# 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_spkb18667 # _entry.id spkb18667 # 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 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" "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" "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 ALA 2 1 n ARG 3 1 n GLY 4 1 n SER 5 1 n VAL 6 1 n ILE 7 1 n LEU 8 1 n LEU 9 1 n GLY 10 1 n TRP 11 1 n LEU 12 1 n LEU 13 1 n LEU 14 1 n VAL 15 1 n VAL 16 1 n THR 17 1 n LEU 18 1 n SER 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 05:32:52)" _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 93.72 _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 81.26 1 1 A ALA 2 2 90.98 1 2 A ARG 3 2 84.87 1 3 A GLY 4 2 95.77 1 4 A SER 5 2 94.76 1 5 A VAL 6 2 96.63 1 6 A ILE 7 2 95.59 1 7 A LEU 8 2 95.60 1 8 A LEU 9 2 95.35 1 9 A GLY 10 2 97.52 1 10 A TRP 11 2 93.45 1 11 A LEU 12 2 95.85 1 12 A LEU 13 2 96.18 1 13 A LEU 14 2 95.62 1 14 A VAL 15 2 97.68 1 15 A VAL 16 2 97.67 1 16 A THR 17 2 96.17 1 17 A LEU 18 2 96.12 1 18 A SER 19 2 90.52 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 ARG . 3 A 3 A 4 1 n GLY . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n ILE . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n GLY . 10 A 10 A 11 1 n TRP . 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 VAL . 15 A 15 A 16 1 n VAL . 16 A 16 A 17 1 n THR . 17 A 17 A 18 1 n LEU . 18 A 18 A 19 1 n SER . 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 ? -14.884 0.276 0.027 1.00 86.39 1 A 1 ATOM 2 C CA . MET A 1 1 ? -13.458 0.064 0.333 1.00 88.23 1 A 1 ATOM 3 C C . MET A 1 1 ? -13.206 0.300 1.817 1.00 88.56 1 A 1 ATOM 4 O O . MET A 1 1 ? -13.517 1.374 2.331 1.00 84.95 1 A 1 ATOM 5 C CB . MET A 1 1 ? -12.577 1.003 -0.479 1.00 83.07 1 A 1 ATOM 6 C CG . MET A 1 1 ? -12.681 0.745 -1.970 1.00 77.83 1 A 1 ATOM 7 S SD . MET A 1 1 ? -11.756 1.943 -2.939 1.00 75.46 1 A 1 ATOM 8 C CE . MET A 1 1 ? -12.060 1.327 -4.578 1.00 65.61 1 A 1 ATOM 9 N N . ALA A 1 2 ? -12.660 -0.704 2.494 1.00 87.77 2 A 1 ATOM 10 C CA . ALA A 1 2 ? -12.400 -0.628 3.923 1.00 92.13 2 A 1 ATOM 11 C C . ALA A 1 2 ? -10.986 -0.114 4.190 1.00 94.08 2 A 1 ATOM 12 O O . ALA A 1 2 ? -10.190 0.072 3.266 1.00 91.91 2 A 1 ATOM 13 C CB . ALA A 1 2 ? -12.600 -2.003 4.552 1.00 89.02 2 A 1 ATOM 14 N N . ARG A 1 3 ? -10.684 0.097 5.482 1.00 92.87 3 A 1 ATOM 15 C CA . ARG A 1 3 ? -9.363 0.574 5.892 1.00 95.29 3 A 1 ATOM 16 C C . ARG A 1 3 ? -8.281 -0.418 5.474 1.00 96.45 3 A 1 ATOM 17 O O . ARG A 1 3 ? -7.205 -0.025 5.025 1.00 95.08 3 A 1 ATOM 18 C CB . ARG A 1 3 ? -9.329 0.781 7.409 1.00 92.84 3 A 1 ATOM 19 C CG . ARG A 1 3 ? -10.367 1.773 7.910 1.00 85.37 3 A 1 ATOM 20 C CD . ARG A 1 3 ? -10.259 1.966 9.407 1.00 84.10 3 A 1 ATOM 21 N NE . ARG A 1 3 ? -11.370 2.778 9.919 1.00 77.94 3 A 1 ATOM 22 C CZ . ARG A 1 3 ? -12.511 2.267 10.370 1.00 76.06 3 A 1 ATOM 23 N NH1 . ARG A 1 3 ? -12.716 0.962 10.376 1.00 69.14 3 A 1 ATOM 24 N NH2 . ARG A 1 3 ? -13.453 3.073 10.820 1.00 68.38 3 A 1 ATOM 25 N N . GLY A 1 4 ? -8.571 -1.712 5.638 1.00 93.96 4 A 1 ATOM 26 C CA . GLY A 1 4 ? -7.628 -2.764 5.267 1.00 95.83 4 A 1 ATOM 27 C C . GLY A 1 4 ? -7.280 -2.727 3.791 1.00 97.07 4 A 1 ATOM 28 O O . GLY A 1 4 ? -6.137 -2.974 3.405 1.00 96.22 4 A 1 ATOM 29 N N . SER A 1 5 ? -8.268 -2.416 2.956 1.00 96.24 5 A 1 ATOM 30 C CA . SER A 1 5 ? -8.060 -2.322 1.514 1.00 97.37 5 A 1 ATOM 31 C C . SER A 1 5 ? -7.074 -1.205 1.177 1.00 97.98 5 A 1 ATOM 32 O O . SER A 1 5 ? -6.226 -1.360 0.300 1.00 97.33 5 A 1 ATOM 33 C CB . SER A 1 5 ? -9.386 -2.072 0.801 1.00 96.14 5 A 1 ATOM 34 O OG . SER A 1 5 ? -10.287 -3.133 1.037 1.00 83.49 5 A 1 ATOM 35 N N . VAL A 1 6 ? -7.190 -0.086 1.888 1.00 97.52 6 A 1 ATOM 36 C CA . VAL A 1 6 ? -6.292 1.053 1.692 1.00 98.03 6 A 1 ATOM 37 C C . VAL A 1 6 ? -4.863 0.680 2.087 1.00 98.27 6 A 1 ATOM 38 O O . VAL A 1 6 ? -3.901 1.053 1.409 1.00 97.75 6 A 1 ATOM 39 C CB . VAL A 1 6 ? -6.763 2.274 2.499 1.00 97.41 6 A 1 ATOM 40 C CG1 . VAL A 1 6 ? -5.785 3.432 2.355 1.00 94.04 6 A 1 ATOM 41 C CG2 . VAL A 1 6 ? -8.149 2.705 2.048 1.00 93.42 6 A 1 ATOM 42 N N . ILE A 1 7 ? -4.731 -0.062 3.190 1.00 97.95 7 A 1 ATOM 43 C CA . ILE A 1 7 ? -3.424 -0.502 3.674 1.00 97.92 7 A 1 ATOM 44 C C . ILE A 1 7 ? -2.757 -1.418 2.653 1.00 98.06 7 A 1 ATOM 45 O O . ILE A 1 7 ? -1.562 -1.290 2.367 1.00 97.75 7 A 1 ATOM 46 C CB . ILE A 1 7 ? -3.554 -1.223 5.029 1.00 97.64 7 A 1 ATOM 47 C CG1 . ILE A 1 7 ? -4.097 -0.269 6.109 1.00 94.94 7 A 1 ATOM 48 C CG2 . ILE A 1 7 ? -2.206 -1.796 5.463 1.00 93.63 7 A 1 ATOM 49 C CD1 . ILE A 1 7 ? -3.194 0.920 6.392 1.00 86.86 7 A 1 ATOM 50 N N . LEU A 1 8 ? -3.533 -2.348 2.105 1.00 98.02 8 A 1 ATOM 51 C CA . LEU A 1 8 ? -3.020 -3.272 1.096 1.00 98.02 8 A 1 ATOM 52 C C . LEU A 1 8 ? -2.551 -2.518 -0.144 1.00 98.19 8 A 1 ATOM 53 O O . LEU A 1 8 ? -1.511 -2.841 -0.722 1.00 98.03 8 A 1 ATOM 54 C CB . LEU A 1 8 ? -4.105 -4.285 0.717 1.00 97.83 8 A 1 ATOM 55 C CG . LEU A 1 8 ? -4.391 -5.334 1.790 1.00 93.93 8 A 1 ATOM 56 C CD1 . LEU A 1 8 ? -5.654 -6.109 1.453 1.00 90.22 8 A 1 ATOM 57 C CD2 . LEU A 1 8 ? -3.211 -6.289 1.927 1.00 90.54 8 A 1 ATOM 58 N N . LEU A 1 9 ? -3.323 -1.521 -0.545 1.00 97.77 9 A 1 ATOM 59 C CA . LEU A 1 9 ? -2.970 -0.693 -1.695 1.00 97.70 9 A 1 ATOM 60 C C . LEU A 1 9 ? -1.671 0.061 -1.431 1.00 97.95 9 A 1 ATOM 61 O O . LEU A 1 9 ? -0.804 0.156 -2.306 1.00 97.63 9 A 1 ATOM 62 C CB . LEU A 1 9 ? -4.103 0.291 -1.993 1.00 97.29 9 A 1 ATOM 63 C CG . LEU A 1 9 ? -3.917 1.107 -3.269 1.00 93.66 9 A 1 ATOM 64 C CD1 . LEU A 1 9 ? -3.977 0.212 -4.502 1.00 90.64 9 A 1 ATOM 65 C CD2 . LEU A 1 9 ? -4.975 2.193 -3.356 1.00 90.13 9 A 1 ATOM 66 N N . GLY A 1 10 ? -1.541 0.593 -0.214 1.00 97.40 10 A 1 ATOM 67 C CA . GLY A 1 10 ? -0.333 1.303 0.187 1.00 97.38 10 A 1 ATOM 68 C C . GLY A 1 10 ? 0.880 0.394 0.171 1.00 97.82 10 A 1 ATOM 69 O O . GLY A 1 10 ? 1.966 0.789 -0.262 1.00 97.49 10 A 1 ATOM 70 N N . TRP A 1 11 ? 0.693 -0.855 0.650 1.00 97.44 11 A 1 ATOM 71 C CA . TRP A 1 11 ? 1.762 -1.850 0.658 1.00 97.58 11 A 1 ATOM 72 C C . TRP A 1 11 ? 2.204 -2.161 -0.763 1.00 98.01 11 A 1 ATOM 73 O O . TRP A 1 11 ? 3.397 -2.253 -1.048 1.00 97.52 11 A 1 ATOM 74 C CB . TRP A 1 11 ? 1.285 -3.131 1.356 1.00 97.24 11 A 1 ATOM 75 C CG . TRP A 1 11 ? 2.066 -3.430 2.594 1.00 95.57 11 A 1 ATOM 76 C CD1 . TRP A 1 11 ? 1.629 -3.324 3.876 1.00 90.84 11 A 1 ATOM 77 C CD2 . TRP A 1 11 ? 3.425 -3.888 2.676 1.00 93.38 11 A 1 ATOM 78 N NE1 . TRP A 1 11 ? 2.633 -3.686 4.746 1.00 89.67 11 A 1 ATOM 79 C CE2 . TRP A 1 11 ? 3.755 -4.040 4.041 1.00 92.68 11 A 1 ATOM 80 C CE3 . TRP A 1 11 ? 4.409 -4.187 1.730 1.00 90.81 11 A 1 ATOM 81 C CZ2 . TRP A 1 11 ? 5.009 -4.471 4.463 1.00 92.06 11 A 1 ATOM 82 C CZ3 . TRP A 1 11 ? 5.660 -4.617 2.151 1.00 87.69 11 A 1 ATOM 83 C CH2 . TRP A 1 11 ? 5.950 -4.752 3.506 1.00 87.83 11 A 1 ATOM 84 N N . LEU A 1 12 ? 1.226 -2.302 -1.660 1.00 97.83 12 A 1 ATOM 85 C CA . LEU A 1 12 ? 1.504 -2.578 -3.067 1.00 97.85 12 A 1 ATOM 86 C C . LEU A 1 12 ? 2.358 -1.470 -3.677 1.00 98.14 12 A 1 ATOM 87 O O . LEU A 1 12 ? 3.338 -1.743 -4.376 1.00 97.80 12 A 1 ATOM 88 C CB . LEU A 1 12 ? 0.188 -2.713 -3.837 1.00 97.58 12 A 1 ATOM 89 C CG . LEU A 1 12 ? 0.339 -3.257 -5.256 1.00 94.81 12 A 1 ATOM 90 C CD1 . LEU A 1 12 ? 0.777 -4.717 -5.230 1.00 91.25 12 A 1 ATOM 91 C CD2 . LEU A 1 12 ? -0.970 -3.119 -6.015 1.00 91.55 12 A 1 ATOM 92 N N . LEU A 1 13 ? 1.983 -0.226 -3.407 1.00 98.08 13 A 1 ATOM 93 C CA . LEU A 1 13 ? 2.726 0.926 -3.907 1.00 98.08 13 A 1 ATOM 94 C C . LEU A 1 13 ? 4.140 0.951 -3.336 1.00 98.28 13 A 1 ATOM 95 O O . LEU A 1 13 ? 5.099 1.256 -4.050 1.00 97.91 13 A 1 ATOM 96 C CB . LEU A 1 13 ? 1.994 2.218 -3.531 1.00 97.80 13 A 1 ATOM 97 C CG . LEU A 1 13 ? 0.705 2.456 -4.317 1.00 95.10 13 A 1 ATOM 98 C CD1 . LEU A 1 13 ? -0.114 3.568 -3.676 1.00 92.21 13 A 1 ATOM 99 C CD2 . LEU A 1 13 ? 1.026 2.816 -5.762 1.00 91.97 13 A 1 ATOM 100 N N . LEU A 1 14 ? 4.264 0.618 -2.040 1.00 98.10 14 A 1 ATOM 101 C CA . LEU A 1 14 ? 5.558 0.585 -1.365 1.00 98.08 14 A 1 ATOM 102 C C . LEU A 1 14 ? 6.468 -0.464 -1.994 1.00 98.36 14 A 1 ATOM 103 O O . LEU A 1 14 ? 7.642 -0.202 -2.261 1.00 98.08 14 A 1 ATOM 104 C CB . LEU A 1 14 ? 5.360 0.281 0.121 1.00 97.70 14 A 1 ATOM 105 C CG . LEU A 1 14 ? 6.614 0.450 0.973 1.00 93.18 14 A 1 ATOM 106 C CD1 . LEU A 1 14 ? 6.960 1.925 1.142 1.00 90.59 14 A 1 ATOM 107 C CD2 . LEU A 1 14 ? 6.423 -0.202 2.334 1.00 90.85 14 A 1 ATOM 108 N N . VAL A 1 15 ? 5.922 -1.665 -2.227 1.00 98.47 15 A 1 ATOM 109 C CA . VAL A 1 15 ? 6.681 -2.759 -2.828 1.00 98.43 15 A 1 ATOM 110 C C . VAL A 1 15 ? 7.155 -2.389 -4.230 1.00 98.53 15 A 1 ATOM 111 O O . VAL A 1 15 ? 8.314 -2.624 -4.583 1.00 98.15 15 A 1 ATOM 112 C CB . VAL A 1 15 ? 5.838 -4.046 -2.871 1.00 97.98 15 A 1 ATOM 113 C CG1 . VAL A 1 15 ? 6.549 -5.139 -3.657 1.00 96.12 15 A 1 ATOM 114 C CG2 . VAL A 1 15 ? 5.548 -4.528 -1.459 1.00 96.09 15 A 1 ATOM 115 N N . VAL A 1 16 ? 6.266 -1.820 -5.030 1.00 98.58 16 A 1 ATOM 116 C CA . VAL A 1 16 ? 6.603 -1.415 -6.396 1.00 98.50 16 A 1 ATOM 117 C C . VAL A 1 16 ? 7.695 -0.348 -6.396 1.00 98.61 16 A 1 ATOM 118 O O . VAL A 1 16 ? 8.625 -0.400 -7.206 1.00 98.27 16 A 1 ATOM 119 C CB . VAL A 1 16 ? 5.354 -0.895 -7.134 1.00 98.08 16 A 1 ATOM 120 C CG1 . VAL A 1 16 ? 5.726 -0.295 -8.487 1.00 95.83 16 A 1 ATOM 121 C CG2 . VAL A 1 16 ? 4.352 -2.020 -7.330 1.00 95.82 16 A 1 ATOM 122 N N . THR A 1 17 ? 7.587 0.602 -5.478 1.00 98.18 17 A 1 ATOM 123 C CA . THR A 1 17 ? 8.561 1.690 -5.379 1.00 98.07 17 A 1 ATOM 124 C C . THR A 1 17 ? 9.929 1.172 -4.937 1.00 98.16 17 A 1 ATOM 125 O O . THR A 1 17 ? 10.960 1.593 -5.469 1.00 97.32 17 A 1 ATOM 126 C CB . THR A 1 17 ? 8.076 2.755 -4.386 1.00 97.37 17 A 1 ATOM 127 O OG1 . THR A 1 17 ? 6.807 3.254 -4.801 1.00 92.83 17 A 1 ATOM 128 C CG2 . THR A 1 17 ? 9.053 3.918 -4.313 1.00 91.26 17 A 1 ATOM 129 N N . LEU A 1 18 ? 9.933 0.260 -3.950 1.00 98.39 18 A 1 ATOM 130 C CA . LEU A 1 18 ? 11.173 -0.294 -3.414 1.00 98.24 18 A 1 ATOM 131 C C . LEU A 1 18 ? 11.796 -1.320 -4.354 1.00 98.23 18 A 1 ATOM 132 O O . LEU A 1 18 ? 13.009 -1.551 -4.305 1.00 97.39 18 A 1 ATOM 133 C CB . LEU A 1 18 ? 10.905 -0.940 -2.048 1.00 97.79 18 A 1 ATOM 134 C CG . LEU A 1 18 ? 10.566 0.050 -0.934 1.00 95.65 18 A 1 ATOM 135 C CD1 . LEU A 1 18 ? 10.086 -0.689 0.307 1.00 92.34 18 A 1 ATOM 136 C CD2 . LEU A 1 18 ? 11.779 0.905 -0.595 1.00 90.97 18 A 1 ATOM 137 N N . SER A 1 19 ? 10.970 -1.936 -5.193 1.00 97.04 19 A 1 ATOM 138 C CA . SER A 1 19 ? 11.424 -2.967 -6.124 1.00 95.60 19 A 1 ATOM 139 C C . SER A 1 19 ? 12.508 -2.417 -7.056 1.00 93.13 19 A 1 ATOM 140 O O . SER A 1 19 ? 13.552 -3.073 -7.210 1.00 87.16 19 A 1 ATOM 141 C CB . SER A 1 19 ? 10.251 -3.509 -6.944 1.00 91.62 19 A 1 ATOM 142 O OG . SER A 1 19 ? 10.684 -4.560 -7.777 1.00 83.58 19 A 1 ATOM 143 O OXT . SER A 1 19 ? 12.315 -1.364 -7.638 1.00 85.48 19 A 1 #