# 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_spkb36301 # _entry.id spkb36301 # 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" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)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" "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" "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 ASN 2 1 n SER 3 1 n PHE 4 1 n VAL 5 1 n VAL 6 1 n VAL 7 1 n LEU 8 1 n LEU 9 1 n LEU 10 1 n PHE 11 1 n ILE 12 1 n ALA 13 1 n ILE 14 1 n LEU 15 1 n CYS 16 1 n ASN 17 1 n ALA 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 00:57:42)" _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 92.11 _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 79.17 1 1 A ASN 2 2 85.75 1 2 A SER 3 2 92.85 1 3 A PHE 4 2 93.20 1 4 A VAL 5 2 94.33 1 5 A VAL 6 2 94.45 1 6 A VAL 7 2 94.68 1 7 A LEU 8 2 93.62 1 8 A LEU 9 2 92.94 1 9 A LEU 10 2 92.60 1 10 A PHE 11 2 93.01 1 11 A ILE 12 2 95.09 1 12 A ALA 13 2 96.92 1 13 A ILE 14 2 95.96 1 14 A LEU 15 2 94.47 1 15 A CYS 16 2 94.49 1 16 A ASN 17 2 89.44 1 17 A ALA 18 2 86.26 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 ASN . 2 A 2 A 3 1 n SER . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n VAL . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n VAL . 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 PHE . 11 A 11 A 12 1 n ILE . 12 A 12 A 13 1 n ALA . 13 A 13 A 14 1 n ILE . 14 A 14 A 15 1 n LEU . 15 A 15 A 16 1 n CYS . 16 A 16 A 17 1 n ASN . 17 A 17 A 18 1 n ALA . 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 ? -3.182 2.901 15.198 1.00 86.30 1 A 1 ATOM 2 C CA . MET A 1 1 ? -1.797 3.415 15.105 1.00 87.94 1 A 1 ATOM 3 C C . MET A 1 1 ? -1.327 3.372 13.645 1.00 88.64 1 A 1 ATOM 4 O O . MET A 1 1 ? -0.778 2.375 13.199 1.00 84.09 1 A 1 ATOM 5 C CB . MET A 1 1 ? -0.850 2.588 15.984 1.00 82.05 1 A 1 ATOM 6 C CG . MET A 1 1 ? -1.142 2.776 17.474 1.00 75.36 1 A 1 ATOM 7 S SD . MET A 1 1 ? -0.008 1.822 18.505 1.00 67.45 1 A 1 ATOM 8 C CE . MET A 1 1 ? -0.569 2.310 20.133 1.00 61.56 1 A 1 ATOM 9 N N . ASN A 1 2 ? -1.579 4.453 12.909 1.00 87.20 2 A 1 ATOM 10 C CA . ASN A 1 2 ? -1.148 4.606 11.514 1.00 91.68 2 A 1 ATOM 11 C C . ASN A 1 2 ? -1.574 3.450 10.591 1.00 92.88 2 A 1 ATOM 12 O O . ASN A 1 2 ? -0.862 3.109 9.651 1.00 90.77 2 A 1 ATOM 13 C CB . ASN A 1 2 ? 0.369 4.850 11.463 1.00 86.86 2 A 1 ATOM 14 C CG . ASN A 1 2 ? 0.777 6.109 12.207 1.00 80.58 2 A 1 ATOM 15 O OD1 . ASN A 1 2 ? 0.014 7.045 12.344 1.00 78.05 2 A 1 ATOM 16 N ND2 . ASN A 1 2 ? 1.993 6.138 12.713 1.00 77.97 2 A 1 ATOM 17 N N . SER A 1 3 ? -2.735 2.864 10.830 1.00 94.18 3 A 1 ATOM 18 C CA . SER A 1 3 ? -3.261 1.782 9.985 1.00 95.20 3 A 1 ATOM 19 C C . SER A 1 3 ? -3.486 2.245 8.541 1.00 95.70 3 A 1 ATOM 20 O O . SER A 1 3 ? -3.481 1.435 7.621 1.00 93.94 3 A 1 ATOM 21 C CB . SER A 1 3 ? -4.570 1.257 10.569 1.00 92.91 3 A 1 ATOM 22 O OG . SER A 1 3 ? -4.391 0.855 11.914 1.00 85.15 3 A 1 ATOM 23 N N . PHE A 1 4 ? -3.619 3.550 8.336 1.00 95.54 4 A 1 ATOM 24 C CA . PHE A 1 4 ? -3.760 4.148 7.009 1.00 95.84 4 A 1 ATOM 25 C C . PHE A 1 4 ? -2.554 3.849 6.114 1.00 96.42 4 A 1 ATOM 26 O O . PHE A 1 4 ? -2.707 3.645 4.915 1.00 95.90 4 A 1 ATOM 27 C CB . PHE A 1 4 ? -3.949 5.665 7.155 1.00 94.98 4 A 1 ATOM 28 C CG . PHE A 1 4 ? -5.268 6.132 6.589 1.00 93.81 4 A 1 ATOM 29 C CD1 . PHE A 1 4 ? -5.371 6.459 5.236 1.00 90.97 4 A 1 ATOM 30 C CD2 . PHE A 1 4 ? -6.389 6.229 7.417 1.00 91.19 4 A 1 ATOM 31 C CE1 . PHE A 1 4 ? -6.586 6.884 4.703 1.00 89.74 4 A 1 ATOM 32 C CE2 . PHE A 1 4 ? -7.611 6.656 6.887 1.00 90.23 4 A 1 ATOM 33 C CZ . PHE A 1 4 ? -7.709 6.983 5.533 1.00 90.58 4 A 1 ATOM 34 N N . VAL A 1 5 ? -1.362 3.783 6.698 1.00 95.64 5 A 1 ATOM 35 C CA . VAL A 1 5 ? -0.127 3.492 5.954 1.00 96.04 5 A 1 ATOM 36 C C . VAL A 1 5 ? -0.165 2.070 5.394 1.00 96.41 5 A 1 ATOM 37 O O . VAL A 1 5 ? 0.223 1.838 4.251 1.00 95.78 5 A 1 ATOM 38 C CB . VAL A 1 5 ? 1.111 3.696 6.849 1.00 95.21 5 A 1 ATOM 39 C CG1 . VAL A 1 5 ? 2.402 3.388 6.097 1.00 90.82 5 A 1 ATOM 40 C CG2 . VAL A 1 5 ? 1.171 5.132 7.366 1.00 90.43 5 A 1 ATOM 41 N N . VAL A 1 6 ? -0.665 1.127 6.173 1.00 95.54 6 A 1 ATOM 42 C CA . VAL A 1 6 ? -0.783 -0.274 5.746 1.00 95.75 6 A 1 ATOM 43 C C . VAL A 1 6 ? -1.767 -0.395 4.582 1.00 96.21 6 A 1 ATOM 44 O O . VAL A 1 6 ? -1.480 -1.073 3.595 1.00 95.81 6 A 1 ATOM 45 C CB . VAL A 1 6 ? -1.211 -1.172 6.925 1.00 94.95 6 A 1 ATOM 46 C CG1 . VAL A 1 6 ? -1.312 -2.633 6.498 1.00 91.45 6 A 1 ATOM 47 C CG2 . VAL A 1 6 ? -0.214 -1.060 8.081 1.00 91.43 6 A 1 ATOM 48 N N . VAL A 1 7 ? -2.887 0.284 4.677 1.00 95.50 7 A 1 ATOM 49 C CA . VAL A 1 7 ? -3.902 0.290 3.615 1.00 95.80 7 A 1 ATOM 50 C C . VAL A 1 7 ? -3.348 0.928 2.339 1.00 96.44 7 A 1 ATOM 51 O O . VAL A 1 7 ? -3.572 0.417 1.240 1.00 96.07 7 A 1 ATOM 52 C CB . VAL A 1 7 ? -5.173 1.020 4.087 1.00 95.14 7 A 1 ATOM 53 C CG1 . VAL A 1 7 ? -6.228 1.076 2.988 1.00 91.89 7 A 1 ATOM 54 C CG2 . VAL A 1 7 ? -5.770 0.323 5.307 1.00 91.95 7 A 1 ATOM 55 N N . LEU A 1 8 ? -2.599 2.002 2.485 1.00 95.68 8 A 1 ATOM 56 C CA . LEU A 1 8 ? -1.975 2.690 1.355 1.00 95.72 8 A 1 ATOM 57 C C . LEU A 1 8 ? -0.969 1.781 0.645 1.00 96.13 8 A 1 ATOM 58 O O . LEU A 1 8 ? -0.985 1.666 -0.577 1.00 96.35 8 A 1 ATOM 59 C CB . LEU A 1 8 ? -1.294 3.970 1.861 1.00 95.73 8 A 1 ATOM 60 C CG . LEU A 1 8 ? -0.846 4.897 0.725 1.00 91.55 8 A 1 ATOM 61 C CD1 . LEU A 1 8 ? -2.007 5.769 0.244 1.00 88.17 8 A 1 ATOM 62 C CD2 . LEU A 1 8 ? 0.292 5.796 1.200 1.00 89.64 8 A 1 ATOM 63 N N . LEU A 1 9 ? -0.112 1.117 1.406 1.00 95.87 9 A 1 ATOM 64 C CA . LEU A 1 9 ? 0.888 0.200 0.855 1.00 95.93 9 A 1 ATOM 65 C C . LEU A 1 9 ? 0.223 -0.987 0.153 1.00 96.43 9 A 1 ATOM 66 O O . LEU A 1 9 ? 0.680 -1.408 -0.910 1.00 96.55 9 A 1 ATOM 67 C CB . LEU A 1 9 ? 1.810 -0.294 1.979 1.00 95.51 9 A 1 ATOM 68 C CG . LEU A 1 9 ? 2.802 0.760 2.486 1.00 88.88 9 A 1 ATOM 69 C CD1 . LEU A 1 9 ? 3.482 0.265 3.759 1.00 86.28 9 A 1 ATOM 70 C CD2 . LEU A 1 9 ? 3.876 1.061 1.440 1.00 88.06 9 A 1 ATOM 71 N N . LEU A 1 10 ? -0.859 -1.500 0.718 1.00 95.29 10 A 1 ATOM 72 C CA . LEU A 1 10 ? -1.626 -2.587 0.112 1.00 95.36 10 A 1 ATOM 73 C C . LEU A 1 10 ? -2.205 -2.150 -1.237 1.00 96.19 10 A 1 ATOM 74 O O . LEU A 1 10 ? -2.127 -2.894 -2.215 1.00 96.30 10 A 1 ATOM 75 C CB . LEU A 1 10 ? -2.741 -3.016 1.076 1.00 95.14 10 A 1 ATOM 76 C CG . LEU A 1 10 ? -3.402 -4.342 0.678 1.00 89.21 10 A 1 ATOM 77 C CD1 . LEU A 1 10 ? -2.572 -5.533 1.163 1.00 85.83 10 A 1 ATOM 78 C CD2 . LEU A 1 10 ? -4.799 -4.436 1.280 1.00 87.51 10 A 1 ATOM 79 N N . PHE A 1 11 ? -2.743 -0.944 -1.302 1.00 95.66 11 A 1 ATOM 80 C CA . PHE A 1 11 ? -3.305 -0.396 -2.532 1.00 96.02 11 A 1 ATOM 81 C C . PHE A 1 11 ? -2.239 -0.258 -3.622 1.00 96.66 11 A 1 ATOM 82 O O . PHE A 1 11 ? -2.470 -0.633 -4.771 1.00 96.39 11 A 1 ATOM 83 C CB . PHE A 1 11 ? -3.961 0.953 -2.224 1.00 95.55 11 A 1 ATOM 84 C CG . PHE A 1 11 ? -4.809 1.455 -3.368 1.00 93.14 11 A 1 ATOM 85 C CD1 . PHE A 1 11 ? -4.303 2.395 -4.271 1.00 89.65 11 A 1 ATOM 86 C CD2 . PHE A 1 11 ? -6.105 0.962 -3.540 1.00 90.77 11 A 1 ATOM 87 C CE1 . PHE A 1 11 ? -5.084 2.844 -5.335 1.00 89.56 11 A 1 ATOM 88 C CE2 . PHE A 1 11 ? -6.886 1.408 -4.609 1.00 89.73 11 A 1 ATOM 89 C CZ . PHE A 1 11 ? -6.376 2.348 -5.506 1.00 90.02 11 A 1 ATOM 90 N N . ILE A 1 12 ? -1.063 0.231 -3.255 1.00 96.53 12 A 1 ATOM 91 C CA . ILE A 1 12 ? 0.063 0.363 -4.188 1.00 96.35 12 A 1 ATOM 92 C C . ILE A 1 12 ? 0.512 -1.016 -4.681 1.00 96.68 12 A 1 ATOM 93 O O . ILE A 1 12 ? 0.788 -1.189 -5.869 1.00 96.30 12 A 1 ATOM 94 C CB . ILE A 1 12 ? 1.230 1.124 -3.524 1.00 96.02 12 A 1 ATOM 95 C CG1 . ILE A 1 12 ? 0.831 2.582 -3.233 1.00 94.53 12 A 1 ATOM 96 C CG2 . ILE A 1 12 ? 2.480 1.100 -4.421 1.00 94.02 12 A 1 ATOM 97 C CD1 . ILE A 1 12 ? 1.738 3.268 -2.219 1.00 90.33 12 A 1 ATOM 98 N N . ALA A 1 13 ? 0.561 -2.003 -3.785 1.00 97.17 13 A 1 ATOM 99 C CA . ALA A 1 13 ? 0.956 -3.363 -4.147 1.00 97.07 13 A 1 ATOM 100 C C . ALA A 1 13 ? -0.018 -3.980 -5.163 1.00 97.31 13 A 1 ATOM 101 O O . ALA A 1 13 ? 0.418 -4.595 -6.135 1.00 96.57 13 A 1 ATOM 102 C CB . ALA A 1 13 ? 1.050 -4.216 -2.879 1.00 96.49 13 A 1 ATOM 103 N N . ILE A 1 14 ? -1.318 -3.782 -4.971 1.00 97.49 14 A 1 ATOM 104 C CA . ILE A 1 14 ? -2.342 -4.270 -5.903 1.00 97.27 14 A 1 ATOM 105 C C . ILE A 1 14 ? -2.206 -3.575 -7.259 1.00 97.36 14 A 1 ATOM 106 O O . ILE A 1 14 ? -2.271 -4.230 -8.304 1.00 96.68 14 A 1 ATOM 107 C CB . ILE A 1 14 ? -3.751 -4.065 -5.309 1.00 96.85 14 A 1 ATOM 108 C CG1 . ILE A 1 14 ? -3.953 -4.958 -4.070 1.00 95.26 14 A 1 ATOM 109 C CG2 . ILE A 1 14 ? -4.834 -4.386 -6.352 1.00 94.82 14 A 1 ATOM 110 C CD1 . ILE A 1 14 ? -5.104 -4.498 -3.182 1.00 91.93 14 A 1 ATOM 111 N N . LEU A 1 15 ? -1.975 -2.274 -7.250 1.00 97.27 15 A 1 ATOM 112 C CA . LEU A 1 15 ? -1.805 -1.497 -8.477 1.00 97.11 15 A 1 ATOM 113 C C . LEU A 1 15 ? -0.549 -1.921 -9.243 1.00 97.01 15 A 1 ATOM 114 O O . LEU A 1 15 ? -0.562 -1.982 -10.470 1.00 96.42 15 A 1 ATOM 115 C CB . LEU A 1 15 ? -1.750 -0.006 -8.113 1.00 96.61 15 A 1 ATOM 116 C CG . LEU A 1 15 ? -1.876 0.922 -9.321 1.00 93.46 15 A 1 ATOM 117 C CD1 . LEU A 1 15 ? -3.306 0.918 -9.870 1.00 88.82 15 A 1 ATOM 118 C CD2 . LEU A 1 15 ? -1.496 2.344 -8.922 1.00 89.05 15 A 1 ATOM 119 N N . CYS A 1 16 ? 0.527 -2.235 -8.535 1.00 96.85 16 A 1 ATOM 120 C CA . CYS A 1 16 ? 1.786 -2.680 -9.141 1.00 96.48 16 A 1 ATOM 121 C C . CYS A 1 16 ? 1.674 -4.101 -9.714 1.00 96.36 16 A 1 ATOM 122 O O . CYS A 1 16 ? 2.408 -4.457 -10.635 1.00 94.71 16 A 1 ATOM 123 C CB . CYS A 1 16 ? 2.903 -2.591 -8.090 1.00 94.98 16 A 1 ATOM 124 S SG . CYS A 1 16 ? 4.534 -2.822 -8.833 1.00 87.57 16 A 1 ATOM 125 N N . ASN A 1 17 ? 0.764 -4.904 -9.183 1.00 95.23 17 A 1 ATOM 126 C CA . ASN A 1 17 ? 0.536 -6.266 -9.674 1.00 94.86 17 A 1 ATOM 127 C C . ASN A 1 17 ? -0.252 -6.288 -10.993 1.00 94.56 17 A 1 ATOM 128 O O . ASN A 1 17 ? -0.212 -7.287 -11.712 1.00 91.77 17 A 1 ATOM 129 C CB . ASN A 1 17 ? -0.188 -7.073 -8.586 1.00 92.60 17 A 1 ATOM 130 C CG . ASN A 1 17 ? -0.260 -8.545 -8.919 1.00 85.71 17 A 1 ATOM 131 O OD1 . ASN A 1 17 ? -1.298 -9.068 -9.278 1.00 80.24 17 A 1 ATOM 132 N ND2 . ASN A 1 17 ? 0.842 -9.252 -8.802 1.00 80.54 17 A 1 ATOM 133 N N . ALA A 1 18 ? -0.941 -5.209 -11.296 1.00 92.71 18 A 1 ATOM 134 C CA . ALA A 1 18 ? -1.723 -5.083 -12.521 1.00 90.76 18 A 1 ATOM 135 C C . ALA A 1 18 ? -0.839 -4.902 -13.764 1.00 87.66 18 A 1 ATOM 136 O O . ALA A 1 18 ? 0.308 -4.433 -13.631 1.00 83.49 18 A 1 ATOM 137 C CB . ALA A 1 18 ? -2.718 -3.935 -12.375 1.00 86.83 18 A 1 ATOM 138 O OXT . ALA A 1 18 ? -1.308 -5.229 -14.865 1.00 76.13 18 A 1 #