C C . LEU A 1 5 ? 3.588 -1.125 9.719 1.00 33.25 5 A 1 ATOM 34 O O . LEU A 1 5 ? 3.120 0.000 9.833 1.00 32.62 5 A 1 ATOM 35 C CB . LEU A 1 5 ? 2.650 -1.974 11.983 1.00 30.79 5 A 1 ATOM 36 C CG . LEU A 1 5 ? 1.790 -3.253 12.007 1.00 28.05 5 A 1 ATOM 37 C CD1 . LEU A 1 5 ? 1.723 -3.822 13.426 1.00 25.92 5 A 1 ATOM 38 C CD2 . LEU A 1 5 ? 0.357 -2.994 11.537 1.00 27.19 5 A 1 ATOM 39 N N . MET A 1 6 ? 4.031 -1.590 8.552 1.00 32.45 6 A 1 ATOM 40 C CA . MET A 1 6 ? 3.727 -0.940 7.276 1.00 33.43 6 A 1 ATOM 41 C C . MET A 1 6 ? 2.279 -1.252 6.922 1.00 34.13 6 A 1 ATOM 42 O O . MET A 1 6 ? 1.975 -2.337 6.443 1.00 33.74 6 A 1 ATOM 43 C CB . MET A 1 6 ? 4.697 -1.423 6.179 1.00 32.68 6 A 1 ATOM 44 C CG . MET A 1 6 ? 6.110 -0.836 6.342 1.00 29.27 6 A 1 ATOM 45 S SD . MET A 1 6 ? 6.294 0.887 5.814 1.00 27.08 6 A 1 ATOM 46 C CE . MET A 1 6 ? 6.158 0.704 4.014 1.00 25.25 6 A 1 ATOM 47 N N . ALA A 1 7 ? 1.370 -0.320 7.188 1.00 32.45 7 A 1 ATOM 48 C CA . ALA A 1 7 ? 0.010 -0.366 6.666 1.00 32.37 7 A 1 ATOM 49 C C . ALA A 1 7 ? 0.073 -0.026 5.170 1.00 33.03 7 A 1 ATOM 50 O O . ALA A 1 7 ? -0.003 1.126 4.774 1.00 32.33 7 A 1 ATOM 51 C CB . ALA A 1 7 ? -0.870 0.592 7.481 1.00 30.55 7 A 1 ATOM 52 N N . CYS A 1 8 ? 0.281 -1.044 4.328 1.00 34.49 8 A 1 ATOM 53 C CA . CYS A 1 8 ? 0.032 -0.928 2.904 1.00 34.64 8 A 1 ATOM 54 C C . CYS A 1 8 ? -1.469 -1.110 2.691 1.00 35.28 8 A 1 ATOM 55 O O . CYS A 1 8 ? -1.987 -2.220 2.779 1.00 34.38 8 A 1 ATOM 56 C CB . CYS A 1 8 ? 0.860 -1.965 2.126 1.00 33.32 8 A 1 ATOM 57 S SG . CYS A 1 8 ? 2.614 -1.520 2.182 1.00 30.48 8 A 1 ATOM 58 N N . GLU A 1 9 ? -2.177 -0.011 2.450 1.00 31.72 9 A 1 ATOM 59 C CA . GLU A 1 9 ? -3.557 -0.065 1.982 1.00 32.87 9 A 1 ATOM 60 C C . GLU A 1 9 ? -3.532 -0.615 0.553 1.00 33.67 9 A 1 ATOM 61 O O . GLU A 1 9 ? -3.129 0.059 -0.393 1.00 32.81 9 A 1 ATOM 62 C CB . GLU A 1 9 ? -4.187 1.329 2.128 1.00 31.86 9 A 1 ATOM 63 C CG . GLU A 1 9 ? -5.724 1.283 2.137 1.00 28.68 9 A 1 ATOM 64 C CD . GLU A 1 9 ? -6.350 2.642 2.527 1.00 27.10 9 A 1 ATOM 65 O OE1 . GLU A 1 9 ? -7.535 2.639 2.935 1.00 25.20 9 A 1 ATOM 66 O OE2 . GLU A 1 9 ? -5.638 3.667 2.435 1.00 26.47 9 A 1 ATOM 67 N N . LEU A 1 10 ? -3.857 -1.897 0.403 1.00 39.69 10 A 1 ATOM 68 C CA . LEU A 1 10 ? -3.957 -2.533 -0.896 1.00 40.13 10 A 1 ATOM 69 C C . LEU A 1 10 ? -5.299 -2.113 -1.517 1.00 39.96 10 A 1 ATOM 70 O O . LEU A 1 10 ? -6.319 -2.754 -1.305 1.00 38.61 10 A 1 ATOM 71 C CB . LEU A 1 10 ? -3.811 -4.066 -0.738 1.00 39.35 10 A 1 ATOM 72 C CG . LEU A 1 10 ? -3.607 -4.786 -2.081 1.00 37.00 10 A 1 ATOM 73 C CD1 . LEU A 1 10 ? -2.152 -4.710 -2.530 1.00 34.78 10 A 1 ATOM 74 C CD2 . LEU A 1 10 ? -4.003 -6.262 -1.976 1.00 34.97 10 A 1 ATOM 75 N N . LEU A 1 11 ? -5.273 -1.022 -2.284 1.00 35.52 11 A 1 ATOM 76 C CA . LEU A 1 11 ? -6.368 -0.680 -3.182 1.00 35.42 11 A 1 ATOM 77 C C . LEU A 1 11 ? -6.380 -1.708 -4.321 1.00 35.56 11 A 1 ATOM 78 O O . LEU A 1 11 ? -5.750 -1.524 -5.357 1.00 33.81 11 A 1 ATOM 79 C CB . LEU A 1 11 ? -6.210 0.771 -3.679 1.00 33.19 11 A 1 ATOM 80 C CG . LEU A 1 11 ? -6.691 1.816 -2.657 1.00 30.34 11 A 1 ATOM 81 C CD1 . LEU A 1 11 ? -6.091 3.189 -2.974 1.00 27.64 11 A 1 ATOM 82 C CD2 . LEU A 1 11 ? -8.216 1.958 -2.683 1.00 28.15 11 A 1 ATOM 83 N N . VAL A 1 12 ? -7.071 -2.834 -4.102 1.00 38.62 12 A 1 ATOM 84 C CA . VAL A 1 12 ? -7.471 -3.730 -5.181 1.00 39.16 12 A 1 ATOM 85 C C . VAL A 1 12 ? -8.547 -2.987 -5.954 1.00 39.48 12 A 1 ATOM 86 O O . VAL A 1 12 ? -9.706 -2.974 -5.555 1.00 38.42 12 A 1 ATOM 87 C CB . VAL A 1 12 ? -7.954 -5.095 -4.649 1.00 37.99 12 A 1 ATOM 88 C CG1 . VAL A 1 12 ? -8.295 -6.051 -5.802 1.00 35.60 12 A 1 ATOM 89 C CG2 . VAL A 1 12 ? -6.886 -5.777 -3.798 1.00 34.73 12 A 1 ATOM 90 N N . GLY A 1 13 ? -8.137 -2.267 -7.015 1.00 38.24 13 A 1 ATOM 91 C CA . GLY A 1 13 ? -9.065 -1.559 -7.876 1.00 38.29 13 A 1 ATOM 92 C C . GLY A 1 13 ? -10.108 -2.524 -8.445 1.00 38.77 13 A 1 ATOM 93 O O . GLY A 1 13 ? -9.773 -3.660 -8.792 1.00 36.74 13 A 1 ATOM 94 N N . ASP A 1 14 ? -11.342 -2.053 -8.550 1.00 36.20 14 A 1 ATOM 95 C CA . ASP A 1 14 ? -12.503 -2.768 -9.107 1.00 37.54 14 A 1 ATOM 96 C C . ASP A 1 14 ? -12.213 -3.408 -10.477 1.00 38.87 14 A 1 ATOM 97 O O . ASP A 1 14 ? -12.801 -4.428 -10.833 1.00 37.38 14 A 1 ATOM 98 C CB . ASP A 1 14 ? -13.668 -1.763 -9.232 1.00 35.97 14 A 1 ATOM 99 C CG . ASP A 1 14 ? -14.877 -2.037 -8.325 1.00 32.85 14 A 1 ATOM 100 O OD1 . ASP A 1 14 ? -14.977 -3.150 -7.754 1.00 29.83 14 A 1 ATOM 101 O OD2 . ASP A 1 14 ? -15.724 -1.112 -8.221 1.00 30.03 14 A 1 ATOM 102 N N . GLU A 1 15 ? -11.236 -2.886 -11.221 1.00 35.06 15 A 1 ATOM 103 C CA . GLU A 1 15 ? -10.808 -3.376 -12.540 1.00 36.17 15 A 1 ATOM 104 C C . GLU A 1 15 ? -10.240 -4.810 -12.528 1.00 37.10 15 A 1 ATOM 105 O O . GLU A 1 15 ? -10.335 -5.508 -13.530 1.00 35.64 15 A 1 ATOM 106 C CB . GLU A 1 15 ? -9.771 -2.403 -13.123 1.00 34.65 15 A 1 ATOM 107 C CG . GLU A 1 15 ? -10.387 -1.033 -13.457 1.00 31.00 15 A 1 ATOM 108 C CD . GLU A 1 15 ? -9.375 -0.051 -14.067 1.00 29.31 15 A 1 ATOM 109 O OE1 . GLU A 1 15 ? -9.836 0.962 -14.642 1.00 27.26 15 A 1 ATOM 110 O OE2 . GLU A 1 15 ? -8.149 -0.292 -13.931 1.00 28.28 15 A 1 ATOM 111 N N . ILE A 1 16 ? -9.693 -5.291 -11.411 1.00 39.58 16 A 1 ATOM 112 C CA . ILE A 1 16 ? -9.234 -6.694 -11.307 1.00 40.19 16 A 1 ATOM 113 C C . ILE A 1 16 ? -10.425 -7.656 -11.132 1.00 39.98 16 A 1 ATOM 114 O O . ILE A 1 16 ? -10.314 -8.852 -11.411 1.00 39.14 16 A 1 ATOM 115 C CB . ILE A 1 16 ? -8.161 -6.832 -10.193 1.00 39.64 16 A 1 ATOM 116 C CG1 . ILE A 1 16 ? -6.951 -5.894 -10.488 1.00 37.85 16 A 1 ATOM 117 C CG2 . ILE A 1 16 ? -7.675 -8.284 -10.048 1.00 37.35 16 A 1 ATOM 118 C CD1 . ILE A 1 16 ? -5.843 -5.900 -9.419 1.00 35.51 16 A 1 ATOM 119 N N . LEU A 1 17 ? -11.581 -7.152 -10.705 1.00 37.44 17 A 1 ATOM 120 C CA . LEU A 1 17 ? -12.789 -7.934 -10.470 1.00 38.38 17 A 1 ATOM 121 C C . LEU A 1 17 ? -13.747 -7.956 -11.666 1.00 38.88 17 A 1 ATOM 122 O O . LEU A 1 17 ? -14.585 -8.851 -11.734 1.00 37.37 17 A 1 ATOM 123 C CB . LEU A 1 17 ? -13.480 -7.420 -9.196 1.00 36.75 17 A 1 ATOM 124 C CG . LEU A 1 17 ? -12.662 -7.623 -7.900 1.00 34.26 17 A 1 ATOM 125 C CD1 . LEU A 1 17 ? -13.370 -6.938 -6.723 1.00 31.45 17 A 1 ATOM 126 C CD2 . LEU A 1 17 ? -12.505 -9.101 -7.546 1.00 31.70 17 A 1 ATOM 127 N N . THR A 1 18 ? -13.616 -7.024 -12.627 1.00 37.63 18 A 1 ATOM 128 C CA . THR A 1 18 ? -14.571 -6.865 -13.744 1.00 38.82 18 A 1 ATOM 129 C C . THR A 1 18 ? -14.331 -7.793 -14.939 1.00 39.02 18 A 1 ATOM 130 O O . THR A 1 18 ? -15.209 -7.924 -15.784 1.00 36.88 18 A 1 ATOM 131 C CB . THR A 1 18 ? -14.620 -5.407 -14.222 1.00 36.62 18 A 1 ATOM 132 O OG1 . THR A 1 18 ? -13.321 -4.908 -14.416 1.00 33.95 18 A 1 ATOM 133 C CG2 . THR A 1 18 ? -15.307 -4.502 -13.202 1.00 32.65 18 A 1 ATOM 134 N N . HIS A 1 19 ? -13.192 -8.492 -15.002 1.00 41.07 19 A 1 ATOM 135 C CA . HIS A 1 19 ? -12.902 -9.471 -16.065 1.00 42.08 19 A 1 ATOM 136 C C . HIS A 1 19 ? -13.118 -10.927 -15.641 1.00 43.04 19 A 1 ATOM 137 O O . HIS A 1 19 ? -12.444 -11.837 -16.122 1.00 41.96 19 A 1 ATOM 138 C CB . HIS A 1 19 ? -11.523 -9.194 -16.676 1.00 39.56 19 A 1 ATOM 139 C CG . HIS A 1 19 ? -11.542 -7.991 -17.589 1.00 36.70 19 A 1 ATOM 140 N ND1 . HIS A 1 19 ? -12.325 -7.863 -18.715 1.00 33.30 19 A 1 ATOM 141 C CD2 . HIS A 1 19 ? -10.801 -6.852 -17.461 1.00 32.87 19 A 1 ATOM 142 C CE1 . HIS A 1 19 ? -12.058 -6.661 -19.256 1.00 30.98 19 A 1 ATOM 143 N NE2 . HIS A 1 19 ? -11.130 -6.007 -18.534 1.00 30.76 19 A 1 ATOM 144 N N . VAL A 1 20 ? -14.065 -11.167 -14.740 1.00 43.36 20 A 1 ATOM 145 C CA . VAL A 1 20 ? -14.463 -12.538 -14.393 1.00 44.23 20 A 1 ATOM 146 C C . VAL A 1 20 ? -15.595 -12.955 -15.321 1.00 45.03 20 A 1 ATOM 147 O O . VAL A 1 20 ? -16.712 -12.469 -15.180 1.00 43.49 20 A 1 ATOM 148 C CB . VAL A 1 20 ? -14.826 -12.665 -12.915 1.00 41.90 20 A 1 ATOM 149 C CG1 . VAL A 1 20 ? -15.128 -14.127 -12.545 1.00 38.79 20 A 1 ATOM 150 C CG2 . VAL A 1 20 ? -13.640 -12.184 -12.078 1.00 38.03 20 A 1 ATOM 151 N N . ASP A 1 21 ? -15.283 -13.843 -16.249 1.00 43.39 21 A 1 ATOM 152 C CA . ASP A 1 21 ? -16.299 -14.484 -17.077 1.00 45.22 21 A 1 ATOM 153 C C . ASP A 1 21 ? -17.320 -15.188 -16.174 1.00 46.11 21 A 1 ATOM 154 O O . ASP A 1 21 ? -16.967 -16.010 -15.328 1.00 44.85 21 A 1 ATOM 155 C CB . ASP A 1 21 ? -15.629 -15.445 -18.078 1.00 43.60 21 A 1 ATOM 156 C CG . ASP A 1 21 ? -16.589 -16.002 -19.132 1.00 39.88 21 A 1 ATOM 157 O OD1 . ASP A 1 21 ? -17.826 -15.853 -18.972 1.00 37.36 21 A 1 ATOM 158 O OD2 . ASP A 1 21 ? -16.093 -16.586 -20.105 1.00 38.23 21 A 1 ATOM 159 N N . VAL A 1 22 ? -18.599 -14.843 -16.349 1.00 46.80 22 A 1 ATOM 160 C CA . VAL A 1 22 ? -19.724 -15.407 -15.589 1.00 47.12 22 A 1 ATOM 161 C C . VAL A 1 22 ? -19.845 -16.917 -15.817 1.00 48.32 22 A 1 ATOM 162 O O . VAL A 1 22 ? -20.378 -17.629 -14.967 1.00 45.97 22 A 1 ATOM 163 C CB . VAL A 1 22 ? -21.027 -14.670 -15.965 1.00 44.53 22 A 1 ATOM 164 C CG1 . VAL A 1 22 ? -22.234 -15.144 -15.140 1.00 40.58 22 A 1 ATOM 165 C CG2 . VAL A 1 22 ? -20.904 -13.153 -15.742 1.00 40.05 22 A 1 ATOM 166 N N . ASN A 1 23 ? -19.303 -17.414 -16.939 1.00 51.32 23 A 1 ATOM 167 C CA . ASN A 1 23 ? -19.309 -18.828 -17.301 1.00 53.28 23 A 1 ATOM 168 C C . ASN A 1 23 ? -18.136 -19.623 -16.705 1.00 53.98 23 A 1 ATOM 169 O O . ASN A 1 23 ? -18.179 -20.850 -16.745 1.00 52.13 23 A 1 ATOM 170 C CB . ASN A 1 23 ? -19.339 -18.949 -18.827 1.00 52.79 23 A 1 ATOM 171 C CG . ASN A 1 23 ? -20.543 -18.242 -19.416 1.00 49.05 23 A 1 ATOM 172 O OD1 . ASN A 1 23 ? -21.696 -18.586 -19.158 1.00 45.94 23 A 1 ATOM 173 N ND2 . ASN A 1 23 ? -20.323 -17.214 -20.197 1.00 45.54 23 A 1 ATOM 174 N N . ASP A 1 24 ? -17.119 -18.958 -16.153 1.00 48.64 24 A 1 ATOM 175 C CA . ASP A 1 24 ? -16.010 -19.607 -15.455 1.00 49.88 24 A 1 ATOM 176 C C . ASP A 1 24 ? -15.936 -19.114 -13.994 1.00 49.52 24 A 1 ATOM 177 O O . ASP A 1 24 ? -15.184 -18.193 -13.653 1.00 48.16 24 A 1 ATOM 178 C CB . ASP A 1 24 ? -14.690 -19.444 -16.225 1.00 48.58 24 A 1 ATOM 179 C CG . ASP A 1 24 ? -13.589 -20.359 -15.653 1.00 45.60 24 A 1 ATOM 180 O OD1 . ASP A 1 24 ? -13.905 -21.232 -14.801 1.00 43.19 24 A 1 ATOM 181 O OD2 . ASP A 1 24 ? -12.425 -20.198 -16.072 1.00 43.47 24 A 1 ATOM 182 N N . PRO A 1 25 ? -16.750 -19.693 -13.109 1.00 48.85 25 A 1 ATOM 183 C CA . PRO A 1 25 ? -16.775 -19.282 -11.726 1.00 48.34 25 A 1 ATOM 184 C C . PRO A 1 25 ? -15.483 -19.725 -11.038 1.00 48.29 25 A 1 ATOM 185 O O . PRO A 1 25 ? -15.376 -20.841 -10.516 1.00 46.35 25 A 1 ATOM 186 C CB . PRO A 1 25 ? -18.053 -19.908 -11.131 1.00 46.03 25 A 1 ATOM 187 C CG . PRO A 1 25 ? -18.252 -21.165 -11.972 1.00 44.44 25 A 1 ATOM 188 C CD . PRO A 1 25 ? -17.722 -20.758 -13.345 1.00 46.31 25 A 1 ATOM 189 N N . VAL A 1 26 ? -14.509 -18.818 -10.963 1.00 48.36 26 A 1 ATOM 190 C CA . VAL A 1 26 ? -13.337 -18.990 -10.101 1.00 48.57 26 A 1 ATOM 191 C C . VAL A 1 26 ? -13.809 -19.042 -8.641 1.00 49.30 26 A 1 ATOM 192 O O . VAL A 1 26 ? -13.901 -18.028 -7.947 1.00 47.09 26 A 1 ATOM 193 C CB . VAL A 1 26 ? -12.278 -17.891 -10.329 1.00 45.42 26 A 1 ATOM 194 C CG1 . VAL A 1 26 ? -11.026 -18.152 -9.478 1.00 41.97 26 A 1 ATOM 195 C CG2 . VAL A 1 26 ? -11.835 -17.827 -11.797 1.00 41.00 26 A 1 ATOM 196 N N . ARG A 1 27 ? -14.149 -20.256 -8.190 1.00 42.55 27 A 1 ATOM 197 C CA . ARG A 1 27 ? -14.806 -20.493 -6.890 1.00 43.50 27 A 1 ATOM 198 C C . ARG A 1 27 ? -13.903 -20.193 -5.692 1.00 44.31 27 A 1 ATOM 199 O O . ARG A 1 27 ? -14.405 -20.059 -4.582 1.00 42.66 27 A 1 ATOM 200 C CB . ARG A 1 27 ? -15.323 -21.938 -6.818 1.00 41.40 27 A 1 ATOM 201 C CG . ARG A 1 27 ? -16.529 -22.164 -7.743 1.00 38.25 27 A 1 ATOM 202 C CD . ARG A 1 27 ? -17.129 -23.559 -7.521 1.00 37.05 27 A 1 ATOM 203 N NE . ARG A 1 27 ? -18.368 -23.742 -8.302 1.00 34.93 27 A 1 ATOM 204 C CZ . ARG A 1 27 ? -19.231 -24.746 -8.187 1.00 33.16 27 A 1 ATOM 205 N NH1 . ARG A 1 27 ? -19.043 -25.728 -7.348 1.00 32.23 27 A 1 ATOM 206 N NH2 . ARG A 1 27 ? -20.300 -24.762 -8.924 1.00 31.76 27 A 1 ATOM 207 N N . ARG A 1 28 ? -12.586 -20.113 -5.905 1.00 42.51 28 A 1 ATOM 208 C CA . ARG A 1 28 ? -11.611 -19.857 -4.845 1.00 42.90 28 A 1 ATOM 209 C C . ARG A 1 28 ? -10.476 -19.007 -5.395 1.00 44.31 28 A 1 ATOM 210 O O . ARG A 1 28 ? -9.720 -19.464 -6.248 1.00 43.07 28 A 1 ATOM 211 C CB . ARG A 1 28 ? -11.080 -21.186 -4.271 1.00 40.28 28 A 1 ATOM 212 C CG . ARG A 1 28 ? -12.185 -21.996 -3.569 1.00 36.68 28 A 1 ATOM 213 C CD . ARG A 1 28 ? -11.632 -23.277 -2.948 1.00 35.11 28 A 1 ATOM 214 N NE . ARG A 1 28 ? -12.715 -24.067 -2.330 1.00 32.82 28 A 1 ATOM 215 C CZ . ARG A 1 28 ? -12.589 -25.263 -1.789 1.00 31.18 28 A 1 ATOM 216 N NH1 . ARG A 1 28 ? -11.447 -25.890 -1.740 1.00 30.00 28 A 1 ATOM 217 N NH2 . ARG A 1 28 ? -13.628 -25.868 -1.288 1.00 29.66 28 A 1 ATOM 218 N N . ARG A 1 29 ? -10.363 -17.791 -4.880 1.00 46.55 29 A 1 ATOM 219 C CA . ARG A 1 29 ? -9.243 -16.886 -5.155 1.00 47.27 29 A 1 ATOM 220 C C . ARG A 1 29 ? -8.436 -16.749 -3.879 1.00 47.52 29 A 1 ATOM 221 O O . ARG A 1 29 ? -8.984 -16.379 -2.843 1.00 46.59 29 A 1 ATOM 222 C CB . ARG A 1 29 ? -9.740 -15.526 -5.659 1.00 45.25 29 A 1 ATOM 223 C CG . ARG A 1 29 ? -10.589 -15.660 -6.931 1.00 41.89 29 A 1 ATOM 224 C CD . ARG A 1 29 ? -11.038 -14.285 -7.437 1.00 40.52 29 A 1 ATOM 225 N NE . ARG A 1 29 ? -12.187 -14.429 -8.347 1.00 38.71 29 A 1 ATOM 226 C CZ . ARG A 1 29 ? -12.894 -13.460 -8.884 1.00 36.23 29 A 1 ATOM 227 N NH1 . ARG A 1 29 ? -12.549 -12.202 -8.794 1.00 34.94 29 A 1 ATOM 228 N NH2 . ARG A 1 29 ? -13.991 -13.748 -9.509 1.00 34.34 29 A 1 ATOM 229 N N . ALA A 1 30 ? -7.154 -17.056 -3.950 1.00 50.76 30 A 1 ATOM 230 C CA . ALA A 1 30 ? -6.229 -16.788 -2.864 1.00 51.27 30 A 1 ATOM 231 C C . ALA A 1 30 ? -5.134 -15.863 -3.408 1.00 52.70 30 A 1 ATOM 232 O O . ALA A 1 30 ? -4.506 -16.186 -4.415 1.00 51.43 30 A 1 ATOM 233 C CB . ALA A 1 30 ? -5.681 -18.106 -2.301 1.00 49.00 30 A 1 ATOM 234 N N . ILE A 1 31 ? -4.936 -14.730 -2.756 1.00 50.72 31 A 1 ATOM 235 C CA . ILE A 1 31 ? -3.840 -13.820 -3.057 1.00 52.58 31 A 1 ATOM 236 C C . ILE A 1 31 ? -2.873 -13.881 -1.880 1.00 52.86 31 A 1 ATOM 237 O O . ILE A 1 31 ? -3.252 -13.598 -0.745 1.00 52.40 31 A 1 ATOM 238 C CB . ILE A 1 31 ? -4.343 -12.390 -3.356 1.00 52.43 31 A 1 ATOM 239 C CG1 . ILE A 1 31 ? -5.338 -12.393 -4.546 1.00 49.51 31 A 1 ATOM 240 C CG2 . ILE A 1 31 ? -3.140 -11.471 -3.652 1.00 48.74 31 A 1 ATOM 241 C CD1 . ILE A 1 31 ? -5.986 -11.037 -4.827 1.00 46.68 31 A 1 ATOM 242 N N . VAL A 1 32 ? -1.642 -14.282 -2.154 1.00 50.82 32 A 1 ATOM 243 C CA . VAL A 1 32 ? -0.577 -14.318 -1.161 1.00 52.98 32 A 1 ATOM 244 C C . VAL A 1 32 ? 0.379 -13.176 -1.462 1.00 54.34 32 A 1 ATOM 245 O O . VAL A 1 32 ? 0.999 -13.134 -2.519 1.00 53.03 32 A 1 ATOM 246 C CB . VAL A 1 32 ? 0.135 -15.683 -1.137 1.00 51.24 32 A 1 ATOM 247 C CG1 . VAL A 1 32 ? 1.239 -15.707 -0.075 1.00 45.00 32 A 1 ATOM 248 C CG2 . VAL A 1 32 ? -0.849 -16.810 -0.812 1.00 45.43 32 A 1 ATOM 249 N N . LEU A 1 33 ? 0.489 -12.261 -0.513 1.00 54.21 33 A 1 ATOM 250 C CA . LEU A 1 33 ? 1.459 -11.169 -0.556 1.00 55.06 33 A 1 ATOM 251 C C . LEU A 1 33 ? 2.648 -11.547 0.323 1.00 55.11 33 A 1 ATOM 252 O O . LEU A 1 33 ? 2.492 -11.757 1.525 1.00 53.30 33 A 1 ATOM 253 C CB . LEU A 1 33 ? 0.782 -9.872 -0.076 1.00 54.01 33 A 1 ATOM 254 C CG . LEU A 1 33 ? -0.356 -9.380 -0.992 1.00 50.02 33 A 1 ATOM 255 C CD1 . LEU A 1 33 ? -1.128 -8.263 -0.287 1.00 46.82 33 A 1 ATOM 256 C CD2 . LEU A 1 33 ? 0.180 -8.831 -2.308 1.00 46.84 33 A 1 ATOM 257 N N . ARG A 1 34 ? 3.821 -11.622 -0.264 1.00 54.89 34 A 1 ATOM 258 C CA . ARG A 1 34 ? 5.069 -11.791 0.480 1.00 55.06 34 A 1 ATOM 259 C C . ARG A 1 34 ? 5.880 -10.501 0.373 1.00 53.56 34 A 1 ATOM 260 O O . ARG A 1 34 ? 6.280 -10.109 -0.717 1.00 51.81 34 A 1 ATOM 261 C CB . ARG A 1 34 ? 5.859 -13.003 -0.037 1.00 54.17 34 A 1 ATOM 262 C CG . ARG A 1 34 ? 5.124 -14.321 0.262 1.00 50.39 34 A 1 ATOM 263 C CD . ARG A 1 34 ? 5.968 -15.502 -0.199 1.00 49.33 34 A 1 ATOM 264 N NE . ARG A 1 34 ? 5.323 -16.790 0.093 1.00 46.05 34 A 1 ATOM 265 C CZ . ARG A 1 34 ? 5.809 -17.990 -0.171 1.00 41.53 34 A 1 ATOM 266 N NH1 . ARG A 1 34 ? 6.972 -18.141 -0.739 1.00 40.43 34 A 1 ATOM 267 N NH2 . ARG A 1 34 ? 5.125 -19.067 0.127 1.00 38.09 34 A 1 ATOM 268 N N . SER A 1 35 ? 6.104 -9.861 1.497 1.00 54.17 35 A 1 ATOM 269 C CA . SER A 1 35 ? 7.018 -8.726 1.584 1.00 53.59 35 A 1 ATOM 270 C C . SER A 1 35 ? 8.358 -9.196 2.138 1.00 53.50 35 A 1 ATOM 271 O O . SER A 1 35 ? 8.417 -9.751 3.237 1.00 50.74 35 A 1 ATOM 272 C CB . SER A 1 35 ? 6.418 -7.605 2.436 1.00 50.66 35 A 1 ATOM 273 O OG . SER A 1 35 ? 6.137 -8.068 3.740 1.00 46.10 35 A 1 ATOM 274 N N . GLY A 1 36 ? 9.435 -8.959 1.409 1.00 55.30 36 A 1 ATOM 275 C CA . GLY A 1 36 ? 10.800 -9.176 1.860 1.00 56.15 36 A 1 ATOM 276 C C . GLY A 1 36 ? 11.537 -7.855 2.057 1.00 55.61 36 A 1 ATOM 277 O O . GLY A 1 36 ? 11.401 -6.932 1.249 1.00 53.13 36 A 1 ATOM 278 N N . ALA A 1 37 ? 12.348 -7.762 3.102 1.00 54.00 37 A 1 ATOM 279 C CA . ALA A 1 37 ? 13.315 -6.679 3.224 1.00 54.57 37 A 1 ATOM 280 C C . ALA A 1 37 ? 14.407 -6.901 2.182 1.00 55.00 37 A 1 ATOM 281 O O . ALA A 1 37 ? 15.217 -7.819 2.292 1.00 52.08 37 A 1 ATOM 282 C CB . ALA A 1 37 ? 13.853 -6.642 4.656 1.00 51.15 37 A 1 ATOM 283 N N . ALA A 1 38 ? 14.422 -6.079 1.132 1.00 52.15 38 A 1 ATOM 284 C CA . ALA A 1 38 ? 15.492 -6.099 0.149 1.00 53.78 38 A 1 ATOM 285 C C . ALA A 1 38 ? 16.660 -5.220 0.624 1.00 55.24 38 A 1 ATOM 286 O O . ALA A 1 38 ? 16.454 -4.210 1.301 1.00 53.33 38 A 1 ATOM 287 C CB . ALA A 1 38 ? 14.934 -5.688 -1.219 1.00 50.24 38 A 1 ATOM 288 N N . PRO A 1 39 ? 17.911 -5.572 0.271 1.00 53.29 39 A 1 ATOM 289 C CA . PRO A 1 39 ? 19.059 -4.742 0.603 1.00 55.57 39 A 1 ATOM 290 C C . PRO A 1 39 ? 18.920 -3.344 -0.018 1.00 56.93 39 A 1 ATOM 291 O O . PRO A 1 39 ? 18.354 -3.174 -1.099 1.00 54.74 39 A 1 ATOM 292 C CB . PRO A 1 39 ? 20.279 -5.518 0.104 1.00 54.13 39 A 1 ATOM 293 C CG . PRO A 1 39 ? 19.722 -6.439 -0.979 1.00 52.24 39 A 1 ATOM 294 C CD . PRO A 1 39 ? 18.295 -6.726 -0.521 1.00 55.64 39 A 1 ATOM 295 N N . HIS A 1 40 ? 19.450 -2.321 0.678 1.00 52.95 40 A 1 ATOM 296 C CA . HIS A 1 40 ? 19.458 -0.919 0.253 1.00 54.87 40 A 1 ATOM 297 C C . HIS A 1 40 ? 18.085 -0.212 0.197 1.00 56.27 40 A 1 ATOM 298 O O . HIS A 1 40 ? 17.770 0.451 -0.788 1.00 53.50 40 A 1 ATOM 299 C CB . HIS A 1 40 ? 20.243 -0.741 -1.062 1.00 52.63 40 A 1 ATOM 300 C CG . HIS A 1 40 ? 21.573 -1.435 -1.067 1.00 49.45 40 A 1 ATOM 301 N ND1 . HIS A 1 40 ? 22.686 -1.041 -0.368 1.00 47.07 40 A 1 ATOM 302 C CD2 . HIS A 1 40 ? 21.891 -2.571 -1.742 1.00 45.63 40 A 1 ATOM 303 C CE1 . HIS A 1 40 ? 23.660 -1.924 -0.621 1.00 43.30 40 A 1 ATOM 304 N NE2 . HIS A 1 40 ? 23.218 -2.881 -1.451 1.00 44.36 40 A 1 ATOM 305 N N . SER A 1 41 ? 17.295 -0.312 1.268 1.00 51.95 41 A 1 ATOM 306 C CA . SER A 1 41 ? 16.034 0.440 1.414 1.00 53.15 41 A 1 ATOM 307 C C . SER A 1 41 ? 15.021 0.207 0.285 1.00 55.75 41 A 1 ATOM 308 O O . SER A 1 41 ? 14.192 1.068 -0.011 1.00 53.65 41 A 1 ATOM 309 C CB . SER A 1 41 ? 16.290 1.952 1.609 1.00 49.83 41 A 1 ATOM 310 O OG . SER A 1 41 ? 17.194 2.165 2.675 1.00 44.53 41 A 1 ATOM 311 N N . LYS A 1 42 ? 15.090 -0.957 -0.346 1.00 52.44 42 A 1 ATOM 312 C CA . LYS A 1 42 ? 14.099 -1.414 -1.316 1.00 54.33 42 A 1 ATOM 313 C C . LYS A 1 42 ? 13.176 -2.420 -0.632 1.00 54.71 42 A 1 ATOM 314 O O . LYS A 1 42 ? 13.614 -3.209 0.199 1.00 53.72 42 A 1 ATOM 315 C CB . LYS A 1 42 ? 14.789 -1.991 -2.560 1.00 52.93 42 A 1 ATOM 316 C CG . LYS A 1 42 ? 15.562 -0.896 -3.330 1.00 49.09 42 A 1 ATOM 317 C CD . LYS A 1 42 ? 16.302 -1.466 -4.538 1.00 47.46 42 A 1 ATOM 318 C CE . LYS A 1 42 ? 17.095 -0.341 -5.206 1.00 44.79 42 A 1 ATOM 319 N NZ . LYS A 1 42 ? 17.878 -0.829 -6.379 1.00 41.02 42 A 1 ATOM 320 N N . VAL A 1 43 ? 11.904 -2.385 -0.977 1.00 54.80 43 A 1 ATOM 321 C CA . VAL A 1 43 ? 10.922 -3.394 -0.572 1.00 55.78 43 A 1 ATOM 322 C C . VAL A 1 43 ? 10.569 -4.179 -1.822 1.00 56.86 43 A 1 ATOM 323 O O . VAL A 1 43 ? 10.114 -3.607 -2.806 1.00 54.88 43 A 1 ATOM 324 C CB . VAL A 1 43 ? 9.691 -2.758 0.102 1.00 53.39 43 A 1 ATOM 325 C CG1 . VAL A 1 43 ? 8.671 -3.826 0.510 1.00 48.93 43 A 1 ATOM 326 C CG2 . VAL A 1 43 ? 10.097 -1.989 1.367 1.00 47.97 43 A 1 ATOM 327 N N . SER A 1 44 ? 10.813 -5.480 -1.801 1.00 56.76 44 A 1 ATOM 328 C CA . SER A 1 44 ? 10.317 -6.379 -2.837 1.00 58.17 44 A 1 ATOM 329 C C . SER A 1 44 ? 8.983 -6.950 -2.384 1.00 59.61 44 A 1 ATOM 330 O O . SER A 1 44 ? 8.886 -7.494 -1.284 1.00 59.48 44 A 1 ATOM 331 C CB . SER A 1 44 ? 11.320 -7.497 -3.152 1.00 55.54 44 A 1 ATOM 332 O OG . SER A 1 44 ? 11.664 -8.223 -1.997 1.00 48.98 44 A 1 ATOM 333 N N . ILE A 1 45 ? 7.975 -6.834 -3.235 1.00 57.26 45 A 1 ATOM 334 C CA . ILE A 1 45 ? 6.670 -7.466 -3.024 1.00 58.93 45 A 1 ATOM 335 C C . ILE A 1 45 ? 6.500 -8.523 -4.113 1.00 59.89 45 A 1 ATOM 336 O O . ILE A 1 45 ? 6.529 -8.216 -5.302 1.00 59.77 45 A 1 ATOM 337 C CB . ILE A 1 45 ? 5.526 -6.429 -2.987 1.00 58.35 45 A 1 ATOM 338 C CG1 . ILE A 1 45 ? 5.789 -5.385 -1.880 1.00 55.24 45 A 1 ATOM 339 C CG2 . ILE A 1 45 ? 4.190 -7.137 -2.778 1.00 54.51 45 A 1 ATOM 340 C CD1 . ILE A 1 45 ? 4.692 -4.315 -1.703 1.00 52.58 45 A 1 ATOM 341 N N . GLU A 1 46 ? 6.362 -9.756 -3.678 1.00 58.79 46 A 1 ATOM 342 C CA . GLU A 1 46 ? 5.975 -10.874 -4.531 1.00 60.53 46 A 1 ATOM 343 C C . GLU A 1 46 ? 4.491 -11.139 -4.307 1.00 61.10 46 A 1 ATOM 344 O O . GLU A 1 46 ? 4.023 -11.248 -3.171 1.00 60.94 46 A 1 ATOM 345 C CB . GLU A 1 46 ? 6.835 -12.112 -4.226 1.00 59.67 46 A 1 ATOM 346 C CG . GLU A 1 46 ? 8.303 -11.882 -4.635 1.00 54.41 46 A 1 ATOM 347 C CD . GLU A 1 46 ? 9.222 -13.076 -4.347 1.00 51.70 46 A 1 ATOM 348 O OE1 . GLU A 1 46 ? 10.399 -12.985 -4.764 1.00 49.02 46 A 1 ATOM 349 O OE2 . GLU A 1 46 ? 8.777 -14.044 -3.688 1.00 48.94 46 A 1 ATOM 350 N N . VAL A 1 47 ? 3.742 -11.195 -5.406 1.00 59.70 47 A 1 ATOM 351 C CA . VAL A 1 47 ? 2.302 -11.468 -5.392 1.00 60.65 47 A 1 ATOM 352 C C . VAL A 1 47 ? 2.083 -12.788 -6.110 1.00 61.24 47 A 1 ATOM 353 O O . VAL A 1 47 ? 2.374 -12.895 -7.298 1.00 59.35 47 A 1 ATOM 354 C CB . VAL A 1 47 ? 1.491 -10.338 -6.056 1.00 59.47 47 A 1 ATOM 355 C CG1 . VAL A 1 47 ? -0.015 -10.586 -5.908 1.00 55.01 47 A 1 ATOM 356 C CG2 . VAL A 1 47 ? 1.826 -8.963 -5.466 1.00 54.83 47 A 1 ATOM 357 N N . SER A 1 48 ? 1.556 -13.768 -5.403 1.00 63.38 48 A 1 ATOM 358 C CA . SER A 1 48 ? 1.118 -15.019 -6.006 1.00 63.54 48 A 1 ATOM 359 C C . SER A 1 48 ? -0.406 -15.088 -5.940 1.00 62.54 48 A 1 ATOM 360 O O . SER A 1 48 ? -0.982 -14.886 -4.872 1.00 61.16 48 A 1 ATOM 361 C CB . SER A 1 48 ? 1.741 -16.235 -5.319 1.00 62.49 48 A 1 ATOM 362 O OG . SER A 1 48 ? 3.156 -16.144 -5.265 1.00 55.62 48 A 1 ATOM 363 N N . ALA A 1 49 ? -1.058 -15.348 -7.056 1.00 61.58 49 A 1 ATOM 364 C CA . ALA A 1 49 ? -2.502 -15.525 -7.109 1.00 61.33 49 A 1 ATOM 365 C C . ALA A 1 49 ? -2.841 -16.956 -7.542 1.00 61.25 49 A 1 ATOM 366 O O . ALA A 1 49 ? -2.300 -17.457 -8.521 1.00 60.25 49 A 1 ATOM 367 C CB . ALA A 1 49 ? -3.119 -14.463 -8.027 1.00 59.41 49 A 1 ATOM 368 N N . LEU A 1 50 ? -3.744 -17.593 -6.815 1.00 56.34 50 A 1 ATOM 369 C CA . LEU A 1 50 ? -4.365 -18.844 -7.238 1.00 56.00 50 A 1 ATOM 370 C C . LEU A 1 50 ? -5.532 -18.505 -8.171 1.00 55.61 50 A 1 ATOM 371 O O . LEU A 1 50 ? -6.516 -17.895 -7.730 1.00 53.80 50 A 1 ATOM 372 C CB . LEU A 1 50 ? -4.813 -19.628 -6.000 1.00 54.19 50 A 1 ATOM 373 C CG . LEU A 1 50 ? -5.355 -21.038 -6.316 1.00 49.47 50 A 1 ATOM 374 C CD1 . LEU A 1 50 ? -4.254 -21.983 -6.786 1.00 47.49 50 A 1 ATOM 375 C CD2 . LEU A 1 50 ? -5.986 -21.638 -5.060 1.00 47.56 50 A 1 ATOM 376 N N . ILE A 1 51 ? -5.408 -18.885 -9.431 1.00 55.81 51 A 1 ATOM 377 C CA . ILE A 1 51 ? -6.445 -18.714 -10.459 1.00 56.23 51 A 1 ATOM 378 C C . ILE A 1 51 ? -6.870 -20.109 -10.924 1.00 56.43 51 A 1 ATOM 379 O O . ILE A 1 51 ? -6.105 -20.820 -11.572 1.00 53.85 51 A 1 ATOM 380 C CB . ILE A 1 51 ? -5.935 -17.815 -11.622 1.00 54.58 51 A 1 ATOM 381 C CG1 . ILE A 1 51 ? -5.446 -16.445 -11.097 1.00 51.56 51 A 1 ATOM 382 C CG2 . ILE A 1 51 ? -7.058 -17.634 -12.660 1.00 50.75 51 A 1 ATOM 383 C CD1 . ILE A 1 51 ? -4.890 -15.505 -12.178 1.00 49.32 51 A 1 ATOM 384 N N . GLY A 1 52 ? -8.082 -20.518 -10.548 1.00 55.72 52 A 1 ATOM 385 C CA . GLY A 1 52 ? -8.537 -21.883 -10.777 1.00 56.01 52 A 1 ATOM 386 C C . GLY A 1 52 ? -7.759 -22.893 -9.935 1.00 57.37 52 A 1 ATOM 387 O O . GLY A 1 52 ? -7.828 -22.856 -8.701 1.00 54.85 52 A 1 ATOM 388 N N . ALA A 1 53 ? -7.027 -23.788 -10.592 1.00 58.91 53 A 1 ATOM 389 C CA . ALA A 1 53 ? -6.176 -24.791 -9.948 1.00 61.22 53 A 1 ATOM 390 C C . ALA A 1 53 ? -4.682 -24.430 -9.961 1.00 63.93 53 A 1 ATOM 391 O O . ALA A 1 53 ? -3.900 -25.095 -9.283 1.00 61.41 53 A 1 ATOM 392 C CB . ALA A 1 53 ? -6.432 -26.148 -10.623 1.00 59.18 53 A 1 ATOM 393 N N . ASP A 1 54 ? -4.308 -23.375 -10.699 1.00 59.10 54 A 1 ATOM 394 C CA . ASP A 1 54 ? -2.914 -23.036 -10.959 1.00 62.91 54 A 1 ATOM 395 C C . ASP A 1 54 ? -2.473 -21.798 -10.179 1.00 64.04 54 A 1 ATOM 396 O O . ASP A 1 54 ? -3.186 -20.800 -10.059 1.00 63.90 54 A 1 ATOM 397 C CB . ASP A 1 54 ? -2.689 -22.869 -12.468 1.00 61.74 54 A 1 ATOM 398 C CG . ASP A 1 54 ? -2.919 -24.184 -13.230 1.00 56.28 54 A 1 ATOM 399 O OD1 . ASP A 1 54 ? -2.413 -25.226 -12.756 1.00 53.05 54 A 1 ATOM 400 O OD2 . ASP A 1 54 ? -3.602 -24.135 -14.272 1.00 52.95 54 A 1 ATOM 401 N N . TRP A 1 55 ? -1.248 -21.852 -9.653 1.00 63.43 55 A 1 ATOM 402 C CA . TRP A 1 55 ? -0.586 -20.710 -9.044 1.00 65.17 55 A 1 ATOM 403 C C . TRP A 1 55 ? 0.117 -19.881 -10.116 1.00 65.54 55 A 1 ATOM 404 O O . TRP A 1 55 ? 0.974 -20.389 -10.833 1.00 63.66 55 A 1 ATOM 405 C CB . TRP A 1 55 ? 0.397 -21.168 -7.966 1.00 63.79 55 A 1 ATOM 406 C CG . TRP A 1 55 ? -0.268 -21.602 -6.691 1.00 62.88 55 A 1 ATOM 407 C CD1 . TRP A 1 55 ? -0.550 -22.876 -6.340 1.00 59.01 55 A 1 ATOM 408 C CD2 . TRP A 1 55 ? -0.746 -20.764 -5.600 1.00 60.39 55 A 1 ATOM 409 N NE1 . TRP A 1 55 ? -1.166 -22.887 -5.101 1.00 56.67 55 A 1 ATOM 410 C CE2 . TRP A 1 55 ? -1.308 -21.605 -4.596 1.00 58.28 55 A 1 ATOM 411 C CE3 . TRP A 1 55 ? -0.763 -19.371 -5.353 1.00 56.00 55 A 1 ATOM 412 C CZ2 . TRP A 1 55 ? -1.857 -21.095 -3.409 1.00 56.89 55 A 1 ATOM 413 C CZ3 . TRP A 1 55 ? -1.314 -18.848 -4.160 1.00 56.05 55 A 1 ATOM 414 C CH2 . TRP A 1 55 ? -1.855 -19.706 -3.196 1.00 55.60 55 A 1 ATOM 415 N N . VAL A 1 56 ? -0.216 -18.596 -10.177 1.00 68.18 56 A 1 ATOM 416 C CA . VAL A 1 56 ? 0.410 -17.626 -11.077 1.00 68.20 56 A 1 ATOM 417 C C . VAL A 1 56 ? 1.174 -16.606 -10.246 1.00 69.06 56 A 1 ATOM 418 O O . VAL A 1 56 ? 0.601 -15.917 -9.405 1.00 66.20 56 A 1 ATOM 419 C CB . VAL A 1 56 ? -0.623 -16.956 -11.999 1.00 65.82 56 A 1 ATOM 420 C CG1 . VAL A 1 56 ? 0.063 -16.043 -13.018 1.00 59.67 56 A 1 ATOM 421 C CG2 . VAL A 1 56 ? -1.439 -18.000 -12.790 1.00 59.96 56 A 1 ATOM 422 N N . ASP A 1 57 ? 2.475 -16.509 -10.496 1.00 66.12 57 A 1 ATOM 423 C CA . ASP A 1 57 ? 3.353 -15.578 -9.806 1.00 67.05 57 A 1 ATOM 424 C C . ASP A 1 57 ? 3.466 -14.256 -10.578 1.00 66.26 57 A 1 ATOM 425 O O . ASP A 1 57 ? 3.889 -14.212 -11.738 1.00 65.03 57 A 1 ATOM 426 C CB . ASP A 1 57 ? 4.739 -16.196 -9.591 1.00 65.48 57 A 1 ATOM 427 C CG . ASP A 1 57 ? 4.750 -17.339 -8.567 1.00 60.60 57 A 1 ATOM 428 O OD1 . ASP A 1 57 ? 3.971 -17.269 -7.592 1.00 57.25 57 A 1 ATOM 429 O OD2 . ASP A 1 57 ? 5.611 -18.231 -8.730 1.00 56.23 57 A 1 ATOM 430 N N . PHE A 1 58 ? 3.166 -13.156 -9.905 1.00 64.56 58 A 1 ATOM 431 C CA . PHE A 1 58 ? 3.313 -11.800 -10.409 1.00 63.82 58 A 1 ATOM 432 C C . PHE A 1 58 ? 4.459 -11.102 -9.678 1.00 63.75 58 A 1 ATOM 433 O O . PHE A 1 58 ? 4.460 -10.978 -8.454 1.00 61.63 58 A 1 ATOM 434 C CB . PHE A 1 58 ? 1.992 -11.033 -10.261 1.00 61.95 58 A 1 ATOM 435 C CG . PHE A 1 58 ? 0.810 -11.680 -10.966 1.00 59.23 58 A 1 ATOM 436 C CD1 . PHE A 1 58 ? 0.513 -11.354 -12.303 1.00 56.12 58 A 1 ATOM 437 C CD2 . PHE A 1 58 ? 0.018 -12.614 -10.281 1.00 55.42 58 A 1 ATOM 438 C CE1 . PHE A 1 58 ? -0.578 -11.963 -12.944 1.00 52.32 58 A 1 ATOM 439 C CE2 . PHE A 1 58 ? -1.074 -13.224 -10.928 1.00 52.58 58 A 1 ATOM 440 C CZ . PHE A 1 58 ? -1.368 -12.898 -12.259 1.00 51.70 58 A 1 ATOM 441 N N . LYS A 1 59 ? 5.428 -10.610 -10.437 1.00 61.96 59 A 1 ATOM 442 C CA . LYS A 1 59 ? 6.516 -9.800 -9.884 1.00 62.12 59 A 1 ATOM 443 C C . LYS A 1 59 ? 6.176 -8.321 -10.016 1.00 61.45 59 A 1 ATOM 444 O O . LYS A 1 59 ? 6.368 -7.732 -11.082 1.00 60.48 59 A 1 ATOM 445 C CB . LYS A 1 59 ? 7.851 -10.167 -10.542 1.00 60.80 59 A 1 ATOM 446 C CG . LYS A 1 59 ? 8.308 -11.573 -10.120 1.00 55.19 59 A 1 ATOM 447 C CD . LYS A 1 59 ? 9.696 -11.915 -10.677 1.00 53.09 59 A 1 ATOM 448 C CE . LYS A 1 59 ? 10.059 -13.325 -10.188 1.00 48.50 59 A 1 ATOM 449 N NZ . LYS A 1 59 ? 11.382 -13.790 -10.672 1.00 44.61 59 A 1 ATOM 450 N N . LEU A 1 60 ? 5.725 -7.704 -8.939 1.00 58.78 60 A 1 ATOM 451 C CA . LEU A 1 60 ? 5.566 -6.255 -8.873 1.00 58.61 60 A 1 ATOM 452 C C . LEU A 1 60 ? 6.917 -5.614 -8.541 1.00 58.27 60 A 1 ATOM 453 O O . LEU A 1 60 ? 7.440 -5.758 -7.434 1.00 56.36 60 A 1 ATOM 454 C CB . LEU A 1 60 ? 4.461 -5.862 -7.870 1.00 57.18 60 A 1 ATOM 455 C CG . LEU A 1 60 ? 3.225 -5.237 -8.549 1.00 52.96 60 A 1 ATOM 456 C CD1 . LEU A 1 60 ? 2.076 -6.227 -8.623 1.00 50.89 60 A 1 ATOM 457 C CD2 . LEU A 1 60 ? 2.760 -3.999 -7.792 1.00 50.68 60 A 1 ATOM 458 N N . LYS A 1 61 ? 7.486 -4.884 -9.498 1.00 55.97 61 A 1 ATOM 459 C CA . LYS A 1 61 ? 8.639 -4.020 -9.234 1.00 56.03 61 A 1 ATOM 460 C C . LYS A 1 61 ? 8.137 -2.636 -8.841 1.00 55.44 61 A 1 ATOM 461 O O . LYS A 1 61 ? 7.772 -1.839 -9.701 1.00 54.00 61 A 1 ATOM 462 C CB . LYS A 1 61 ? 9.581 -3.953 -10.450 1.00 54.05 61 A 1 ATOM 463 C CG . LYS A 1 61 ? 10.378 -5.255 -10.639 1.00 49.35 61 A 1 ATOM 464 C CD . LYS A 1 61 ? 11.361 -5.099 -11.811 1.00 46.61 61 A 1 ATOM 465 C CE . LYS A 1 61 ? 12.169 -6.380 -12.012 1.00 43.83 61 A 1 ATOM 466 N NZ . LYS A 1 61 ? 13.094 -6.274 -13.179 1.00 40.02 61 A 1 ATOM 467 N N . LEU A 1 62 ? 8.147 -2.343 -7.554 1.00 54.75 62 A 1 ATOM 468 C CA . LEU A 1 62 ? 7.939 -0.980 -7.079 1.00 54.32 62 A 1 ATOM 469 C C . LEU A 1 62 ? 9.203 -0.163 -7.363 1.00 53.56 62 A 1 ATOM 470 O O . LEU A 1 62 ? 10.232 -0.348 -6.725 1.00 51.72 62 A 1 ATOM 471 C CB . LEU A 1 62 ? 7.564 -1.003 -5.583 1.00 52.83 62 A 1 ATOM 472 C CG . LEU A 1 62 ? 6.145 -1.523 -5.322 1.00 50.46 62 A 1 ATOM 473 C CD1 . LEU A 1 62 ? 5.981 -1.861 -3.841 1.00 48.02 62 A 1 ATOM 474 C CD2 . LEU A 1 62 ? 5.071 -0.491 -5.678 1.00 48.27 62 A 1 ATOM 475 N N . ALA A 1 63 ? 9.123 0.719 -8.358 1.00 52.11 63 A 1 ATOM 476 C CA . ALA A 1 63 ? 10.153 1.708 -8.630 1.00 52.05 63 A 1 ATOM 477 C C . ALA A 1 63 ? 10.008 2.861 -7.628 1.00 51.07 63 A 1 ATOM 478 O O . ALA A 1 63 ? 9.297 3.827 -7.871 1.00 47.83 63 A 1 ATOM 479 C CB . ALA A 1 63 ? 10.055 2.146 -10.099 1.00 50.06 63 A 1 ATOM 480 N N . GLY A 1 64 ? 10.667 2.739 -6.494 1.00 48.87 64 A 1 ATOM 481 C CA . GLY A 1 64 ? 10.715 3.809 -5.509 1.00 49.06 64 A 1 ATOM 482 C C . GLY A 1 64 ? 11.689 3.476 -4.385 1.00 49.39 64 A 1 ATOM 483 O O . GLY A 1 64 ? 11.570 2.449 -3.729 1.00 47.60 64 A 1 ATOM 484 N N . THR A 1 65 ? 12.665 4.337 -4.169 1.00 42.32 65 A 1 ATOM 485 C CA . THR A 1 65 ? 13.448 4.363 -2.933 1.00 43.31 65 A 1 ATOM 486 C C . THR A 1 65 ? 12.542 4.881 -1.823 1.00 44.03 65 A 1 ATOM 487 O O . THR A 1 65 ? 12.236 6.070 -1.778 1.00 42.12 65 A 1 ATOM 488 C CB . THR A 1 65 ? 14.705 5.243 -3.058 1.00 41.77 65 A 1 ATOM 489 O OG1 . THR A 1 65 ? 14.596 6.155 -4.127 1.00 38.14 65 A 1 ATOM 490 C CG2 . THR A 1 65 ? 15.948 4.408 -3.310 1.00 37.67 65 A 1 ATOM 491 N N . ILE A 1 66 ? 12.099 3.993 -0.940 1.00 40.31 66 A 1 ATOM 492 C CA . ILE A 1 66 ? 11.426 4.411 0.287 1.00 41.62 66 A 1 ATOM 493 C C . ILE A 1 66 ? 12.515 4.937 1.221 1.00 41.86 66 A 1 ATOM 494 O O . ILE A 1 66 ? 13.102 4.212 2.011 1.00 40.50 66 A 1 ATOM 495 C CB . ILE A 1 66 ? 10.575 3.271 0.908 1.00 41.09 66 A 1 ATOM 496 C CG1 . ILE A 1 66 ? 9.564 2.707 -0.116 1.00 38.91 66 A 1 ATOM 497 C CG2 . ILE A 1 66 ? 9.840 3.803 2.158 1.00 39.23 66 A 1 ATOM 498 C CD1 . ILE A 1 66 ? 8.723 1.522 0.406 1.00 37.30 66 A 1 ATOM 499 N N . LEU A 1 67 ? 12.845 6.222 1.058 1.00 40.43 67 A 1 ATOM 500 C CA . LEU A 1 67 ? 13.669 6.930 2.027 1.00 42.30 67 A 1 ATOM 501 C C . LEU A 1 67 ? 12.834 7.117 3.305 1.00 43.26 67 A 1 ATOM 502 O O . LEU A 1 67 ? 11.765 7.727 3.220 1.00 40.56 67 A 1 ATOM 503 C CB . LEU A 1 67 ? 14.142 8.268 1.433 1.00 40.04 67 A 1 ATOM 504 C CG . LEU A 1 67 ? 15.443 8.135 0.626 1.00 36.62 67 A 1 ATOM 505 C CD1 . LEU A 1 67 ? 15.525 9.217 -0.449 1.00 34.12 67 A 1 ATOM 506 C CD2 . LEU A 1 67 ? 16.666 8.269 1.529 1.00 35.54 67 A 1 ATOM 507 N N . PRO A 1 68 ? 13.309 6.675 4.465 1.00 39.79 68 A 1 ATOM 508 C CA . PRO A 1 68 ? 12.602 6.895 5.735 1.00 41.81 68 A 1 ATOM 509 C C . PRO A 1 68 ? 12.323 8.374 6.022 1.00 42.43 68 A 1 ATOM 510 O O . PRO A 1 68 ? 11.370 8.718 6.709 1.00 41.74 68 A 1 ATOM 511 C CB . PRO A 1 68 ? 13.503 6.284 6.823 1.00 41.24 68 A 1 ATOM 512 C CG . PRO A 1 68 ? 14.444 5.350 6.080 1.00 40.23 68 A 1 ATOM 513 C CD . PRO A 1 68 ? 14.533 5.927 4.675 1.00 42.45 68 A 1 ATOM 514 N N . SER A 1 69 ? 13.142 9.276 5.441 1.00 40.26 69 A 1 ATOM 515 C CA . SER A 1 69 ? 12.987 10.725 5.556 1.00 42.97 69 A 1 ATOM 516 C C . SER A 1 69 ? 11.773 11.280 4.797 1.00 43.04 69 A 1 ATOM 517 O O . SER A 1 69 ? 11.203 12.276 5.240 1.00 41.29 69 A 1 ATOM 518 C CB . SER A 1 69 ? 14.263 11.414 5.082 1.00 42.57 69 A 1 ATOM 519 O OG . SER A 1 69 ? 14.554 11.077 3.741 1.00 37.70 69 A 1 ATOM 520 N N . ALA A 1 70 ? 11.328 10.647 3.706 1.00 38.61 70 A 1 ATOM 521 C CA . ALA A 1 70 ? 10.201 11.135 2.910 1.00 40.73 70 A 1 ATOM 522 C C . ALA A 1 70 ? 8.856 11.022 3.655 1.00 41.07 70 A 1 ATOM 523 O O . ALA A 1 70 ? 7.963 11.847 3.445 1.00 38.47 70 A 1 ATOM 524 C CB . ALA A 1 70 ? 10.170 10.378 1.577 1.00 38.98 70 A 1 ATOM 525 N N . TYR A 1 71 ? 8.731 10.068 4.581 1.00 33.94 71 A 1 ATOM 526 C CA . TYR A 1 71 ? 7.526 9.912 5.403 1.00 35.74 71 A 1 ATOM 527 C C . TYR A 1 71 ? 7.359 11.052 6.415 1.00 36.56 71 A 1 ATOM 528 O O . TYR A 1 71 ? 6.239 11.481 6.682 1.00 34.55 71 A 1 ATOM 529 C CB . TYR A 1 71 ? 7.556 8.534 6.092 1.00 34.43 71 A 1 ATOM 530 C CG . TYR A 1 71 ? 6.285 7.743 5.845 1.00 31.73 71 A 1 ATOM 531 C CD1 . TYR A 1 71 ? 5.209 7.824 6.743 1.00 29.05 71 A 1 ATOM 532 C CD2 . TYR A 1 71 ? 6.177 6.939 4.695 1.00 29.08 71 A 1 ATOM 533 C CE1 . TYR A 1 71 ? 4.022 7.097 6.495 1.00 29.00 71 A 1 ATOM 534 C CE2 . TYR A 1 71 ? 4.995 6.209 4.447 1.00 30.22 71 A 1 ATOM 535 C CZ . TYR A 1 71 ? 3.914 6.281 5.343 1.00 29.85 71 A 1 ATOM 536 O OH . TYR A 1 71 ? 2.775 5.581 5.104 1.00 28.16 71 A 1 ATOM 537 N N . MET A 1 72 ? 8.457 11.598 6.936 1.00 34.83 72 A 1 ATOM 538 C CA . MET A 1 72 ? 8.410 12.725 7.876 1.00 36.25 72 A 1 ATOM 539 C C . MET A 1 72 ? 8.183 14.078 7.186 1.00 36.40 72 A 1 ATOM 540 O O . MET A 1 72 ? 7.635 14.995 7.796 1.00 34.20 72 A 1 ATOM 541 C CB . MET A 1 72 ? 9.684 12.767 8.737 1.00 34.78 72 A 1 ATOM 542 C CG . MET A 1 72 ? 9.773 11.560 9.677 1.00 30.73 72 A 1 ATOM 543 S SD . MET A 1 72 ? 10.879 11.836 11.102 1.00 29.27 72 A 1 ATOM 544 C CE . MET A 1 72 ? 9.721 12.640 12.244 1.00 26.91 72 A 1 ATOM 545 N N . THR A 1 73 ? 8.561 14.227 5.914 1.00 39.46 73 A 1 ATOM 546 C CA . THR A 1 73 ? 8.368 15.484 5.169 1.00 41.51 73 A 1 ATOM 547 C C . THR A 1 73 ? 6.944 15.622 4.655 1.00 40.82 73 A 1 ATOM 548 O O . THR A 1 73 ? 6.393 16.722 4.702 1.00 38.19 73 A 1 ATOM 549 C CB . THR A 1 73 ? 9.375 15.637 4.015 1.00 40.85 73 A 1 ATOM 550 O OG1 . THR A 1 73 ? 10.493 14.798 4.161 1.00 36.71 73 A 1 ATOM 551 C CG2 . THR A 1 73 ? 9.932 17.057 3.965 1.00 37.52 73 A 1 ATOM 552 N N . SER A 1 74 ? 6.310 14.530 4.238 1.00 38.10 74 A 1 ATOM 553 C CA . SER A 1 74 ? 4.930 14.542 3.728 1.00 40.73 74 A 1 ATOM 554 C C . SER A 1 74 ? 3.910 14.948 4.798 1.00 40.56 74 A 1 ATOM 555 O O . SER A 1 74 ? 3.049 15.792 4.548 1.00 38.55 74 A 1 ATOM 556 C CB . SER A 1 74 ? 4.581 13.168 3.149 1.00 39.58 74 A 1 ATOM 557 O OG . SER A 1 74 ? 3.276 13.181 2.616 1.00 34.36 74 A 1 ATOM 558 N N . THR A 1 75 ? 4.041 14.430 6.019 1.00 35.91 75 A 1 ATOM 559 C CA . THR A 1 75 ? 3.156 14.803 7.142 1.00 39.01 75 A 1 ATOM 560 C C . THR A 1 75 ? 3.371 16.240 7.600 1.00 39.10 75 A 1 ATOM 561 O O . THR A 1 75 ? 2.407 16.919 7.945 1.00 36.60 75 A 1 ATOM 562 C CB . THR A 1 75 ? 3.324 13.854 8.338 1.00 37.06 75 A 1 ATOM 563 O OG1 . THR A 1 75 ? 4.617 13.296 8.376 1.00 32.80 75 A 1 ATOM 564 C CG2 . THR A 1 75 ? 2.344 12.693 8.261 1.00 33.47 75 A 1 ATOM 565 N N . ARG A 1 76 ? 4.607 16.754 7.539 1.00 39.77 76 A 1 ATOM 566 C CA . ARG A 1 76 ? 4.913 18.137 7.925 1.00 43.69 76 A 1 ATOM 567 C C . ARG A 1 76 ? 4.437 19.155 6.884 1.00 42.78 76 A 1 ATOM 568 O O . ARG A 1 76 ? 3.933 20.210 7.265 1.00 42.24 76 A 1 ATOM 569 C CB . ARG A 1 76 ? 6.420 18.258 8.228 1.00 43.58 76 A 1 ATOM 570 C CG . ARG A 1 76 ? 6.668 19.090 9.483 1.00 39.81 76 A 1 ATOM 571 C CD . ARG A 1 76 ? 8.168 19.088 9.813 1.00 39.36 76 A 1 ATOM 572 N NE . ARG A 1 76 ? 8.458 19.898 11.005 1.00 36.68 76 A 1 ATOM 573 C CZ . ARG A 1 76 ? 9.646 20.102 11.550 1.00 37.92 76 A 1 ATOM 574 N NH1 . ARG A 1 76 ? 10.723 19.546 11.061 1.00 34.28 76 A 1 ATOM 575 N NH2 . ARG A 1 76 ? 9.779 20.860 12.593 1.00 34.91 76 A 1 ATOM 576 N N . SER A 1 77 ? 4.517 18.824 5.585 1.00 42.53 77 A 1 ATOM 577 C CA . SER A 1 77 ? 3.995 19.666 4.505 1.00 46.65 77 A 1 ATOM 578 C C . SER A 1 77 ? 2.467 19.658 4.449 1.00 45.56 77 A 1 ATOM 579 O O . SER A 1 77 ? 1.866 20.701 4.197 1.00 44.15 77 A 1 ATOM 580 C CB . SER A 1 77 ? 4.574 19.224 3.160 1.00 46.31 77 A 1 ATOM 581 O OG . SER A 1 77 ? 5.978 19.379 3.169 1.00 41.33 77 A 1 ATOM 582 N N . ALA A 1 78 ? 1.805 18.542 4.751 1.00 42.99 78 A 1 ATOM 583 C CA . ALA A 1 78 ? 0.345 18.478 4.827 1.00 46.22 78 A 1 ATOM 584 C C . ALA A 1 78 ? -0.222 19.296 6.003 1.00 45.66 78 A 1 ATOM 585 O O . ALA A 1 78 ? -1.262 19.936 5.863 1.00 44.94 78 A 1 ATOM 586 C CB . ALA A 1 78 ? -0.074 17.001 4.904 1.00 45.19 78 A 1 ATOM 587 N N . LEU A 1 79 ? 0.485 19.342 7.133 1.00 36.03 79 A 1 ATOM 588 C CA . LEU A 1 79 ? 0.129 20.194 8.276 1.00 42.70 79 A 1 ATOM 589 C C . LEU A 1 79 ? 0.384 21.682 8.019 1.00 42.80 79 A 1 ATOM 590 O O . LEU A 1 79 ? -0.356 22.515 8.520 1.00 42.80 79 A 1 ATOM 591 C CB . LEU A 1 79 ? 0.879 19.679 9.520 1.00 42.51 79 A 1 ATOM 592 C CG . LEU A 1 79 ? -0.043 18.874 10.465 1.00 40.62 79 A 1 ATOM 593 C CD1 . LEU A 1 79 ? 0.691 17.672 11.053 1.00 38.34 79 A 1 ATOM 594 C CD2 . LEU A 1 79 ? -0.530 19.754 11.611 1.00 43.34 79 A 1 ATOM 595 N N . ALA A 1 80 ? 1.403 22.027 7.214 1.00 54.42 80 A 1 ATOM 596 C CA . ALA A 1 80 ? 1.689 23.412 6.836 1.00 57.94 80 A 1 ATOM 597 C C . ALA A 1 80 ? 0.748 23.958 5.744 1.00 56.51 80 A 1 ATOM 598 O O . ALA A 1 80 ? 0.595 25.166 5.614 1.00 55.60 80 A 1 ATOM 599 C CB . ALA A 1 80 ? 3.158 23.495 6.400 1.00 57.49 80 A 1 ATOM 600 N N . ALA A 1 81 ? 0.088 23.072 4.974 1.00 55.18 81 A 1 ATOM 601 C CA . ALA A 1 81 ? -0.868 23.435 3.928 1.00 57.03 81 A 1 ATOM 602 C C . ALA A 1 81 ? -2.319 23.573 4.438 1.00 55.27 81 A 1 ATOM 603 O O . ALA A 1 81 ? -3.208 23.904 3.654 1.00 54.12 81 A 1 ATOM 604 C CB . ALA A 1 81 ? -0.753 22.416 2.795 1.00 56.70 81 A 1 ATOM 605 N N . LEU A 1 82 ? -2.576 23.333 5.726 1.00 42.06 82 A 1 ATOM 606 C CA . LEU A 1 82 ? -3.867 23.683 6.316 1.00 48.91 82 A 1 ATOM 607 C C . LEU A 1 82 ? -3.994 25.214 6.315 1.00 48.50 82 A 1 ATOM 608 O O . LEU A 1 82 ? -3.167 25.885 6.936 1.00 46.92 82 A 1 ATOM 609 C CB . LEU A 1 82 ? -3.988 23.096 7.735 1.00 47.48 82 A 1 ATOM 610 C CG . LEU A 1 82 ? -4.373 21.609 7.737 1.00 44.92 82 A 1 ATOM 611 C CD1 . LEU A 1 82 ? -4.063 20.975 9.094 1.00 42.13 82 A 1 ATOM 612 C CD2 . LEU A 1 82 ? -5.866 21.421 7.462 1.00 46.94 82 A 1 ATOM 613 N N . PRO A 1 83 ? -4.996 25.791 5.623 1.00 55.53 83 A 1 ATOM 614 C CA . PRO A 1 83 ? -5.204 27.227 5.654 1.00 60.01 83 A 1 ATOM 615 C C . PRO A 1 83 ? -5.400 27.618 7.116 1.00 60.23 83 A 1 ATOM 616 O O . PRO A 1 83 ? -6.262 27.076 7.808 1.00 55.97 83 A 1 ATOM 617 C CB . PRO A 1 83 ? -6.430 27.502 4.779 1.00 57.31 83 A 1 ATOM 618 C CG . PRO A 1 83 ? -7.190 26.178 4.792 1.00 55.60 83 A 1 ATOM 619 C CD . PRO A 1 83 ? -6.082 25.136 4.925 1.00 60.98 83 A 1 ATOM 620 N N . ASN A 1 84 ? -4.570 28.552 7.556 1.00 48.06 84 A 1 ATOM 621 C CA . ASN A 1 84 ? -4.644 29.171 8.863 1.00 52.85 84 A 1 ATOM 622 C C . ASN A 1 84 ? -6.076 29.707 9.058 1.00 51.18 84 A 1 ATOM 623 O O . ASN A 1 84 ? -6.387 30.820 8.631 1.00 48.16 84 A 1 ATOM 624 C CB . ASN A 1 84 ? -3.555 30.261 8.912 1.00 51.07 84 A 1 ATOM 625 C CG . ASN A 1 84 ? -3.387 30.915 10.273 1.00 45.18 84 A 1 ATOM 626 O OD1 . ASN A 1 84 ? -4.067 30.618 11.239 1.00 44.80 84 A 1 ATOM 627 N ND2 . ASN A 1 84 ? -2.465 31.824 10.402 1.00 43.18 84 A 1 ATOM 628 N N . ARG A 1 85 ? -6.968 28.882 9.626 1.00 42.50 85 A 1 ATOM 629 C CA . ARG A 1 85 ? -8.282 29.315 10.071 1.00 46.78 85 A 1 ATOM 630 C C . ARG A 1 85 ? -8.041 30.242 11.253 1.00 45.47 85 A 1 ATOM 631 O O . ARG A 1 85 ? -8.029 29.800 12.403 1.00 43.25 85 A 1 ATOM 632 C CB . ARG A 1 85 ? -9.213 28.152 10.443 1.00 45.93 85 A 1 ATOM 633 C CG . ARG A 1 85 ? -9.846 27.429 9.235 1.00 43.16 85 A 1 ATOM 634 C CD . ARG A 1 85 ? -11.007 26.544 9.705 1.00 42.55 85 A 1 ATOM 635 N NE . ARG A 1 85 ? -11.569 25.711 8.620 1.00 39.33 85 A 1 ATOM 636 C CZ . ARG A 1 85 ? -12.783 25.178 8.570 1.00 37.96 85 A 1 ATOM 637 N NH1 . ARG A 1 85 ? -13.667 25.383 9.504 1.00 35.95 85 A 1 ATOM 638 N NH2 . ARG A 1 85 ? -13.123 24.425 7.565 1.00 35.08 85 A 1 ATOM 639 N N . ARG A 1 86 ? -7.804 31.504 10.936 1.00 45.34 86 A 1 ATOM 640 C CA . ARG A 1 86 ? -7.971 32.571 11.910 1.00 50.50 86 A 1 ATOM 641 C C . ARG A 1 86 ? -9.384 32.437 12.452 1.00 48.73 86 A 1 ATOM 642 O O . ARG A 1 86 ? -10.355 32.593 11.715 1.00 46.57 86 A 1 ATOM 643 C CB . ARG A 1 86 ? -7.753 33.955 11.283 1.00 50.65 86 A 1 ATOM 644 C CG . ARG A 1 86 ? -6.279 34.211 10.935 1.00 47.65 86 A 1 ATOM 645 C CD . ARG A 1 86 ? -6.098 35.651 10.448 1.00 46.43 86 A 1 ATOM 646 N NE . ARG A 1 86 ? -4.722 35.892 9.979 1.00 43.98 86 A 1 ATOM 647 C CZ . ARG A 1 86 ? -4.201 37.062 9.636 1.00 41.12 86 A 1 ATOM 648 N NH1 . ARG A 1 86 ? -4.879 38.164 9.715 1.00 38.93 86 A 1 ATOM 649 N NH2 . ARG A 1 86 ? -2.973 37.133 9.206 1.00 38.16 86 A 1 ATOM 650 N N . THR A 1 87 ? -9.480 32.076 13.713 1.00 43.67 87 A 1 ATOM 651 C CA . THR A 1 87 ? -10.728 32.076 14.459 1.00 47.79 87 A 1 ATOM 652 C C . THR A 1 87 ? -11.329 33.487 14.387 1.00 46.99 87 A 1 ATOM 653 O O . THR A 1 87 ? -10.595 34.468 14.517 1.00 43.67 87 A 1 ATOM 654 C CB . THR A 1 87 ? -10.482 31.654 15.916 1.00 45.58 87 A 1 ATOM 655 O OG1 . THR A 1 87 ? -9.312 32.267 16.406 1.00 41.40 87 A 1 ATOM 656 C CG2 . THR A 1 87 ? -10.267 30.155 16.028 1.00 42.13 87 A 1 ATOM 657 N N . PRO A 1 88 ? -12.643 33.629 14.164 1.00 46.35 88 A 1 ATOM 658 C CA . PRO A 1 88 ? -13.279 34.929 13.908 1.00 52.81 88 A 1 ATOM 659 C C . PRO A 1 88 ? -13.451 35.808 15.164 1.00 54.67 88 A 1 ATOM 660 O O . PRO A 1 88 ? -14.302 36.678 15.194 1.00 52.03 88 A 1 ATOM 661 C CB . PRO A 1 88 ? -14.606 34.571 13.214 1.00 49.76 88 A 1 ATOM 662 C CG . PRO A 1 88 ? -14.961 33.217 13.804 1.00 47.44 88 A 1 ATOM 663 C CD . PRO A 1 88 ? -13.600 32.548 13.993 1.00 52.35 88 A 1 ATOM 664 N N . TRP A 1 89 ? -12.617 35.617 16.194 1.00 45.31 89 A 1 ATOM 665 C CA . TRP A 1 89 ? -12.745 36.307 17.487 1.00 46.24 89 A 1 ATOM 666 C C . TRP A 1 89 ? -11.598 37.271 17.812 1.00 46.30 89 A 1 ATOM 667 O O . TRP A 1 89 ? -11.370 37.575 18.970 1.00 43.65 89 A 1 ATOM 668 C CB . TRP A 1 89 ? -13.007 35.278 18.595 1.00 44.15 89 A 1 ATOM 669 C CG . TRP A 1 89 ? -14.303 34.543 18.450 1.00 42.25 89 A 1 ATOM 670 C CD1 . TRP A 1 89 ? -14.445 33.265 18.036 1.00 38.85 89 A 1 ATOM 671 C CD2 . TRP A 1 89 ? -15.650 35.034 18.729 1.00 41.11 89 A 1 ATOM 672 N NE1 . TRP A 1 89 ? -15.781 32.932 18.034 1.00 37.43 89 A 1 ATOM 673 C CE2 . TRP A 1 89 ? -16.580 33.981 18.460 1.00 39.36 89 A 1 ATOM 674 C CE3 . TRP A 1 89 ? -16.183 36.255 19.196 1.00 40.73 89 A 1 ATOM 675 C CZ2 . TRP A 1 89 ? -17.957 34.131 18.641 1.00 41.86 89 A 1 ATOM 676 C CZ3 . TRP A 1 89 ? -17.568 36.409 19.384 1.00 37.87 89 A 1 ATOM 677 C CH2 . TRP A 1 89 ? -18.457 35.355 19.112 1.00 37.78 89 A 1 ATOM 678 N N . GLN A 1 90 ? -10.886 37.766 16.783 1.00 40.51 90 A 1 ATOM 679 C CA . GLN A 1 90 ? -9.989 38.913 16.956 1.00 45.62 90 A 1 ATOM 680 C C . GLN A 1 90 ? -10.451 40.104 16.098 1.00 44.13 90 A 1 ATOM 681 O O . GLN A 1 90 ? -9.740 40.590 15.225 1.00 43.18 90 A 1 ATOM 682 C CB . GLN A 1 90 ? -8.516 38.540 16.742 1.00 46.99 90 A 1 ATOM 683 C CG . GLN A 1 90 ? -7.936 37.771 17.944 1.00 46.50 90 A 1 ATOM 684 C CD . GLN A 1 90 ? -6.411 37.718 17.910 1.00 43.11 90 A 1 ATOM 685 O OE1 . GLN A 1 90 ? -5.766 37.900 16.895 1.00 42.51 90 A 1 ATOM 686 N NE2 . GLN A 1 90 ? -5.776 37.461 19.032 1.00 41.28 90 A 1 ATOM 687 N N . LYS A 1 91 ? -11.666 40.541 16.334 1.00 40.02 91 A 1 ATOM 688 C CA . LYS A 1 91 ? -12.131 41.906 16.068 1.00 48.61 91 A 1 ATOM 689 C C . LYS A 1 91 ? -12.992 42.312 17.260 1.00 46.61 91 A 1 ATOM 690 O O . LYS A 1 91 ? -14.170 41.960 17.280 1.00 44.62 91 A 1 ATOM 691 C CB . LYS A 1 91 ? -12.937 42.013 14.762 1.00 47.97 91 A 1 ATOM 692 C CG . LYS A 1 91 ? -12.066 42.116 13.511 1.00 45.58 91 A 1 ATOM 693 C CD . LYS A 1 91 ? -12.942 42.455 12.301 1.00 45.85 91 A 1 ATOM 694 C CE . LYS A 1 91 ? -12.079 42.656 11.054 1.00 41.09 91 A 1 ATOM 695 N NZ . LYS A 1 91 ? -12.921 43.044 9.886 1.00 37.23 91 A 1 ATOM 696 N N . LEU A 1 92 ? -12.352 42.952 18.215 1.00 53.69 92 A 1 ATOM 697 C CA . LEU A 1 92 ? -12.821 44.120 18.967 1.00 58.35 92 A 1 ATOM 698 C C . LEU A 1 92 ? -11.760 44.450 20.016 1.00 54.50 92 A 1 ATOM 699 O O . LEU A 1 92 ? -11.401 43.546 20.794 1.00 49.28 92 A 1 ATOM 700 C CB . LEU A 1 92 ? -14.226 43.916 19.580 1.00 53.44 92 A 1 ATOM 701 C CG . LEU A 1 92 ? -15.350 44.405 18.632 1.00 49.09 92 A 1 ATOM 702 C CD1 . LEU A 1 92 ? -16.682 43.773 19.032 1.00 47.82 92 A 1 ATOM 703 C CD2 . LEU A 1 92 ? -15.499 45.921 18.673 1.00 49.88 92 A 1 ATOM 704 O OXT . LEU A 1 92 ? -11.323 45.619 19.972 1.00 48.40 92 A 1 #