# 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_spkb26697 # _entry.id spkb26697 # 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" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[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 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)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" "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 HIS 2 1 n LEU 3 1 n VAL 4 1 n SER 5 1 n SER 6 1 n LEU 7 1 n LEU 8 1 n VAL 9 1 n VAL 10 1 n GLY 11 1 n ALA 12 1 n ALA 13 1 n PHE 14 1 n GLN 15 1 n ALA 16 1 n VAL 17 1 n LEU 18 1 n GLY 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 @ 2025-07-03 12:28:36)" _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 94.51 _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 85.93 1 1 A HIS 2 2 86.27 1 2 A LEU 3 2 92.75 1 3 A VAL 4 2 95.88 1 4 A SER 5 2 95.51 1 5 A SER 6 2 96.52 1 6 A LEU 7 2 96.03 1 7 A LEU 8 2 96.13 1 8 A VAL 9 2 97.44 1 9 A VAL 10 2 97.28 1 10 A GLY 11 2 97.84 1 11 A ALA 12 2 97.94 1 12 A ALA 13 2 98.12 1 13 A PHE 14 2 95.07 1 14 A GLN 15 2 93.28 1 15 A ALA 16 2 98.41 1 16 A VAL 17 2 97.74 1 17 A LEU 18 2 95.13 1 18 A GLY 19 2 90.96 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 HIS . 2 A 2 A 3 1 n LEU . 3 A 3 A 4 1 n VAL . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n SER . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n VAL . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n ALA . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n PHE . 14 A 14 A 15 1 n GLN . 15 A 15 A 16 1 n ALA . 16 A 16 A 17 1 n VAL . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n GLY . 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 ? -8.512 -2.900 11.567 1.00 91.28 1 A 1 ATOM 2 C CA . MET A 1 1 ? -7.110 -2.875 11.119 1.00 92.95 1 A 1 ATOM 3 C C . MET A 1 1 ? -6.975 -2.461 9.652 1.00 93.14 1 A 1 ATOM 4 O O . MET A 1 1 ? -5.910 -2.590 9.060 1.00 89.83 1 A 1 ATOM 5 C CB . MET A 1 1 ? -6.471 -4.252 11.319 1.00 88.44 1 A 1 ATOM 6 C CG . MET A 1 1 ? -5.856 -4.410 12.693 1.00 83.47 1 A 1 ATOM 7 S SD . MET A 1 1 ? -4.971 -5.962 12.856 1.00 79.61 1 A 1 ATOM 8 C CE . MET A 1 1 ? -4.026 -5.622 14.333 1.00 68.71 1 A 1 ATOM 9 N N . HIS A 1 2 ? -8.056 -1.981 9.096 1.00 92.15 2 A 1 ATOM 10 C CA . HIS A 1 2 ? -8.054 -1.551 7.702 1.00 94.01 2 A 1 ATOM 11 C C . HIS A 1 2 ? -7.365 -0.199 7.527 1.00 95.72 2 A 1 ATOM 12 O O . HIS A 1 2 ? -6.828 0.097 6.457 1.00 94.15 2 A 1 ATOM 13 C CB . HIS A 1 2 ? -9.494 -1.493 7.180 1.00 91.38 2 A 1 ATOM 14 C CG . HIS A 1 2 ? -10.459 -0.925 8.183 1.00 86.33 2 A 1 ATOM 15 N ND1 . HIS A 1 2 ? -11.251 -1.704 8.980 1.00 78.40 2 A 1 ATOM 16 C CD2 . HIS A 1 2 ? -10.744 0.361 8.500 1.00 75.47 2 A 1 ATOM 17 C CE1 . HIS A 1 2 ? -11.991 -0.909 9.750 1.00 76.91 2 A 1 ATOM 18 N NE2 . HIS A 1 2 ? -11.701 0.351 9.482 1.00 78.19 2 A 1 ATOM 19 N N . LEU A 1 3 ? -7.351 0.608 8.570 1.00 95.16 3 A 1 ATOM 20 C CA . LEU A 1 3 ? -6.731 1.931 8.513 1.00 96.33 3 A 1 ATOM 21 C C . LEU A 1 3 ? -5.218 1.822 8.344 1.00 97.28 3 A 1 ATOM 22 O O . LEU A 1 3 ? -4.634 2.425 7.442 1.00 96.33 3 A 1 ATOM 23 C CB . LEU A 1 3 ? -7.066 2.722 9.784 1.00 95.08 3 A 1 ATOM 24 C CG . LEU A 1 3 ? -8.556 2.975 10.002 1.00 90.03 3 A 1 ATOM 25 C CD1 . LEU A 1 3 ? -8.787 3.539 11.391 1.00 87.10 3 A 1 ATOM 26 C CD2 . LEU A 1 3 ? -9.091 3.939 8.948 1.00 84.65 3 A 1 ATOM 27 N N . VAL A 1 4 ? -4.591 1.044 9.214 1.00 96.98 4 A 1 ATOM 28 C CA . VAL A 1 4 ? -3.139 0.846 9.164 1.00 97.28 4 A 1 ATOM 29 C C . VAL A 1 4 ? -2.739 0.096 7.898 1.00 97.72 4 A 1 ATOM 30 O O . VAL A 1 4 ? -1.748 0.439 7.244 1.00 97.36 4 A 1 ATOM 31 C CB . VAL A 1 4 ? -2.644 0.086 10.405 1.00 96.32 4 A 1 ATOM 32 C CG1 . VAL A 1 4 ? -1.136 -0.103 10.355 1.00 92.45 4 A 1 ATOM 33 C CG2 . VAL A 1 4 ? -3.034 0.826 11.674 1.00 93.03 4 A 1 ATOM 34 N N . SER A 1 5 ? -3.507 -0.921 7.543 1.00 97.13 5 A 1 ATOM 35 C CA . SER A 1 5 ? -3.231 -1.722 6.353 1.00 97.41 5 A 1 ATOM 36 C C . SER A 1 5 ? -3.312 -0.871 5.089 1.00 97.82 5 A 1 ATOM 37 O O . SER A 1 5 ? -2.461 -0.975 4.206 1.00 97.28 5 A 1 ATOM 38 C CB . SER A 1 5 ? -4.214 -2.884 6.263 1.00 96.30 5 A 1 ATOM 39 O OG . SER A 1 5 ? -4.068 -3.747 7.379 1.00 87.10 5 A 1 ATOM 40 N N . SER A 1 6 ? -4.316 -0.016 5.012 1.00 97.79 6 A 1 ATOM 41 C CA . SER A 1 6 ? -4.496 0.864 3.859 1.00 98.05 6 A 1 ATOM 42 C C . SER A 1 6 ? -3.323 1.830 3.724 1.00 98.39 6 A 1 ATOM 43 O O . SER A 1 6 ? -2.807 2.048 2.626 1.00 97.94 6 A 1 ATOM 44 C CB . SER A 1 6 ? -5.799 1.648 3.991 1.00 97.42 6 A 1 ATOM 45 O OG . SER A 1 6 ? -6.908 0.773 3.973 1.00 89.52 6 A 1 ATOM 46 N N . LEU A 1 7 ? -2.889 2.392 4.848 1.00 97.76 7 A 1 ATOM 47 C CA . LEU A 1 7 ? -1.760 3.320 4.855 1.00 97.97 7 A 1 ATOM 48 C C . LEU A 1 7 ? -0.479 2.632 4.397 1.00 98.28 7 A 1 ATOM 49 O O . LEU A 1 7 ? 0.302 3.204 3.632 1.00 97.87 7 A 1 ATOM 50 C CB . LEU A 1 7 ? -1.570 3.891 6.261 1.00 97.68 7 A 1 ATOM 51 C CG . LEU A 1 7 ? -2.492 5.065 6.574 1.00 94.43 7 A 1 ATOM 52 C CD1 . LEU A 1 7 ? -2.615 5.265 8.076 1.00 92.32 7 A 1 ATOM 53 C CD2 . LEU A 1 7 ? -1.962 6.332 5.919 1.00 91.92 7 A 1 ATOM 54 N N . LEU A 1 8 ? -0.276 1.407 4.852 1.00 98.13 8 A 1 ATOM 55 C CA . LEU A 1 8 ? 0.910 0.638 4.480 1.00 98.09 8 A 1 ATOM 56 C C . LEU A 1 8 ? 0.910 0.303 2.994 1.00 98.25 8 A 1 ATOM 57 O O . LEU A 1 8 ? 1.932 0.438 2.320 1.00 97.86 8 A 1 ATOM 58 C CB . LEU A 1 8 ? 0.972 -0.648 5.308 1.00 97.75 8 A 1 ATOM 59 C CG . LEU A 1 8 ? 1.627 -0.462 6.676 1.00 94.58 8 A 1 ATOM 60 C CD1 . LEU A 1 8 ? 1.252 -1.601 7.607 1.00 92.29 8 A 1 ATOM 61 C CD2 . LEU A 1 8 ? 3.139 -0.382 6.523 1.00 92.07 8 A 1 ATOM 62 N N . VAL A 1 9 ? -0.232 -0.130 2.485 1.00 98.00 9 A 1 ATOM 63 C CA . VAL A 1 9 ? -0.359 -0.493 1.075 1.00 98.04 9 A 1 ATOM 64 C C . VAL A 1 9 ? -0.137 0.722 0.179 1.00 98.24 9 A 1 ATOM 65 O O . VAL A 1 9 ? 0.619 0.657 -0.795 1.00 97.99 9 A 1 ATOM 66 C CB . VAL A 1 9 ? -1.737 -1.111 0.793 1.00 97.55 9 A 1 ATOM 67 C CG1 . VAL A 1 9 ? -1.928 -1.356 -0.698 1.00 96.13 9 A 1 ATOM 68 C CG2 . VAL A 1 9 ? -1.891 -2.418 1.553 1.00 96.16 9 A 1 ATOM 69 N N . VAL A 1 10 ? -0.786 1.819 0.504 1.00 97.89 10 A 1 ATOM 70 C CA . VAL A 1 10 ? -0.655 3.049 -0.277 1.00 97.87 10 A 1 ATOM 71 C C . VAL A 1 10 ? 0.775 3.575 -0.224 1.00 98.14 10 A 1 ATOM 72 O O . VAL A 1 10 ? 1.345 3.956 -1.250 1.00 97.91 10 A 1 ATOM 73 C CB . VAL A 1 10 ? -1.633 4.124 0.227 1.00 97.34 10 A 1 ATOM 74 C CG1 . VAL A 1 10 ? -1.413 5.445 -0.500 1.00 95.89 10 A 1 ATOM 75 C CG2 . VAL A 1 10 ? -3.069 3.664 0.030 1.00 95.95 10 A 1 ATOM 76 N N . GLY A 1 11 ? 1.348 3.587 0.970 1.00 97.79 11 A 1 ATOM 77 C CA . GLY A 1 11 ? 2.716 4.060 1.145 1.00 97.65 11 A 1 ATOM 78 C C . GLY A 1 11 ? 3.718 3.203 0.401 1.00 98.04 11 A 1 ATOM 79 O O . GLY A 1 11 ? 4.625 3.718 -0.256 1.00 97.90 11 A 1 ATOM 80 N N . ALA A 1 12 ? 3.556 1.890 0.487 1.00 98.09 12 A 1 ATOM 81 C CA . ALA A 1 12 ? 4.449 0.954 -0.192 1.00 98.03 12 A 1 ATOM 82 C C . ALA A 1 12 ? 4.348 1.095 -1.706 1.00 98.27 12 A 1 ATOM 83 O O . ALA A 1 12 ? 5.361 1.073 -2.406 1.00 97.69 12 A 1 ATOM 84 C CB . ALA A 1 12 ? 4.117 -0.474 0.227 1.00 97.60 12 A 1 ATOM 85 N N . ALA A 1 13 ? 3.131 1.235 -2.212 1.00 98.28 13 A 1 ATOM 86 C CA . ALA A 1 13 ? 2.909 1.389 -3.647 1.00 98.24 13 A 1 ATOM 87 C C . ALA A 1 13 ? 3.553 2.671 -4.169 1.00 98.33 13 A 1 ATOM 88 O O . ALA A 1 13 ? 4.201 2.672 -5.217 1.00 97.83 13 A 1 ATOM 89 C CB . ALA A 1 13 ? 1.412 1.398 -3.943 1.00 97.93 13 A 1 ATOM 90 N N . PHE A 1 14 ? 3.373 3.759 -3.436 1.00 98.13 14 A 1 ATOM 91 C CA . PHE A 1 14 ? 3.942 5.047 -3.819 1.00 97.83 14 A 1 ATOM 92 C C . PHE A 1 14 ? 5.467 5.015 -3.752 1.00 98.00 14 A 1 ATOM 93 O O . PHE A 1 14 ? 6.150 5.559 -4.621 1.00 97.73 14 A 1 ATOM 94 C CB . PHE A 1 14 ? 3.396 6.140 -2.899 1.00 97.42 14 A 1 ATOM 95 C CG . PHE A 1 14 ? 3.280 7.468 -3.592 1.00 95.51 14 A 1 ATOM 96 C CD1 . PHE A 1 14 ? 2.316 7.666 -4.566 1.00 93.00 14 A 1 ATOM 97 C CD2 . PHE A 1 14 ? 4.123 8.515 -3.260 1.00 92.98 14 A 1 ATOM 98 C CE1 . PHE A 1 14 ? 2.206 8.889 -5.207 1.00 91.71 14 A 1 ATOM 99 C CE2 . PHE A 1 14 ? 4.020 9.743 -3.898 1.00 91.35 14 A 1 ATOM 100 C CZ . PHE A 1 14 ? 3.059 9.930 -4.874 1.00 92.15 14 A 1 ATOM 101 N N . GLN A 1 15 ? 5.997 4.366 -2.716 1.00 98.01 15 A 1 ATOM 102 C CA . GLN A 1 15 ? 7.444 4.239 -2.547 1.00 98.00 15 A 1 ATOM 103 C C . GLN A 1 15 ? 8.054 3.386 -3.645 1.00 98.32 15 A 1 ATOM 104 O O . GLN A 1 15 ? 9.146 3.677 -4.132 1.00 97.92 15 A 1 ATOM 105 C CB . GLN A 1 15 ? 7.763 3.626 -1.178 1.00 97.39 15 A 1 ATOM 106 C CG . GLN A 1 15 ? 8.161 4.692 -0.173 1.00 92.53 15 A 1 ATOM 107 C CD . GLN A 1 15 ? 9.552 5.232 -0.463 1.00 89.59 15 A 1 ATOM 108 O OE1 . GLN A 1 15 ? 10.526 4.491 -0.438 1.00 84.91 15 A 1 ATOM 109 N NE2 . GLN A 1 15 ? 9.655 6.513 -0.736 1.00 82.81 15 A 1 ATOM 110 N N . ALA A 1 16 ? 7.355 2.342 -4.050 1.00 98.49 16 A 1 ATOM 111 C CA . ALA A 1 16 ? 7.828 1.449 -5.103 1.00 98.51 16 A 1 ATOM 112 C C . ALA A 1 16 ? 7.984 2.194 -6.425 1.00 98.61 16 A 1 ATOM 113 O O . ALA A 1 16 ? 8.903 1.919 -7.197 1.00 98.21 16 A 1 ATOM 114 C CB . ALA A 1 16 ? 6.863 0.280 -5.266 1.00 98.24 16 A 1 ATOM 115 N N . VAL A 1 17 ? 7.086 3.132 -6.691 1.00 98.62 17 A 1 ATOM 116 C CA . VAL A 1 17 ? 7.131 3.921 -7.921 1.00 98.57 17 A 1 ATOM 117 C C . VAL A 1 17 ? 8.238 4.971 -7.869 1.00 98.61 17 A 1 ATOM 118 O O . VAL A 1 17 ? 8.980 5.153 -8.843 1.00 98.24 17 A 1 ATOM 119 C CB . VAL A 1 17 ? 5.776 4.605 -8.186 1.00 98.18 17 A 1 ATOM 120 C CG1 . VAL A 1 17 ? 5.845 5.469 -9.439 1.00 96.17 17 A 1 ATOM 121 C CG2 . VAL A 1 17 ? 4.674 3.570 -8.332 1.00 95.82 17 A 1 ATOM 122 N N . LEU A 1 18 ? 8.339 5.660 -6.747 1.00 97.86 18 A 1 ATOM 123 C CA . LEU A 1 18 ? 9.340 6.714 -6.573 1.00 97.62 18 A 1 ATOM 124 C C . LEU A 1 18 ? 10.733 6.151 -6.313 1.00 97.47 18 A 1 ATOM 125 O O . LEU A 1 18 ? 11.712 6.593 -6.921 1.00 96.47 18 A 1 ATOM 126 C CB . LEU A 1 18 ? 8.926 7.628 -5.419 1.00 96.81 18 A 1 ATOM 127 C CG . LEU A 1 18 ? 7.650 8.432 -5.672 1.00 94.24 18 A 1 ATOM 128 C CD1 . LEU A 1 18 ? 7.177 9.078 -4.380 1.00 91.38 18 A 1 ATOM 129 C CD2 . LEU A 1 18 ? 7.891 9.495 -6.735 1.00 89.21 18 A 1 ATOM 130 N N . GLY A 1 19 ? 10.824 5.190 -5.389 1.00 95.60 19 A 1 ATOM 131 C CA . GLY A 1 19 ? 12.094 4.578 -5.000 1.00 93.04 19 A 1 ATOM 132 C C . GLY A 1 19 ? 12.358 3.274 -5.723 1.00 90.45 19 A 1 ATOM 133 O O . GLY A 1 19 ? 11.742 2.264 -5.362 1.00 86.17 19 A 1 ATOM 134 O OXT . GLY A 1 19 ? 13.203 3.288 -6.628 1.00 89.54 19 A 1 #