# 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_spkb24403 # _entry.id spkb24403 # 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" "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" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])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" "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" # _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 PRO 3 1 n ALA 4 1 n LYS 5 1 n TRP 6 1 n LEU 7 1 n ILE 8 1 n ALA 9 1 n SER 10 1 n LEU 11 1 n ALA 12 1 n PHE 13 1 n ALA 14 1 n SER 15 1 n THR 16 1 n GLY 17 1 n LEU 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 @ 2025-07-08 10:36:16)" _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 91.79 _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 76.07 1 1 A ALA 2 2 89.15 1 2 A PRO 3 2 93.17 1 3 A ALA 4 2 95.65 1 4 A LYS 5 2 90.76 1 5 A TRP 6 2 92.43 1 6 A LEU 7 2 94.39 1 7 A ILE 8 2 95.20 1 8 A ALA 9 2 96.84 1 9 A SER 10 2 95.52 1 10 A LEU 11 2 94.81 1 11 A ALA 12 2 96.90 1 12 A PHE 13 2 93.29 1 13 A ALA 14 2 96.39 1 14 A SER 15 2 94.64 1 15 A THR 16 2 93.67 1 16 A GLY 17 2 94.18 1 17 A LEU 18 2 84.56 1 18 A ALA 19 2 82.26 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 ALA . 2 A 2 A 3 1 n PRO . 3 A 3 A 4 1 n ALA . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n TRP . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n ILE . 8 A 8 A 9 1 n ALA . 9 A 9 A 10 1 n SER . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n ALA . 14 A 14 A 15 1 n SER . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n GLY . 17 A 17 A 18 1 n LEU . 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 ? -12.856 11.632 5.835 1.00 82.34 1 A 1 ATOM 2 C CA . MET A 1 1 ? -11.544 11.297 5.247 1.00 83.40 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.461 9.801 4.958 1.00 82.99 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.676 8.992 5.863 1.00 77.80 1 A 1 ATOM 5 C CB . MET A 1 1 ? -10.411 11.689 6.197 1.00 77.57 1 A 1 ATOM 6 C CG . MET A 1 1 ? -10.335 13.190 6.432 1.00 73.49 1 A 1 ATOM 7 S SD . MET A 1 1 ? -9.028 13.632 7.593 1.00 69.97 1 A 1 ATOM 8 C CE . MET A 1 1 ? -9.205 15.408 7.617 1.00 61.01 1 A 1 ATOM 9 N N . ALA A 1 2 ? -11.167 9.439 3.703 1.00 84.95 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -11.049 8.036 3.304 1.00 90.20 2 A 1 ATOM 11 C C . ALA A 1 2 ? -9.721 7.805 2.570 1.00 93.03 2 A 1 ATOM 12 O O . ALA A 1 2 ? -9.666 7.908 1.343 1.00 91.74 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -12.227 7.651 2.415 1.00 85.84 2 A 1 ATOM 14 N N . PRO A 1 3 ? -8.649 7.495 3.304 1.00 93.94 3 A 1 ATOM 15 C CA . PRO A 1 3 ? -7.320 7.284 2.722 1.00 95.00 3 A 1 ATOM 16 C C . PRO A 1 3 ? -7.186 5.920 2.042 1.00 96.22 3 A 1 ATOM 17 O O . PRO A 1 3 ? -6.524 5.014 2.560 1.00 94.64 3 A 1 ATOM 18 C CB . PRO A 1 3 ? -6.383 7.393 3.927 1.00 92.08 3 A 1 ATOM 19 C CG . PRO A 1 3 ? -7.200 6.940 5.092 1.00 88.87 3 A 1 ATOM 20 C CD . PRO A 1 3 ? -8.633 7.328 4.770 1.00 91.43 3 A 1 ATOM 21 N N . ALA A 1 4 ? -7.825 5.762 0.879 1.00 94.95 4 A 1 ATOM 22 C CA . ALA A 1 4 ? -7.770 4.507 0.130 1.00 96.06 4 A 1 ATOM 23 C C . ALA A 1 4 ? -6.345 4.210 -0.330 1.00 96.70 4 A 1 ATOM 24 O O . ALA A 1 4 ? -5.910 3.056 -0.331 1.00 95.50 4 A 1 ATOM 25 C CB . ALA A 1 4 ? -8.717 4.576 -1.065 1.00 95.02 4 A 1 ATOM 26 N N . LYS A 1 5 ? -5.607 5.261 -0.713 1.00 96.02 5 A 1 ATOM 27 C CA . LYS A 1 5 ? -4.219 5.117 -1.161 1.00 96.10 5 A 1 ATOM 28 C C . LYS A 1 5 ? -3.338 4.575 -0.038 1.00 96.40 5 A 1 ATOM 29 O O . LYS A 1 5 ? -2.444 3.766 -0.277 1.00 96.39 5 A 1 ATOM 30 C CB . LYS A 1 5 ? -3.687 6.461 -1.650 1.00 95.42 5 A 1 ATOM 31 C CG . LYS A 1 5 ? -4.336 6.909 -2.949 1.00 90.57 5 A 1 ATOM 32 C CD . LYS A 1 5 ? -3.695 8.180 -3.497 1.00 87.02 5 A 1 ATOM 33 C CE . LYS A 1 5 ? -4.133 9.405 -2.711 1.00 82.64 5 A 1 ATOM 34 N NZ . LYS A 1 5 ? -3.634 10.658 -3.352 1.00 76.24 5 A 1 ATOM 35 N N . TRP A 1 6 ? -3.605 5.017 1.201 1.00 96.24 6 A 1 ATOM 36 C CA . TRP A 1 6 ? -2.845 4.559 2.360 1.00 96.24 6 A 1 ATOM 37 C C . TRP A 1 6 ? -3.101 3.078 2.614 1.00 96.58 6 A 1 ATOM 38 O O . TRP A 1 6 ? -2.181 2.324 2.929 1.00 95.85 6 A 1 ATOM 39 C CB . TRP A 1 6 ? -3.213 5.388 3.594 1.00 95.99 6 A 1 ATOM 40 C CG . TRP A 1 6 ? -2.014 5.972 4.276 1.00 94.22 6 A 1 ATOM 41 C CD1 . TRP A 1 6 ? -1.430 7.167 4.006 1.00 90.68 6 A 1 ATOM 42 C CD2 . TRP A 1 6 ? -1.236 5.378 5.341 1.00 93.19 6 A 1 ATOM 43 N NE1 . TRP A 1 6 ? -0.340 7.356 4.827 1.00 89.76 6 A 1 ATOM 44 C CE2 . TRP A 1 6 ? -0.197 6.276 5.658 1.00 92.53 6 A 1 ATOM 45 C CE3 . TRP A 1 6 ? -1.333 4.183 6.049 1.00 89.99 6 A 1 ATOM 46 C CZ2 . TRP A 1 6 ? 0.739 5.997 6.659 1.00 90.64 6 A 1 ATOM 47 C CZ3 . TRP A 1 6 ? -0.401 3.912 7.050 1.00 85.91 6 A 1 ATOM 48 C CH2 . TRP A 1 6 ? 0.619 4.815 7.339 1.00 86.16 6 A 1 ATOM 49 N N . LEU A 1 7 ? -4.366 2.651 2.445 1.00 96.38 7 A 1 ATOM 50 C CA . LEU A 1 7 ? -4.736 1.247 2.620 1.00 96.25 7 A 1 ATOM 51 C C . LEU A 1 7 ? -4.037 0.375 1.580 1.00 96.72 7 A 1 ATOM 52 O O . LEU A 1 7 ? -3.525 -0.700 1.898 1.00 96.75 7 A 1 ATOM 53 C CB . LEU A 1 7 ? -6.254 1.090 2.504 1.00 96.40 7 A 1 ATOM 54 C CG . LEU A 1 7 ? -7.049 1.720 3.650 1.00 93.05 7 A 1 ATOM 55 C CD1 . LEU A 1 7 ? -8.538 1.720 3.335 1.00 89.40 7 A 1 ATOM 56 C CD2 . LEU A 1 7 ? -6.790 0.976 4.952 1.00 90.20 7 A 1 ATOM 57 N N . ILE A 1 8 ? -4.012 0.841 0.335 1.00 96.68 8 A 1 ATOM 58 C CA . ILE A 1 8 ? -3.353 0.120 -0.754 1.00 96.33 8 A 1 ATOM 59 C C . ILE A 1 8 ? -1.851 0.030 -0.492 1.00 96.35 8 A 1 ATOM 60 O O . ILE A 1 8 ? -1.228 -1.013 -0.724 1.00 96.12 8 A 1 ATOM 61 C CB . ILE A 1 8 ? -3.626 0.809 -2.104 1.00 96.39 8 A 1 ATOM 62 C CG1 . ILE A 1 8 ? -5.126 0.768 -2.438 1.00 94.99 8 A 1 ATOM 63 C CG2 . ILE A 1 8 ? -2.829 0.126 -3.222 1.00 94.07 8 A 1 ATOM 64 C CD1 . ILE A 1 8 ? -5.509 1.667 -3.598 1.00 90.68 8 A 1 ATOM 65 N N . ALA A 1 9 ? -1.266 1.115 -0.001 1.00 97.21 9 A 1 ATOM 66 C CA . ALA A 1 9 ? 0.160 1.149 0.316 1.00 96.92 9 A 1 ATOM 67 C C . ALA A 1 9 ? 0.499 0.144 1.411 1.00 97.04 9 A 1 ATOM 68 O O . ALA A 1 9 ? 1.508 -0.560 1.329 1.00 96.38 9 A 1 ATOM 69 C CB . ALA A 1 9 ? 0.560 2.555 0.748 1.00 96.67 9 A 1 ATOM 70 N N . SER A 1 10 ? -0.359 0.065 2.431 1.00 96.74 10 A 1 ATOM 71 C CA . SER A 1 10 ? -0.169 -0.876 3.531 1.00 96.45 10 A 1 ATOM 72 C C . SER A 1 10 ? -0.268 -2.314 3.032 1.00 96.79 10 A 1 ATOM 73 O O . SER A 1 10 ? 0.514 -3.179 3.430 1.00 96.11 10 A 1 ATOM 74 C CB . SER A 1 10 ? -1.208 -0.632 4.621 1.00 95.82 10 A 1 ATOM 75 O OG . SER A 1 10 ? -1.051 0.662 5.174 1.00 91.23 10 A 1 ATOM 76 N N . LEU A 1 11 ? -1.232 -2.564 2.141 1.00 96.70 11 A 1 ATOM 77 C CA . LEU A 1 11 ? -1.427 -3.892 1.566 1.00 96.37 11 A 1 ATOM 78 C C . LEU A 1 11 ? -0.220 -4.296 0.728 1.00 96.87 11 A 1 ATOM 79 O O . LEU A 1 11 ? 0.243 -5.439 0.804 1.00 96.53 11 A 1 ATOM 80 C CB . LEU A 1 11 ? -2.690 -3.907 0.702 1.00 96.10 11 A 1 ATOM 81 C CG . LEU A 1 11 ? -3.122 -5.302 0.250 1.00 93.22 11 A 1 ATOM 82 C CD1 . LEU A 1 11 ? -3.665 -6.101 1.421 1.00 90.53 11 A 1 ATOM 83 C CD2 . LEU A 1 11 ? -4.169 -5.202 -0.850 1.00 92.13 11 A 1 ATOM 84 N N . ALA A 1 12 ? 0.299 -3.364 -0.070 1.00 97.03 12 A 1 ATOM 85 C CA . ALA A 1 12 ? 1.473 -3.614 -0.901 1.00 96.94 12 A 1 ATOM 86 C C . ALA A 1 12 ? 2.699 -3.887 -0.039 1.00 97.25 12 A 1 ATOM 87 O O . ALA A 1 12 ? 3.504 -4.769 -0.346 1.00 96.66 12 A 1 ATOM 88 C CB . ALA A 1 12 ? 1.724 -2.418 -1.816 1.00 96.60 12 A 1 ATOM 89 N N . PHE A 1 13 ? 2.822 -3.148 1.055 1.00 95.91 13 A 1 ATOM 90 C CA . PHE A 1 13 ? 3.920 -3.322 2.000 1.00 95.56 13 A 1 ATOM 91 C C . PHE A 1 13 ? 3.901 -4.726 2.597 1.00 96.56 13 A 1 ATOM 92 O O . PHE A 1 13 ? 4.938 -5.386 2.699 1.00 96.01 13 A 1 ATOM 93 C CB . PHE A 1 13 ? 3.811 -2.271 3.108 1.00 94.88 13 A 1 ATOM 94 C CG . PHE A 1 13 ? 4.873 -2.399 4.170 1.00 93.53 13 A 1 ATOM 95 C CD1 . PHE A 1 13 ? 6.154 -1.915 3.949 1.00 91.58 13 A 1 ATOM 96 C CD2 . PHE A 1 13 ? 4.580 -2.988 5.387 1.00 91.72 13 A 1 ATOM 97 C CE1 . PHE A 1 13 ? 7.134 -2.028 4.925 1.00 90.10 13 A 1 ATOM 98 C CE2 . PHE A 1 13 ? 5.558 -3.105 6.371 1.00 90.29 13 A 1 ATOM 99 C CZ . PHE A 1 13 ? 6.835 -2.625 6.137 1.00 90.06 13 A 1 ATOM 100 N N . ALA A 1 14 ? 2.712 -5.187 2.986 1.00 96.64 14 A 1 ATOM 101 C CA . ALA A 1 14 ? 2.556 -6.525 3.553 1.00 96.45 14 A 1 ATOM 102 C C . ALA A 1 14 ? 2.725 -7.603 2.483 1.00 97.17 14 A 1 ATOM 103 O O . ALA A 1 14 ? 3.256 -8.680 2.758 1.00 96.30 14 A 1 ATOM 104 C CB . ALA A 1 14 ? 1.188 -6.649 4.218 1.00 95.38 14 A 1 ATOM 105 N N . SER A 1 15 ? 2.264 -7.313 1.255 1.00 96.74 15 A 1 ATOM 106 C CA . SER A 1 15 ? 2.344 -8.254 0.140 1.00 96.63 15 A 1 ATOM 107 C C . SER A 1 15 ? 3.792 -8.553 -0.227 1.00 96.80 15 A 1 ATOM 108 O O . SER A 1 15 ? 4.157 -9.711 -0.438 1.00 95.27 15 A 1 ATOM 109 C CB . SER A 1 15 ? 1.610 -7.698 -1.078 1.00 95.37 15 A 1 ATOM 110 O OG . SER A 1 15 ? 1.575 -8.652 -2.112 1.00 87.02 15 A 1 ATOM 111 N N . THR A 1 16 ? 4.626 -7.517 -0.298 1.00 96.64 16 A 1 ATOM 112 C CA . THR A 1 16 ? 6.036 -7.695 -0.645 1.00 96.16 16 A 1 ATOM 113 C C . THR A 1 16 ? 6.859 -8.153 0.556 1.00 96.39 16 A 1 ATOM 114 O O . THR A 1 16 ? 7.968 -8.664 0.398 1.00 93.89 16 A 1 ATOM 115 C CB . THR A 1 16 ? 6.621 -6.392 -1.218 1.00 94.35 16 A 1 ATOM 116 O OG1 . THR A 1 16 ? 7.921 -6.647 -1.749 1.00 89.73 16 A 1 ATOM 117 C CG2 . THR A 1 16 ? 6.726 -5.312 -0.160 1.00 88.56 16 A 1 ATOM 118 N N . GLY A 1 17 ? 6.295 -7.998 1.745 1.00 94.91 17 A 1 ATOM 119 C CA . GLY A 1 17 ? 6.978 -8.409 2.970 1.00 93.89 17 A 1 ATOM 120 C C . GLY A 1 17 ? 8.249 -7.621 3.228 1.00 94.73 17 A 1 ATOM 121 O O . GLY A 1 17 ? 9.156 -8.108 3.902 1.00 93.18 17 A 1 ATOM 122 N N . LEU A 1 18 ? 8.304 -6.402 2.681 1.00 89.70 18 A 1 ATOM 123 C CA . LEU A 1 18 ? 9.485 -5.539 2.816 1.00 89.41 18 A 1 ATOM 124 C C . LEU A 1 18 ? 10.744 -6.283 2.368 1.00 91.15 18 A 1 ATOM 125 O O . LEU A 1 18 ? 11.706 -6.450 3.126 1.00 88.47 18 A 1 ATOM 126 C CB . LEU A 1 18 ? 9.602 -5.053 4.269 1.00 85.92 18 A 1 ATOM 127 C CG . LEU A 1 18 ? 10.361 -3.739 4.488 1.00 81.72 18 A 1 ATOM 128 C CD1 . LEU A 1 18 ? 11.851 -3.938 4.477 1.00 76.77 18 A 1 ATOM 129 C CD2 . LEU A 1 18 ? 9.933 -2.714 3.447 1.00 73.36 18 A 1 ATOM 130 N N . ALA A 1 19 ? 10.707 -6.757 1.083 1.00 88.45 19 A 1 ATOM 131 C CA . ALA A 1 19 ? 11.821 -7.517 0.527 1.00 87.25 19 A 1 ATOM 132 C C . ALA A 1 19 ? 12.332 -6.843 -0.744 1.00 85.05 19 A 1 ATOM 133 O O . ALA A 1 19 ? 11.541 -6.651 -1.675 1.00 78.97 19 A 1 ATOM 134 C CB . ALA A 1 19 ? 11.402 -8.950 0.247 1.00 80.53 19 A 1 ATOM 135 O OXT . ALA A 1 19 ? 13.532 -6.510 -0.830 1.00 73.30 19 A 1 #