# 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_spkb15838 # _entry.id spkb15838 # 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 "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" "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" "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 LEU 2 1 n SER 3 1 n LEU 4 1 n PRO 5 1 n LEU 6 1 n LEU 7 1 n LEU 8 1 n LEU 9 1 n LEU 10 1 n LEU 11 1 n TRP 12 1 n GLY 13 1 n MET 14 1 n GLY 15 1 n SER 16 1 n HIS 17 1 n SER 18 # _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 @ 2025-07-05 20:30:12)" _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 90.05 _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 83.47 1 1 A LEU 2 2 89.75 1 2 A SER 3 2 94.15 1 3 A LEU 4 2 94.22 1 4 A PRO 5 2 96.19 1 5 A LEU 6 2 94.04 1 6 A LEU 7 2 93.47 1 7 A LEU 8 2 93.40 1 8 A LEU 9 2 93.29 1 9 A LEU 10 2 94.32 1 10 A LEU 11 2 94.70 1 11 A TRP 12 2 92.14 1 12 A GLY 13 2 95.33 1 13 A MET 14 2 87.53 1 14 A GLY 15 2 92.16 1 15 A SER 16 2 86.80 1 16 A HIS 17 2 72.82 1 17 A SER 18 2 79.11 1 18 # _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 LEU . 2 A 2 A 3 1 n SER . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n PRO . 5 A 5 A 6 1 n LEU . 6 A 6 A 7 1 n LEU . 7 A 7 A 8 1 n LEU . 8 A 8 A 9 1 n LEU . 9 A 9 A 10 1 n LEU . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n TRP . 12 A 12 A 13 1 n GLY . 13 A 13 A 14 1 n MET . 14 A 14 A 15 1 n GLY . 15 A 15 A 16 1 n SER . 16 A 16 A 17 1 n HIS . 17 A 17 A 18 1 n SER . 18 A 18 # _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 ? -9.820 -5.968 6.193 1.00 90.60 1 A 1 ATOM 2 C CA . MET A 1 1 ? -8.660 -6.182 7.076 1.00 91.50 1 A 1 ATOM 3 C C . MET A 1 1 ? -7.334 -6.036 6.325 1.00 91.66 1 A 1 ATOM 4 O O . MET A 1 1 ? -6.396 -5.426 6.831 1.00 88.12 1 A 1 ATOM 5 C CB . MET A 1 1 ? -8.723 -7.579 7.713 1.00 84.54 1 A 1 ATOM 6 C CG . MET A 1 1 ? -9.902 -7.762 8.655 1.00 78.93 1 A 1 ATOM 7 S SD . MET A 1 1 ? -9.943 -9.411 9.369 1.00 75.71 1 A 1 ATOM 8 C CE . MET A 1 1 ? -11.334 -9.245 10.474 1.00 66.74 1 A 1 ATOM 9 N N . LEU A 1 2 ? -7.253 -6.597 5.120 1.00 93.51 2 A 1 ATOM 10 C CA . LEU A 1 2 ? -6.025 -6.578 4.320 1.00 94.94 2 A 1 ATOM 11 C C . LEU A 1 2 ? -5.876 -5.294 3.498 1.00 96.42 2 A 1 ATOM 12 O O . LEU A 1 2 ? -4.763 -4.822 3.254 1.00 95.09 2 A 1 ATOM 13 C CB . LEU A 1 2 ? -5.997 -7.806 3.397 1.00 92.86 2 A 1 ATOM 14 C CG . LEU A 1 2 ? -4.665 -8.539 3.281 1.00 85.70 2 A 1 ATOM 15 C CD1 . LEU A 1 2 ? -3.601 -7.668 2.650 1.00 81.37 2 A 1 ATOM 16 C CD2 . LEU A 1 2 ? -4.224 -9.052 4.640 1.00 78.12 2 A 1 ATOM 17 N N . SER A 1 3 ? -6.997 -4.719 3.070 1.00 96.02 3 A 1 ATOM 18 C CA . SER A 1 3 ? -7.005 -3.525 2.221 1.00 96.74 3 A 1 ATOM 19 C C . SER A 1 3 ? -6.373 -2.305 2.898 1.00 97.18 3 A 1 ATOM 20 O O . SER A 1 3 ? -5.630 -1.553 2.258 1.00 95.76 3 A 1 ATOM 21 C CB . SER A 1 3 ? -8.437 -3.190 1.798 1.00 95.16 3 A 1 ATOM 22 O OG . SER A 1 3 ? -9.078 -4.311 1.228 1.00 84.03 3 A 1 ATOM 23 N N . LEU A 1 4 ? -6.660 -2.098 4.187 1.00 97.06 4 A 1 ATOM 24 C CA . LEU A 1 4 ? -6.145 -0.950 4.939 1.00 97.04 4 A 1 ATOM 25 C C . LEU A 1 4 ? -4.610 -0.948 5.044 1.00 97.34 4 A 1 ATOM 26 O O . LEU A 1 4 ? -3.980 0.053 4.689 1.00 96.96 4 A 1 ATOM 27 C CB . LEU A 1 4 ? -6.797 -0.888 6.332 1.00 96.57 4 A 1 ATOM 28 C CG . LEU A 1 4 ? -7.138 0.515 6.847 1.00 92.23 4 A 1 ATOM 29 C CD1 . LEU A 1 4 ? -5.891 1.320 7.142 1.00 88.26 4 A 1 ATOM 30 C CD2 . LEU A 1 4 ? -8.044 1.237 5.862 1.00 88.30 4 A 1 ATOM 31 N N . PRO A 1 5 ? -3.986 -2.045 5.516 1.00 97.12 5 A 1 ATOM 32 C CA . PRO A 1 5 ? -2.516 -2.114 5.603 1.00 96.89 5 A 1 ATOM 33 C C . PRO A 1 5 ? -1.829 -1.932 4.254 1.00 97.03 5 A 1 ATOM 34 O O . PRO A 1 5 ? -0.784 -1.280 4.169 1.00 95.93 5 A 1 ATOM 35 C CB . PRO A 1 5 ? -2.249 -3.523 6.150 1.00 95.94 5 A 1 ATOM 36 C CG . PRO A 1 5 ? -3.498 -3.909 6.852 1.00 94.35 5 A 1 ATOM 37 C CD . PRO A 1 5 ? -4.612 -3.243 6.097 1.00 96.06 5 A 1 ATOM 38 N N . LEU A 1 6 ? -2.410 -2.488 3.188 1.00 96.94 6 A 1 ATOM 39 C CA . LEU A 1 6 ? -1.858 -2.378 1.840 1.00 96.89 6 A 1 ATOM 40 C C . LEU A 1 6 ? -1.893 -0.936 1.339 1.00 97.06 6 A 1 ATOM 41 O O . LEU A 1 6 ? -0.937 -0.460 0.722 1.00 96.74 6 A 1 ATOM 42 C CB . LEU A 1 6 ? -2.628 -3.293 0.875 1.00 96.73 6 A 1 ATOM 43 C CG . LEU A 1 6 ? -1.952 -4.628 0.553 1.00 90.83 6 A 1 ATOM 44 C CD1 . LEU A 1 6 ? -0.674 -4.400 -0.224 1.00 88.12 6 A 1 ATOM 45 C CD2 . LEU A 1 6 ? -1.687 -5.421 1.819 1.00 88.98 6 A 1 ATOM 46 N N . LEU A 1 7 ? -2.992 -0.238 1.609 1.00 96.49 7 A 1 ATOM 47 C CA . LEU A 1 7 ? -3.154 1.165 1.229 1.00 96.18 7 A 1 ATOM 48 C C . LEU A 1 7 ? -2.110 2.041 1.918 1.00 96.50 7 A 1 ATOM 49 O O . LEU A 1 7 ? -1.526 2.932 1.295 1.00 96.35 7 A 1 ATOM 50 C CB . LEU A 1 7 ? -4.565 1.638 1.594 1.00 96.00 7 A 1 ATOM 51 C CG . LEU A 1 7 ? -4.912 3.062 1.176 1.00 90.67 7 A 1 ATOM 52 C CD1 . LEU A 1 7 ? -5.012 3.177 -0.341 1.00 87.40 7 A 1 ATOM 53 C CD2 . LEU A 1 7 ? -6.217 3.495 1.819 1.00 88.15 7 A 1 ATOM 54 N N . LEU A 1 8 ? -1.870 1.783 3.190 1.00 96.14 8 A 1 ATOM 55 C CA . LEU A 1 8 ? -0.885 2.521 3.980 1.00 96.08 8 A 1 ATOM 56 C C . LEU A 1 8 ? 0.534 2.264 3.473 1.00 96.40 8 A 1 ATOM 57 O O . LEU A 1 8 ? 1.356 3.182 3.407 1.00 96.43 8 A 1 ATOM 58 C CB . LEU A 1 8 ? -0.999 2.113 5.452 1.00 95.99 8 A 1 ATOM 59 C CG . LEU A 1 8 ? -0.567 3.183 6.449 1.00 89.71 8 A 1 ATOM 60 C CD1 . LEU A 1 8 ? -1.568 4.336 6.477 1.00 87.50 8 A 1 ATOM 61 C CD2 . LEU A 1 8 ? -0.434 2.575 7.838 1.00 88.92 8 A 1 ATOM 62 N N . LEU A 1 9 ? 0.813 1.025 3.095 1.00 96.34 9 A 1 ATOM 63 C CA . LEU A 1 9 ? 2.121 0.610 2.592 1.00 96.15 9 A 1 ATOM 64 C C . LEU A 1 9 ? 2.467 1.302 1.278 1.00 96.56 9 A 1 ATOM 65 O O . LEU A 1 9 ? 3.578 1.806 1.115 1.00 96.39 9 A 1 ATOM 66 C CB . LEU A 1 9 ? 2.151 -0.909 2.407 1.00 95.88 9 A 1 ATOM 67 C CG . LEU A 1 9 ? 3.516 -1.501 2.069 1.00 89.37 9 A 1 ATOM 68 C CD1 . LEU A 1 9 ? 4.462 -1.402 3.256 1.00 87.41 9 A 1 ATOM 69 C CD2 . LEU A 1 9 ? 3.362 -2.949 1.636 1.00 88.20 9 A 1 ATOM 70 N N . LEU A 1 10 ? 1.528 1.329 0.329 1.00 96.59 10 A 1 ATOM 71 C CA . LEU A 1 10 ? 1.763 1.961 -0.966 1.00 96.59 10 A 1 ATOM 72 C C . LEU A 1 10 ? 1.838 3.480 -0.850 1.00 96.74 10 A 1 ATOM 73 O O . LEU A 1 10 ? 2.539 4.129 -1.636 1.00 96.41 10 A 1 ATOM 74 C CB . LEU A 1 10 ? 0.693 1.533 -1.984 1.00 96.69 10 A 1 ATOM 75 C CG . LEU A 1 10 ? -0.741 1.971 -1.709 1.00 92.68 10 A 1 ATOM 76 C CD1 . LEU A 1 10 ? -1.058 3.268 -2.448 1.00 88.61 10 A 1 ATOM 77 C CD2 . LEU A 1 10 ? -1.699 0.878 -2.158 1.00 90.26 10 A 1 ATOM 78 N N . LEU A 1 11 ? 1.150 4.057 0.125 1.00 96.93 11 A 1 ATOM 79 C CA . LEU A 1 11 ? 1.176 5.494 0.375 1.00 96.80 11 A 1 ATOM 80 C C . LEU A 1 11 ? 2.577 5.949 0.775 1.00 96.73 11 A 1 ATOM 81 O O . LEU A 1 11 ? 3.062 6.978 0.304 1.00 96.19 11 A 1 ATOM 82 C CB . LEU A 1 11 ? 0.169 5.856 1.472 1.00 96.71 11 A 1 ATOM 83 C CG . LEU A 1 11 ? -0.005 7.346 1.727 1.00 93.68 11 A 1 ATOM 84 C CD1 . LEU A 1 11 ? -0.729 8.015 0.563 1.00 89.90 11 A 1 ATOM 85 C CD2 . LEU A 1 11 ? -0.773 7.574 3.020 1.00 90.63 11 A 1 ATOM 86 N N . TRP A 1 12 ? 3.239 5.187 1.638 1.00 97.02 12 A 1 ATOM 87 C CA . TRP A 1 12 ? 4.600 5.481 2.073 1.00 96.83 12 A 1 ATOM 88 C C . TRP A 1 12 ? 5.612 5.098 1.002 1.00 97.00 12 A 1 ATOM 89 O O . TRP A 1 12 ? 6.576 5.826 0.768 1.00 95.72 12 A 1 ATOM 90 C CB . TRP A 1 12 ? 4.906 4.737 3.382 1.00 96.36 12 A 1 ATOM 91 C CG . TRP A 1 12 ? 4.803 5.611 4.597 1.00 94.42 12 A 1 ATOM 92 C CD1 . TRP A 1 12 ? 5.836 6.177 5.281 1.00 89.26 12 A 1 ATOM 93 C CD2 . TRP A 1 12 ? 3.605 6.020 5.273 1.00 91.94 12 A 1 ATOM 94 N NE1 . TRP A 1 12 ? 5.357 6.913 6.338 1.00 89.91 12 A 1 ATOM 95 C CE2 . TRP A 1 12 ? 3.987 6.837 6.361 1.00 92.26 12 A 1 ATOM 96 C CE3 . TRP A 1 12 ? 2.254 5.772 5.066 1.00 90.27 12 A 1 ATOM 97 C CZ2 . TRP A 1 12 ? 3.049 7.402 7.231 1.00 89.64 12 A 1 ATOM 98 C CZ3 . TRP A 1 12 ? 1.322 6.336 5.931 1.00 84.17 12 A 1 ATOM 99 C CH2 . TRP A 1 12 ? 1.722 7.141 7.001 1.00 85.16 12 A 1 ATOM 100 N N . GLY A 1 13 ? 5.403 3.960 0.344 1.00 96.65 13 A 1 ATOM 101 C CA . GLY A 1 13 ? 6.309 3.473 -0.686 1.00 95.99 13 A 1 ATOM 102 C C . GLY A 1 13 ? 6.369 4.359 -1.916 1.00 95.73 13 A 1 ATOM 103 O O . GLY A 1 13 ? 7.448 4.615 -2.455 1.00 92.94 13 A 1 ATOM 104 N N . MET A 1 14 ? 5.219 4.846 -2.385 1.00 95.84 14 A 1 ATOM 105 C CA . MET A 1 14 ? 5.133 5.693 -3.576 1.00 94.94 14 A 1 ATOM 106 C C . MET A 1 14 ? 5.075 7.184 -3.242 1.00 94.11 14 A 1 ATOM 107 O O . MET A 1 14 ? 5.789 7.985 -3.844 1.00 89.12 14 A 1 ATOM 108 C CB . MET A 1 14 ? 3.906 5.308 -4.404 1.00 92.98 14 A 1 ATOM 109 C CG . MET A 1 14 ? 3.953 3.893 -4.935 1.00 85.97 14 A 1 ATOM 110 S SD . MET A 1 14 ? 2.505 3.505 -5.918 1.00 78.57 14 A 1 ATOM 111 C CE . MET A 1 14 ? 2.894 1.839 -6.400 1.00 68.68 14 A 1 ATOM 112 N N . GLY A 1 15 ? 4.227 7.546 -2.291 1.00 94.80 15 A 1 ATOM 113 C CA . GLY A 1 15 ? 4.021 8.943 -1.927 1.00 93.42 15 A 1 ATOM 114 C C . GLY A 1 15 ? 5.202 9.602 -1.243 1.00 92.32 15 A 1 ATOM 115 O O . GLY A 1 15 ? 5.614 10.699 -1.624 1.00 88.09 15 A 1 ATOM 116 N N . SER A 1 16 ? 5.778 8.949 -0.245 1.00 92.44 16 A 1 ATOM 117 C CA . SER A 1 16 ? 6.889 9.506 0.527 1.00 91.27 16 A 1 ATOM 118 C C . SER A 1 16 ? 8.225 9.381 -0.195 1.00 89.73 16 A 1 ATOM 119 O O . SER A 1 16 ? 9.099 10.236 -0.046 1.00 83.61 16 A 1 ATOM 120 C CB . SER A 1 16 ? 6.988 8.831 1.894 1.00 87.77 16 A 1 ATOM 121 O OG . SER A 1 16 ? 5.788 9.000 2.618 1.00 75.96 16 A 1 ATOM 122 N N . HIS A 1 17 ? 8.392 8.301 -0.968 1.00 89.69 17 A 1 ATOM 123 C CA . HIS A 1 17 ? 9.646 8.048 -1.676 1.00 86.17 17 A 1 ATOM 124 C C . HIS A 1 17 ? 9.776 8.890 -2.946 1.00 85.40 17 A 1 ATOM 125 O O . HIS A 1 17 ? 10.887 9.201 -3.382 1.00 76.15 17 A 1 ATOM 126 C CB . HIS A 1 17 ? 9.768 6.562 -2.026 1.00 79.71 17 A 1 ATOM 127 C CG . HIS A 1 17 ? 11.156 6.139 -2.386 1.00 72.22 17 A 1 ATOM 128 N ND1 . HIS A 1 17 ? 11.599 6.042 -3.672 1.00 63.22 17 A 1 ATOM 129 C CD2 . HIS A 1 17 ? 12.191 5.795 -1.600 1.00 60.30 17 A 1 ATOM 130 C CE1 . HIS A 1 17 ? 12.862 5.654 -3.662 1.00 56.37 17 A 1 ATOM 131 N NE2 . HIS A 1 17 ? 13.254 5.486 -2.416 1.00 58.97 17 A 1 ATOM 132 N N . SER A 1 18 ? 8.656 9.258 -3.545 1.00 88.55 18 A 1 ATOM 133 C CA . SER A 1 18 ? 8.638 10.038 -4.784 1.00 85.77 18 A 1 ATOM 134 C C . SER A 1 18 ? 8.286 11.494 -4.505 1.00 81.11 18 A 1 ATOM 135 O O . SER A 1 18 ? 9.080 12.385 -4.856 1.00 72.91 18 A 1 ATOM 136 C CB . SER A 1 18 ? 7.651 9.437 -5.787 1.00 79.80 18 A 1 ATOM 137 O OG . SER A 1 18 ? 7.994 8.107 -6.092 1.00 72.58 18 A 1 ATOM 138 O OXT . SER A 1 18 ? 7.195 11.754 -3.947 1.00 73.05 18 A 1 #