# By using this file you agree to the legally binding terms of use found at # https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. # To request access to the AlphaFold 3 model parameters, follow the process set # out at https://github.com/google-deepmind/alphafold3. You may only use these if # received directly from Google. Use is subject to terms of use available at # https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. data_spkb09201 # _entry.id spkb09201 # 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](C(=O)O)N ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@@H](C(=O)O)N ? "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 LEU 2 1 n LEU 3 1 n TYR 4 1 n VAL 5 1 n THR 6 1 n LEU 7 1 n ILE 8 1 n LEU 9 1 n GLY 10 1 n CYS 11 1 n TRP 12 1 n SER 13 1 n ALA 14 1 n PHE 15 1 n SER 16 1 n GLU 17 1 n SER 18 # _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 (3.0.0 @ 2025-07-09 22:39:45)" _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 90.82 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # loop_ _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value _ma_qa_metric_local.model_id _ma_qa_metric_local.ordinal_id A MET 1 2 86.49 1 1 A LEU 2 2 90.03 1 2 A LEU 3 2 92.27 1 3 A TYR 4 2 94.16 1 4 A VAL 5 2 96.27 1 5 A THR 6 2 94.01 1 6 A LEU 7 2 92.99 1 7 A ILE 8 2 94.71 1 8 A LEU 9 2 92.66 1 9 A GLY 10 2 95.75 1 10 A CYS 11 2 94.63 1 11 A TRP 12 2 90.52 1 12 A SER 13 2 92.20 1 13 A ALA 14 2 96.38 1 14 A PHE 15 2 89.63 1 15 A SER 16 2 89.64 1 16 A GLU 17 2 77.32 1 17 A SER 18 2 81.31 1 18 # _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 https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. To request access to the AlphaFold 3 model parameters, follow the process set out at https://github.com/google-deepmind/alphafold3. You may only use these if received directly from Google. Use is subject to terms of use available at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. ; 1 license https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md ;AlphaFold 3 and its output are not intended for, have not been validated for, and are not approved for clinical use. They are provided "as-is" without any warranty of any kind, whether expressed or implied. No warranty is given that use 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 LEU . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n TYR . 4 A 4 A 5 1 n VAL . 5 A 5 A 6 1 n THR . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n ILE . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n GLY . 10 A 10 A 11 1 n CYS . 11 A 11 A 12 1 n TRP . 12 A 12 A 13 1 n SER . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n PHE . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n GLU . 17 A 17 A 18 1 n SER . 18 A 18 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (9ceee3b5f7825b611ab42eaad843248507ced2da1e745fa3b3d93c6c4ad3ca74)" # _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 ? -0.139 4.944 15.610 1.00 93.93 1 A 1 ATOM 2 C CA . MET A 1 1 ? 0.839 4.807 14.510 1.00 94.71 1 A 1 ATOM 3 C C . MET A 1 1 ? 0.454 3.670 13.564 1.00 95.70 1 A 1 ATOM 4 O O . MET A 1 1 ? 1.063 3.489 12.515 1.00 93.65 1 A 1 ATOM 5 C CB . MET A 1 1 ? 2.232 4.548 15.087 1.00 89.07 1 A 1 ATOM 6 C CG . MET A 1 1 ? 2.765 5.778 15.803 1.00 80.00 1 A 1 ATOM 7 S SD . MET A 1 1 ? 4.336 5.474 16.613 1.00 76.28 1 A 1 ATOM 8 C CE . MET A 1 1 ? 4.726 7.128 17.160 1.00 68.57 1 A 1 ATOM 9 N N . LEU A 1 2 ? -0.566 2.928 13.927 1.00 92.40 2 A 1 ATOM 10 C CA . LEU A 1 2 ? -1.043 1.821 13.097 1.00 95.04 2 A 1 ATOM 11 C C . LEU A 1 2 ? -1.559 2.344 11.754 1.00 96.65 2 A 1 ATOM 12 O O . LEU A 1 2 ? -1.427 1.688 10.722 1.00 96.05 2 A 1 ATOM 13 C CB . LEU A 1 2 ? -2.144 1.074 13.858 1.00 93.60 2 A 1 ATOM 14 C CG . LEU A 1 2 ? -2.130 -0.434 13.606 1.00 84.64 2 A 1 ATOM 15 C CD1 . LEU A 1 2 ? -2.896 -1.148 14.719 1.00 81.38 2 A 1 ATOM 16 C CD2 . LEU A 1 2 ? -2.746 -0.776 12.265 1.00 80.50 2 A 1 ATOM 17 N N . LEU A 1 3 ? -2.128 3.553 11.770 1.00 96.01 3 A 1 ATOM 18 C CA . LEU A 1 3 ? -2.647 4.173 10.548 1.00 96.67 3 A 1 ATOM 19 C C . LEU A 1 3 ? -1.541 4.368 9.515 1.00 97.42 3 A 1 ATOM 20 O O . LEU A 1 3 ? -1.781 4.271 8.314 1.00 97.15 3 A 1 ATOM 21 C CB . LEU A 1 3 ? -3.280 5.518 10.901 1.00 96.12 3 A 1 ATOM 22 C CG . LEU A 1 3 ? -4.592 5.378 11.675 1.00 87.81 3 A 1 ATOM 23 C CD1 . LEU A 1 3 ? -4.926 6.691 12.375 1.00 83.53 3 A 1 ATOM 24 C CD2 . LEU A 1 3 ? -5.726 5.002 10.731 1.00 83.43 3 A 1 ATOM 25 N N . TYR A 1 4 ? -0.337 4.634 9.983 1.00 96.68 4 A 1 ATOM 26 C CA . TYR A 1 4 ? 0.809 4.839 9.097 1.00 96.99 4 A 1 ATOM 27 C C . TYR A 1 4 ? 1.108 3.568 8.306 1.00 97.36 4 A 1 ATOM 28 O O . TYR A 1 4 ? 1.250 3.593 7.084 1.00 96.94 4 A 1 ATOM 29 C CB . TYR A 1 4 ? 2.021 5.244 9.939 1.00 96.79 4 A 1 ATOM 30 C CG . TYR A 1 4 ? 2.852 6.302 9.257 1.00 95.00 4 A 1 ATOM 31 C CD1 . TYR A 1 4 ? 2.491 7.645 9.344 1.00 91.64 4 A 1 ATOM 32 C CD2 . TYR A 1 4 ? 3.985 5.951 8.534 1.00 91.86 4 A 1 ATOM 33 C CE1 . TYR A 1 4 ? 3.255 8.623 8.715 1.00 91.44 4 A 1 ATOM 34 C CE2 . TYR A 1 4 ? 4.751 6.925 7.900 1.00 91.68 4 A 1 ATOM 35 C CZ . TYR A 1 4 ? 4.383 8.259 7.996 1.00 92.56 4 A 1 ATOM 36 O OH . TYR A 1 4 ? 5.138 9.221 7.375 1.00 91.02 4 A 1 ATOM 37 N N . VAL A 1 5 ? 1.182 2.458 8.992 1.00 97.39 5 A 1 ATOM 38 C CA . VAL A 1 5 ? 1.453 1.164 8.359 1.00 97.47 5 A 1 ATOM 39 C C . VAL A 1 5 ? 0.281 0.762 7.466 1.00 97.78 5 A 1 ATOM 40 O O . VAL A 1 5 ? 0.475 0.222 6.375 1.00 97.00 5 A 1 ATOM 41 C CB . VAL A 1 5 ? 1.705 0.086 9.428 1.00 96.91 5 A 1 ATOM 42 C CG1 . VAL A 1 5 ? 2.062 -1.243 8.779 1.00 93.50 5 A 1 ATOM 43 C CG2 . VAL A 1 5 ? 2.823 0.519 10.368 1.00 93.86 5 A 1 ATOM 44 N N . THR A 1 6 ? -0.926 1.039 7.915 1.00 96.60 6 A 1 ATOM 45 C CA . THR A 1 6 ? -2.132 0.704 7.154 1.00 96.63 6 A 1 ATOM 46 C C . THR A 1 6 ? -2.138 1.421 5.804 1.00 97.08 6 A 1 ATOM 47 O O . THR A 1 6 ? -2.500 0.832 4.784 1.00 96.34 6 A 1 ATOM 48 C CB . THR A 1 6 ? -3.379 1.093 7.953 1.00 95.98 6 A 1 ATOM 49 O OG1 . THR A 1 6 ? -3.311 0.507 9.249 1.00 88.38 6 A 1 ATOM 50 C CG2 . THR A 1 6 ? -4.641 0.594 7.272 1.00 87.03 6 A 1 ATOM 51 N N . LEU A 1 7 ? -1.732 2.678 5.789 1.00 96.69 7 A 1 ATOM 52 C CA . LEU A 1 7 ? -1.686 3.457 4.553 1.00 96.66 7 A 1 ATOM 53 C C . LEU A 1 7 ? -0.684 2.861 3.569 1.00 97.01 7 A 1 ATOM 54 O O . LEU A 1 7 ? -0.978 2.715 2.382 1.00 96.57 7 A 1 ATOM 55 C CB . LEU A 1 7 ? -1.313 4.904 4.883 1.00 96.46 7 A 1 ATOM 56 C CG . LEU A 1 7 ? -2.488 5.717 5.428 1.00 89.35 7 A 1 ATOM 57 C CD1 . LEU A 1 7 ? -1.986 6.970 6.131 1.00 85.41 7 A 1 ATOM 58 C CD2 . LEU A 1 7 ? -3.432 6.107 4.299 1.00 85.77 7 A 1 ATOM 59 N N . ILE A 1 8 ? 0.483 2.506 4.065 1.00 97.04 8 A 1 ATOM 60 C CA . ILE A 1 8 ? 1.525 1.921 3.223 1.00 96.90 8 A 1 ATOM 61 C C . ILE A 1 8 ? 1.062 0.581 2.660 1.00 96.99 8 A 1 ATOM 62 O O . ILE A 1 8 ? 1.193 0.320 1.462 1.00 96.47 8 A 1 ATOM 63 C CB . ILE A 1 8 ? 2.828 1.751 4.027 1.00 96.52 8 A 1 ATOM 64 C CG1 . ILE A 1 8 ? 3.362 3.115 4.471 1.00 93.92 8 A 1 ATOM 65 C CG2 . ILE A 1 8 ? 3.880 1.034 3.173 1.00 93.68 8 A 1 ATOM 66 C CD1 . ILE A 1 8 ? 4.396 3.012 5.580 1.00 86.18 8 A 1 ATOM 67 N N . LEU A 1 9 ? 0.515 -0.257 3.515 1.00 96.76 9 A 1 ATOM 68 C CA . LEU A 1 9 ? 0.025 -1.571 3.099 1.00 96.31 9 A 1 ATOM 69 C C . LEU A 1 9 ? -1.126 -1.431 2.105 1.00 96.28 9 A 1 ATOM 70 O O . LEU A 1 9 ? -1.214 -2.185 1.137 1.00 95.34 9 A 1 ATOM 71 C CB . LEU A 1 9 ? -0.432 -2.367 4.326 1.00 96.04 9 A 1 ATOM 72 C CG . LEU A 1 9 ? 0.632 -3.325 4.865 1.00 89.56 9 A 1 ATOM 73 C CD1 . LEU A 1 9 ? 1.810 -2.557 5.456 1.00 85.66 9 A 1 ATOM 74 C CD2 . LEU A 1 9 ? 0.021 -4.236 5.919 1.00 85.37 9 A 1 ATOM 75 N N . GLY A 1 10 ? -2.004 -0.463 2.346 1.00 96.28 10 A 1 ATOM 76 C CA . GLY A 1 10 ? -3.136 -0.221 1.459 1.00 95.75 10 A 1 ATOM 77 C C . GLY A 1 10 ? -2.689 0.188 0.068 1.00 96.19 10 A 1 ATOM 78 O O . GLY A 1 10 ? -3.177 -0.335 -0.933 1.00 94.79 10 A 1 ATOM 79 N N . CYS A 1 11 ? -1.745 1.113 -0.005 1.00 96.57 11 A 1 ATOM 80 C CA . CYS A 1 11 ? -1.220 1.581 -1.288 1.00 96.70 11 A 1 ATOM 81 C C . CYS A 1 11 ? -0.505 0.456 -2.033 1.00 96.64 11 A 1 ATOM 82 O O . CYS A 1 11 ? -0.681 0.286 -3.234 1.00 94.36 11 A 1 ATOM 83 C CB . CYS A 1 11 ? -0.255 2.743 -1.047 1.00 95.66 11 A 1 ATOM 84 S SG . CYS A 1 11 ? -1.136 4.256 -0.614 1.00 87.84 11 A 1 ATOM 85 N N . TRP A 1 12 ? 0.293 -0.313 -1.304 1.00 96.21 12 A 1 ATOM 86 C CA . TRP A 1 12 ? 1.038 -1.419 -1.906 1.00 96.15 12 A 1 ATOM 87 C C . TRP A 1 12 ? 0.088 -2.498 -2.418 1.00 96.54 12 A 1 ATOM 88 O O . TRP A 1 12 ? 0.277 -3.031 -3.508 1.00 95.46 12 A 1 ATOM 89 C CB . TRP A 1 12 ? 2.008 -2.001 -0.883 1.00 95.38 12 A 1 ATOM 90 C CG . TRP A 1 12 ? 3.394 -2.105 -1.420 1.00 92.57 12 A 1 ATOM 91 C CD1 . TRP A 1 12 ? 4.194 -1.065 -1.770 1.00 87.41 12 A 1 ATOM 92 C CD2 . TRP A 1 12 ? 4.139 -3.306 -1.689 1.00 90.92 12 A 1 ATOM 93 N NE1 . TRP A 1 12 ? 5.391 -1.545 -2.246 1.00 86.76 12 A 1 ATOM 94 C CE2 . TRP A 1 12 ? 5.396 -2.920 -2.207 1.00 90.78 12 A 1 ATOM 95 C CE3 . TRP A 1 12 ? 3.868 -4.672 -1.550 1.00 86.19 12 A 1 ATOM 96 C CZ2 . TRP A 1 12 ? 6.367 -3.850 -2.572 1.00 87.74 12 A 1 ATOM 97 C CZ3 . TRP A 1 12 ? 4.831 -5.603 -1.914 1.00 82.31 12 A 1 ATOM 98 C CH2 . TRP A 1 12 ? 6.067 -5.193 -2.423 1.00 82.81 12 A 1 ATOM 99 N N . SER A 1 13 ? -0.943 -2.784 -1.654 1.00 96.38 13 A 1 ATOM 100 C CA . SER A 1 13 ? -1.933 -3.788 -2.041 1.00 96.00 13 A 1 ATOM 101 C C . SER A 1 13 ? -2.667 -3.359 -3.309 1.00 96.05 13 A 1 ATOM 102 O O . SER A 1 13 ? -2.887 -4.164 -4.212 1.00 93.45 13 A 1 ATOM 103 C CB . SER A 1 13 ? -2.930 -4.001 -0.905 1.00 93.90 13 A 1 ATOM 104 O OG . SER A 1 13 ? -3.741 -5.113 -1.180 1.00 77.42 13 A 1 ATOM 105 N N . ALA A 1 14 ? -3.032 -2.090 -3.388 1.00 96.67 14 A 1 ATOM 106 C CA . ALA A 1 14 ? -3.722 -1.552 -4.562 1.00 96.83 14 A 1 ATOM 107 C C . ALA A 1 14 ? -2.835 -1.635 -5.802 1.00 97.03 14 A 1 ATOM 108 O O . ALA A 1 14 ? -3.298 -1.975 -6.889 1.00 95.78 14 A 1 ATOM 109 C CB . ALA A 1 14 ? -4.134 -0.109 -4.300 1.00 95.60 14 A 1 ATOM 110 N N . PHE A 1 15 ? -1.563 -1.331 -5.634 1.00 95.80 15 A 1 ATOM 111 C CA . PHE A 1 15 ? -0.609 -1.392 -6.739 1.00 95.40 15 A 1 ATOM 112 C C . PHE A 1 15 ? -0.385 -2.831 -7.190 1.00 95.50 15 A 1 ATOM 113 O O . PHE A 1 15 ? -0.300 -3.104 -8.386 1.00 92.95 15 A 1 ATOM 114 C CB . PHE A 1 15 ? 0.712 -0.767 -6.298 1.00 93.62 15 A 1 ATOM 115 C CG . PHE A 1 15 ? 1.716 -0.702 -7.417 1.00 89.84 15 A 1 ATOM 116 C CD1 . PHE A 1 15 ? 1.563 0.222 -8.439 1.00 85.31 15 A 1 ATOM 117 C CD2 . PHE A 1 15 ? 2.795 -1.572 -7.440 1.00 85.54 15 A 1 ATOM 118 C CE1 . PHE A 1 15 ? 2.478 0.283 -9.478 1.00 83.05 15 A 1 ATOM 119 C CE2 . PHE A 1 15 ? 3.715 -1.518 -8.482 1.00 85.52 15 A 1 ATOM 120 C CZ . PHE A 1 15 ? 3.555 -0.589 -9.497 1.00 83.37 15 A 1 ATOM 121 N N . SER A 1 16 ? -0.286 -3.737 -6.245 1.00 94.88 16 A 1 ATOM 122 C CA . SER A 1 16 ? -0.085 -5.155 -6.549 1.00 94.16 16 A 1 ATOM 123 C C . SER A 1 16 ? -1.302 -5.736 -7.261 1.00 93.30 16 A 1 ATOM 124 O O . SER A 1 16 ? -1.173 -6.582 -8.146 1.00 89.65 16 A 1 ATOM 125 C CB . SER A 1 16 ? 0.190 -5.929 -5.265 1.00 90.72 16 A 1 ATOM 126 O OG . SER A 1 16 ? 0.633 -7.233 -5.567 1.00 75.16 16 A 1 ATOM 127 N N . GLU A 1 17 ? -2.484 -5.259 -6.891 1.00 92.22 17 A 1 ATOM 128 C CA . GLU A 1 17 ? -3.740 -5.705 -7.497 1.00 90.00 17 A 1 ATOM 129 C C . GLU A 1 17 ? -4.018 -4.946 -8.801 1.00 87.19 17 A 1 ATOM 130 O O . GLU A 1 17 ? -5.164 -4.661 -9.147 1.00 76.14 17 A 1 ATOM 131 C CB . GLU A 1 17 ? -4.882 -5.501 -6.501 1.00 85.14 17 A 1 ATOM 132 C CG . GLU A 1 17 ? -6.208 -6.084 -6.946 1.00 73.89 17 A 1 ATOM 133 C CD . GLU A 1 17 ? -6.246 -7.599 -6.769 1.00 68.61 17 A 1 ATOM 134 O OE1 . GLU A 1 17 ? -5.469 -8.288 -7.423 1.00 60.23 17 A 1 ATOM 135 O OE2 . GLU A 1 17 ? -7.071 -8.074 -5.978 1.00 62.47 17 A 1 ATOM 136 N N . SER A 1 18 ? -2.964 -4.617 -9.511 1.00 89.61 18 A 1 ATOM 137 C CA . SER A 1 18 ? -3.079 -3.865 -10.758 1.00 88.27 18 A 1 ATOM 138 C C . SER A 1 18 ? -3.829 -4.674 -11.816 1.00 84.39 18 A 1 ATOM 139 O O . SER A 1 18 ? -3.245 -5.587 -12.406 1.00 75.17 18 A 1 ATOM 140 C CB . SER A 1 18 ? -1.705 -3.471 -11.279 1.00 82.79 18 A 1 ATOM 141 O OG . SER A 1 18 ? -1.839 -2.698 -12.447 1.00 74.43 18 A 1 ATOM 142 O OXT . SER A 1 18 ? -5.005 -4.411 -12.040 1.00 74.54 18 A 1 #