# 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_spkb33393 # _entry.id spkb33393 # 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" "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" "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 ARG 2 1 n PRO 3 1 n LEU 4 1 n CYS 5 1 n MET 6 1 n THR 7 1 n TYR 8 1 n TRP 9 1 n TRP 10 1 n LEU 11 1 n GLY 12 1 n LEU 13 1 n LEU 14 1 n ALA 15 1 n THR 16 1 n VAL 17 1 n GLY 18 1 n ALA 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 @ 2025-07-03 09:37:24)" _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 91.58 _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 80.50 1 1 A ARG 2 2 78.48 1 2 A PRO 3 2 92.48 1 3 A LEU 4 2 92.83 1 4 A CYS 5 2 94.39 1 5 A MET 6 2 91.49 1 6 A THR 7 2 94.82 1 7 A TYR 8 2 92.83 1 8 A TRP 9 2 92.80 1 9 A TRP 10 2 93.30 1 10 A LEU 11 2 94.62 1 11 A GLY 12 2 96.53 1 12 A LEU 13 2 94.14 1 13 A LEU 14 2 94.83 1 14 A ALA 15 2 96.87 1 15 A THR 16 2 94.06 1 16 A VAL 17 2 93.45 1 17 A GLY 18 2 92.75 1 18 A ALA 19 2 86.40 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 ARG . 2 A 2 A 3 1 n PRO . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n CYS . 5 A 5 A 6 1 n MET . 6 A 6 A 7 1 n THR . 7 A 7 A 8 1 n TYR . 8 A 8 A 9 1 n TRP . 9 A 9 A 10 1 n TRP . 10 A 10 A 11 1 n LEU . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n LEU . 13 A 13 A 14 1 n LEU . 14 A 14 A 15 1 n ALA . 15 A 15 A 16 1 n THR . 16 A 16 A 17 1 n VAL . 17 A 17 A 18 1 n GLY . 18 A 18 A 19 1 n ALA . 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 ? -14.111 -6.273 2.810 1.00 87.56 1 A 1 ATOM 2 C CA . MET A 1 1 ? -13.527 -5.438 3.884 1.00 86.72 1 A 1 ATOM 3 C C . MET A 1 1 ? -12.063 -5.122 3.579 1.00 87.59 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.387 -5.885 2.898 1.00 82.15 1 A 1 ATOM 5 C CB . MET A 1 1 ? -13.619 -6.183 5.213 1.00 82.72 1 A 1 ATOM 6 C CG . MET A 1 1 ? -13.827 -5.233 6.379 1.00 78.12 1 A 1 ATOM 7 S SD . MET A 1 1 ? -14.034 -6.136 7.910 1.00 73.71 1 A 1 ATOM 8 C CE . MET A 1 1 ? -14.777 -4.863 8.927 1.00 65.47 1 A 1 ATOM 9 N N . ARG A 1 2 ? -11.577 -4.009 4.094 1.00 86.93 2 A 1 ATOM 10 C CA . ARG A 1 2 ? -10.186 -3.600 3.865 1.00 89.21 2 A 1 ATOM 11 C C . ARG A 1 2 ? -9.567 -3.109 5.178 1.00 91.34 2 A 1 ATOM 12 O O . ARG A 1 2 ? -9.740 -1.955 5.552 1.00 89.22 2 A 1 ATOM 13 C CB . ARG A 1 2 ? -10.153 -2.491 2.815 1.00 84.74 2 A 1 ATOM 14 C CG . ARG A 1 2 ? -11.279 -1.487 3.011 1.00 77.89 2 A 1 ATOM 15 C CD . ARG A 1 2 ? -11.005 -0.228 2.235 1.00 76.03 2 A 1 ATOM 16 N NE . ARG A 1 2 ? -11.831 0.841 2.788 1.00 71.34 2 A 1 ATOM 17 C CZ . ARG A 1 2 ? -13.126 0.959 2.549 1.00 68.78 2 A 1 ATOM 18 N NH1 . ARG A 1 2 ? -13.740 0.160 1.696 1.00 64.20 2 A 1 ATOM 19 N NH2 . ARG A 1 2 ? -13.805 1.879 3.181 1.00 63.64 2 A 1 ATOM 20 N N . PRO A 1 3 ? -8.846 -3.988 5.860 1.00 92.98 3 A 1 ATOM 21 C CA . PRO A 1 3 ? -8.199 -3.630 7.121 1.00 94.47 3 A 1 ATOM 22 C C . PRO A 1 3 ? -7.083 -2.605 6.914 1.00 95.89 3 A 1 ATOM 23 O O . PRO A 1 3 ? -6.669 -2.344 5.784 1.00 93.75 3 A 1 ATOM 24 C CB . PRO A 1 3 ? -7.637 -4.962 7.628 1.00 91.54 3 A 1 ATOM 25 C CG . PRO A 1 3 ? -7.486 -5.810 6.415 1.00 87.90 3 A 1 ATOM 26 C CD . PRO A 1 3 ? -8.570 -5.364 5.460 1.00 90.84 3 A 1 ATOM 27 N N . LEU A 1 4 ? -6.597 -2.048 8.010 1.00 95.41 4 A 1 ATOM 28 C CA . LEU A 1 4 ? -5.515 -1.062 7.939 1.00 95.74 4 A 1 ATOM 29 C C . LEU A 1 4 ? -4.286 -1.658 7.263 1.00 96.52 4 A 1 ATOM 30 O O . LEU A 1 4 ? -3.549 -0.955 6.574 1.00 95.75 4 A 1 ATOM 31 C CB . LEU A 1 4 ? -5.172 -0.599 9.356 1.00 94.94 4 A 1 ATOM 32 C CG . LEU A 1 4 ? -6.208 0.381 9.916 1.00 90.93 4 A 1 ATOM 33 C CD1 . LEU A 1 4 ? -6.127 0.418 11.438 1.00 87.63 4 A 1 ATOM 34 C CD2 . LEU A 1 4 ? -5.951 1.773 9.349 1.00 85.72 4 A 1 ATOM 35 N N . CYS A 1 5 ? -4.086 -2.957 7.461 1.00 96.04 5 A 1 ATOM 36 C CA . CYS A 1 5 ? -2.952 -3.649 6.838 1.00 96.06 5 A 1 ATOM 37 C C . CYS A 1 5 ? -3.004 -3.494 5.321 1.00 96.69 5 A 1 ATOM 38 O O . CYS A 1 5 ? -1.987 -3.267 4.674 1.00 95.74 5 A 1 ATOM 39 C CB . CYS A 1 5 ? -2.989 -5.130 7.215 1.00 94.54 5 A 1 ATOM 40 S SG . CYS A 1 5 ? -2.394 -5.416 8.898 1.00 87.26 5 A 1 ATOM 41 N N . MET A 1 6 ? -4.204 -3.632 4.783 1.00 96.04 6 A 1 ATOM 42 C CA . MET A 1 6 ? -4.386 -3.491 3.334 1.00 96.28 6 A 1 ATOM 43 C C . MET A 1 6 ? -4.136 -2.044 2.906 1.00 96.95 6 A 1 ATOM 44 O O . MET A 1 6 ? -3.504 -1.792 1.881 1.00 96.33 6 A 1 ATOM 45 C CB . MET A 1 6 ? -5.808 -3.915 2.955 1.00 95.64 6 A 1 ATOM 46 C CG . MET A 1 6 ? -5.784 -5.026 1.921 1.00 90.51 6 A 1 ATOM 47 S SD . MET A 1 6 ? -5.630 -4.356 0.277 1.00 84.66 6 A 1 ATOM 48 C CE . MET A 1 6 ? -5.163 -5.833 -0.617 1.00 75.53 6 A 1 ATOM 49 N N . THR A 1 7 ? -4.636 -1.119 3.686 1.00 96.60 7 A 1 ATOM 50 C CA . THR A 1 7 ? -4.443 0.305 3.393 1.00 96.57 7 A 1 ATOM 51 C C . THR A 1 7 ? -2.957 0.655 3.436 1.00 97.07 7 A 1 ATOM 52 O O . THR A 1 7 ? -2.460 1.390 2.583 1.00 96.71 7 A 1 ATOM 53 C CB . THR A 1 7 ? -5.210 1.149 4.415 1.00 95.97 7 A 1 ATOM 54 O OG1 . THR A 1 7 ? -6.579 0.743 4.416 1.00 91.10 7 A 1 ATOM 55 C CG2 . THR A 1 7 ? -5.138 2.623 4.050 1.00 89.75 7 A 1 ATOM 56 N N . TYR A 1 8 ? -2.273 0.121 4.422 1.00 96.06 8 A 1 ATOM 57 C CA . TYR A 1 8 ? -0.835 0.352 4.552 1.00 96.37 8 A 1 ATOM 58 C C . TYR A 1 8 ? -0.104 -0.203 3.334 1.00 96.87 8 A 1 ATOM 59 O O . TYR A 1 8 ? 0.786 0.441 2.775 1.00 96.35 8 A 1 ATOM 60 C CB . TYR A 1 8 ? -0.322 -0.337 5.814 1.00 95.96 8 A 1 ATOM 61 C CG . TYR A 1 8 ? -0.114 0.640 6.948 1.00 93.33 8 A 1 ATOM 62 C CD1 . TYR A 1 8 ? 0.835 1.651 6.849 1.00 90.28 8 A 1 ATOM 63 C CD2 . TYR A 1 8 ? -0.860 0.536 8.119 1.00 90.47 8 A 1 ATOM 64 C CE1 . TYR A 1 8 ? 1.029 2.545 7.894 1.00 89.72 8 A 1 ATOM 65 C CE2 . TYR A 1 8 ? -0.668 1.426 9.168 1.00 89.79 8 A 1 ATOM 66 C CZ . TYR A 1 8 ? 0.278 2.426 9.050 1.00 90.32 8 A 1 ATOM 67 O OH . TYR A 1 8 ? 0.472 3.306 10.083 1.00 88.43 8 A 1 ATOM 68 N N . TRP A 1 9 ? -0.497 -1.395 2.943 1.00 96.13 9 A 1 ATOM 69 C CA . TRP A 1 9 ? 0.104 -2.044 1.774 1.00 96.09 9 A 1 ATOM 70 C C . TRP A 1 9 ? -0.156 -1.201 0.525 1.00 96.63 9 A 1 ATOM 71 O O . TRP A 1 9 ? 0.731 -1.015 -0.307 1.00 96.10 9 A 1 ATOM 72 C CB . TRP A 1 9 ? -0.497 -3.444 1.620 1.00 95.84 9 A 1 ATOM 73 C CG . TRP A 1 9 ? -0.084 -4.139 0.357 1.00 94.39 9 A 1 ATOM 74 C CD1 . TRP A 1 9 ? -0.890 -4.886 -0.444 1.00 90.94 9 A 1 ATOM 75 C CD2 . TRP A 1 9 ? 1.215 -4.160 -0.260 1.00 92.96 9 A 1 ATOM 76 N NE1 . TRP A 1 9 ? -0.179 -5.369 -1.508 1.00 89.86 9 A 1 ATOM 77 C CE2 . TRP A 1 9 ? 1.118 -4.941 -1.433 1.00 92.51 9 A 1 ATOM 78 C CE3 . TRP A 1 9 ? 2.455 -3.596 0.059 1.00 91.12 9 A 1 ATOM 79 C CZ2 . TRP A 1 9 ? 2.215 -5.161 -2.274 1.00 91.27 9 A 1 ATOM 80 C CZ3 . TRP A 1 9 ? 3.545 -3.815 -0.781 1.00 87.60 9 A 1 ATOM 81 C CH2 . TRP A 1 9 ? 3.418 -4.588 -1.935 1.00 87.81 9 A 1 ATOM 82 N N . TRP A 1 10 ? -1.371 -0.704 0.409 1.00 96.04 10 A 1 ATOM 83 C CA . TRP A 1 10 ? -1.744 0.122 -0.739 1.00 95.96 10 A 1 ATOM 84 C C . TRP A 1 10 ? -0.887 1.388 -0.778 1.00 96.51 10 A 1 ATOM 85 O O . TRP A 1 10 ? -0.414 1.788 -1.842 1.00 96.23 10 A 1 ATOM 86 C CB . TRP A 1 10 ? -3.232 0.480 -0.625 1.00 95.84 10 A 1 ATOM 87 C CG . TRP A 1 10 ? -3.849 0.862 -1.938 1.00 94.61 10 A 1 ATOM 88 C CD1 . TRP A 1 10 ? -4.978 1.620 -2.088 1.00 91.55 10 A 1 ATOM 89 C CD2 . TRP A 1 10 ? -3.423 0.527 -3.271 1.00 93.45 10 A 1 ATOM 90 N NE1 . TRP A 1 10 ? -5.266 1.769 -3.414 1.00 91.04 10 A 1 ATOM 91 C CE2 . TRP A 1 10 ? -4.332 1.112 -4.175 1.00 93.02 10 A 1 ATOM 92 C CE3 . TRP A 1 10 ? -2.359 -0.212 -3.801 1.00 91.96 10 A 1 ATOM 93 C CZ2 . TRP A 1 10 ? -4.195 0.980 -5.564 1.00 91.83 10 A 1 ATOM 94 C CZ3 . TRP A 1 10 ? -2.220 -0.343 -5.187 1.00 89.15 10 A 1 ATOM 95 C CH2 . TRP A 1 10 ? -3.133 0.254 -6.051 1.00 89.07 10 A 1 ATOM 96 N N . LEU A 1 11 ? -0.694 2.002 0.381 1.00 96.05 11 A 1 ATOM 97 C CA . LEU A 1 11 ? 0.127 3.214 0.464 1.00 96.08 11 A 1 ATOM 98 C C . LEU A 1 11 ? 1.554 2.917 0.024 1.00 96.62 11 A 1 ATOM 99 O O . LEU A 1 11 ? 2.159 3.694 -0.715 1.00 96.28 11 A 1 ATOM 100 C CB . LEU A 1 11 ? 0.112 3.730 1.902 1.00 95.71 11 A 1 ATOM 101 C CG . LEU A 1 11 ? -1.214 4.398 2.275 1.00 93.72 11 A 1 ATOM 102 C CD1 . LEU A 1 11 ? -1.383 4.430 3.785 1.00 91.36 11 A 1 ATOM 103 C CD2 . LEU A 1 11 ? -1.252 5.819 1.715 1.00 91.13 11 A 1 ATOM 104 N N . GLY A 1 12 ? 2.076 1.804 0.493 1.00 96.53 12 A 1 ATOM 105 C CA . GLY A 1 12 ? 3.431 1.401 0.120 1.00 96.26 12 A 1 ATOM 106 C C . GLY A 1 12 ? 3.523 1.110 -1.363 1.00 96.88 12 A 1 ATOM 107 O O . GLY A 1 12 ? 4.500 1.474 -2.022 1.00 96.46 12 A 1 ATOM 108 N N . LEU A 1 13 ? 2.499 0.460 -1.877 1.00 96.62 13 A 1 ATOM 109 C CA . LEU A 1 13 ? 2.450 0.133 -3.300 1.00 96.43 13 A 1 ATOM 110 C C . LEU A 1 13 ? 2.441 1.414 -4.130 1.00 96.91 13 A 1 ATOM 111 O O . LEU A 1 13 ? 3.145 1.520 -5.132 1.00 96.51 13 A 1 ATOM 112 C CB . LEU A 1 13 ? 1.192 -0.694 -3.600 1.00 96.12 13 A 1 ATOM 113 C CG . LEU A 1 13 ? 1.377 -1.634 -4.789 1.00 92.36 13 A 1 ATOM 114 C CD1 . LEU A 1 13 ? 1.858 -2.999 -4.310 1.00 89.03 13 A 1 ATOM 115 C CD2 . LEU A 1 13 ? 0.077 -1.775 -5.560 1.00 89.15 13 A 1 ATOM 116 N N . LEU A 1 14 ? 1.650 2.383 -3.704 1.00 96.79 14 A 1 ATOM 117 C CA . LEU A 1 14 ? 1.569 3.664 -4.410 1.00 96.53 14 A 1 ATOM 118 C C . LEU A 1 14 ? 2.934 4.341 -4.428 1.00 96.94 14 A 1 ATOM 119 O O . LEU A 1 14 ? 3.335 4.915 -5.443 1.00 96.58 14 A 1 ATOM 120 C CB . LEU A 1 14 ? 0.541 4.553 -3.707 1.00 96.06 14 A 1 ATOM 121 C CG . LEU A 1 14 ? -0.901 4.210 -4.092 1.00 93.93 14 A 1 ATOM 122 C CD1 . LEU A 1 14 ? -1.870 4.727 -3.038 1.00 91.16 14 A 1 ATOM 123 C CD2 . LEU A 1 14 ? -1.234 4.814 -5.450 1.00 90.68 14 A 1 ATOM 124 N N . ALA A 1 15 ? 3.630 4.274 -3.311 1.00 97.20 15 A 1 ATOM 125 C CA . ALA A 1 15 ? 4.963 4.869 -3.214 1.00 97.11 15 A 1 ATOM 126 C C . ALA A 1 15 ? 5.928 4.164 -4.163 1.00 97.42 15 A 1 ATOM 127 O O . ALA A 1 15 ? 6.739 4.806 -4.826 1.00 96.23 15 A 1 ATOM 128 C CB . ALA A 1 15 ? 5.463 4.776 -1.780 1.00 96.38 15 A 1 ATOM 129 N N . THR A 1 16 ? 5.824 2.851 -4.214 1.00 97.13 16 A 1 ATOM 130 C CA . THR A 1 16 ? 6.692 2.059 -5.089 1.00 96.70 16 A 1 ATOM 131 C C . THR A 1 16 ? 6.378 2.344 -6.553 1.00 96.85 16 A 1 ATOM 132 O O . THR A 1 16 ? 7.288 2.481 -7.374 1.00 95.39 16 A 1 ATOM 133 C CB . THR A 1 16 ? 6.500 0.564 -4.806 1.00 95.53 16 A 1 ATOM 134 O OG1 . THR A 1 16 ? 6.790 0.312 -3.434 1.00 89.44 16 A 1 ATOM 135 C CG2 . THR A 1 16 ? 7.442 -0.273 -5.659 1.00 87.36 16 A 1 ATOM 136 N N . VAL A 1 17 ? 5.100 2.421 -6.869 1.00 96.76 17 A 1 ATOM 137 C CA . VAL A 1 17 ? 4.675 2.693 -8.243 1.00 96.22 17 A 1 ATOM 138 C C . VAL A 1 17 ? 5.054 4.115 -8.644 1.00 96.38 17 A 1 ATOM 139 O O . VAL A 1 17 ? 5.515 4.351 -9.765 1.00 93.90 17 A 1 ATOM 140 C CB . VAL A 1 17 ? 3.156 2.485 -8.386 1.00 94.46 17 A 1 ATOM 141 C CG1 . VAL A 1 17 ? 2.685 2.908 -9.772 1.00 87.63 17 A 1 ATOM 142 C CG2 . VAL A 1 17 ? 2.795 1.025 -8.153 1.00 88.79 17 A 1 ATOM 143 N N . GLY A 1 18 ? 4.847 5.056 -7.738 1.00 94.54 18 A 1 ATOM 144 C CA . GLY A 1 18 ? 5.178 6.458 -8.007 1.00 93.09 18 A 1 ATOM 145 C C . GLY A 1 18 ? 6.672 6.686 -8.114 1.00 93.19 18 A 1 ATOM 146 O O . GLY A 1 18 ? 7.166 7.211 -9.109 1.00 90.16 18 A 1 ATOM 147 N N . ALA A 1 19 ? 7.394 6.299 -7.068 1.00 92.27 19 A 1 ATOM 148 C CA . ALA A 1 19 ? 8.840 6.477 -7.034 1.00 90.54 19 A 1 ATOM 149 C C . ALA A 1 19 ? 9.559 5.347 -7.774 1.00 89.14 19 A 1 ATOM 150 O O . ALA A 1 19 ? 8.920 4.348 -8.133 1.00 82.64 19 A 1 ATOM 151 C CB . ALA A 1 19 ? 9.320 6.568 -5.591 1.00 86.18 19 A 1 ATOM 152 O OXT . ALA A 1 19 ? 10.772 5.447 -7.989 1.00 77.64 19 A 1 #