# 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_spkb39846 # _entry.id spkb39846 # 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" "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" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])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" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[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 ILE 3 1 n THR 4 1 n LYS 5 1 n ALA 6 1 n TYR 7 1 n VAL 8 1 n ILE 9 1 n PHE 10 1 n PHE 11 1 n LEU 12 1 n VAL 13 1 n VAL 14 1 n ILE 15 1 n LEU 16 1 n THR 17 1 n ASN 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 06:41:29)" _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 93.65 _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 81.91 1 1 A ASN 2 2 90.16 1 2 A ILE 3 2 94.17 1 3 A THR 4 2 94.67 1 4 A LYS 5 2 90.80 1 5 A ALA 6 2 97.04 1 6 A TYR 7 2 94.22 1 7 A VAL 8 2 97.06 1 8 A ILE 9 2 95.76 1 9 A PHE 10 2 94.48 1 10 A PHE 11 2 93.22 1 11 A LEU 12 2 94.72 1 12 A VAL 13 2 97.47 1 13 A VAL 14 2 97.65 1 14 A ILE 15 2 97.39 1 15 A LEU 16 2 95.45 1 16 A THR 17 2 95.94 1 17 A ASN 18 2 92.59 1 18 A SER 19 2 86.85 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 ASN . 2 A 2 A 3 1 n ILE . 3 A 3 A 4 1 n THR . 4 A 4 A 5 1 n LYS . 5 A 5 A 6 1 n ALA . 6 A 6 A 7 1 n TYR . 7 A 7 A 8 1 n VAL . 8 A 8 A 9 1 n ILE . 9 A 9 A 10 1 n PHE . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n VAL . 13 A 13 A 14 1 n VAL . 14 A 14 A 15 1 n ILE . 15 A 15 A 16 1 n LEU . 16 A 16 A 17 1 n THR . 17 A 17 A 18 1 n ASN . 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 ? -13.785 -2.959 -0.808 1.00 89.38 1 A 1 ATOM 2 C CA . MET A 1 1 ? -12.400 -2.937 -0.306 1.00 91.08 1 A 1 ATOM 3 C C . MET A 1 1 ? -12.246 -1.828 0.727 1.00 92.67 1 A 1 ATOM 4 O O . MET A 1 1 ? -12.753 -0.723 0.525 1.00 89.26 1 A 1 ATOM 5 C CB . MET A 1 1 ? -11.409 -2.730 -1.460 1.00 83.99 1 A 1 ATOM 6 C CG . MET A 1 1 ? -9.945 -2.915 -1.064 1.00 76.03 1 A 1 ATOM 7 S SD . MET A 1 1 ? -8.864 -2.892 -2.509 1.00 70.28 1 A 1 ATOM 8 C CE . MET A 1 1 ? -7.265 -3.093 -1.725 1.00 62.58 1 A 1 ATOM 9 N N . ASN A 1 2 ? -11.575 -2.100 1.826 1.00 89.23 2 A 1 ATOM 10 C CA . ASN A 1 2 ? -11.426 -1.136 2.908 1.00 94.99 2 A 1 ATOM 11 C C . ASN A 1 2 ? -10.369 -0.082 2.566 1.00 96.32 2 A 1 ATOM 12 O O . ASN A 1 2 ? -9.261 -0.416 2.151 1.00 95.17 2 A 1 ATOM 13 C CB . ASN A 1 2 ? -11.066 -1.863 4.203 1.00 92.18 2 A 1 ATOM 14 C CG . ASN A 1 2 ? -11.192 -0.973 5.424 1.00 87.61 2 A 1 ATOM 15 O OD1 . ASN A 1 2 ? -11.422 0.225 5.321 1.00 83.15 2 A 1 ATOM 16 N ND2 . ASN A 1 2 ? -11.050 -1.564 6.597 1.00 82.64 2 A 1 ATOM 17 N N . ILE A 1 3 ? -10.719 1.189 2.761 1.00 96.73 3 A 1 ATOM 18 C CA . ILE A 1 3 ? -9.820 2.313 2.481 1.00 97.13 3 A 1 ATOM 19 C C . ILE A 1 3 ? -8.561 2.234 3.344 1.00 97.51 3 A 1 ATOM 20 O O . ILE A 1 3 ? -7.463 2.584 2.901 1.00 97.01 3 A 1 ATOM 21 C CB . ILE A 1 3 ? -10.554 3.651 2.709 1.00 96.23 3 A 1 ATOM 22 C CG1 . ILE A 1 3 ? -11.777 3.778 1.781 1.00 91.80 3 A 1 ATOM 23 C CG2 . ILE A 1 3 ? -9.617 4.836 2.497 1.00 90.81 3 A 1 ATOM 24 C CD1 . ILE A 1 3 ? -11.428 3.767 0.293 1.00 86.13 3 A 1 ATOM 25 N N . THR A 1 4 ? -8.702 1.748 4.570 1.00 96.69 4 A 1 ATOM 26 C CA . THR A 1 4 ? -7.576 1.607 5.495 1.00 97.17 4 A 1 ATOM 27 C C . THR A 1 4 ? -6.476 0.728 4.900 1.00 97.38 4 A 1 ATOM 28 O O . THR A 1 4 ? -5.290 1.047 5.012 1.00 97.02 4 A 1 ATOM 29 C CB . THR A 1 4 ? -8.044 1.012 6.826 1.00 96.69 4 A 1 ATOM 30 O OG1 . THR A 1 4 ? -9.132 1.779 7.337 1.00 90.47 4 A 1 ATOM 31 C CG2 . THR A 1 4 ? -6.913 1.012 7.846 1.00 87.27 4 A 1 ATOM 32 N N . LYS A 1 5 ? -6.863 -0.361 4.243 1.00 97.31 5 A 1 ATOM 33 C CA . LYS A 1 5 ? -5.903 -1.261 3.609 1.00 97.13 5 A 1 ATOM 34 C C . LYS A 1 5 ? -5.170 -0.560 2.469 1.00 97.22 5 A 1 ATOM 35 O O . LYS A 1 5 ? -3.971 -0.768 2.281 1.00 96.95 5 A 1 ATOM 36 C CB . LYS A 1 5 ? -6.601 -2.521 3.097 1.00 96.63 5 A 1 ATOM 37 C CG . LYS A 1 5 ? -7.119 -3.401 4.227 1.00 90.87 5 A 1 ATOM 38 C CD . LYS A 1 5 ? -7.713 -4.686 3.687 1.00 86.76 5 A 1 ATOM 39 C CE . LYS A 1 5 ? -8.179 -5.590 4.822 1.00 81.60 5 A 1 ATOM 40 N NZ . LYS A 1 5 ? -8.718 -6.870 4.310 1.00 72.70 5 A 1 ATOM 41 N N . ALA A 1 6 ? -5.877 0.278 1.729 1.00 96.92 6 A 1 ATOM 42 C CA . ALA A 1 6 ? -5.278 1.045 0.641 1.00 97.19 6 A 1 ATOM 43 C C . ALA A 1 6 ? -4.210 2.006 1.171 1.00 97.53 6 A 1 ATOM 44 O O . ALA A 1 6 ? -3.145 2.150 0.570 1.00 97.00 6 A 1 ATOM 45 C CB . ALA A 1 6 ? -6.360 1.808 -0.119 1.00 96.55 6 A 1 ATOM 46 N N . TYR A 1 7 ? -4.491 2.636 2.304 1.00 97.91 7 A 1 ATOM 47 C CA . TYR A 1 7 ? -3.529 3.540 2.932 1.00 97.97 7 A 1 ATOM 48 C C . TYR A 1 7 ? -2.275 2.794 3.393 1.00 98.03 7 A 1 ATOM 49 O O . TYR A 1 7 ? -1.157 3.287 3.223 1.00 97.67 7 A 1 ATOM 50 C CB . TYR A 1 7 ? -4.170 4.259 4.124 1.00 97.64 7 A 1 ATOM 51 C CG . TYR A 1 7 ? -5.025 5.444 3.734 1.00 94.96 7 A 1 ATOM 52 C CD1 . TYR A 1 7 ? -4.444 6.587 3.192 1.00 91.42 7 A 1 ATOM 53 C CD2 . TYR A 1 7 ? -6.399 5.418 3.928 1.00 91.76 7 A 1 ATOM 54 C CE1 . TYR A 1 7 ? -5.225 7.683 2.841 1.00 89.67 7 A 1 ATOM 55 C CE2 . TYR A 1 7 ? -7.189 6.513 3.579 1.00 91.06 7 A 1 ATOM 56 C CZ . TYR A 1 7 ? -6.592 7.640 3.035 1.00 91.59 7 A 1 ATOM 57 O OH . TYR A 1 7 ? -7.365 8.721 2.690 1.00 90.91 7 A 1 ATOM 58 N N . VAL A 1 8 ? -2.450 1.610 3.958 1.00 97.68 8 A 1 ATOM 59 C CA . VAL A 1 8 ? -1.320 0.799 4.417 1.00 97.80 8 A 1 ATOM 60 C C . VAL A 1 8 ? -0.430 0.398 3.243 1.00 97.98 8 A 1 ATOM 61 O O . VAL A 1 8 ? 0.797 0.506 3.314 1.00 97.67 8 A 1 ATOM 62 C CB . VAL A 1 8 ? -1.806 -0.451 5.175 1.00 97.43 8 A 1 ATOM 63 C CG1 . VAL A 1 8 ? -0.641 -1.377 5.517 1.00 95.50 8 A 1 ATOM 64 C CG2 . VAL A 1 8 ? -2.518 -0.039 6.457 1.00 95.38 8 A 1 ATOM 65 N N . ILE A 1 9 ? -1.042 -0.058 2.162 1.00 97.67 9 A 1 ATOM 66 C CA . ILE A 1 9 ? -0.302 -0.460 0.966 1.00 97.59 9 A 1 ATOM 67 C C . ILE A 1 9 ? 0.439 0.739 0.374 1.00 97.63 9 A 1 ATOM 68 O O . ILE A 1 9 ? 1.621 0.644 0.031 1.00 97.41 9 A 1 ATOM 69 C CB . ILE A 1 9 ? -1.247 -1.088 -0.077 1.00 97.34 9 A 1 ATOM 70 C CG1 . ILE A 1 9 ? -1.817 -2.411 0.460 1.00 95.10 9 A 1 ATOM 71 C CG2 . ILE A 1 9 ? -0.507 -1.329 -1.397 1.00 94.25 9 A 1 ATOM 72 C CD1 . ILE A 1 9 ? -2.980 -2.948 -0.356 1.00 89.13 9 A 1 ATOM 73 N N . PHE A 1 10 ? -0.250 1.868 0.262 1.00 97.51 10 A 1 ATOM 74 C CA . PHE A 1 10 ? 0.351 3.095 -0.264 1.00 97.44 10 A 1 ATOM 75 C C . PHE A 1 10 ? 1.553 3.521 0.579 1.00 97.66 10 A 1 ATOM 76 O O . PHE A 1 10 ? 2.616 3.847 0.045 1.00 97.31 10 A 1 ATOM 77 C CB . PHE A 1 10 ? -0.695 4.211 -0.302 1.00 97.11 10 A 1 ATOM 78 C CG . PHE A 1 10 ? -0.148 5.523 -0.806 1.00 94.90 10 A 1 ATOM 79 C CD1 . PHE A 1 10 ? 0.103 5.712 -2.161 1.00 91.61 10 A 1 ATOM 80 C CD2 . PHE A 1 10 ? 0.120 6.554 0.082 1.00 92.65 10 A 1 ATOM 81 C CE1 . PHE A 1 10 ? 0.615 6.917 -2.628 1.00 90.78 10 A 1 ATOM 82 C CE2 . PHE A 1 10 ? 0.638 7.765 -0.381 1.00 90.97 10 A 1 ATOM 83 C CZ . PHE A 1 10 ? 0.886 7.945 -1.735 1.00 91.33 10 A 1 ATOM 84 N N . PHE A 1 11 ? 1.389 3.504 1.901 1.00 97.85 11 A 1 ATOM 85 C CA . PHE A 1 11 ? 2.452 3.884 2.828 1.00 97.82 11 A 1 ATOM 86 C C . PHE A 1 11 ? 3.672 2.977 2.677 1.00 98.09 11 A 1 ATOM 87 O O . PHE A 1 11 ? 4.810 3.455 2.670 1.00 97.63 11 A 1 ATOM 88 C CB . PHE A 1 11 ? 1.916 3.836 4.263 1.00 97.33 11 A 1 ATOM 89 C CG . PHE A 1 11 ? 2.884 4.361 5.291 1.00 92.90 11 A 1 ATOM 90 C CD1 . PHE A 1 11 ? 3.297 5.689 5.272 1.00 88.99 11 A 1 ATOM 91 C CD2 . PHE A 1 11 ? 3.365 3.519 6.290 1.00 90.45 11 A 1 ATOM 92 C CE1 . PHE A 1 11 ? 4.181 6.173 6.231 1.00 87.75 11 A 1 ATOM 93 C CE2 . PHE A 1 11 ? 4.253 3.999 7.251 1.00 88.68 11 A 1 ATOM 94 C CZ . PHE A 1 11 ? 4.661 5.327 7.222 1.00 87.89 11 A 1 ATOM 95 N N . LEU A 1 12 ? 3.433 1.675 2.536 1.00 97.82 12 A 1 ATOM 96 C CA . LEU A 1 12 ? 4.512 0.709 2.341 1.00 97.84 12 A 1 ATOM 97 C C . LEU A 1 12 ? 5.285 1.004 1.057 1.00 98.16 12 A 1 ATOM 98 O O . LEU A 1 12 ? 6.518 0.986 1.051 1.00 97.98 12 A 1 ATOM 99 C CB . LEU A 1 12 ? 3.936 -0.714 2.302 1.00 97.44 12 A 1 ATOM 100 C CG . LEU A 1 12 ? 4.975 -1.825 2.123 1.00 90.76 12 A 1 ATOM 101 C CD1 . LEU A 1 12 ? 5.953 -1.856 3.293 1.00 88.03 12 A 1 ATOM 102 C CD2 . LEU A 1 12 ? 4.287 -3.176 1.990 1.00 89.74 12 A 1 ATOM 103 N N . VAL A 1 13 ? 4.571 1.283 -0.026 1.00 98.27 13 A 1 ATOM 104 C CA . VAL A 1 13 ? 5.195 1.604 -1.311 1.00 98.24 13 A 1 ATOM 105 C C . VAL A 1 13 ? 6.042 2.870 -1.197 1.00 98.36 13 A 1 ATOM 106 O O . VAL A 1 13 ? 7.158 2.928 -1.724 1.00 97.90 13 A 1 ATOM 107 C CB . VAL A 1 13 ? 4.130 1.762 -2.414 1.00 97.72 13 A 1 ATOM 108 C CG1 . VAL A 1 13 ? 4.754 2.254 -3.720 1.00 95.90 13 A 1 ATOM 109 C CG2 . VAL A 1 13 ? 3.428 0.431 -2.659 1.00 95.92 13 A 1 ATOM 110 N N . VAL A 1 14 ? 5.535 3.878 -0.498 1.00 98.42 14 A 1 ATOM 111 C CA . VAL A 1 14 ? 6.264 5.131 -0.296 1.00 98.37 14 A 1 ATOM 112 C C . VAL A 1 14 ? 7.571 4.886 0.458 1.00 98.51 14 A 1 ATOM 113 O O . VAL A 1 14 ? 8.617 5.420 0.084 1.00 98.20 14 A 1 ATOM 114 C CB . VAL A 1 14 ? 5.394 6.161 0.453 1.00 97.85 14 A 1 ATOM 115 C CG1 . VAL A 1 14 ? 6.207 7.397 0.836 1.00 96.06 14 A 1 ATOM 116 C CG2 . VAL A 1 14 ? 4.218 6.583 -0.415 1.00 96.11 14 A 1 ATOM 117 N N . ILE A 1 15 ? 7.532 4.071 1.506 1.00 98.39 15 A 1 ATOM 118 C CA . ILE A 1 15 ? 8.730 3.739 2.279 1.00 98.28 15 A 1 ATOM 119 C C . ILE A 1 15 ? 9.755 3.017 1.407 1.00 98.37 15 A 1 ATOM 120 O O . ILE A 1 15 ? 10.941 3.357 1.418 1.00 98.06 15 A 1 ATOM 121 C CB . ILE A 1 15 ? 8.373 2.881 3.512 1.00 97.97 15 A 1 ATOM 122 C CG1 . ILE A 1 15 ? 7.544 3.706 4.510 1.00 96.91 15 A 1 ATOM 123 C CG2 . ILE A 1 15 ? 9.642 2.357 4.191 1.00 96.31 15 A 1 ATOM 124 C CD1 . ILE A 1 15 ? 6.923 2.868 5.606 1.00 94.79 15 A 1 ATOM 125 N N . LEU A 1 16 ? 9.301 2.028 0.638 1.00 98.25 16 A 1 ATOM 126 C CA . LEU A 1 16 ? 10.187 1.244 -0.218 1.00 98.11 16 A 1 ATOM 127 C C . LEU A 1 16 ? 10.838 2.105 -1.295 1.00 98.13 16 A 1 ATOM 128 O O . LEU A 1 16 ? 12.015 1.922 -1.615 1.00 97.71 16 A 1 ATOM 129 C CB . LEU A 1 16 ? 9.403 0.092 -0.863 1.00 97.82 16 A 1 ATOM 130 C CG . LEU A 1 16 ? 8.947 -0.996 0.116 1.00 94.08 16 A 1 ATOM 131 C CD1 . LEU A 1 16 ? 7.999 -1.966 -0.580 1.00 89.88 16 A 1 ATOM 132 C CD2 . LEU A 1 16 ? 10.139 -1.755 0.684 1.00 89.60 16 A 1 ATOM 133 N N . THR A 1 17 ? 10.086 3.048 -1.851 1.00 98.15 17 A 1 ATOM 134 C CA . THR A 1 17 ? 10.603 3.928 -2.900 1.00 98.02 17 A 1 ATOM 135 C C . THR A 1 17 ? 11.487 5.039 -2.335 1.00 97.86 17 A 1 ATOM 136 O O . THR A 1 17 ? 12.374 5.542 -3.031 1.00 96.58 17 A 1 ATOM 137 C CB . THR A 1 17 ? 9.457 4.548 -3.714 1.00 97.19 17 A 1 ATOM 138 O OG1 . THR A 1 17 ? 8.521 5.188 -2.859 1.00 92.58 17 A 1 ATOM 139 C CG2 . THR A 1 17 ? 8.743 3.487 -4.533 1.00 91.23 17 A 1 ATOM 140 N N . ASN A 1 18 ? 11.251 5.422 -1.090 1.00 97.02 18 A 1 ATOM 141 C CA . ASN A 1 18 ? 12.018 6.483 -0.441 1.00 96.79 18 A 1 ATOM 142 C C . ASN A 1 18 ? 13.345 5.973 0.128 1.00 96.12 18 A 1 ATOM 143 O O . ASN A 1 18 ? 14.284 6.753 0.318 1.00 93.66 18 A 1 ATOM 144 C CB . ASN A 1 18 ? 11.174 7.115 0.678 1.00 95.00 18 A 1 ATOM 145 C CG . ASN A 1 18 ? 11.778 8.391 1.219 1.00 90.90 18 A 1 ATOM 146 O OD1 . ASN A 1 18 ? 12.267 9.226 0.473 1.00 86.31 18 A 1 ATOM 147 N ND2 . ASN A 1 18 ? 11.737 8.563 2.532 1.00 84.91 18 A 1 ATOM 148 N N . SER A 1 19 ? 13.409 4.684 0.422 1.00 94.28 19 A 1 ATOM 149 C CA . SER A 1 19 ? 14.601 4.077 1.018 1.00 92.70 19 A 1 ATOM 150 C C . SER A 1 19 ? 15.621 3.689 -0.055 1.00 89.05 19 A 1 ATOM 151 O O . SER A 1 19 ? 16.825 3.908 0.154 1.00 82.13 19 A 1 ATOM 152 C CB . SER A 1 19 ? 14.211 2.848 1.851 1.00 88.57 19 A 1 ATOM 153 O OG . SER A 1 19 ? 13.352 3.214 2.919 1.00 80.23 19 A 1 ATOM 154 O OXT . SER A 1 19 ? 15.223 3.147 -1.083 1.00 80.97 19 A 1 #