# 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_spkb18724 # _entry.id spkb18724 # 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" "C6 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])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 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" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)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 PRO 2 1 n LEU 3 1 n PRO 4 1 n ARG 5 1 n ALA 6 1 n ALA 7 1 n PHE 8 1 n LEU 9 1 n LEU 10 1 n GLY 11 1 n LEU 12 1 n LEU 13 1 n LEU 14 1 n ALA 15 1 n ALA 16 1 n ALA 17 1 n ALA 18 1 n ALA 19 # _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 @ 2025-07-07 14:41:57)" _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 94.47 _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 82.27 1 1 A PRO 2 2 91.74 1 2 A LEU 3 2 90.15 1 3 A PRO 4 2 95.49 1 4 A ARG 5 2 91.34 1 5 A ALA 6 2 97.66 1 6 A ALA 7 2 97.91 1 7 A PHE 8 2 95.70 1 8 A LEU 9 2 96.62 1 9 A LEU 10 2 95.59 1 10 A GLY 11 2 97.74 1 11 A LEU 12 2 96.44 1 12 A LEU 13 2 96.74 1 13 A LEU 14 2 96.39 1 14 A ALA 15 2 98.28 1 15 A ALA 16 2 98.33 1 16 A ALA 17 2 97.96 1 17 A ALA 18 2 96.97 1 18 A ALA 19 2 90.26 1 19 # _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 PRO . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n PRO . 4 A 4 A 5 1 n ARG . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n ALA . 7 A 7 A 8 1 n PHE . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n ALA . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n ALA . 19 A 19 # _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 ? -7.104 11.477 -4.936 1.00 87.33 1 A 1 ATOM 2 C CA . MET A 1 1 ? -7.777 10.245 -4.489 1.00 88.34 1 A 1 ATOM 3 C C . MET A 1 1 ? -7.189 9.753 -3.173 1.00 90.22 1 A 1 ATOM 4 O O . MET A 1 1 ? -5.994 9.471 -3.111 1.00 87.85 1 A 1 ATOM 5 C CB . MET A 1 1 ? -7.619 9.136 -5.529 1.00 83.26 1 A 1 ATOM 6 C CG . MET A 1 1 ? -8.368 9.426 -6.805 1.00 78.89 1 A 1 ATOM 7 S SD . MET A 1 1 ? -8.404 8.000 -7.903 1.00 75.36 1 A 1 ATOM 8 C CE . MET A 1 1 ? -6.667 7.828 -8.264 1.00 66.93 1 A 1 ATOM 9 N N . PRO A 1 2 ? -7.996 9.663 -2.128 1.00 92.17 2 A 1 ATOM 10 C CA . PRO A 1 2 ? -7.527 9.143 -0.842 1.00 94.01 2 A 1 ATOM 11 C C . PRO A 1 2 ? -7.302 7.634 -0.924 1.00 95.21 2 A 1 ATOM 12 O O . PRO A 1 2 ? -8.158 6.897 -1.422 1.00 92.54 2 A 1 ATOM 13 C CB . PRO A 1 2 ? -8.668 9.481 0.121 1.00 91.14 2 A 1 ATOM 14 C CG . PRO A 1 2 ? -9.885 9.569 -0.748 1.00 87.49 2 A 1 ATOM 15 C CD . PRO A 1 2 ? -9.398 10.049 -2.102 1.00 89.64 2 A 1 ATOM 16 N N . LEU A 1 3 ? -6.155 7.164 -0.453 1.00 92.81 3 A 1 ATOM 17 C CA . LEU A 1 3 ? -5.842 5.738 -0.492 1.00 93.70 3 A 1 ATOM 18 C C . LEU A 1 3 ? -6.466 5.023 0.700 1.00 94.89 3 A 1 ATOM 19 O O . LEU A 1 3 ? -6.175 5.371 1.843 1.00 93.39 3 A 1 ATOM 20 C CB . LEU A 1 3 ? -4.325 5.539 -0.485 1.00 92.11 3 A 1 ATOM 21 C CG . LEU A 1 3 ? -3.662 5.983 -1.783 1.00 88.09 3 A 1 ATOM 22 C CD1 . LEU A 1 3 ? -2.144 5.946 -1.637 1.00 84.83 3 A 1 ATOM 23 C CD2 . LEU A 1 3 ? -4.098 5.085 -2.936 1.00 81.40 3 A 1 ATOM 24 N N . PRO A 1 4 ? -7.317 4.024 0.437 1.00 96.37 4 A 1 ATOM 25 C CA . PRO A 1 4 ? -7.925 3.251 1.513 1.00 96.51 4 A 1 ATOM 26 C C . PRO A 1 4 ? -6.877 2.400 2.227 1.00 97.06 4 A 1 ATOM 27 O O . PRO A 1 4 ? -5.808 2.118 1.683 1.00 96.24 4 A 1 ATOM 28 C CB . PRO A 1 4 ? -8.966 2.377 0.803 1.00 94.73 4 A 1 ATOM 29 C CG . PRO A 1 4 ? -8.520 2.307 -0.619 1.00 92.76 4 A 1 ATOM 30 C CD . PRO A 1 4 ? -7.779 3.599 -0.880 1.00 94.76 4 A 1 ATOM 31 N N . ARG A 1 5 ? -7.200 1.980 3.437 1.00 96.82 5 A 1 ATOM 32 C CA . ARG A 1 5 ? -6.281 1.183 4.257 1.00 97.53 5 A 1 ATOM 33 C C . ARG A 1 5 ? -5.841 -0.081 3.521 1.00 98.00 5 A 1 ATOM 34 O O . ARG A 1 5 ? -4.661 -0.427 3.510 1.00 97.69 5 A 1 ATOM 35 C CB . ARG A 1 5 ? -6.988 0.823 5.567 1.00 96.62 5 A 1 ATOM 36 C CG . ARG A 1 5 ? -6.032 0.259 6.601 1.00 92.44 5 A 1 ATOM 37 C CD . ARG A 1 5 ? -6.813 -0.189 7.817 1.00 90.31 5 A 1 ATOM 38 N NE . ARG A 1 5 ? -5.922 -0.654 8.885 1.00 87.83 5 A 1 ATOM 39 C CZ . ARG A 1 5 ? -5.619 0.059 9.965 1.00 86.44 5 A 1 ATOM 40 N NH1 . ARG A 1 5 ? -6.105 1.274 10.141 1.00 80.28 5 A 1 ATOM 41 N NH2 . ARG A 1 5 ? -4.821 -0.457 10.882 1.00 80.75 5 A 1 ATOM 42 N N . ALA A 1 6 ? -6.787 -0.766 2.882 1.00 97.64 6 A 1 ATOM 43 C CA . ALA A 1 6 ? -6.485 -2.004 2.165 1.00 97.79 6 A 1 ATOM 44 C C . ALA A 1 6 ? -5.542 -1.753 0.991 1.00 98.01 6 A 1 ATOM 45 O O . ALA A 1 6 ? -4.610 -2.524 0.758 1.00 97.60 6 A 1 ATOM 46 C CB . ALA A 1 6 ? -7.783 -2.637 1.679 1.00 97.28 6 A 1 ATOM 47 N N . ALA A 1 7 ? -5.779 -0.686 0.248 1.00 97.97 7 A 1 ATOM 48 C CA . ALA A 1 7 ? -4.938 -0.354 -0.900 1.00 98.02 7 A 1 ATOM 49 C C . ALA A 1 7 ? -3.515 -0.033 -0.458 1.00 98.16 7 A 1 ATOM 50 O O . ALA A 1 7 ? -2.550 -0.424 -1.117 1.00 97.80 7 A 1 ATOM 51 C CB . ALA A 1 7 ? -5.533 0.825 -1.653 1.00 97.62 7 A 1 ATOM 52 N N . PHE A 1 8 ? -3.380 0.673 0.655 1.00 97.37 8 A 1 ATOM 53 C CA . PHE A 1 8 ? -2.065 1.018 1.182 1.00 97.41 8 A 1 ATOM 54 C C . PHE A 1 8 ? -1.281 -0.238 1.546 1.00 97.74 8 A 1 ATOM 55 O O . PHE A 1 8 ? -0.113 -0.382 1.183 1.00 97.55 8 A 1 ATOM 56 C CB . PHE A 1 8 ? -2.219 1.913 2.407 1.00 97.20 8 A 1 ATOM 57 C CG . PHE A 1 8 ? -0.898 2.225 3.054 1.00 96.19 8 A 1 ATOM 58 C CD1 . PHE A 1 8 ? -0.027 3.138 2.475 1.00 94.31 8 A 1 ATOM 59 C CD2 . PHE A 1 8 ? -0.526 1.592 4.228 1.00 94.24 8 A 1 ATOM 60 C CE1 . PHE A 1 8 ? 1.196 3.417 3.063 1.00 93.57 8 A 1 ATOM 61 C CE2 . PHE A 1 8 ? 0.700 1.867 4.820 1.00 93.38 8 A 1 ATOM 62 C CZ . PHE A 1 8 ? 1.561 2.779 4.236 1.00 93.78 8 A 1 ATOM 63 N N . LEU A 1 9 ? -1.930 -1.148 2.246 1.00 97.45 9 A 1 ATOM 64 C CA . LEU A 1 9 ? -1.274 -2.390 2.661 1.00 97.53 9 A 1 ATOM 65 C C . LEU A 1 9 ? -0.887 -3.232 1.450 1.00 97.80 9 A 1 ATOM 66 O O . LEU A 1 9 ? 0.215 -3.778 1.388 1.00 97.83 9 A 1 ATOM 67 C CB . LEU A 1 9 ? -2.209 -3.187 3.574 1.00 97.57 9 A 1 ATOM 68 C CG . LEU A 1 9 ? -2.442 -2.524 4.927 1.00 96.03 9 A 1 ATOM 69 C CD1 . LEU A 1 9 ? -3.509 -3.277 5.705 1.00 94.42 9 A 1 ATOM 70 C CD2 . LEU A 1 9 ? -1.150 -2.484 5.737 1.00 94.32 9 A 1 ATOM 71 N N . LEU A 1 10 ? -1.784 -3.328 0.484 1.00 97.35 10 A 1 ATOM 72 C CA . LEU A 1 10 ? -1.517 -4.100 -0.729 1.00 97.26 10 A 1 ATOM 73 C C . LEU A 1 10 ? -0.332 -3.513 -1.487 1.00 97.64 10 A 1 ATOM 74 O O . LEU A 1 10 ? 0.554 -4.241 -1.935 1.00 97.66 10 A 1 ATOM 75 C CB . LEU A 1 10 ? -2.764 -4.114 -1.610 1.00 96.99 10 A 1 ATOM 76 C CG . LEU A 1 10 ? -2.598 -4.949 -2.879 1.00 93.35 10 A 1 ATOM 77 C CD1 . LEU A 1 10 ? -2.353 -6.416 -2.535 1.00 92.10 10 A 1 ATOM 78 C CD2 . LEU A 1 10 ? -3.835 -4.819 -3.753 1.00 92.39 10 A 1 ATOM 79 N N . GLY A 1 11 ? -0.317 -2.202 -1.632 1.00 97.66 11 A 1 ATOM 80 C CA . GLY A 1 11 ? 0.781 -1.536 -2.326 1.00 97.57 11 A 1 ATOM 81 C C . GLY A 1 11 ? 2.104 -1.747 -1.613 1.00 97.93 11 A 1 ATOM 82 O O . GLY A 1 11 ? 3.141 -1.955 -2.249 1.00 97.79 11 A 1 ATOM 83 N N . LEU A 1 12 ? 2.070 -1.711 -0.292 1.00 97.49 12 A 1 ATOM 84 C CA . LEU A 1 12 ? 3.272 -1.921 0.509 1.00 97.46 12 A 1 ATOM 85 C C . LEU A 1 12 ? 3.825 -3.328 0.295 1.00 97.83 12 A 1 ATOM 86 O O . LEU A 1 12 ? 5.036 -3.517 0.161 1.00 97.67 12 A 1 ATOM 87 C CB . LEU A 1 12 ? 2.945 -1.700 1.984 1.00 97.21 12 A 1 ATOM 88 C CG . LEU A 1 12 ? 4.175 -1.745 2.884 1.00 96.11 12 A 1 ATOM 89 C CD1 . LEU A 1 12 ? 5.122 -0.601 2.560 1.00 94.11 12 A 1 ATOM 90 C CD2 . LEU A 1 12 ? 3.750 -1.674 4.344 1.00 93.68 12 A 1 ATOM 91 N N . LEU A 1 13 ? 2.939 -4.309 0.253 1.00 97.74 13 A 1 ATOM 92 C CA . LEU A 1 13 ? 3.351 -5.695 0.034 1.00 97.79 13 A 1 ATOM 93 C C . LEU A 1 13 ? 3.969 -5.864 -1.349 1.00 98.12 13 A 1 ATOM 94 O O . LEU A 1 13 ? 4.978 -6.556 -1.507 1.00 98.00 13 A 1 ATOM 95 C CB . LEU A 1 13 ? 2.144 -6.623 0.185 1.00 97.68 13 A 1 ATOM 96 C CG . LEU A 1 13 ? 1.646 -6.737 1.625 1.00 96.35 13 A 1 ATOM 97 C CD1 . LEU A 1 13 ? 0.332 -7.499 1.666 1.00 94.20 13 A 1 ATOM 98 C CD2 . LEU A 1 13 ? 2.682 -7.441 2.495 1.00 94.01 13 A 1 ATOM 99 N N . LEU A 1 14 ? 3.376 -5.226 -2.350 1.00 98.12 14 A 1 ATOM 100 C CA . LEU A 1 14 ? 3.899 -5.304 -3.711 1.00 98.13 14 A 1 ATOM 101 C C . LEU A 1 14 ? 5.290 -4.685 -3.784 1.00 98.39 14 A 1 ATOM 102 O O . LEU A 1 14 ? 6.187 -5.228 -4.432 1.00 98.27 14 A 1 ATOM 103 C CB . LEU A 1 14 ? 2.948 -4.581 -4.662 1.00 97.80 14 A 1 ATOM 104 C CG . LEU A 1 14 ? 1.628 -5.321 -4.871 1.00 94.77 14 A 1 ATOM 105 C CD1 . LEU A 1 14 ? 0.652 -4.445 -5.641 1.00 92.97 14 A 1 ATOM 106 C CD2 . LEU A 1 14 ? 1.863 -6.627 -5.622 1.00 92.67 14 A 1 ATOM 107 N N . ALA A 1 15 ? 5.465 -3.563 -3.111 1.00 98.47 15 A 1 ATOM 108 C CA . ALA A 1 15 ? 6.764 -2.902 -3.086 1.00 98.37 15 A 1 ATOM 109 C C . ALA A 1 15 ? 7.808 -3.787 -2.408 1.00 98.53 15 A 1 ATOM 110 O O . ALA A 1 15 ? 8.953 -3.870 -2.858 1.00 98.13 15 A 1 ATOM 111 C CB . ALA A 1 15 ? 6.644 -1.569 -2.357 1.00 97.92 15 A 1 ATOM 112 N N . ALA A 1 16 ? 7.415 -4.448 -1.331 1.00 98.55 16 A 1 ATOM 113 C CA . ALA A 1 16 ? 8.321 -5.340 -0.612 1.00 98.44 16 A 1 ATOM 114 C C . ALA A 1 16 ? 8.713 -6.530 -1.481 1.00 98.56 16 A 1 ATOM 115 O O . ALA A 1 16 ? 9.862 -6.975 -1.457 1.00 98.08 16 A 1 ATOM 116 C CB . ALA A 1 16 ? 7.658 -5.823 0.675 1.00 98.00 16 A 1 ATOM 117 N N . ALA A 1 17 ? 7.766 -7.050 -2.247 1.00 98.39 17 A 1 ATOM 118 C CA . ALA A 1 17 ? 8.030 -8.182 -3.132 1.00 98.18 17 A 1 ATOM 119 C C . ALA A 1 17 ? 8.984 -7.786 -4.252 1.00 98.24 17 A 1 ATOM 120 O O . ALA A 1 17 ? 9.806 -8.593 -4.693 1.00 97.42 17 A 1 ATOM 121 C CB . ALA A 1 17 ? 6.717 -8.701 -3.717 1.00 97.58 17 A 1 ATOM 122 N N . ALA A 1 18 ? 8.875 -6.552 -4.722 1.00 97.72 18 A 1 ATOM 123 C CA . ALA A 1 18 ? 9.743 -6.051 -5.786 1.00 97.33 18 A 1 ATOM 124 C C . ALA A 1 18 ? 11.176 -5.875 -5.299 1.00 97.38 18 A 1 ATOM 125 O O . ALA A 1 18 ? 12.127 -6.005 -6.076 1.00 96.06 18 A 1 ATOM 126 C CB . ALA A 1 18 ? 9.200 -4.728 -6.312 1.00 96.34 18 A 1 ATOM 127 N N . ALA A 1 19 ? 11.345 -5.574 -4.012 1.00 96.09 19 A 1 ATOM 128 C CA . ALA A 1 19 ? 12.666 -5.368 -3.437 1.00 94.28 19 A 1 ATOM 129 C C . ALA A 1 19 ? 13.355 -6.699 -3.140 1.00 91.83 19 A 1 ATOM 130 O O . ALA A 1 19 ? 12.680 -7.665 -2.758 1.00 86.44 19 A 1 ATOM 131 C CB . ALA A 1 19 ? 12.560 -4.522 -2.169 1.00 90.47 19 A 1 ATOM 132 O OXT . ALA A 1 19 ? 14.582 -6.783 -3.278 1.00 82.46 19 A 1 #