# 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_spkb10821 # _entry.id spkb10821 # 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" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "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" "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 TRP 2 1 n ARG 3 1 n SER 4 1 n LEU 5 1 n GLY 6 1 n LEU 7 1 n ALA 8 1 n LEU 9 1 n ALA 10 1 n LEU 11 1 n CYS 12 1 n LEU 13 1 n LEU 14 1 n PRO 15 1 n SER 16 1 n GLY 17 1 n GLY 18 1 n THR 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 09:36:27)" _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 85.52 _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 81.59 1 1 A TRP 2 2 77.99 1 2 A ARG 3 2 81.72 1 3 A SER 4 2 90.24 1 4 A LEU 5 2 89.28 1 5 A GLY 6 2 92.05 1 6 A LEU 7 2 89.17 1 7 A ALA 8 2 92.91 1 8 A LEU 9 2 89.13 1 9 A ALA 10 2 92.34 1 10 A LEU 11 2 89.91 1 11 A CYS 12 2 90.80 1 12 A LEU 13 2 89.79 1 13 A LEU 14 2 87.21 1 14 A PRO 15 2 88.07 1 15 A SER 16 2 83.50 1 16 A GLY 17 2 79.08 1 17 A GLY 18 2 76.73 1 18 A THR 19 2 73.72 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 TRP . 2 A 2 A 3 1 n ARG . 3 A 3 A 4 1 n SER . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n GLY . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n ALA . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n ALA . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n CYS . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n PRO . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n GLY . 17 A 17 A 18 1 n GLY . 18 A 18 A 19 1 n THR . 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 ? -4.531 8.496 13.021 1.00 88.05 1 A 1 ATOM 2 C CA . MET A 1 1 ? -4.463 7.412 12.013 1.00 88.84 1 A 1 ATOM 3 C C . MET A 1 1 ? -3.052 7.256 11.471 1.00 90.23 1 A 1 ATOM 4 O O . MET A 1 1 ? -2.414 8.239 11.123 1.00 86.84 1 A 1 ATOM 5 C CB . MET A 1 1 ? -5.409 7.727 10.869 1.00 83.67 1 A 1 ATOM 6 C CG . MET A 1 1 ? -6.753 7.069 11.079 1.00 77.33 1 A 1 ATOM 7 S SD . MET A 1 1 ? -7.839 7.370 9.679 1.00 73.70 1 A 1 ATOM 8 C CE . MET A 1 1 ? -9.092 8.339 10.475 1.00 64.06 1 A 1 ATOM 9 N N . TRP A 1 2 ? -2.552 6.043 11.416 1.00 82.71 2 A 1 ATOM 10 C CA . TRP A 1 2 ? -1.196 5.798 10.929 1.00 85.58 2 A 1 ATOM 11 C C . TRP A 1 2 ? -1.241 4.723 9.842 1.00 88.27 2 A 1 ATOM 12 O O . TRP A 1 2 ? -0.576 4.845 8.821 1.00 84.50 2 A 1 ATOM 13 C CB . TRP A 1 2 ? -0.285 5.351 12.084 1.00 81.72 2 A 1 ATOM 14 C CG . TRP A 1 2 ? -0.994 5.296 13.424 1.00 77.76 2 A 1 ATOM 15 C CD1 . TRP A 1 2 ? -0.626 4.536 14.468 1.00 74.35 2 A 1 ATOM 16 C CD2 . TRP A 1 2 ? -2.161 6.040 13.888 1.00 78.93 2 A 1 ATOM 17 N NE1 . TRP A 1 2 ? -1.471 4.746 15.527 1.00 73.14 2 A 1 ATOM 18 C CE2 . TRP A 1 2 ? -2.428 5.660 15.200 1.00 78.42 2 A 1 ATOM 19 C CE3 . TRP A 1 2 ? -2.997 6.988 13.310 1.00 73.59 2 A 1 ATOM 20 C CZ2 . TRP A 1 2 ? -3.508 6.198 15.931 1.00 74.14 2 A 1 ATOM 21 C CZ3 . TRP A 1 2 ? -4.081 7.523 14.045 1.00 69.31 2 A 1 ATOM 22 C CH2 . TRP A 1 2 ? -4.326 7.127 15.336 1.00 69.50 2 A 1 ATOM 23 N N . ARG A 1 3 ? -2.004 3.664 10.073 1.00 91.53 3 A 1 ATOM 24 C CA . ARG A 1 3 ? -2.119 2.586 9.087 1.00 92.10 3 A 1 ATOM 25 C C . ARG A 1 3 ? -2.857 3.076 7.849 1.00 93.19 3 A 1 ATOM 26 O O . ARG A 1 3 ? -2.521 2.706 6.727 1.00 91.95 3 A 1 ATOM 27 C CB . ARG A 1 3 ? -2.872 1.418 9.712 1.00 90.02 3 A 1 ATOM 28 C CG . ARG A 1 3 ? -1.964 0.618 10.632 1.00 82.41 3 A 1 ATOM 29 C CD . ARG A 1 3 ? -2.749 -0.419 11.383 1.00 79.97 3 A 1 ATOM 30 N NE . ARG A 1 3 ? -1.876 -1.134 12.308 1.00 73.94 3 A 1 ATOM 31 C CZ . ARG A 1 3 ? -2.134 -1.274 13.597 1.00 71.73 3 A 1 ATOM 32 N NH1 . ARG A 1 3 ? -3.250 -0.808 14.111 1.00 64.91 3 A 1 ATOM 33 N NH2 . ARG A 1 3 ? -1.260 -1.884 14.368 1.00 67.21 3 A 1 ATOM 34 N N . SER A 1 4 ? -3.848 3.904 8.058 1.00 93.11 4 A 1 ATOM 35 C CA . SER A 1 4 ? -4.612 4.457 6.941 1.00 93.36 4 A 1 ATOM 36 C C . SER A 1 4 ? -3.710 5.303 6.049 1.00 93.70 4 A 1 ATOM 37 O O . SER A 1 4 ? -3.838 5.297 4.824 1.00 92.28 4 A 1 ATOM 38 C CB . SER A 1 4 ? -5.758 5.306 7.477 1.00 91.55 4 A 1 ATOM 39 O OG . SER A 1 4 ? -6.865 5.214 6.623 1.00 77.42 4 A 1 ATOM 40 N N . LEU A 1 5 ? -2.789 6.017 6.664 1.00 93.42 5 A 1 ATOM 41 C CA . LEU A 1 5 ? -1.847 6.851 5.908 1.00 92.95 5 A 1 ATOM 42 C C . LEU A 1 5 ? -0.920 5.978 5.074 1.00 93.80 5 A 1 ATOM 43 O O . LEU A 1 5 ? -0.535 6.347 3.968 1.00 92.73 5 A 1 ATOM 44 C CB . LEU A 1 5 ? -1.036 7.690 6.892 1.00 92.13 5 A 1 ATOM 45 C CG . LEU A 1 5 ? -1.869 8.797 7.534 1.00 86.78 5 A 1 ATOM 46 C CD1 . LEU A 1 5 ? -1.126 9.384 8.727 1.00 81.64 5 A 1 ATOM 47 C CD2 . LEU A 1 5 ? -2.150 9.891 6.511 1.00 80.81 5 A 1 ATOM 48 N N . GLY A 1 6 ? -0.552 4.837 5.604 1.00 91.86 6 A 1 ATOM 49 C CA . GLY A 1 6 ? 0.320 3.915 4.874 1.00 91.59 6 A 1 ATOM 50 C C . GLY A 1 6 ? -0.325 3.447 3.585 1.00 92.67 6 A 1 ATOM 51 O O . GLY A 1 6 ? 0.347 3.243 2.578 1.00 92.09 6 A 1 ATOM 52 N N . LEU A 1 7 ? -1.638 3.283 3.615 1.00 92.25 7 A 1 ATOM 53 C CA . LEU A 1 7 ? -2.370 2.845 2.425 1.00 91.80 7 A 1 ATOM 54 C C . LEU A 1 7 ? -2.255 3.888 1.323 1.00 92.94 7 A 1 ATOM 55 O O . LEU A 1 7 ? -2.151 3.551 0.146 1.00 92.45 7 A 1 ATOM 56 C CB . LEU A 1 7 ? -3.837 2.639 2.791 1.00 91.07 7 A 1 ATOM 57 C CG . LEU A 1 7 ? -4.057 1.420 3.678 1.00 86.33 7 A 1 ATOM 58 C CD1 . LEU A 1 7 ? -5.452 1.457 4.281 1.00 83.92 7 A 1 ATOM 59 C CD2 . LEU A 1 7 ? -3.874 0.150 2.861 1.00 82.58 7 A 1 ATOM 60 N N . ALA A 1 8 ? -2.275 5.140 1.704 1.00 93.07 8 A 1 ATOM 61 C CA . ALA A 1 8 ? -2.155 6.231 0.733 1.00 92.88 8 A 1 ATOM 62 C C . ALA A 1 8 ? -0.798 6.174 0.039 1.00 93.87 8 A 1 ATOM 63 O O . ALA A 1 8 ? -0.686 6.466 -1.150 1.00 92.62 8 A 1 ATOM 64 C CB . ALA A 1 8 ? -2.327 7.566 1.443 1.00 92.13 8 A 1 ATOM 65 N N . LEU A 1 9 ? 0.228 5.785 0.784 1.00 91.99 9 A 1 ATOM 66 C CA . LEU A 1 9 ? 1.575 5.691 0.218 1.00 91.47 9 A 1 ATOM 67 C C . LEU A 1 9 ? 1.662 4.519 -0.747 1.00 92.57 9 A 1 ATOM 68 O O . LEU A 1 9 ? 2.280 4.623 -1.806 1.00 92.22 9 A 1 ATOM 69 C CB . LEU A 1 9 ? 2.578 5.509 1.353 1.00 90.81 9 A 1 ATOM 70 C CG . LEU A 1 9 ? 2.691 6.746 2.239 1.00 86.52 9 A 1 ATOM 71 C CD1 . LEU A 1 9 ? 3.483 6.415 3.495 1.00 84.08 9 A 1 ATOM 72 C CD2 . LEU A 1 9 ? 3.367 7.875 1.474 1.00 83.41 9 A 1 ATOM 73 N N . ALA A 1 10 ? 1.048 3.409 -0.381 1.00 92.69 10 A 1 ATOM 74 C CA . ALA A 1 10 ? 1.058 2.219 -1.233 1.00 92.44 10 A 1 ATOM 75 C C . ALA A 1 10 ? 0.387 2.513 -2.568 1.00 93.29 10 A 1 ATOM 76 O O . ALA A 1 10 ? 0.751 1.945 -3.596 1.00 91.70 10 A 1 ATOM 77 C CB . ALA A 1 10 ? 0.337 1.081 -0.524 1.00 91.56 10 A 1 ATOM 78 N N . LEU A 1 11 ? -0.585 3.394 -2.552 1.00 92.44 11 A 1 ATOM 79 C CA . LEU A 1 11 ? -1.291 3.768 -3.776 1.00 91.82 11 A 1 ATOM 80 C C . LEU A 1 11 ? -0.353 4.489 -4.739 1.00 92.87 11 A 1 ATOM 81 O O . LEU A 1 11 ? -0.515 4.401 -5.958 1.00 91.67 11 A 1 ATOM 82 C CB . LEU A 1 11 ? -2.467 4.680 -3.412 1.00 91.12 11 A 1 ATOM 83 C CG . LEU A 1 11 ? -3.202 5.232 -4.626 1.00 88.70 11 A 1 ATOM 84 C CD1 . LEU A 1 11 ? -3.974 4.118 -5.330 1.00 85.79 11 A 1 ATOM 85 C CD2 . LEU A 1 11 ? -4.167 6.330 -4.196 1.00 84.85 11 A 1 ATOM 86 N N . CYS A 1 12 ? 0.623 5.202 -4.207 1.00 92.97 12 A 1 ATOM 87 C CA . CYS A 1 12 ? 1.565 5.957 -5.037 1.00 92.50 12 A 1 ATOM 88 C C . CYS A 1 12 ? 2.629 5.047 -5.641 1.00 92.95 12 A 1 ATOM 89 O O . CYS A 1 12 ? 3.205 5.365 -6.677 1.00 90.08 12 A 1 ATOM 90 C CB . CYS A 1 12 ? 2.230 7.047 -4.190 1.00 90.79 12 A 1 ATOM 91 S SG . CYS A 1 12 ? 1.630 8.689 -4.631 1.00 85.53 12 A 1 ATOM 92 N N . LEU A 1 13 ? 2.902 3.916 -4.996 1.00 92.33 13 A 1 ATOM 93 C CA . LEU A 1 13 ? 3.920 2.987 -5.492 1.00 91.72 13 A 1 ATOM 94 C C . LEU A 1 13 ? 3.352 1.596 -5.726 1.00 92.52 13 A 1 ATOM 95 O O . LEU A 1 13 ? 4.054 0.717 -6.213 1.00 90.38 13 A 1 ATOM 96 C CB . LEU A 1 13 ? 5.062 2.913 -4.484 1.00 90.86 13 A 1 ATOM 97 C CG . LEU A 1 13 ? 4.559 2.599 -3.073 1.00 89.27 13 A 1 ATOM 98 C CD1 . LEU A 1 13 ? 5.302 1.399 -2.507 1.00 86.31 13 A 1 ATOM 99 C CD2 . LEU A 1 13 ? 4.762 3.803 -2.173 1.00 84.93 13 A 1 ATOM 100 N N . LEU A 1 14 ? 2.074 1.404 -5.410 1.00 91.72 14 A 1 ATOM 101 C CA . LEU A 1 14 ? 1.420 0.104 -5.590 1.00 90.48 14 A 1 ATOM 102 C C . LEU A 1 14 ? 2.111 -0.971 -4.751 1.00 91.27 14 A 1 ATOM 103 O O . LEU A 1 14 ? 3.247 -0.796 -4.319 1.00 88.89 14 A 1 ATOM 104 C CB . LEU A 1 14 ? 1.459 -0.279 -7.075 1.00 88.85 14 A 1 ATOM 105 C CG . LEU A 1 14 ? 0.147 0.022 -7.803 1.00 85.24 14 A 1 ATOM 106 C CD1 . LEU A 1 14 ? 0.404 0.197 -9.293 1.00 81.39 14 A 1 ATOM 107 C CD2 . LEU A 1 14 ? -0.845 -1.106 -7.566 1.00 79.81 14 A 1 ATOM 108 N N . PRO A 1 15 ? 1.434 -2.100 -4.508 1.00 90.91 15 A 1 ATOM 109 C CA . PRO A 1 15 ? 2.017 -3.172 -3.697 1.00 89.84 15 A 1 ATOM 110 C C . PRO A 1 15 ? 3.297 -3.712 -4.323 1.00 89.87 15 A 1 ATOM 111 O O . PRO A 1 15 ? 3.290 -4.199 -5.452 1.00 85.33 15 A 1 ATOM 112 C CB . PRO A 1 15 ? 0.921 -4.242 -3.677 1.00 87.02 15 A 1 ATOM 113 C CG . PRO A 1 15 ? 0.034 -3.918 -4.834 1.00 85.02 15 A 1 ATOM 114 C CD . PRO A 1 15 ? 0.105 -2.423 -5.012 1.00 88.53 15 A 1 ATOM 115 N N . SER A 1 16 ? 4.388 -3.627 -3.591 1.00 88.23 16 A 1 ATOM 116 C CA . SER A 1 16 ? 5.679 -4.109 -4.075 1.00 87.25 16 A 1 ATOM 117 C C . SER A 1 16 ? 5.900 -5.548 -3.629 1.00 87.25 16 A 1 ATOM 118 O O . SER A 1 16 ? 5.889 -5.843 -2.438 1.00 81.06 16 A 1 ATOM 119 C CB . SER A 1 16 ? 6.793 -3.213 -3.541 1.00 83.66 16 A 1 ATOM 120 O OG . SER A 1 16 ? 6.487 -1.857 -3.797 1.00 73.53 16 A 1 ATOM 121 N N . GLY A 1 17 ? 6.112 -6.435 -4.592 1.00 83.00 17 A 1 ATOM 122 C CA . GLY A 1 17 ? 6.345 -7.842 -4.280 1.00 79.48 17 A 1 ATOM 123 C C . GLY A 1 17 ? 7.543 -8.394 -5.026 1.00 79.61 17 A 1 ATOM 124 O O . GLY A 1 17 ? 7.970 -9.519 -4.790 1.00 74.24 17 A 1 ATOM 125 N N . GLY A 1 18 ? 8.098 -7.607 -5.942 1.00 81.11 18 A 1 ATOM 126 C CA . GLY A 1 18 ? 9.265 -8.038 -6.720 1.00 77.24 18 A 1 ATOM 127 C C . GLY A 1 18 ? 10.565 -7.542 -6.118 1.00 77.01 18 A 1 ATOM 128 O O . GLY A 1 18 ? 10.863 -7.777 -4.956 1.00 71.58 18 A 1 ATOM 129 N N . THR A 1 19 ? 11.330 -6.845 -6.910 1.00 84.80 19 A 1 ATOM 130 C CA . THR A 1 19 ? 12.615 -6.324 -6.453 1.00 81.05 19 A 1 ATOM 131 C C . THR A 1 19 ? 12.430 -5.038 -5.674 1.00 77.70 19 A 1 ATOM 132 O O . THR A 1 19 ? 11.428 -4.351 -5.890 1.00 69.16 19 A 1 ATOM 133 C CB . THR A 1 19 ? 13.535 -6.060 -7.648 1.00 74.19 19 A 1 ATOM 134 O OG1 . THR A 1 19 ? 12.929 -5.096 -8.499 1.00 67.75 19 A 1 ATOM 135 C CG2 . THR A 1 19 ? 13.777 -7.337 -8.420 1.00 67.66 19 A 1 ATOM 136 O OXT . THR A 1 19 ? 13.294 -4.710 -4.866 1.00 67.44 19 A 1 #