# By using this file you agree to the legally binding terms of use found at alphafoldserver.com/output-terms data_23ce34c438a12e9d # _entry.id 23ce34c438a12e9d # 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](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE N[C@@H](CCCNC(N)=[NH2+])C(O)=O ? "L-PEPTIDE LINKING" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE N[C@@H](CC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" N[C@@H](CC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE N[C@@H](CS)C(O)=O ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE N[C@@H](CCC(N)=O)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" N[C@@H](CCC(O)=O)C(O)=O ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE NCC(O)=O ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE N[C@@H](Cc1c[nH]c[nH+]1)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE N[C@@H](CCCC[NH3+])C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE N[C@@H](Cc1ccccc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE OC(=O)[C@@H]1CCCN1 ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE N[C@@H](CO)C(O)=O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@@H](O)[C@H](N)C(O)=O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE N[C@@H](Cc1ccc(O)cc1)C(O)=O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@H](N)C(O)=O ? "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 ? _citation.page_first ? _citation.page_last ? _citation.pdbx_database_id_DOI ? _citation.pdbx_database_id_PubMed ? _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 ILE 2 1 n THR 3 1 n LEU 4 1 n ASP 5 1 n VAL 6 1 n ILE 7 1 n LYS 8 1 n SER 9 1 n ASP 10 1 n GLY 11 1 n SER 12 1 n SER 13 1 n LYS 14 1 n THR 15 1 n CYS 16 1 n THR 17 1 n HIS 18 1 n LEU 19 1 n LYS 20 1 n LYS 21 1 n ILE 22 1 n ILE 23 1 n LYS 24 1 n ASP 25 1 n HIS 26 1 n SER 27 1 n GLY 28 1 n LYS 29 1 n VAL 30 1 n LEU 31 1 n ILE 32 1 n ALA 33 1 n LEU 34 1 n LYS 35 1 n LEU 36 1 n ILE 37 1 n LEU 38 1 n ALA 39 1 n LEU 40 1 n LEU 41 1 n THR 42 1 n PHE 43 1 n PHE 44 1 n THR 45 1 n ILE 46 1 n THR 47 1 n ILE 48 1 n THR 49 1 n ILE 50 1 n ASN 51 1 n TYR 52 1 n ILE 53 1 n LYS 54 1 n VAL 55 1 n GLU 56 1 n ASN 57 1 n ASN 58 1 n LEU 59 1 n GLN 60 1 n ILE 61 1 n CYS 62 1 n GLN 63 1 n SER 64 1 n LYS 65 1 n THR 66 1 n GLU 67 1 n SER 68 1 n ASP 69 1 n LYS 70 1 n GLU 71 1 n ASP 72 1 n SER 73 1 n PRO 74 1 n SER 75 1 n ASN 76 1 n THR 77 1 n THR 78 1 n SER 79 1 n VAL 80 1 n THR 81 1 n THR 82 1 n LYS 83 1 n THR 84 1 n THR 85 1 n LEU 86 1 n ASP 87 1 n HIS 88 1 n ASP 89 1 n ILE 90 1 n THR 91 1 n GLN 92 1 n TYR 93 1 n PHE 94 1 n LYS 95 1 n ARG 96 1 n LEU 97 1 n ILE 98 1 n GLN 99 1 n ARG 100 1 n TYR 101 1 n THR 102 1 n ASP 103 1 n SER 104 1 n VAL 105 1 n ILE 106 1 n ASN 107 1 n LYS 108 1 n ASP 109 1 n THR 110 1 n CYS 111 1 n TRP 112 1 n LYS 113 1 n ILE 114 1 n SER 115 1 n ARG 116 1 n ASN 117 1 n GLN 118 1 n CYS 119 1 n THR 120 1 n ASN 121 1 n ILE 122 1 n THR 123 1 n THR 124 1 n TYR 125 1 n LYS 126 1 n PHE 127 1 n LEU 128 1 n CYS 129 1 n PHE 130 1 n LYS 131 1 n PRO 132 1 n GLU 133 1 n ASP 134 1 n SER 135 1 n LYS 136 1 n ILE 137 1 n ASN 138 1 n SER 139 1 n CYS 140 1 n ASP 141 1 n ARG 142 1 n LEU 143 1 n THR 144 1 n ASP 145 1 n LEU 146 1 n CYS 147 1 n ARG 148 1 n ASN 149 1 n LYS 150 1 n SER 151 1 n LYS 152 1 n SER 153 1 n ALA 154 1 n ALA 155 1 n GLU 156 1 n ALA 157 1 n TYR 158 1 n HIS 159 1 n THR 160 1 n VAL 161 1 n GLU 162 1 n CYS 163 1 n HIS 164 1 n CYS 165 1 n ILE 166 1 n TYR 167 1 n THR 168 1 n ILE 169 1 n GLU 170 1 n TRP 171 1 n LYS 172 1 n CYS 173 1 n TYR 174 1 n HIS 175 1 n HIS 176 1 n SER 177 1 n ILE 178 1 n ASP 179 # _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 (fb0b9d13-0bdd-4522-ba5f-0ee1f426d085 @ 2025-01-10 06:38:58)" _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 48.95 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # _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 alphafoldserver.com/output-terms. ; 1 license ? ;THE INFORMATION IS NOT INTENDED FOR, HAS NOT BEEN VALIDATED FOR, AND IS NOT APPROVED FOR CLINICAL USE. IT SHOULD NOT BE USED FOR CLINICAL PURPOSE OR RELIED ON FOR MEDICAL OR OTHER PROFESSIONAL ADVICE. IT IS THEORETICAL MODELLING ONLY AND CAUTION SHOULD BE EXERCISED IN ITS USE. IT IS PROVIDED "AS-IS" WITHOUT ANY WARRANTY OF ANY KIND, WHETHER EXPRESSED OR IMPLIED. NO WARRANTY IS GIVEN THAT USE OF THE INFORMATION 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 ILE . 2 A 2 A 3 1 n THR . 3 A 3 A 4 1 n LEU . 4 A 4 A 5 1 n ASP . 5 A 5 A 6 1 n VAL . 6 A 6 A 7 1 n ILE . 7 A 7 A 8 1 n LYS . 8 A 8 A 9 1 n SER . 9 A 9 A 10 1 n ASP . 10 A 10 A 11 1 n GLY . 11 A 11 A 12 1 n SER . 12 A 12 A 13 1 n SER . 13 A 13 A 14 1 n LYS . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n CYS . 16 A 16 A 17 1 n THR . 17 A 17 A 18 1 n HIS . 18 A 18 A 19 1 n LEU . 19 A 19 A 20 1 n LYS . 20 A 20 A 21 1 n LYS . 21 A 21 A 22 1 n ILE . 22 A 22 A 23 1 n ILE . 23 A 23 A 24 1 n LYS . 24 A 24 A 25 1 n ASP . 25 A 25 A 26 1 n HIS . 26 A 26 A 27 1 n SER . 27 A 27 A 28 1 n GLY . 28 A 28 A 29 1 n LYS . 29 A 29 A 30 1 n VAL . 30 A 30 A 31 1 n LEU . 31 A 31 A 32 1 n ILE . 32 A 32 A 33 1 n ALA . 33 A 33 A 34 1 n LEU . 34 A 34 A 35 1 n LYS . 35 A 35 A 36 1 n LEU . 36 A 36 A 37 1 n ILE . 37 A 37 A 38 1 n LEU . 38 A 38 A 39 1 n ALA . 39 A 39 A 40 1 n LEU . 40 A 40 A 41 1 n LEU . 41 A 41 A 42 1 n THR . 42 A 42 A 43 1 n PHE . 43 A 43 A 44 1 n PHE . 44 A 44 A 45 1 n THR . 45 A 45 A 46 1 n ILE . 46 A 46 A 47 1 n THR . 47 A 47 A 48 1 n ILE . 48 A 48 A 49 1 n THR . 49 A 49 A 50 1 n ILE . 50 A 50 A 51 1 n ASN . 51 A 51 A 52 1 n TYR . 52 A 52 A 53 1 n ILE . 53 A 53 A 54 1 n LYS . 54 A 54 A 55 1 n VAL . 55 A 55 A 56 1 n GLU . 56 A 56 A 57 1 n ASN . 57 A 57 A 58 1 n ASN . 58 A 58 A 59 1 n LEU . 59 A 59 A 60 1 n GLN . 60 A 60 A 61 1 n ILE . 61 A 61 A 62 1 n CYS . 62 A 62 A 63 1 n GLN . 63 A 63 A 64 1 n SER . 64 A 64 A 65 1 n LYS . 65 A 65 A 66 1 n THR . 66 A 66 A 67 1 n GLU . 67 A 67 A 68 1 n SER . 68 A 68 A 69 1 n ASP . 69 A 69 A 70 1 n LYS . 70 A 70 A 71 1 n GLU . 71 A 71 A 72 1 n ASP . 72 A 72 A 73 1 n SER . 73 A 73 A 74 1 n PRO . 74 A 74 A 75 1 n SER . 75 A 75 A 76 1 n ASN . 76 A 76 A 77 1 n THR . 77 A 77 A 78 1 n THR . 78 A 78 A 79 1 n SER . 79 A 79 A 80 1 n VAL . 80 A 80 A 81 1 n THR . 81 A 81 A 82 1 n THR . 82 A 82 A 83 1 n LYS . 83 A 83 A 84 1 n THR . 84 A 84 A 85 1 n THR . 85 A 85 A 86 1 n LEU . 86 A 86 A 87 1 n ASP . 87 A 87 A 88 1 n HIS . 88 A 88 A 89 1 n ASP . 89 A 89 A 90 1 n ILE . 90 A 90 A 91 1 n THR . 91 A 91 A 92 1 n GLN . 92 A 92 A 93 1 n TYR . 93 A 93 A 94 1 n PHE . 94 A 94 A 95 1 n LYS . 95 A 95 A 96 1 n ARG . 96 A 96 A 97 1 n LEU . 97 A 97 A 98 1 n ILE . 98 A 98 A 99 1 n GLN . 99 A 99 A 100 1 n ARG . 100 A 100 A 101 1 n TYR . 101 A 101 A 102 1 n THR . 102 A 102 A 103 1 n ASP . 103 A 103 A 104 1 n SER . 104 A 104 A 105 1 n VAL . 105 A 105 A 106 1 n ILE . 106 A 106 A 107 1 n ASN . 107 A 107 A 108 1 n LYS . 108 A 108 A 109 1 n ASP . 109 A 109 A 110 1 n THR . 110 A 110 A 111 1 n CYS . 111 A 111 A 112 1 n TRP . 112 A 112 A 113 1 n LYS . 113 A 113 A 114 1 n ILE . 114 A 114 A 115 1 n SER . 115 A 115 A 116 1 n ARG . 116 A 116 A 117 1 n ASN . 117 A 117 A 118 1 n GLN . 118 A 118 A 119 1 n CYS . 119 A 119 A 120 1 n THR . 120 A 120 A 121 1 n ASN . 121 A 121 A 122 1 n ILE . 122 A 122 A 123 1 n THR . 123 A 123 A 124 1 n THR . 124 A 124 A 125 1 n TYR . 125 A 125 A 126 1 n LYS . 126 A 126 A 127 1 n PHE . 127 A 127 A 128 1 n LEU . 128 A 128 A 129 1 n CYS . 129 A 129 A 130 1 n PHE . 130 A 130 A 131 1 n LYS . 131 A 131 A 132 1 n PRO . 132 A 132 A 133 1 n GLU . 133 A 133 A 134 1 n ASP . 134 A 134 A 135 1 n SER . 135 A 135 A 136 1 n LYS . 136 A 136 A 137 1 n ILE . 137 A 137 A 138 1 n ASN . 138 A 138 A 139 1 n SER . 139 A 139 A 140 1 n CYS . 140 A 140 A 141 1 n ASP . 141 A 141 A 142 1 n ARG . 142 A 142 A 143 1 n LEU . 143 A 143 A 144 1 n THR . 144 A 144 A 145 1 n ASP . 145 A 145 A 146 1 n LEU . 146 A 146 A 147 1 n CYS . 147 A 147 A 148 1 n ARG . 148 A 148 A 149 1 n ASN . 149 A 149 A 150 1 n LYS . 150 A 150 A 151 1 n SER . 151 A 151 A 152 1 n LYS . 152 A 152 A 153 1 n SER . 153 A 153 A 154 1 n ALA . 154 A 154 A 155 1 n ALA . 155 A 155 A 156 1 n GLU . 156 A 156 A 157 1 n ALA . 157 A 157 A 158 1 n TYR . 158 A 158 A 159 1 n HIS . 159 A 159 A 160 1 n THR . 160 A 160 A 161 1 n VAL . 161 A 161 A 162 1 n GLU . 162 A 162 A 163 1 n CYS . 163 A 163 A 164 1 n HIS . 164 A 164 A 165 1 n CYS . 165 A 165 A 166 1 n ILE . 166 A 166 A 167 1 n TYR . 167 A 167 A 168 1 n THR . 168 A 168 A 169 1 n ILE . 169 A 169 A 170 1 n GLU . 170 A 170 A 171 1 n TRP . 171 A 171 A 172 1 n LYS . 172 A 172 A 173 1 n CYS . 173 A 173 A 174 1 n TYR . 174 A 174 A 175 1 n HIS . 175 A 175 A 176 1 n HIS . 176 A 176 A 177 1 n SER . 177 A 177 A 178 1 n ILE . 178 A 178 A 179 1 n ASP . 179 A 179 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fb0b9d13-0bdd-4522-ba5f-0ee1f426d085 @ 2025-01-10 06:38:58)" # _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 ? 40.202 51.310 -28.001 1.00 32.52 1 A 1 ATOM 2 C CA . MET A 1 1 ? 39.904 49.970 -28.536 1.00 59.28 1 A 1 ATOM 3 C C . MET A 1 1 ? 39.793 49.039 -27.329 1.00 60.21 1 A 1 ATOM 4 O O . MET A 1 1 ? 40.812 48.699 -26.747 1.00 56.14 1 A 1 ATOM 5 C CB . MET A 1 1 ? 41.010 49.555 -29.524 1.00 56.52 1 A 1 ATOM 6 C CG . MET A 1 1 ? 40.509 48.718 -30.714 1.00 50.74 1 A 1 ATOM 7 S SD . MET A 1 1 ? 41.806 48.555 -31.979 1.00 46.62 1 A 1 ATOM 8 C CE . MET A 1 1 ? 40.928 47.618 -33.260 1.00 41.91 1 A 1 ATOM 9 N N . ILE A 1 2 ? 38.576 48.778 -26.851 1.00 38.47 2 A 1 ATOM 10 C CA . ILE A 1 2 ? 38.325 47.983 -25.640 1.00 47.87 2 A 1 ATOM 11 C C . ILE A 1 2 ? 37.969 46.580 -26.121 1.00 46.98 2 A 1 ATOM 12 O O . ILE A 1 2 ? 36.930 46.381 -26.746 1.00 44.72 2 A 1 ATOM 13 C CB . ILE A 1 2 ? 37.219 48.626 -24.769 1.00 48.15 2 A 1 ATOM 14 C CG1 . ILE A 1 2 ? 37.627 50.048 -24.323 1.00 45.51 2 A 1 ATOM 15 C CG2 . ILE A 1 2 ? 36.910 47.749 -23.542 1.00 47.27 2 A 1 ATOM 16 C CD1 . ILE A 1 2 ? 36.515 50.855 -23.623 1.00 42.52 2 A 1 ATOM 17 N N . THR A 1 3 ? 38.872 45.619 -25.904 1.00 35.24 3 A 1 ATOM 18 C CA . THR A 1 3 ? 38.651 44.193 -26.163 1.00 41.69 3 A 1 ATOM 19 C C . THR A 1 3 ? 37.711 43.638 -25.101 1.00 42.09 3 A 1 ATOM 20 O O . THR A 1 3 ? 38.025 43.614 -23.918 1.00 41.31 3 A 1 ATOM 21 C CB . THR A 1 3 ? 39.991 43.422 -26.187 1.00 40.38 3 A 1 ATOM 22 O OG1 . THR A 1 3 ? 40.973 44.094 -25.432 1.00 35.19 3 A 1 ATOM 23 C CG2 . THR A 1 3 ? 40.517 43.317 -27.616 1.00 39.73 3 A 1 ATOM 24 N N . LEU A 1 4 ? 36.530 43.226 -25.536 1.00 32.52 4 A 1 ATOM 25 C CA . LEU A 1 4 ? 35.532 42.537 -24.727 1.00 36.83 4 A 1 ATOM 26 C C . LEU A 1 4 ? 35.967 41.059 -24.600 1.00 36.44 4 A 1 ATOM 27 O O . LEU A 1 4 ? 35.813 40.290 -25.543 1.00 35.03 4 A 1 ATOM 28 C CB . LEU A 1 4 ? 34.151 42.685 -25.396 1.00 36.87 4 A 1 ATOM 29 C CG . LEU A 1 4 ? 33.004 42.989 -24.418 1.00 34.04 4 A 1 ATOM 30 C CD1 . LEU A 1 4 ? 32.693 44.489 -24.423 1.00 33.00 4 A 1 ATOM 31 C CD2 . LEU A 1 4 ? 31.730 42.244 -24.808 1.00 38.73 4 A 1 ATOM 32 N N . ASP A 1 5 ? 36.511 40.680 -23.446 1.00 36.87 5 A 1 ATOM 33 C CA . ASP A 1 5 ? 36.766 39.275 -23.129 1.00 41.93 5 A 1 ATOM 34 C C . ASP A 1 5 ? 35.436 38.544 -22.925 1.00 40.16 5 A 1 ATOM 35 O O . ASP A 1 5 ? 34.715 38.728 -21.940 1.00 39.73 5 A 1 ATOM 36 C CB . ASP A 1 5 ? 37.698 39.138 -21.904 1.00 42.27 5 A 1 ATOM 37 C CG . ASP A 1 5 ? 39.178 39.195 -22.279 1.00 38.77 5 A 1 ATOM 38 O OD1 . ASP A 1 5 ? 39.531 38.705 -23.379 1.00 36.91 5 A 1 ATOM 39 O OD2 . ASP A 1 5 ? 39.958 39.709 -21.452 1.00 37.01 5 A 1 ATOM 40 N N . VAL A 1 6 ? 35.097 37.714 -23.898 1.00 38.27 6 A 1 ATOM 41 C CA . VAL A 1 6 ? 33.956 36.796 -23.842 1.00 45.29 6 A 1 ATOM 42 C C . VAL A 1 6 ? 34.294 35.679 -22.854 1.00 45.42 6 A 1 ATOM 43 O O . VAL A 1 6 ? 35.007 34.739 -23.176 1.00 44.61 6 A 1 ATOM 44 C CB . VAL A 1 6 ? 33.627 36.250 -25.247 1.00 44.07 6 A 1 ATOM 45 C CG1 . VAL A 1 6 ? 32.505 35.204 -25.222 1.00 38.20 6 A 1 ATOM 46 C CG2 . VAL A 1 6 ? 33.183 37.387 -26.183 1.00 41.03 6 A 1 ATOM 47 N N . ILE A 1 7 ? 33.749 35.765 -21.639 1.00 39.60 7 A 1 ATOM 48 C CA . ILE A 1 7 ? 33.782 34.684 -20.653 1.00 42.97 7 A 1 ATOM 49 C C . ILE A 1 7 ? 32.936 33.529 -21.200 1.00 42.16 7 A 1 ATOM 50 O O . ILE A 1 7 ? 31.703 33.533 -21.117 1.00 39.63 7 A 1 ATOM 51 C CB . ILE A 1 7 ? 33.307 35.180 -19.270 1.00 41.05 7 A 1 ATOM 52 C CG1 . ILE A 1 7 ? 34.203 36.341 -18.767 1.00 37.95 7 A 1 ATOM 53 C CG2 . ILE A 1 7 ? 33.304 34.023 -18.257 1.00 39.32 7 A 1 ATOM 54 C CD1 . ILE A 1 7 ? 33.730 36.993 -17.462 1.00 37.25 7 A 1 ATOM 55 N N . LYS A 1 8 ? 33.597 32.518 -21.792 1.00 43.30 8 A 1 ATOM 56 C CA . LYS A 1 8 ? 32.984 31.226 -22.114 1.00 47.52 8 A 1 ATOM 57 C C . LYS A 1 8 ? 32.610 30.513 -20.819 1.00 46.71 8 A 1 ATOM 58 O O . LYS A 1 8 ? 33.464 29.973 -20.119 1.00 44.95 8 A 1 ATOM 59 C CB . LYS A 1 8 ? 33.941 30.374 -22.971 1.00 47.24 8 A 1 ATOM 60 C CG . LYS A 1 8 ? 33.598 30.414 -24.465 1.00 42.29 8 A 1 ATOM 61 C CD . LYS A 1 8 ? 34.596 29.545 -25.254 1.00 41.35 8 A 1 ATOM 62 C CE . LYS A 1 8 ? 34.203 29.458 -26.725 1.00 38.01 8 A 1 ATOM 63 N NZ . LYS A 1 8 ? 35.211 28.703 -27.511 1.00 35.78 8 A 1 ATOM 64 N N . SER A 1 9 ? 31.323 30.486 -20.485 1.00 51.67 9 A 1 ATOM 65 C CA . SER A 1 9 ? 30.772 29.722 -19.368 1.00 54.46 9 A 1 ATOM 66 C C . SER A 1 9 ? 30.628 28.238 -19.739 1.00 54.71 9 A 1 ATOM 67 O O . SER A 1 9 ? 29.540 27.767 -20.056 1.00 51.12 9 A 1 ATOM 68 C CB . SER A 1 9 ? 29.451 30.356 -18.910 1.00 51.59 9 A 1 ATOM 69 O OG . SER A 1 9 ? 28.534 30.408 -19.978 1.00 46.96 9 A 1 ATOM 70 N N . ASP A 1 10 ? 31.711 27.463 -19.660 1.00 55.91 10 A 1 ATOM 71 C CA . ASP A 1 10 ? 31.722 26.003 -19.891 1.00 58.35 10 A 1 ATOM 72 C C . ASP A 1 10 ? 31.097 25.167 -18.745 1.00 58.47 10 A 1 ATOM 73 O O . ASP A 1 10 ? 31.200 23.942 -18.704 1.00 54.00 10 A 1 ATOM 74 C CB . ASP A 1 10 ? 33.157 25.553 -20.240 1.00 55.31 10 A 1 ATOM 75 C CG . ASP A 1 10 ? 33.544 25.783 -21.710 1.00 50.50 10 A 1 ATOM 76 O OD1 . ASP A 1 10 ? 32.637 25.794 -22.567 1.00 46.26 10 A 1 ATOM 77 O OD2 . ASP A 1 10 ? 34.759 25.898 -21.982 1.00 45.03 10 A 1 ATOM 78 N N . GLY A 1 11 ? 30.402 25.792 -17.798 1.00 56.95 11 A 1 ATOM 79 C CA . GLY A 1 11 ? 29.840 25.133 -16.612 1.00 59.61 11 A 1 ATOM 80 C C . GLY A 1 11 ? 28.471 24.459 -16.786 1.00 61.38 11 A 1 ATOM 81 O O . GLY A 1 11 ? 28.091 23.623 -15.957 1.00 56.87 11 A 1 ATOM 82 N N . SER A 1 12 ? 27.709 24.782 -17.848 1.00 66.40 12 A 1 ATOM 83 C CA . SER A 1 12 ? 26.287 24.410 -17.944 1.00 69.13 12 A 1 ATOM 84 C C . SER A 1 12 ? 26.013 23.034 -18.582 1.00 70.28 12 A 1 ATOM 85 O O . SER A 1 12 ? 24.980 22.416 -18.326 1.00 66.31 12 A 1 ATOM 86 C CB . SER A 1 12 ? 25.547 25.519 -18.697 1.00 64.24 12 A 1 ATOM 87 O OG . SER A 1 12 ? 24.158 25.285 -18.706 1.00 55.82 12 A 1 ATOM 88 N N . SER A 1 13 ? 26.942 22.504 -19.383 1.00 72.93 13 A 1 ATOM 89 C CA . SER A 1 13 ? 26.726 21.278 -20.167 1.00 76.48 13 A 1 ATOM 90 C C . SER A 1 13 ? 26.758 19.994 -19.311 1.00 77.97 13 A 1 ATOM 91 O O . SER A 1 13 ? 25.922 19.107 -19.485 1.00 75.49 13 A 1 ATOM 92 C CB . SER A 1 13 ? 27.768 21.233 -21.293 1.00 71.95 13 A 1 ATOM 93 O OG . SER A 1 13 ? 27.686 20.016 -21.998 1.00 62.36 13 A 1 ATOM 94 N N . LYS A 1 14 ? 27.680 19.896 -18.350 1.00 79.31 14 A 1 ATOM 95 C CA . LYS A 1 14 ? 27.859 18.687 -17.517 1.00 81.56 14 A 1 ATOM 96 C C . LYS A 1 14 ? 26.725 18.482 -16.504 1.00 82.80 14 A 1 ATOM 97 O O . LYS A 1 14 ? 26.306 17.348 -16.280 1.00 80.13 14 A 1 ATOM 98 C CB . LYS A 1 14 ? 29.230 18.725 -16.812 1.00 78.24 14 A 1 ATOM 99 C CG . LYS A 1 14 ? 30.400 18.534 -17.793 1.00 70.57 14 A 1 ATOM 100 C CD . LYS A 1 14 ? 31.748 18.518 -17.054 1.00 68.55 14 A 1 ATOM 101 C CE . LYS A 1 14 ? 32.899 18.350 -18.051 1.00 60.30 14 A 1 ATOM 102 N NZ . LYS A 1 14 ? 34.232 18.410 -17.392 1.00 53.82 14 A 1 ATOM 103 N N . THR A 1 15 ? 26.199 19.547 -15.915 1.00 78.45 15 A 1 ATOM 104 C CA . THR A 1 15 ? 25.071 19.493 -14.975 1.00 79.17 15 A 1 ATOM 105 C C . THR A 1 15 ? 23.770 19.095 -15.675 1.00 79.48 15 A 1 ATOM 106 O O . THR A 1 15 ? 23.046 18.237 -15.172 1.00 78.06 15 A 1 ATOM 107 C CB . THR A 1 15 ? 24.897 20.835 -14.252 1.00 76.98 15 A 1 ATOM 108 O OG1 . THR A 1 15 ? 25.211 21.905 -15.113 1.00 66.08 15 A 1 ATOM 109 C CG2 . THR A 1 15 ? 25.848 20.934 -13.055 1.00 67.11 15 A 1 ATOM 110 N N . CYS A 1 16 ? 23.514 19.620 -16.873 1.00 78.41 16 A 1 ATOM 111 C CA . CYS A 1 16 ? 22.318 19.289 -17.644 1.00 79.84 16 A 1 ATOM 112 C C . CYS A 1 16 ? 22.298 17.822 -18.111 1.00 80.74 16 A 1 ATOM 113 O O . CYS A 1 16 ? 21.279 17.139 -18.005 1.00 78.61 16 A 1 ATOM 114 C CB . CYS A 1 16 ? 22.225 20.275 -18.823 1.00 75.80 16 A 1 ATOM 115 S SG . CYS A 1 16 ? 20.579 20.207 -19.559 1.00 64.83 16 A 1 ATOM 116 N N . THR A 1 17 ? 23.430 17.288 -18.552 1.00 80.87 17 A 1 ATOM 117 C CA . THR A 1 17 ? 23.546 15.871 -18.959 1.00 81.21 17 A 1 ATOM 118 C C . THR A 1 17 ? 23.406 14.920 -17.767 1.00 81.05 17 A 1 ATOM 119 O O . THR A 1 17 ? 22.734 13.891 -17.886 1.00 80.98 17 A 1 ATOM 120 C CB . THR A 1 17 ? 24.873 15.603 -19.687 1.00 81.55 17 A 1 ATOM 121 O OG1 . THR A 1 17 ? 25.949 16.167 -18.989 1.00 74.33 17 A 1 ATOM 122 C CG2 . THR A 1 17 ? 24.871 16.200 -21.090 1.00 72.19 17 A 1 ATOM 123 N N . HIS A 1 18 ? 23.943 15.270 -16.603 1.00 80.97 18 A 1 ATOM 124 C CA . HIS A 1 18 ? 23.798 14.487 -15.375 1.00 81.00 18 A 1 ATOM 125 C C . HIS A 1 18 ? 22.345 14.482 -14.868 1.00 80.61 18 A 1 ATOM 126 O O . HIS A 1 18 ? 21.810 13.422 -14.541 1.00 80.66 18 A 1 ATOM 127 C CB . HIS A 1 18 ? 24.773 15.035 -14.321 1.00 80.74 18 A 1 ATOM 128 C CG . HIS A 1 18 ? 24.945 14.097 -13.146 1.00 73.26 18 A 1 ATOM 129 N ND1 . HIS A 1 18 ? 24.294 14.167 -11.939 1.00 65.13 18 A 1 ATOM 130 C CD2 . HIS A 1 18 ? 25.798 13.027 -13.079 1.00 63.36 18 A 1 ATOM 131 C CE1 . HIS A 1 18 ? 24.745 13.166 -11.154 1.00 63.39 18 A 1 ATOM 132 N NE2 . HIS A 1 18 ? 25.659 12.442 -11.816 1.00 66.63 18 A 1 ATOM 133 N N . LEU A 1 19 ? 21.662 15.626 -14.893 1.00 76.72 19 A 1 ATOM 134 C CA . LEU A 1 19 ? 20.244 15.733 -14.522 1.00 74.07 19 A 1 ATOM 135 C C . LEU A 1 19 ? 19.344 14.910 -15.460 1.00 74.41 19 A 1 ATOM 136 O O . LEU A 1 19 ? 18.475 14.166 -15.009 1.00 74.55 19 A 1 ATOM 137 C CB . LEU A 1 19 ? 19.826 17.220 -14.520 1.00 74.11 19 A 1 ATOM 138 C CG . LEU A 1 19 ? 18.953 17.588 -13.295 1.00 67.39 19 A 1 ATOM 139 C CD1 . LEU A 1 19 ? 19.754 18.493 -12.353 1.00 61.27 19 A 1 ATOM 140 C CD2 . LEU A 1 19 ? 17.684 18.322 -13.708 1.00 63.81 19 A 1 ATOM 141 N N . LYS A 1 20 ? 19.595 14.962 -16.771 1.00 77.03 20 A 1 ATOM 142 C CA . LYS A 1 20 ? 18.853 14.193 -17.775 1.00 76.98 20 A 1 ATOM 143 C C . LYS A 1 20 ? 19.044 12.681 -17.596 1.00 76.57 20 A 1 ATOM 144 O O . LYS A 1 20 ? 18.089 11.923 -17.771 1.00 77.31 20 A 1 ATOM 145 C CB . LYS A 1 20 ? 19.271 14.675 -19.173 1.00 77.16 20 A 1 ATOM 146 C CG . LYS A 1 20 ? 18.336 14.166 -20.278 1.00 71.10 20 A 1 ATOM 147 C CD . LYS A 1 20 ? 18.703 14.810 -21.629 1.00 68.71 20 A 1 ATOM 148 C CE . LYS A 1 20 ? 17.705 14.399 -22.722 1.00 61.43 20 A 1 ATOM 149 N NZ . LYS A 1 20 ? 17.990 15.088 -24.007 1.00 55.44 20 A 1 ATOM 150 N N . LYS A 1 21 ? 20.226 12.247 -17.194 1.00 82.16 21 A 1 ATOM 151 C CA . LYS A 1 21 ? 20.516 10.843 -16.871 1.00 83.23 21 A 1 ATOM 152 C C . LYS A 1 21 ? 19.754 10.390 -15.619 1.00 82.62 21 A 1 ATOM 153 O O . LYS A 1 21 ? 19.067 9.376 -15.686 1.00 80.88 21 A 1 ATOM 154 C CB . LYS A 1 21 ? 22.031 10.648 -16.745 1.00 83.43 21 A 1 ATOM 155 C CG . LYS A 1 21 ? 22.384 9.162 -16.620 1.00 78.81 21 A 1 ATOM 156 C CD . LYS A 1 21 ? 23.905 8.948 -16.552 1.00 76.81 21 A 1 ATOM 157 C CE . LYS A 1 21 ? 24.174 7.447 -16.389 1.00 68.60 21 A 1 ATOM 158 N NZ . LYS A 1 21 ? 25.625 7.145 -16.263 1.00 63.04 21 A 1 ATOM 159 N N . ILE A 1 22 ? 19.772 11.176 -14.541 1.00 82.24 22 A 1 ATOM 160 C CA . ILE A 1 22 ? 19.023 10.884 -13.310 1.00 80.89 22 A 1 ATOM 161 C C . ILE A 1 22 ? 17.520 10.781 -13.592 1.00 81.67 22 A 1 ATOM 162 O O . ILE A 1 22 ? 16.885 9.804 -13.197 1.00 80.03 22 A 1 ATOM 163 C CB . ILE A 1 22 ? 19.326 11.957 -12.226 1.00 81.46 22 A 1 ATOM 164 C CG1 . ILE A 1 22 ? 20.792 11.834 -11.748 1.00 75.25 22 A 1 ATOM 165 C CG2 . ILE A 1 22 ? 18.376 11.823 -11.026 1.00 73.14 22 A 1 ATOM 166 C CD1 . ILE A 1 22 ? 21.268 13.029 -10.920 1.00 68.03 22 A 1 ATOM 167 N N . ILE A 1 23 ? 16.941 11.720 -14.329 1.00 81.19 23 A 1 ATOM 168 C CA . ILE A 1 23 ? 15.514 11.695 -14.692 1.00 79.62 23 A 1 ATOM 169 C C . ILE A 1 23 ? 15.192 10.438 -15.507 1.00 80.15 23 A 1 ATOM 170 O O . ILE A 1 23 ? 14.205 9.763 -15.214 1.00 79.55 23 A 1 ATOM 171 C CB . ILE A 1 23 ? 15.115 12.995 -15.431 1.00 78.94 23 A 1 ATOM 172 C CG1 . ILE A 1 23 ? 15.183 14.195 -14.464 1.00 73.75 23 A 1 ATOM 173 C CG2 . ILE A 1 23 ? 13.692 12.882 -16.017 1.00 71.00 23 A 1 ATOM 174 C CD1 . ILE A 1 23 ? 15.128 15.560 -15.166 1.00 66.31 23 A 1 ATOM 175 N N . LYS A 1 24 ? 16.030 10.068 -16.479 1.00 82.51 24 A 1 ATOM 176 C CA . LYS A 1 24 ? 15.820 8.876 -17.305 1.00 83.12 24 A 1 ATOM 177 C C . LYS A 1 24 ? 15.885 7.579 -16.479 1.00 83.14 24 A 1 ATOM 178 O O . LYS A 1 24 ? 14.988 6.754 -16.594 1.00 81.70 24 A 1 ATOM 179 C CB . LYS A 1 24 ? 16.827 8.887 -18.470 1.00 82.67 24 A 1 ATOM 180 C CG . LYS A 1 24 ? 16.490 7.811 -19.511 1.00 77.08 24 A 1 ATOM 181 C CD . LYS A 1 24 ? 17.464 7.891 -20.703 1.00 73.50 24 A 1 ATOM 182 C CE . LYS A 1 24 ? 17.097 6.801 -21.715 1.00 65.64 24 A 1 ATOM 183 N NZ . LYS A 1 24 ? 18.022 6.790 -22.893 1.00 59.31 24 A 1 ATOM 184 N N . ASP A 1 25 ? 16.867 7.447 -15.602 1.00 83.81 25 A 1 ATOM 185 C CA . ASP A 1 25 ? 17.078 6.244 -14.780 1.00 85.01 25 A 1 ATOM 186 C C . ASP A 1 25 ? 15.998 6.079 -13.692 1.00 85.40 25 A 1 ATOM 187 O O . ASP A 1 25 ? 15.641 4.957 -13.325 1.00 81.77 25 A 1 ATOM 188 C CB . ASP A 1 25 ? 18.485 6.308 -14.146 1.00 83.60 25 A 1 ATOM 189 C CG . ASP A 1 25 ? 19.638 6.139 -15.159 1.00 77.74 25 A 1 ATOM 190 O OD1 . ASP A 1 25 ? 19.373 5.723 -16.313 1.00 73.30 25 A 1 ATOM 191 O OD2 . ASP A 1 25 ? 20.798 6.417 -14.773 1.00 73.22 25 A 1 ATOM 192 N N . HIS A 1 26 ? 15.416 7.183 -13.192 1.00 82.10 26 A 1 ATOM 193 C CA . HIS A 1 26 ? 14.371 7.151 -12.166 1.00 81.89 26 A 1 ATOM 194 C C . HIS A 1 26 ? 12.944 7.233 -12.712 1.00 82.40 26 A 1 ATOM 195 O O . HIS A 1 26 ? 12.020 6.810 -12.012 1.00 79.71 26 A 1 ATOM 196 C CB . HIS A 1 26 ? 14.667 8.213 -11.097 1.00 81.60 26 A 1 ATOM 197 C CG . HIS A 1 26 ? 15.849 7.830 -10.240 1.00 78.61 26 A 1 ATOM 198 N ND1 . HIS A 1 26 ? 15.839 6.919 -9.209 1.00 67.81 26 A 1 ATOM 199 C CD2 . HIS A 1 26 ? 17.150 8.267 -10.368 1.00 69.13 26 A 1 ATOM 200 C CE1 . HIS A 1 26 ? 17.094 6.821 -8.721 1.00 68.34 26 A 1 ATOM 201 N NE2 . HIS A 1 26 ? 17.923 7.613 -9.406 1.00 71.46 26 A 1 ATOM 202 N N . SER A 1 27 ? 12.712 7.688 -13.953 1.00 82.94 27 A 1 ATOM 203 C CA . SER A 1 27 ? 11.369 7.822 -14.528 1.00 83.89 27 A 1 ATOM 204 C C . SER A 1 27 ? 10.593 6.499 -14.546 1.00 84.19 27 A 1 ATOM 205 O O . SER A 1 27 ? 9.416 6.479 -14.175 1.00 80.12 27 A 1 ATOM 206 C CB . SER A 1 27 ? 11.418 8.418 -15.939 1.00 80.40 27 A 1 ATOM 207 O OG . SER A 1 27 ? 12.092 7.572 -16.860 1.00 67.61 27 A 1 ATOM 208 N N . GLY A 1 28 ? 11.246 5.381 -14.862 1.00 85.40 28 A 1 ATOM 209 C CA . GLY A 1 28 ? 10.626 4.053 -14.855 1.00 87.64 28 A 1 ATOM 210 C C . GLY A 1 28 ? 10.191 3.621 -13.453 1.00 89.24 28 A 1 ATOM 211 O O . GLY A 1 28 ? 9.075 3.136 -13.272 1.00 85.80 28 A 1 ATOM 212 N N . LYS A 1 29 ? 11.028 3.868 -12.438 1.00 85.42 29 A 1 ATOM 213 C CA . LYS A 1 29 ? 10.731 3.532 -11.033 1.00 87.00 29 A 1 ATOM 214 C C . LYS A 1 29 ? 9.572 4.369 -10.478 1.00 87.72 29 A 1 ATOM 215 O O . LYS A 1 29 ? 8.696 3.833 -9.824 1.00 85.15 29 A 1 ATOM 216 C CB . LYS A 1 29 ? 11.981 3.705 -10.164 1.00 86.02 29 A 1 ATOM 217 C CG . LYS A 1 29 ? 13.106 2.733 -10.548 1.00 81.71 29 A 1 ATOM 218 C CD . LYS A 1 29 ? 14.314 2.924 -9.610 1.00 77.48 29 A 1 ATOM 219 C CE . LYS A 1 29 ? 15.457 1.987 -10.014 1.00 69.52 29 A 1 ATOM 220 N NZ . LYS A 1 29 ? 16.666 2.189 -9.176 1.00 63.80 29 A 1 ATOM 221 N N . VAL A 1 30 ? 9.545 5.664 -10.790 1.00 82.90 30 A 1 ATOM 222 C CA . VAL A 1 30 ? 8.455 6.573 -10.400 1.00 85.58 30 A 1 ATOM 223 C C . VAL A 1 30 ? 7.140 6.140 -11.051 1.00 87.63 30 A 1 ATOM 224 O O . VAL A 1 30 ? 6.117 6.096 -10.382 1.00 85.81 30 A 1 ATOM 225 C CB . VAL A 1 30 ? 8.808 8.027 -10.756 1.00 82.68 30 A 1 ATOM 226 C CG1 . VAL A 1 30 ? 7.641 8.998 -10.506 1.00 74.38 30 A 1 ATOM 227 C CG2 . VAL A 1 30 ? 9.990 8.517 -9.906 1.00 75.87 30 A 1 ATOM 228 N N . LEU A 1 31 ? 7.157 5.737 -12.318 1.00 82.34 31 A 1 ATOM 229 C CA . LEU A 1 31 ? 5.959 5.302 -13.043 1.00 84.34 31 A 1 ATOM 230 C C . LEU A 1 31 ? 5.403 3.972 -12.491 1.00 86.70 31 A 1 ATOM 231 O O . LEU A 1 31 ? 4.189 3.806 -12.393 1.00 88.76 31 A 1 ATOM 232 C CB . LEU A 1 31 ? 6.313 5.256 -14.536 1.00 84.04 31 A 1 ATOM 233 C CG . LEU A 1 31 ? 5.100 5.352 -15.474 1.00 74.56 31 A 1 ATOM 234 C CD1 . LEU A 1 31 ? 5.448 6.219 -16.685 1.00 68.69 31 A 1 ATOM 235 C CD2 . LEU A 1 31 ? 4.666 3.983 -15.990 1.00 68.92 31 A 1 ATOM 236 N N . ILE A 1 32 ? 6.274 3.048 -12.066 1.00 86.76 32 A 1 ATOM 237 C CA . ILE A 1 32 ? 5.879 1.815 -11.374 1.00 88.54 32 A 1 ATOM 238 C C . ILE A 1 32 ? 5.255 2.142 -10.011 1.00 89.70 32 A 1 ATOM 239 O O . ILE A 1 32 ? 4.176 1.633 -9.705 1.00 90.18 32 A 1 ATOM 240 C CB . ILE A 1 32 ? 7.084 0.853 -11.240 1.00 88.73 32 A 1 ATOM 241 C CG1 . ILE A 1 32 ? 7.502 0.328 -12.631 1.00 83.59 32 A 1 ATOM 242 C CG2 . ILE A 1 32 ? 6.750 -0.338 -10.321 1.00 80.70 32 A 1 ATOM 243 C CD1 . ILE A 1 32 ? 8.902 -0.299 -12.663 1.00 72.60 32 A 1 ATOM 244 N N . ALA A 1 33 ? 5.866 3.020 -9.215 1.00 87.77 33 A 1 ATOM 245 C CA . ALA A 1 33 ? 5.324 3.444 -7.928 1.00 88.65 33 A 1 ATOM 246 C C . ALA A 1 33 ? 3.940 4.091 -8.076 1.00 90.05 33 A 1 ATOM 247 O O . ALA A 1 33 ? 3.023 3.767 -7.324 1.00 89.31 33 A 1 ATOM 248 C CB . ALA A 1 33 ? 6.327 4.397 -7.264 1.00 88.52 33 A 1 ATOM 249 N N . LEU A 1 34 ? 3.750 4.924 -9.087 1.00 85.71 34 A 1 ATOM 250 C CA . LEU A 1 34 ? 2.476 5.591 -9.358 1.00 85.38 34 A 1 ATOM 251 C C . LEU A 1 34 ? 1.375 4.592 -9.748 1.00 86.85 34 A 1 ATOM 252 O O . LEU A 1 34 ? 0.249 4.697 -9.275 1.00 88.37 34 A 1 ATOM 253 C CB . LEU A 1 34 ? 2.710 6.664 -10.434 1.00 85.58 34 A 1 ATOM 254 C CG . LEU A 1 34 ? 1.751 7.868 -10.303 1.00 77.97 34 A 1 ATOM 255 C CD1 . LEU A 1 34 ? 2.561 9.167 -10.196 1.00 70.18 34 A 1 ATOM 256 C CD2 . LEU A 1 34 ? 0.829 7.988 -11.510 1.00 72.74 34 A 1 ATOM 257 N N . LYS A 1 35 ? 1.707 3.554 -10.536 1.00 88.58 35 A 1 ATOM 258 C CA . LYS A 1 35 ? 0.780 2.444 -10.853 1.00 87.14 35 A 1 ATOM 259 C C . LYS A 1 35 ? 0.388 1.639 -9.613 1.00 88.51 35 A 1 ATOM 260 O O . LYS A 1 35 ? -0.776 1.278 -9.475 1.00 89.18 35 A 1 ATOM 261 C CB . LYS A 1 35 ? 1.402 1.509 -11.903 1.00 87.78 35 A 1 ATOM 262 C CG . LYS A 1 35 ? 1.363 2.114 -13.307 1.00 83.29 35 A 1 ATOM 263 C CD . LYS A 1 35 ? 1.955 1.125 -14.317 1.00 76.61 35 A 1 ATOM 264 C CE . LYS A 1 35 ? 1.860 1.698 -15.738 1.00 70.49 35 A 1 ATOM 265 N NZ . LYS A 1 35 ? 2.307 0.709 -16.754 1.00 62.68 35 A 1 ATOM 266 N N . LEU A 1 36 ? 1.323 1.371 -8.696 1.00 89.39 36 A 1 ATOM 267 C CA . LEU A 1 36 ? 1.048 0.673 -7.443 1.00 89.41 36 A 1 ATOM 268 C C . LEU A 1 36 ? 0.137 1.489 -6.521 1.00 90.45 36 A 1 ATOM 269 O O . LEU A 1 36 ? -0.808 0.944 -5.965 1.00 91.12 36 A 1 ATOM 270 C CB . LEU A 1 36 ? 2.368 0.339 -6.729 1.00 90.88 36 A 1 ATOM 271 C CG . LEU A 1 36 ? 3.187 -0.779 -7.397 1.00 85.15 36 A 1 ATOM 272 C CD1 . LEU A 1 36 ? 4.565 -0.873 -6.737 1.00 77.42 36 A 1 ATOM 273 C CD2 . LEU A 1 36 ? 2.505 -2.136 -7.261 1.00 79.06 36 A 1 ATOM 274 N N . ILE A 1 37 ? 0.363 2.791 -6.399 1.00 88.85 37 A 1 ATOM 275 C CA . ILE A 1 37 ? -0.501 3.697 -5.627 1.00 89.28 37 A 1 ATOM 276 C C . ILE A 1 37 ? -1.917 3.696 -6.196 1.00 90.38 37 A 1 ATOM 277 O O . ILE A 1 37 ? -2.880 3.559 -5.446 1.00 89.84 37 A 1 ATOM 278 C CB . ILE A 1 37 ? 0.110 5.119 -5.579 1.00 90.53 37 A 1 ATOM 279 C CG1 . ILE A 1 37 ? 1.412 5.119 -4.747 1.00 90.77 37 A 1 ATOM 280 C CG2 . ILE A 1 37 ? -0.891 6.129 -4.991 1.00 87.18 37 A 1 ATOM 281 C CD1 . ILE A 1 37 ? 2.280 6.365 -4.952 1.00 81.73 37 A 1 ATOM 282 N N . LEU A 1 38 ? -2.068 3.778 -7.520 1.00 89.01 38 A 1 ATOM 283 C CA . LEU A 1 38 ? -3.376 3.738 -8.166 1.00 87.42 38 A 1 ATOM 284 C C . LEU A 1 38 ? -4.105 2.412 -7.897 1.00 87.76 38 A 1 ATOM 285 O O . LEU A 1 38 ? -5.288 2.414 -7.563 1.00 89.99 38 A 1 ATOM 286 C CB . LEU A 1 38 ? -3.188 3.983 -9.676 1.00 88.96 38 A 1 ATOM 287 C CG . LEU A 1 38 ? -4.502 4.411 -10.371 1.00 80.07 38 A 1 ATOM 288 C CD1 . LEU A 1 38 ? -4.759 5.909 -10.170 1.00 71.44 38 A 1 ATOM 289 C CD2 . LEU A 1 38 ? -4.417 4.144 -11.870 1.00 75.06 38 A 1 ATOM 290 N N . ALA A 1 39 ? -3.403 1.266 -7.969 1.00 91.71 39 A 1 ATOM 291 C CA . ALA A 1 39 ? -3.958 -0.053 -7.672 1.00 91.03 39 A 1 ATOM 292 C C . ALA A 1 39 ? -4.393 -0.191 -6.197 1.00 91.66 39 A 1 ATOM 293 O O . ALA A 1 39 ? -5.438 -0.770 -5.909 1.00 90.41 39 A 1 ATOM 294 C CB . ALA A 1 39 ? -2.921 -1.116 -8.050 1.00 92.06 39 A 1 ATOM 295 N N . LEU A 1 40 ? -3.633 0.373 -5.252 1.00 89.74 40 A 1 ATOM 296 C CA . LEU A 1 40 ? -4.010 0.401 -3.837 1.00 89.31 40 A 1 ATOM 297 C C . LEU A 1 40 ? -5.261 1.249 -3.605 1.00 88.92 40 A 1 ATOM 298 O O . LEU A 1 40 ? -6.173 0.809 -2.915 1.00 88.73 40 A 1 ATOM 299 C CB . LEU A 1 40 ? -2.835 0.915 -2.999 1.00 90.87 40 A 1 ATOM 300 C CG . LEU A 1 40 ? -1.685 -0.100 -2.839 1.00 86.75 40 A 1 ATOM 301 C CD1 . LEU A 1 40 ? -0.482 0.591 -2.201 1.00 78.17 40 A 1 ATOM 302 C CD2 . LEU A 1 40 ? -2.086 -1.281 -1.955 1.00 80.68 40 A 1 ATOM 303 N N . LEU A 1 41 ? -5.354 2.425 -4.223 1.00 89.19 41 A 1 ATOM 304 C CA . LEU A 1 41 ? -6.531 3.288 -4.109 1.00 88.71 41 A 1 ATOM 305 C C . LEU A 1 41 ? -7.796 2.600 -4.636 1.00 88.92 41 A 1 ATOM 306 O O . LEU A 1 41 ? -8.828 2.632 -3.976 1.00 88.38 41 A 1 ATOM 307 C CB . LEU A 1 41 ? -6.282 4.610 -4.850 1.00 90.16 41 A 1 ATOM 308 C CG . LEU A 1 41 ? -5.294 5.561 -4.143 1.00 89.78 41 A 1 ATOM 309 C CD1 . LEU A 1 41 ? -4.966 6.733 -5.070 1.00 80.61 41 A 1 ATOM 310 C CD2 . LEU A 1 41 ? -5.849 6.119 -2.837 1.00 82.80 41 A 1 ATOM 311 N N . THR A 1 42 ? -7.712 1.903 -5.779 1.00 88.52 42 A 1 ATOM 312 C CA . THR A 1 42 ? -8.852 1.133 -6.309 1.00 87.38 42 A 1 ATOM 313 C C . THR A 1 42 ? -9.232 -0.041 -5.400 1.00 87.25 42 A 1 ATOM 314 O O . THR A 1 42 ? -10.413 -0.310 -5.216 1.00 85.83 42 A 1 ATOM 315 C CB . THR A 1 42 ? -8.597 0.628 -7.731 1.00 88.59 42 A 1 ATOM 316 O OG1 . THR A 1 42 ? -7.415 -0.127 -7.831 1.00 82.81 42 A 1 ATOM 317 C CG2 . THR A 1 42 ? -8.486 1.767 -8.738 1.00 78.67 42 A 1 ATOM 318 N N . PHE A 1 43 ? -8.273 -0.708 -4.770 1.00 82.84 43 A 1 ATOM 319 C CA . PHE A 1 43 ? -8.554 -1.774 -3.807 1.00 82.03 43 A 1 ATOM 320 C C . PHE A 1 43 ? -9.281 -1.243 -2.561 1.00 82.18 43 A 1 ATOM 321 O O . PHE A 1 43 ? -10.259 -1.843 -2.114 1.00 81.36 43 A 1 ATOM 322 C CB . PHE A 1 43 ? -7.241 -2.465 -3.438 1.00 82.99 43 A 1 ATOM 323 C CG . PHE A 1 43 ? -7.444 -3.618 -2.480 1.00 83.38 43 A 1 ATOM 324 C CD1 . PHE A 1 43 ? -7.268 -3.429 -1.095 1.00 76.30 43 A 1 ATOM 325 C CD2 . PHE A 1 43 ? -7.846 -4.874 -2.967 1.00 77.90 43 A 1 ATOM 326 C CE1 . PHE A 1 43 ? -7.491 -4.494 -0.210 1.00 75.83 43 A 1 ATOM 327 C CE2 . PHE A 1 43 ? -8.072 -5.935 -2.081 1.00 76.22 43 A 1 ATOM 328 C CZ . PHE A 1 43 ? -7.889 -5.744 -0.700 1.00 77.99 43 A 1 ATOM 329 N N . PHE A 1 44 ? -8.865 -0.101 -2.024 1.00 80.62 44 A 1 ATOM 330 C CA . PHE A 1 44 ? -9.530 0.533 -0.890 1.00 80.06 44 A 1 ATOM 331 C C . PHE A 1 44 ? -10.957 0.971 -1.232 1.00 81.56 44 A 1 ATOM 332 O O . PHE A 1 44 ? -11.866 0.685 -0.457 1.00 79.93 44 A 1 ATOM 333 C CB . PHE A 1 44 ? -8.709 1.728 -0.378 1.00 79.55 44 A 1 ATOM 334 C CG . PHE A 1 44 ? -7.546 1.329 0.515 1.00 80.94 44 A 1 ATOM 335 C CD1 . PHE A 1 44 ? -7.796 0.731 1.765 1.00 72.21 44 A 1 ATOM 336 C CD2 . PHE A 1 44 ? -6.220 1.563 0.117 1.00 73.53 44 A 1 ATOM 337 C CE1 . PHE A 1 44 ? -6.732 0.349 2.590 1.00 70.63 44 A 1 ATOM 338 C CE2 . PHE A 1 44 ? -5.153 1.173 0.943 1.00 71.40 44 A 1 ATOM 339 C CZ . PHE A 1 44 ? -5.412 0.564 2.184 1.00 73.97 44 A 1 ATOM 340 N N . THR A 1 45 ? -11.194 1.584 -2.392 1.00 82.16 45 A 1 ATOM 341 C CA . THR A 1 45 ? -12.547 1.992 -2.796 1.00 82.13 45 A 1 ATOM 342 C C . THR A 1 45 ? -13.484 0.795 -2.956 1.00 81.53 45 A 1 ATOM 343 O O . THR A 1 45 ? -14.599 0.841 -2.454 1.00 80.43 45 A 1 ATOM 344 C CB . THR A 1 45 ? -12.549 2.827 -4.085 1.00 83.37 45 A 1 ATOM 345 O OG1 . THR A 1 45 ? -11.806 2.219 -5.105 1.00 79.24 45 A 1 ATOM 346 C CG2 . THR A 1 45 ? -11.946 4.212 -3.873 1.00 77.18 45 A 1 ATOM 347 N N . ILE A 1 46 ? -13.025 -0.313 -3.554 1.00 85.69 46 A 1 ATOM 348 C CA . ILE A 1 46 ? -13.808 -1.551 -3.664 1.00 86.03 46 A 1 ATOM 349 C C . ILE A 1 46 ? -14.136 -2.110 -2.276 1.00 85.50 46 A 1 ATOM 350 O O . ILE A 1 46 ? -15.286 -2.452 -1.999 1.00 82.97 46 A 1 ATOM 351 C CB . ILE A 1 46 ? -13.059 -2.586 -4.542 1.00 87.85 46 A 1 ATOM 352 C CG1 . ILE A 1 46 ? -12.997 -2.096 -6.014 1.00 87.99 46 A 1 ATOM 353 C CG2 . ILE A 1 46 ? -13.740 -3.966 -4.487 1.00 84.55 46 A 1 ATOM 354 C CD1 . ILE A 1 46 ? -11.970 -2.846 -6.868 1.00 79.97 46 A 1 ATOM 355 N N . THR A 1 47 ? -13.163 -2.169 -1.372 1.00 78.55 47 A 1 ATOM 356 C CA . THR A 1 47 ? -13.352 -2.699 -0.005 1.00 78.47 47 A 1 ATOM 357 C C . THR A 1 47 ? -14.361 -1.863 0.790 1.00 78.86 47 A 1 ATOM 358 O O . THR A 1 47 ? -15.228 -2.426 1.460 1.00 77.16 47 A 1 ATOM 359 C CB . THR A 1 47 ? -12.011 -2.743 0.741 1.00 80.12 47 A 1 ATOM 360 O OG1 . THR A 1 47 ? -11.078 -3.517 0.024 1.00 78.43 47 A 1 ATOM 361 C CG2 . THR A 1 47 ? -12.141 -3.397 2.113 1.00 76.74 47 A 1 ATOM 362 N N . ILE A 1 48 ? -14.294 -0.538 0.704 1.00 74.49 48 A 1 ATOM 363 C CA . ILE A 1 48 ? -15.248 0.372 1.350 1.00 75.02 48 A 1 ATOM 364 C C . ILE A 1 48 ? -16.652 0.161 0.779 1.00 74.51 48 A 1 ATOM 365 O O . ILE A 1 48 ? -17.601 0.039 1.547 1.00 72.72 48 A 1 ATOM 366 C CB . ILE A 1 48 ? -14.769 1.836 1.212 1.00 76.52 48 A 1 ATOM 367 C CG1 . ILE A 1 48 ? -13.486 2.059 2.054 1.00 78.25 48 A 1 ATOM 368 C CG2 . ILE A 1 48 ? -15.862 2.825 1.664 1.00 73.62 48 A 1 ATOM 369 C CD1 . ILE A 1 48 ? -12.734 3.352 1.710 1.00 69.23 48 A 1 ATOM 370 N N . THR A 1 49 ? -16.788 0.041 -0.544 1.00 73.25 49 A 1 ATOM 371 C CA . THR A 1 49 ? -18.085 -0.174 -1.211 1.00 74.56 49 A 1 ATOM 372 C C . THR A 1 49 ? -18.729 -1.494 -0.788 1.00 75.58 49 A 1 ATOM 373 O O . THR A 1 49 ? -19.910 -1.523 -0.459 1.00 76.49 49 A 1 ATOM 374 C CB . THR A 1 49 ? -17.919 -0.126 -2.735 1.00 77.08 49 A 1 ATOM 375 O OG1 . THR A 1 49 ? -17.317 1.087 -3.130 1.00 74.00 49 A 1 ATOM 376 C CG2 . THR A 1 49 ? -19.254 -0.195 -3.469 1.00 72.56 49 A 1 ATOM 377 N N . ILE A 1 50 ? -17.968 -2.590 -0.712 1.00 81.33 50 A 1 ATOM 378 C CA . ILE A 1 50 ? -18.469 -3.893 -0.252 1.00 81.39 50 A 1 ATOM 379 C C . ILE A 1 50 ? -18.954 -3.812 1.203 1.00 80.43 50 A 1 ATOM 380 O O . ILE A 1 50 ? -20.024 -4.326 1.529 1.00 78.22 50 A 1 ATOM 381 C CB . ILE A 1 50 ? -17.381 -4.983 -0.425 1.00 83.95 50 A 1 ATOM 382 C CG1 . ILE A 1 50 ? -17.139 -5.259 -1.927 1.00 83.57 50 A 1 ATOM 383 C CG2 . ILE A 1 50 ? -17.777 -6.292 0.293 1.00 79.82 50 A 1 ATOM 384 C CD1 . ILE A 1 50 ? -15.868 -6.080 -2.204 1.00 75.08 50 A 1 ATOM 385 N N . ASN A 1 51 ? -18.199 -3.165 2.079 1.00 77.20 51 A 1 ATOM 386 C CA . ASN A 1 51 ? -18.596 -2.995 3.475 1.00 76.38 51 A 1 ATOM 387 C C . ASN A 1 51 ? -19.846 -2.115 3.609 1.00 76.62 51 A 1 ATOM 388 O O . ASN A 1 51 ? -20.709 -2.435 4.415 1.00 76.03 51 A 1 ATOM 389 C CB . ASN A 1 51 ? -17.419 -2.426 4.279 1.00 77.45 51 A 1 ATOM 390 C CG . ASN A 1 51 ? -16.364 -3.471 4.577 1.00 74.18 51 A 1 ATOM 391 O OD1 . ASN A 1 51 ? -16.622 -4.656 4.740 1.00 66.69 51 A 1 ATOM 392 N ND2 . ASN A 1 51 ? -15.120 -3.066 4.727 1.00 66.03 51 A 1 ATOM 393 N N . TYR A 1 52 ? -19.961 -1.061 2.807 1.00 74.24 52 A 1 ATOM 394 C CA . TYR A 1 52 ? -21.144 -0.208 2.771 1.00 74.25 52 A 1 ATOM 395 C C . TYR A 1 52 ? -22.401 -1.002 2.382 1.00 72.83 52 A 1 ATOM 396 O O . TYR A 1 52 ? -23.368 -1.009 3.138 1.00 72.37 52 A 1 ATOM 397 C CB . TYR A 1 52 ? -20.881 0.967 1.820 1.00 75.29 52 A 1 ATOM 398 C CG . TYR A 1 52 ? -22.050 1.918 1.736 1.00 74.72 52 A 1 ATOM 399 C CD1 . TYR A 1 52 ? -23.038 1.748 0.743 1.00 68.23 52 A 1 ATOM 400 C CD2 . TYR A 1 52 ? -22.195 2.948 2.688 1.00 67.64 52 A 1 ATOM 401 C CE1 . TYR A 1 52 ? -24.163 2.584 0.703 1.00 62.99 52 A 1 ATOM 402 C CE2 . TYR A 1 52 ? -23.327 3.792 2.662 1.00 66.61 52 A 1 ATOM 403 C CZ . TYR A 1 52 ? -24.314 3.600 1.670 1.00 66.42 52 A 1 ATOM 404 O OH . TYR A 1 52 ? -25.429 4.383 1.663 1.00 66.53 52 A 1 ATOM 405 N N . ILE A 1 53 ? -22.355 -1.775 1.292 1.00 76.30 53 A 1 ATOM 406 C CA . ILE A 1 53 ? -23.474 -2.622 0.836 1.00 77.22 53 A 1 ATOM 407 C C . ILE A 1 53 ? -23.853 -3.648 1.918 1.00 76.80 53 A 1 ATOM 408 O O . ILE A 1 53 ? -25.033 -3.898 2.169 1.00 75.43 53 A 1 ATOM 409 C CB . ILE A 1 53 ? -23.097 -3.325 -0.495 1.00 80.50 53 A 1 ATOM 410 C CG1 . ILE A 1 53 ? -22.954 -2.284 -1.631 1.00 81.08 53 A 1 ATOM 411 C CG2 . ILE A 1 53 ? -24.137 -4.393 -0.882 1.00 77.53 53 A 1 ATOM 412 C CD1 . ILE A 1 53 ? -22.264 -2.837 -2.890 1.00 73.73 53 A 1 ATOM 413 N N . LYS A 1 54 ? -22.877 -4.232 2.603 1.00 74.25 54 A 1 ATOM 414 C CA . LYS A 1 54 ? -23.128 -5.189 3.689 1.00 74.96 54 A 1 ATOM 415 C C . LYS A 1 54 ? -23.856 -4.541 4.875 1.00 73.20 54 A 1 ATOM 416 O O . LYS A 1 54 ? -24.753 -5.164 5.444 1.00 73.90 54 A 1 ATOM 417 C CB . LYS A 1 54 ? -21.792 -5.814 4.113 1.00 76.39 54 A 1 ATOM 418 C CG . LYS A 1 54 ? -21.995 -6.942 5.125 1.00 73.27 54 A 1 ATOM 419 C CD . LYS A 1 54 ? -20.655 -7.578 5.476 1.00 70.30 54 A 1 ATOM 420 C CE . LYS A 1 54 ? -20.881 -8.720 6.484 1.00 63.86 54 A 1 ATOM 421 N NZ . LYS A 1 54 ? -19.601 -9.352 6.870 1.00 58.62 54 A 1 ATOM 422 N N . VAL A 1 55 ? -23.488 -3.324 5.250 1.00 70.16 55 A 1 ATOM 423 C CA . VAL A 1 55 ? -24.157 -2.574 6.320 1.00 70.40 55 A 1 ATOM 424 C C . VAL A 1 55 ? -25.580 -2.199 5.905 1.00 69.36 55 A 1 ATOM 425 O O . VAL A 1 55 ? -26.497 -2.392 6.699 1.00 66.61 55 A 1 ATOM 426 C CB . VAL A 1 55 ? -23.332 -1.336 6.721 1.00 69.15 55 A 1 ATOM 427 C CG1 . VAL A 1 55 ? -24.085 -0.402 7.679 1.00 62.52 55 A 1 ATOM 428 C CG2 . VAL A 1 55 ? -22.044 -1.771 7.442 1.00 61.92 55 A 1 ATOM 429 N N . GLU A 1 56 ? -25.772 -1.745 4.687 1.00 70.72 56 A 1 ATOM 430 C CA . GLU A 1 56 ? -27.090 -1.376 4.155 1.00 73.99 56 A 1 ATOM 431 C C . GLU A 1 56 ? -28.049 -2.574 4.112 1.00 73.08 56 A 1 ATOM 432 O O . GLU A 1 56 ? -29.161 -2.493 4.631 1.00 72.50 56 A 1 ATOM 433 C CB . GLU A 1 56 ? -26.879 -0.727 2.780 1.00 74.83 56 A 1 ATOM 434 C CG . GLU A 1 56 ? -28.159 -0.077 2.230 1.00 66.87 56 A 1 ATOM 435 C CD . GLU A 1 56 ? -27.889 0.784 0.977 1.00 64.36 56 A 1 ATOM 436 O OE1 . GLU A 1 56 ? -28.768 1.608 0.644 1.00 55.78 56 A 1 ATOM 437 O OE2 . GLU A 1 56 ? -26.794 0.647 0.374 1.00 58.62 56 A 1 ATOM 438 N N . ASN A 1 57 ? -27.604 -3.736 3.641 1.00 75.37 57 A 1 ATOM 439 C CA . ASN A 1 57 ? -28.386 -4.975 3.652 1.00 75.15 57 A 1 ATOM 440 C C . ASN A 1 57 ? -28.760 -5.404 5.079 1.00 74.09 57 A 1 ATOM 441 O O . ASN A 1 57 ? -29.897 -5.799 5.339 1.00 73.51 57 A 1 ATOM 442 C CB . ASN A 1 57 ? -27.586 -6.088 2.953 1.00 76.11 57 A 1 ATOM 443 C CG . ASN A 1 57 ? -27.587 -5.976 1.436 1.00 70.88 57 A 1 ATOM 444 O OD1 . ASN A 1 57 ? -28.398 -5.320 0.817 1.00 65.47 57 A 1 ATOM 445 N ND2 . ASN A 1 57 ? -26.689 -6.670 0.770 1.00 64.31 57 A 1 ATOM 446 N N . ASN A 1 58 ? -27.833 -5.322 6.027 1.00 67.93 58 A 1 ATOM 447 C CA . ASN A 1 58 ? -28.123 -5.648 7.424 1.00 67.09 58 A 1 ATOM 448 C C . ASN A 1 58 ? -29.132 -4.671 8.046 1.00 65.32 58 A 1 ATOM 449 O O . ASN A 1 58 ? -30.003 -5.094 8.805 1.00 65.17 58 A 1 ATOM 450 C CB . ASN A 1 58 ? -26.807 -5.655 8.231 1.00 67.16 58 A 1 ATOM 451 C CG . ASN A 1 58 ? -25.944 -6.874 7.983 1.00 65.01 58 A 1 ATOM 452 O OD1 . ASN A 1 58 ? -26.361 -7.933 7.549 1.00 61.19 58 A 1 ATOM 453 N ND2 . ASN A 1 58 ? -24.678 -6.786 8.322 1.00 58.63 58 A 1 ATOM 454 N N . LEU A 1 59 ? -29.045 -3.390 7.704 1.00 71.32 59 A 1 ATOM 455 C CA . LEU A 1 59 ? -29.998 -2.372 8.153 1.00 70.87 59 A 1 ATOM 456 C C . LEU A 1 59 ? -31.402 -2.651 7.608 1.00 69.55 59 A 1 ATOM 457 O O . LEU A 1 59 ? -32.375 -2.599 8.360 1.00 68.20 59 A 1 ATOM 458 C CB . LEU A 1 59 ? -29.493 -0.994 7.694 1.00 71.55 59 A 1 ATOM 459 C CG . LEU A 1 59 ? -30.165 0.159 8.470 1.00 66.78 59 A 1 ATOM 460 C CD1 . LEU A 1 59 ? -29.341 0.529 9.702 1.00 61.08 59 A 1 ATOM 461 C CD2 . LEU A 1 59 ? -30.294 1.395 7.589 1.00 63.75 59 A 1 ATOM 462 N N . GLN A 1 60 ? -31.512 -3.040 6.342 1.00 69.10 60 A 1 ATOM 463 C CA . GLN A 1 60 ? -32.783 -3.389 5.699 1.00 71.06 60 A 1 ATOM 464 C C . GLN A 1 60 ? -33.423 -4.641 6.338 1.00 67.25 60 A 1 ATOM 465 O O . GLN A 1 60 ? -34.629 -4.667 6.579 1.00 67.73 60 A 1 ATOM 466 C CB . GLN A 1 60 ? -32.522 -3.572 4.198 1.00 72.95 60 A 1 ATOM 467 C CG . GLN A 1 60 ? -33.822 -3.535 3.381 1.00 68.70 60 A 1 ATOM 468 C CD . GLN A 1 60 ? -33.573 -3.621 1.881 1.00 67.68 60 A 1 ATOM 469 O OE1 . GLN A 1 60 ? -32.573 -4.115 1.402 1.00 61.69 60 A 1 ATOM 470 N NE2 . GLN A 1 60 ? -34.499 -3.159 1.071 1.00 58.89 60 A 1 ATOM 471 N N . ILE A 1 61 ? -32.624 -5.650 6.694 1.00 72.00 61 A 1 ATOM 472 C CA . ILE A 1 61 ? -33.085 -6.838 7.433 1.00 72.28 61 A 1 ATOM 473 C C . ILE A 1 61 ? -33.566 -6.461 8.844 1.00 68.98 61 A 1 ATOM 474 O O . ILE A 1 61 ? -34.570 -6.997 9.306 1.00 66.41 61 A 1 ATOM 475 C CB . ILE A 1 61 ? -31.957 -7.905 7.478 1.00 73.43 61 A 1 ATOM 476 C CG1 . ILE A 1 61 ? -31.703 -8.480 6.069 1.00 71.53 61 A 1 ATOM 477 C CG2 . ILE A 1 61 ? -32.312 -9.063 8.442 1.00 70.22 61 A 1 ATOM 478 C CD1 . ILE A 1 61 ? -30.376 -9.253 5.953 1.00 64.94 61 A 1 ATOM 479 N N . CYS A 1 62 ? -32.896 -5.548 9.528 1.00 70.14 62 A 1 ATOM 480 C CA . CYS A 1 62 ? -33.338 -5.070 10.838 1.00 68.87 62 A 1 ATOM 481 C C . CYS A 1 62 ? -34.649 -4.264 10.759 1.00 68.25 62 A 1 ATOM 482 O O . CYS A 1 62 ? -35.512 -4.456 11.603 1.00 64.65 62 A 1 ATOM 483 C CB . CYS A 1 62 ? -32.218 -4.233 11.483 1.00 68.17 62 A 1 ATOM 484 S SG . CYS A 1 62 ? -30.899 -5.325 12.093 1.00 62.58 62 A 1 ATOM 485 N N . GLN A 1 63 ? -34.825 -3.436 9.739 1.00 65.95 63 A 1 ATOM 486 C CA . GLN A 1 63 ? -36.069 -2.681 9.528 1.00 68.44 63 A 1 ATOM 487 C C . GLN A 1 63 ? -37.248 -3.615 9.228 1.00 65.40 63 A 1 ATOM 488 O O . GLN A 1 63 ? -38.298 -3.476 9.852 1.00 64.93 63 A 1 ATOM 489 C CB . GLN A 1 63 ? -35.864 -1.661 8.404 1.00 68.55 63 A 1 ATOM 490 C CG . GLN A 1 63 ? -35.027 -0.464 8.876 1.00 63.09 63 A 1 ATOM 491 C CD . GLN A 1 63 ? -34.717 0.538 7.757 1.00 62.61 63 A 1 ATOM 492 O OE1 . GLN A 1 63 ? -34.917 0.307 6.582 1.00 59.65 63 A 1 ATOM 493 N NE2 . GLN A 1 63 ? -34.198 1.696 8.091 1.00 55.88 63 A 1 ATOM 494 N N . SER A 1 64 ? -37.063 -4.637 8.386 1.00 69.98 64 A 1 ATOM 495 C CA . SER A 1 64 ? -38.121 -5.607 8.071 1.00 71.09 64 A 1 ATOM 496 C C . SER A 1 64 ? -38.561 -6.451 9.276 1.00 68.28 64 A 1 ATOM 497 O O . SER A 1 64 ? -39.728 -6.815 9.377 1.00 65.25 64 A 1 ATOM 498 C CB . SER A 1 64 ? -37.677 -6.523 6.924 1.00 69.76 64 A 1 ATOM 499 O OG . SER A 1 64 ? -36.571 -7.336 7.282 1.00 63.54 64 A 1 ATOM 500 N N . LYS A 1 65 ? -37.667 -6.712 10.243 1.00 65.74 65 A 1 ATOM 501 C CA . LYS A 1 65 ? -38.006 -7.402 11.499 1.00 66.95 65 A 1 ATOM 502 C C . LYS A 1 65 ? -38.753 -6.503 12.492 1.00 63.84 65 A 1 ATOM 503 O O . LYS A 1 65 ? -39.510 -7.012 13.298 1.00 62.84 65 A 1 ATOM 504 C CB . LYS A 1 65 ? -36.745 -7.962 12.158 1.00 65.30 65 A 1 ATOM 505 C CG . LYS A 1 65 ? -36.226 -9.192 11.408 1.00 59.99 65 A 1 ATOM 506 C CD . LYS A 1 65 ? -34.998 -9.748 12.128 1.00 58.78 65 A 1 ATOM 507 C CE . LYS A 1 65 ? -34.519 -11.015 11.420 1.00 53.60 65 A 1 ATOM 508 N NZ . LYS A 1 65 ? -33.427 -11.663 12.187 1.00 47.29 65 A 1 ATOM 509 N N . THR A 1 66 ? -38.552 -5.200 12.437 1.00 61.83 66 A 1 ATOM 510 C CA . THR A 1 66 ? -39.217 -4.254 13.347 1.00 63.85 66 A 1 ATOM 511 C C . THR A 1 66 ? -40.668 -3.964 12.918 1.00 62.09 66 A 1 ATOM 512 O O . THR A 1 66 ? -41.486 -3.613 13.763 1.00 58.96 66 A 1 ATOM 513 C CB . THR A 1 66 ? -38.404 -2.957 13.471 1.00 62.05 66 A 1 ATOM 514 O OG1 . THR A 1 66 ? -37.027 -3.230 13.641 1.00 55.68 66 A 1 ATOM 515 C CG2 . THR A 1 66 ? -38.800 -2.126 14.687 1.00 55.54 66 A 1 ATOM 516 N N . GLU A 1 67 ? -41.005 -4.145 11.655 1.00 63.42 67 A 1 ATOM 517 C CA . GLU A 1 67 ? -42.387 -4.055 11.160 1.00 63.78 67 A 1 ATOM 518 C C . GLU A 1 67 ? -43.211 -5.326 11.437 1.00 60.89 67 A 1 ATOM 519 O O . GLU A 1 67 ? -44.425 -5.230 11.594 1.00 58.54 67 A 1 ATOM 520 C CB . GLU A 1 67 ? -42.396 -3.695 9.662 1.00 62.45 67 A 1 ATOM 521 C CG . GLU A 1 67 ? -42.123 -2.198 9.447 1.00 53.95 67 A 1 ATOM 522 C CD . GLU A 1 67 ? -42.155 -1.763 7.970 1.00 53.32 67 A 1 ATOM 523 O OE1 . GLU A 1 67 ? -42.431 -0.559 7.730 1.00 49.50 67 A 1 ATOM 524 O OE2 . GLU A 1 67 ? -41.860 -2.598 7.089 1.00 50.96 67 A 1 ATOM 525 N N . SER A 1 68 ? -42.595 -6.518 11.587 1.00 56.94 68 A 1 ATOM 526 C CA . SER A 1 68 ? -43.322 -7.767 11.852 1.00 60.07 68 A 1 ATOM 527 C C . SER A 1 68 ? -43.821 -7.929 13.301 1.00 58.15 68 A 1 ATOM 528 O O . SER A 1 68 ? -44.657 -8.793 13.553 1.00 54.98 68 A 1 ATOM 529 C CB . SER A 1 68 ? -42.493 -8.991 11.437 1.00 57.55 68 A 1 ATOM 530 O OG . SER A 1 68 ? -41.292 -9.116 12.157 1.00 49.54 68 A 1 ATOM 531 N N . ASP A 1 69 ? -43.361 -7.119 14.243 1.00 57.37 69 A 1 ATOM 532 C CA . ASP A 1 69 ? -43.753 -7.194 15.658 1.00 57.81 69 A 1 ATOM 533 C C . ASP A 1 69 ? -44.965 -6.302 16.003 1.00 54.21 69 A 1 ATOM 534 O O . ASP A 1 69 ? -45.248 -6.072 17.182 1.00 52.39 69 A 1 ATOM 535 C CB . ASP A 1 69 ? -42.528 -6.921 16.556 1.00 55.58 69 A 1 ATOM 536 C CG . ASP A 1 69 ? -41.484 -8.046 16.578 1.00 49.47 69 A 1 ATOM 537 O OD1 . ASP A 1 69 ? -41.817 -9.194 16.225 1.00 47.29 69 A 1 ATOM 538 O OD2 . ASP A 1 69 ? -40.333 -7.757 16.992 1.00 47.90 69 A 1 ATOM 539 N N . LYS A 1 70 ? -45.705 -5.781 15.021 1.00 51.70 70 A 1 ATOM 540 C CA . LYS A 1 70 ? -46.793 -4.820 15.227 1.00 54.09 70 A 1 ATOM 541 C C . LYS A 1 70 ? -48.154 -5.181 14.630 1.00 50.19 70 A 1 ATOM 542 O O . LYS A 1 70 ? -48.955 -4.267 14.521 1.00 48.25 70 A 1 ATOM 543 C CB . LYS A 1 70 ? -46.336 -3.394 14.872 1.00 53.34 70 A 1 ATOM 544 C CG . LYS A 1 70 ? -45.818 -2.661 16.120 1.00 46.98 70 A 1 ATOM 545 C CD . LYS A 1 70 ? -45.694 -1.171 15.824 1.00 45.84 70 A 1 ATOM 546 C CE . LYS A 1 70 ? -45.194 -0.441 17.058 1.00 42.87 70 A 1 ATOM 547 N NZ . LYS A 1 70 ? -45.117 1.015 16.813 1.00 40.03 70 A 1 ATOM 548 N N . GLU A 1 71 ? -48.482 -6.447 14.334 1.00 44.61 71 A 1 ATOM 549 C CA . GLU A 1 71 ? -49.897 -6.781 14.067 1.00 47.14 71 A 1 ATOM 550 C C . GLU A 1 71 ? -50.224 -8.269 14.293 1.00 45.02 71 A 1 ATOM 551 O O . GLU A 1 71 ? -49.831 -9.153 13.527 1.00 42.86 71 A 1 ATOM 552 C CB . GLU A 1 71 ? -50.334 -6.269 12.678 1.00 46.63 71 A 1 ATOM 553 C CG . GLU A 1 71 ? -51.405 -5.163 12.827 1.00 40.48 71 A 1 ATOM 554 C CD . GLU A 1 71 ? -51.661 -4.362 11.535 1.00 38.28 71 A 1 ATOM 555 O OE1 . GLU A 1 71 ? -52.335 -3.303 11.652 1.00 35.70 71 A 1 ATOM 556 O OE2 . GLU A 1 71 ? -51.242 -4.800 10.448 1.00 38.32 71 A 1 ATOM 557 N N . ASP A 1 72 ? -51.005 -8.550 15.359 1.00 44.60 72 A 1 ATOM 558 C CA . ASP A 1 72 ? -51.837 -9.746 15.472 1.00 47.74 72 A 1 ATOM 559 C C . ASP A 1 72 ? -52.997 -9.653 14.467 1.00 46.08 72 A 1 ATOM 560 O O . ASP A 1 72 ? -53.988 -8.969 14.730 1.00 42.71 72 A 1 ATOM 561 C CB . ASP A 1 72 ? -52.420 -9.840 16.903 1.00 45.45 72 A 1 ATOM 562 C CG . ASP A 1 72 ? -51.500 -10.456 17.949 1.00 39.38 72 A 1 ATOM 563 O OD1 . ASP A 1 72 ? -50.846 -11.471 17.624 1.00 36.47 72 A 1 ATOM 564 O OD2 . ASP A 1 72 ? -51.517 -9.953 19.097 1.00 36.73 72 A 1 ATOM 565 N N . SER A 1 73 ? -52.935 -10.356 13.326 1.00 38.44 73 A 1 ATOM 566 C CA . SER A 1 73 ? -54.105 -10.933 12.636 1.00 43.02 73 A 1 ATOM 567 C C . SER A 1 73 ? -53.696 -11.771 11.415 1.00 41.16 73 A 1 ATOM 568 O O . SER A 1 73 ? -52.756 -11.407 10.716 1.00 38.20 73 A 1 ATOM 569 C CB . SER A 1 73 ? -55.103 -9.871 12.169 1.00 40.73 73 A 1 ATOM 570 O OG . SER A 1 73 ? -56.399 -10.447 12.087 1.00 34.91 73 A 1 ATOM 571 N N . PRO A 1 74 ? -54.374 -12.910 11.118 1.00 38.30 74 A 1 ATOM 572 C CA . PRO A 1 74 ? -53.927 -13.831 10.086 1.00 43.52 74 A 1 ATOM 573 C C . PRO A 1 74 ? -54.561 -13.500 8.726 1.00 44.35 74 A 1 ATOM 574 O O . PRO A 1 74 ? -55.766 -13.659 8.558 1.00 42.39 74 A 1 ATOM 575 C CB . PRO A 1 74 ? -54.363 -15.211 10.605 1.00 40.77 74 A 1 ATOM 576 C CG . PRO A 1 74 ? -55.672 -14.911 11.341 1.00 39.80 74 A 1 ATOM 577 C CD . PRO A 1 74 ? -55.528 -13.460 11.799 1.00 44.72 74 A 1 ATOM 578 N N . SER A 1 75 ? -53.762 -13.162 7.727 1.00 35.11 75 A 1 ATOM 579 C CA . SER A 1 75 ? -54.190 -13.328 6.332 1.00 39.95 75 A 1 ATOM 580 C C . SER A 1 75 ? -53.016 -13.375 5.352 1.00 38.57 75 A 1 ATOM 581 O O . SER A 1 75 ? -52.288 -12.419 5.158 1.00 34.96 75 A 1 ATOM 582 C CB . SER A 1 75 ? -55.221 -12.282 5.896 1.00 37.85 75 A 1 ATOM 583 O OG . SER A 1 75 ? -54.719 -10.973 5.966 1.00 33.54 75 A 1 ATOM 584 N N . ASN A 1 76 ? -52.902 -14.549 4.719 1.00 32.12 76 A 1 ATOM 585 C CA . ASN A 1 76 ? -52.510 -14.818 3.335 1.00 38.50 76 A 1 ATOM 586 C C . ASN A 1 76 ? -51.323 -14.071 2.699 1.00 37.29 76 A 1 ATOM 587 O O . ASN A 1 76 ? -51.432 -12.946 2.231 1.00 34.47 76 A 1 ATOM 588 C CB . ASN A 1 76 ? -53.781 -14.725 2.473 1.00 37.25 76 A 1 ATOM 589 C CG . ASN A 1 76 ? -54.800 -15.787 2.832 1.00 32.82 76 A 1 ATOM 590 O OD1 . ASN A 1 76 ? -54.507 -16.795 3.464 1.00 31.64 76 A 1 ATOM 591 N ND2 . ASN A 1 76 ? -56.035 -15.610 2.455 1.00 30.60 76 A 1 ATOM 592 N N . THR A 1 77 ? -50.271 -14.857 2.482 1.00 33.45 77 A 1 ATOM 593 C CA . THR A 1 77 ? -49.593 -15.072 1.203 1.00 38.90 77 A 1 ATOM 594 C C . THR A 1 77 ? -49.191 -13.833 0.389 1.00 38.42 77 A 1 ATOM 595 O O . THR A 1 77 ? -49.986 -13.296 -0.367 1.00 35.17 77 A 1 ATOM 596 C CB . THR A 1 77 ? -50.441 -15.998 0.300 1.00 35.61 77 A 1 ATOM 597 O OG1 . THR A 1 77 ? -51.064 -17.011 1.054 1.00 31.37 77 A 1 ATOM 598 C CG2 . THR A 1 77 ? -49.611 -16.721 -0.755 1.00 32.03 77 A 1 ATOM 599 N N . THR A 1 78 ? -47.904 -13.508 0.362 1.00 36.06 78 A 1 ATOM 600 C CA . THR A 1 78 ? -47.111 -13.536 -0.884 1.00 41.92 78 A 1 ATOM 601 C C . THR A 1 78 ? -45.623 -13.495 -0.518 1.00 42.04 78 A 1 ATOM 602 O O . THR A 1 78 ? -45.085 -12.478 -0.099 1.00 39.43 78 A 1 ATOM 603 C CB . THR A 1 78 ? -47.416 -12.389 -1.875 1.00 39.41 78 A 1 ATOM 604 O OG1 . THR A 1 78 ? -48.761 -12.409 -2.276 1.00 34.63 78 A 1 ATOM 605 C CG2 . THR A 1 78 ? -46.640 -12.553 -3.186 1.00 35.34 78 A 1 ATOM 606 N N . SER A 1 79 ? -44.950 -14.633 -0.678 1.00 33.20 79 A 1 ATOM 607 C CA . SER A 1 79 ? -43.492 -14.709 -0.669 1.00 37.13 79 A 1 ATOM 608 C C . SER A 1 79 ? -42.947 -13.978 -1.896 1.00 35.98 79 A 1 ATOM 609 O O . SER A 1 79 ? -42.921 -14.534 -2.992 1.00 33.45 79 A 1 ATOM 610 C CB . SER A 1 79 ? -43.070 -16.181 -0.668 1.00 35.42 79 A 1 ATOM 611 O OG . SER A 1 79 ? -43.730 -16.881 -1.705 1.00 31.31 79 A 1 ATOM 612 N N . VAL A 1 80 ? -42.495 -12.747 -1.728 1.00 34.19 80 A 1 ATOM 613 C CA . VAL A 1 80 ? -41.694 -12.074 -2.747 1.00 39.78 80 A 1 ATOM 614 C C . VAL A 1 80 ? -40.281 -12.661 -2.690 1.00 39.36 80 A 1 ATOM 615 O O . VAL A 1 80 ? -39.393 -12.184 -1.995 1.00 36.96 80 A 1 ATOM 616 C CB . VAL A 1 80 ? -41.735 -10.541 -2.626 1.00 37.53 80 A 1 ATOM 617 C CG1 . VAL A 1 80 ? -40.910 -9.875 -3.731 1.00 32.44 80 A 1 ATOM 618 C CG2 . VAL A 1 80 ? -43.171 -10.029 -2.759 1.00 33.79 80 A 1 ATOM 619 N N . THR A 1 81 ? -40.103 -13.757 -3.429 1.00 37.68 81 A 1 ATOM 620 C CA . THR A 1 81 ? -38.793 -14.318 -3.765 1.00 42.40 81 A 1 ATOM 621 C C . THR A 1 81 ? -38.111 -13.375 -4.757 1.00 41.99 81 A 1 ATOM 622 O O . THR A 1 81 ? -38.144 -13.581 -5.969 1.00 39.08 81 A 1 ATOM 623 C CB . THR A 1 81 ? -38.948 -15.740 -4.333 1.00 39.83 81 A 1 ATOM 624 O OG1 . THR A 1 81 ? -39.821 -16.501 -3.534 1.00 34.88 81 A 1 ATOM 625 C CG2 . THR A 1 81 ? -37.629 -16.496 -4.377 1.00 35.31 81 A 1 ATOM 626 N N . THR A 1 82 ? -37.519 -12.296 -4.282 1.00 37.86 82 A 1 ATOM 627 C CA . THR A 1 82 ? -36.682 -11.423 -5.113 1.00 41.59 82 A 1 ATOM 628 C C . THR A 1 82 ? -35.297 -12.055 -5.301 1.00 40.99 82 A 1 ATOM 629 O O . THR A 1 82 ? -34.379 -11.873 -4.524 1.00 38.00 82 A 1 ATOM 630 C CB . THR A 1 82 ? -36.620 -9.967 -4.615 1.00 39.46 82 A 1 ATOM 631 O OG1 . THR A 1 82 ? -37.160 -9.825 -3.319 1.00 35.15 82 A 1 ATOM 632 C CG2 . THR A 1 82 ? -37.437 -9.057 -5.526 1.00 35.90 82 A 1 ATOM 633 N N . LYS A 1 83 ? -35.222 -12.858 -6.368 1.00 36.67 83 A 1 ATOM 634 C CA . LYS A 1 83 ? -34.063 -13.143 -7.224 1.00 40.06 83 A 1 ATOM 635 C C . LYS A 1 83 ? -32.665 -12.957 -6.598 1.00 38.67 83 A 1 ATOM 636 O O . LYS A 1 83 ? -31.981 -11.962 -6.858 1.00 36.93 83 A 1 ATOM 637 C CB . LYS A 1 83 ? -34.205 -12.330 -8.522 1.00 39.16 83 A 1 ATOM 638 C CG . LYS A 1 83 ? -35.327 -12.853 -9.436 1.00 35.50 83 A 1 ATOM 639 C CD . LYS A 1 83 ? -35.440 -11.992 -10.700 1.00 33.59 83 A 1 ATOM 640 C CE . LYS A 1 83 ? -36.515 -12.564 -11.642 1.00 29.59 83 A 1 ATOM 641 N NZ . LYS A 1 83 ? -36.701 -11.717 -12.842 1.00 29.12 83 A 1 ATOM 642 N N . THR A 1 84 ? -32.176 -14.036 -5.985 1.00 39.63 84 A 1 ATOM 643 C CA . THR A 1 84 ? -30.755 -14.312 -5.684 1.00 43.27 84 A 1 ATOM 644 C C . THR A 1 84 ? -29.881 -14.625 -6.918 1.00 42.97 84 A 1 ATOM 645 O O . THR A 1 84 ? -28.741 -15.056 -6.771 1.00 40.28 84 A 1 ATOM 646 C CB . THR A 1 84 ? -30.676 -15.487 -4.691 1.00 40.10 84 A 1 ATOM 647 O OG1 . THR A 1 84 ? -31.652 -16.460 -5.007 1.00 36.34 84 A 1 ATOM 648 C CG2 . THR A 1 84 ? -30.936 -15.049 -3.250 1.00 36.41 84 A 1 ATOM 649 N N . THR A 1 85 ? -30.373 -14.430 -8.138 1.00 44.34 85 A 1 ATOM 650 C CA . THR A 1 85 ? -29.640 -14.810 -9.364 1.00 48.22 85 A 1 ATOM 651 C C . THR A 1 85 ? -28.662 -13.744 -9.858 1.00 47.29 85 A 1 ATOM 652 O O . THR A 1 85 ? -27.673 -14.091 -10.503 1.00 45.38 85 A 1 ATOM 653 C CB . THR A 1 85 ? -30.610 -15.197 -10.490 1.00 45.65 85 A 1 ATOM 654 O OG1 . THR A 1 85 ? -31.682 -14.281 -10.555 1.00 40.03 85 A 1 ATOM 655 C CG2 . THR A 1 85 ? -31.219 -16.586 -10.244 1.00 41.57 85 A 1 ATOM 656 N N . LEU A 1 86 ? -28.852 -12.474 -9.508 1.00 43.31 86 A 1 ATOM 657 C CA . LEU A 1 86 ? -27.927 -11.400 -9.918 1.00 44.54 86 A 1 ATOM 658 C C . LEU A 1 86 ? -26.602 -11.430 -9.133 1.00 46.71 86 A 1 ATOM 659 O O . LEU A 1 86 ? -25.549 -11.090 -9.665 1.00 43.54 86 A 1 ATOM 660 C CB . LEU A 1 86 ? -28.657 -10.047 -9.767 1.00 40.09 86 A 1 ATOM 661 C CG . LEU A 1 86 ? -27.965 -8.893 -10.504 1.00 34.05 86 A 1 ATOM 662 C CD1 . LEU A 1 86 ? -28.118 -9.005 -12.027 1.00 31.70 86 A 1 ATOM 663 C CD2 . LEU A 1 86 ? -28.585 -7.559 -10.069 1.00 35.08 86 A 1 ATOM 664 N N . ASP A 1 87 ? -26.644 -11.882 -7.885 1.00 50.17 87 A 1 ATOM 665 C CA . ASP A 1 87 ? -25.480 -11.902 -6.982 1.00 52.15 87 A 1 ATOM 666 C C . ASP A 1 87 ? -24.467 -12.997 -7.365 1.00 51.81 87 A 1 ATOM 667 O O . ASP A 1 87 ? -23.248 -12.813 -7.279 1.00 50.50 87 A 1 ATOM 668 C CB . ASP A 1 87 ? -26.018 -12.065 -5.555 1.00 50.18 87 A 1 ATOM 669 C CG . ASP A 1 87 ? -25.006 -11.664 -4.477 1.00 44.36 87 A 1 ATOM 670 O OD1 . ASP A 1 87 ? -24.136 -10.814 -4.770 1.00 41.77 87 A 1 ATOM 671 O OD2 . ASP A 1 87 ? -25.124 -12.213 -3.367 1.00 41.18 87 A 1 ATOM 672 N N . HIS A 1 88 ? -24.960 -14.142 -7.889 1.00 51.52 88 A 1 ATOM 673 C CA . HIS A 1 88 ? -24.098 -15.251 -8.287 1.00 55.33 88 A 1 ATOM 674 C C . HIS A 1 88 ? -23.236 -14.925 -9.530 1.00 54.94 88 A 1 ATOM 675 O O . HIS A 1 88 ? -22.044 -15.235 -9.539 1.00 53.38 88 A 1 ATOM 676 C CB . HIS A 1 88 ? -24.950 -16.505 -8.507 1.00 54.37 88 A 1 ATOM 677 C CG . HIS A 1 88 ? -24.108 -17.755 -8.577 1.00 50.30 88 A 1 ATOM 678 N ND1 . HIS A 1 88 ? -23.396 -18.300 -7.539 1.00 48.67 88 A 1 ATOM 679 C CD2 . HIS A 1 88 ? -23.899 -18.554 -9.667 1.00 46.60 88 A 1 ATOM 680 C CE1 . HIS A 1 88 ? -22.778 -19.397 -7.984 1.00 44.65 88 A 1 ATOM 681 N NE2 . HIS A 1 88 ? -23.049 -19.600 -9.282 1.00 46.14 88 A 1 ATOM 682 N N . ASP A 1 89 ? -23.804 -14.256 -10.530 1.00 54.46 89 A 1 ATOM 683 C CA . ASP A 1 89 ? -23.077 -13.885 -11.753 1.00 58.57 89 A 1 ATOM 684 C C . ASP A 1 89 ? -22.032 -12.793 -11.505 1.00 57.06 89 A 1 ATOM 685 O O . ASP A 1 89 ? -20.908 -12.877 -12.010 1.00 56.30 89 A 1 ATOM 686 C CB . ASP A 1 89 ? -24.071 -13.451 -12.845 1.00 57.69 89 A 1 ATOM 687 C CG . ASP A 1 89 ? -24.631 -14.613 -13.670 1.00 52.14 89 A 1 ATOM 688 O OD1 . ASP A 1 89 ? -24.035 -15.712 -13.643 1.00 49.60 89 A 1 ATOM 689 O OD2 . ASP A 1 89 ? -25.629 -14.368 -14.380 1.00 49.15 89 A 1 ATOM 690 N N . ILE A 1 90 ? -22.355 -11.808 -10.675 1.00 52.80 90 A 1 ATOM 691 C CA . ILE A 1 90 ? -21.418 -10.756 -10.270 1.00 55.33 90 A 1 ATOM 692 C C . ILE A 1 90 ? -20.268 -11.365 -9.447 1.00 55.04 90 A 1 ATOM 693 O O . ILE A 1 90 ? -19.099 -11.104 -9.723 1.00 54.01 90 A 1 ATOM 694 C CB . ILE A 1 90 ? -22.158 -9.628 -9.529 1.00 55.01 90 A 1 ATOM 695 C CG1 . ILE A 1 90 ? -23.106 -8.900 -10.515 1.00 51.48 90 A 1 ATOM 696 C CG2 . ILE A 1 90 ? -21.181 -8.624 -8.907 1.00 52.07 90 A 1 ATOM 697 C CD1 . ILE A 1 90 ? -24.027 -7.864 -9.862 1.00 48.79 90 A 1 ATOM 698 N N . THR A 1 91 ? -20.590 -12.260 -8.503 1.00 53.58 91 A 1 ATOM 699 C CA . THR A 1 91 ? -19.581 -12.952 -7.690 1.00 55.96 91 A 1 ATOM 700 C C . THR A 1 91 ? -18.677 -13.845 -8.540 1.00 55.71 91 A 1 ATOM 701 O O . THR A 1 91 ? -17.455 -13.831 -8.366 1.00 55.75 91 A 1 ATOM 702 C CB . THR A 1 91 ? -20.254 -13.769 -6.576 1.00 56.01 91 A 1 ATOM 703 O OG1 . THR A 1 91 ? -21.013 -12.909 -5.755 1.00 51.60 91 A 1 ATOM 704 C CG2 . THR A 1 91 ? -19.248 -14.437 -5.648 1.00 53.19 91 A 1 ATOM 705 N N . GLN A 1 92 ? -19.220 -14.585 -9.518 1.00 55.37 92 A 1 ATOM 706 C CA . GLN A 1 92 ? -18.411 -15.368 -10.457 1.00 59.84 92 A 1 ATOM 707 C C . GLN A 1 92 ? -17.544 -14.489 -11.363 1.00 59.11 92 A 1 ATOM 708 O O . GLN A 1 92 ? -16.389 -14.846 -11.624 1.00 59.88 92 A 1 ATOM 709 C CB . GLN A 1 92 ? -19.287 -16.257 -11.358 1.00 59.86 92 A 1 ATOM 710 C CG . GLN A 1 92 ? -19.561 -17.638 -10.759 1.00 57.41 92 A 1 ATOM 711 C CD . GLN A 1 92 ? -19.831 -18.702 -11.816 1.00 57.99 92 A 1 ATOM 712 O OE1 . GLN A 1 92 ? -19.623 -18.529 -13.014 1.00 52.82 92 A 1 ATOM 713 N NE2 . GLN A 1 92 ? -20.247 -19.882 -11.434 1.00 51.94 92 A 1 ATOM 714 N N . TYR A 1 93 ? -18.053 -13.362 -11.840 1.00 51.69 93 A 1 ATOM 715 C CA . TYR A 1 93 ? -17.296 -12.424 -12.658 1.00 53.61 93 A 1 ATOM 716 C C . TYR A 1 93 ? -16.092 -11.868 -11.888 1.00 52.34 93 A 1 ATOM 717 O O . TYR A 1 93 ? -14.961 -11.976 -12.372 1.00 53.51 93 A 1 ATOM 718 C CB . TYR A 1 93 ? -18.227 -11.312 -13.150 1.00 53.86 93 A 1 ATOM 719 C CG . TYR A 1 93 ? -17.523 -10.283 -14.005 1.00 50.33 93 A 1 ATOM 720 C CD1 . TYR A 1 93 ? -17.107 -9.056 -13.444 1.00 51.01 93 A 1 ATOM 721 C CD2 . TYR A 1 93 ? -17.263 -10.558 -15.358 1.00 50.02 93 A 1 ATOM 722 C CE1 . TYR A 1 93 ? -16.443 -8.107 -14.239 1.00 47.70 93 A 1 ATOM 723 C CE2 . TYR A 1 93 ? -16.594 -9.613 -16.157 1.00 50.37 93 A 1 ATOM 724 C CZ . TYR A 1 93 ? -16.180 -8.386 -15.597 1.00 48.66 93 A 1 ATOM 725 O OH . TYR A 1 93 ? -15.527 -7.469 -16.365 1.00 50.01 93 A 1 ATOM 726 N N . PHE A 1 94 ? -16.292 -11.393 -10.657 1.00 49.86 94 A 1 ATOM 727 C CA . PHE A 1 94 ? -15.198 -10.915 -9.815 1.00 51.39 94 A 1 ATOM 728 C C . PHE A 1 94 ? -14.222 -12.032 -9.434 1.00 50.87 94 A 1 ATOM 729 O O . PHE A 1 94 ? -13.005 -11.812 -9.479 1.00 50.27 94 A 1 ATOM 730 C CB . PHE A 1 94 ? -15.751 -10.223 -8.562 1.00 50.60 94 A 1 ATOM 731 C CG . PHE A 1 94 ? -16.198 -8.797 -8.822 1.00 48.42 94 A 1 ATOM 732 C CD1 . PHE A 1 94 ? -15.235 -7.811 -9.128 1.00 46.03 94 A 1 ATOM 733 C CD2 . PHE A 1 94 ? -17.555 -8.446 -8.775 1.00 46.43 94 A 1 ATOM 734 C CE1 . PHE A 1 94 ? -15.631 -6.495 -9.386 1.00 41.75 94 A 1 ATOM 735 C CE2 . PHE A 1 94 ? -17.953 -7.123 -9.039 1.00 43.57 94 A 1 ATOM 736 C CZ . PHE A 1 94 ? -16.990 -6.153 -9.350 1.00 44.52 94 A 1 ATOM 737 N N . LYS A 1 95 ? -14.690 -13.237 -9.151 1.00 53.73 95 A 1 ATOM 738 C CA . LYS A 1 95 ? -13.828 -14.396 -8.867 1.00 56.05 95 A 1 ATOM 739 C C . LYS A 1 95 ? -12.937 -14.740 -10.062 1.00 54.86 95 A 1 ATOM 740 O O . LYS A 1 95 ? -11.748 -14.950 -9.880 1.00 55.63 95 A 1 ATOM 741 C CB . LYS A 1 95 ? -14.705 -15.573 -8.412 1.00 56.20 95 A 1 ATOM 742 C CG . LYS A 1 95 ? -13.884 -16.706 -7.776 1.00 53.38 95 A 1 ATOM 743 C CD . LYS A 1 95 ? -14.833 -17.784 -7.217 1.00 53.88 95 A 1 ATOM 744 C CE . LYS A 1 95 ? -14.038 -18.876 -6.494 1.00 48.05 95 A 1 ATOM 745 N NZ . LYS A 1 95 ? -14.941 -19.907 -5.929 1.00 44.81 95 A 1 ATOM 746 N N . ARG A 1 96 ? -13.468 -14.718 -11.292 1.00 53.45 96 A 1 ATOM 747 C CA . ARG A 1 96 ? -12.681 -14.930 -12.523 1.00 55.98 96 A 1 ATOM 748 C C . ARG A 1 96 ? -11.701 -13.796 -12.799 1.00 54.64 96 A 1 ATOM 749 O O . ARG A 1 96 ? -10.609 -14.057 -13.293 1.00 55.62 96 A 1 ATOM 750 C CB . ARG A 1 96 ? -13.628 -15.088 -13.730 1.00 55.74 96 A 1 ATOM 751 C CG . ARG A 1 96 ? -14.333 -16.451 -13.746 1.00 52.27 96 A 1 ATOM 752 C CD . ARG A 1 96 ? -15.292 -16.515 -14.936 1.00 54.11 96 A 1 ATOM 753 N NE . ARG A 1 96 ? -16.099 -17.748 -14.936 1.00 47.90 96 A 1 ATOM 754 C CZ . ARG A 1 96 ? -17.087 -18.039 -15.764 1.00 45.59 96 A 1 ATOM 755 N NH1 . ARG A 1 96 ? -17.426 -17.251 -16.748 1.00 44.15 96 A 1 ATOM 756 N NH2 . ARG A 1 96 ? -17.777 -19.127 -15.608 1.00 41.19 96 A 1 ATOM 757 N N . LEU A 1 97 ? -12.072 -12.562 -12.478 1.00 50.13 97 A 1 ATOM 758 C CA . LEU A 1 97 ? -11.206 -11.390 -12.630 1.00 50.74 97 A 1 ATOM 759 C C . LEU A 1 97 ? -10.026 -11.454 -11.652 1.00 48.84 97 A 1 ATOM 760 O O . LEU A 1 97 ? -8.878 -11.352 -12.076 1.00 49.24 97 A 1 ATOM 761 C CB . LEU A 1 97 ? -12.071 -10.127 -12.468 1.00 50.17 97 A 1 ATOM 762 C CG . LEU A 1 97 ? -11.855 -9.103 -13.598 1.00 47.68 97 A 1 ATOM 763 C CD1 . LEU A 1 97 ? -13.143 -8.335 -13.887 1.00 47.16 97 A 1 ATOM 764 C CD2 . LEU A 1 97 ? -10.781 -8.086 -13.236 1.00 49.44 97 A 1 ATOM 765 N N . ILE A 1 98 ? -10.298 -11.765 -10.372 1.00 50.52 98 A 1 ATOM 766 C CA . ILE A 1 98 ? -9.276 -11.983 -9.347 1.00 51.13 98 A 1 ATOM 767 C C . ILE A 1 98 ? -8.376 -13.155 -9.750 1.00 50.57 98 A 1 ATOM 768 O O . ILE A 1 98 ? -7.152 -13.004 -9.721 1.00 49.53 98 A 1 ATOM 769 C CB . ILE A 1 98 ? -9.929 -12.193 -7.963 1.00 50.25 98 A 1 ATOM 770 C CG1 . ILE A 1 98 ? -10.592 -10.878 -7.484 1.00 46.77 98 A 1 ATOM 771 C CG2 . ILE A 1 98 ? -8.897 -12.664 -6.916 1.00 46.98 98 A 1 ATOM 772 C CD1 . ILE A 1 98 ? -11.561 -11.068 -6.316 1.00 44.36 98 A 1 ATOM 773 N N . GLN A 1 99 ? -8.930 -14.286 -10.198 1.00 50.60 99 A 1 ATOM 774 C CA . GLN A 1 99 ? -8.161 -15.443 -10.664 1.00 53.11 99 A 1 ATOM 775 C C . GLN A 1 99 ? -7.229 -15.068 -11.826 1.00 52.43 99 A 1 ATOM 776 O O . GLN A 1 99 ? -6.034 -15.313 -11.743 1.00 52.80 99 A 1 ATOM 777 C CB . GLN A 1 99 ? -9.130 -16.572 -11.052 1.00 53.85 99 A 1 ATOM 778 C CG . GLN A 1 99 ? -8.435 -17.949 -11.119 1.00 48.87 99 A 1 ATOM 779 C CD . GLN A 1 99 ? -8.554 -18.772 -9.835 1.00 48.79 99 A 1 ATOM 780 O OE1 . GLN A 1 99 ? -9.475 -18.637 -9.034 1.00 45.91 99 A 1 ATOM 781 N NE2 . GLN A 1 99 ? -7.638 -19.681 -9.611 1.00 43.99 99 A 1 ATOM 782 N N . ARG A 1 100 ? -7.715 -14.369 -12.858 1.00 48.93 100 A 1 ATOM 783 C CA . ARG A 1 100 ? -6.887 -13.925 -14.001 1.00 50.18 100 A 1 ATOM 784 C C . ARG A 1 100 ? -5.757 -12.991 -13.600 1.00 48.37 100 A 1 ATOM 785 O O . ARG A 1 100 ? -4.654 -13.122 -14.121 1.00 47.93 100 A 1 ATOM 786 C CB . ARG A 1 100 ? -7.755 -13.220 -15.056 1.00 49.99 100 A 1 ATOM 787 C CG . ARG A 1 100 ? -8.195 -14.171 -16.179 1.00 46.63 100 A 1 ATOM 788 C CD . ARG A 1 100 ? -8.920 -13.373 -17.264 1.00 47.75 100 A 1 ATOM 789 N NE . ARG A 1 100 ? -9.254 -14.232 -18.427 1.00 42.30 100 A 1 ATOM 790 C CZ . ARG A 1 100 ? -9.967 -13.861 -19.477 1.00 40.21 100 A 1 ATOM 791 N NH1 . ARG A 1 100 ? -10.459 -12.653 -19.594 1.00 38.76 100 A 1 ATOM 792 N NH2 . ARG A 1 100 ? -10.189 -14.702 -20.448 1.00 36.92 100 A 1 ATOM 793 N N . TYR A 1 101 ? -6.014 -12.045 -12.695 1.00 42.37 101 A 1 ATOM 794 C CA . TYR A 1 101 ? -4.976 -11.135 -12.214 1.00 43.79 101 A 1 ATOM 795 C C . TYR A 1 101 ? -3.973 -11.867 -11.319 1.00 42.83 101 A 1 ATOM 796 O O . TYR A 1 101 ? -2.771 -11.637 -11.450 1.00 41.68 101 A 1 ATOM 797 C CB . TYR A 1 101 ? -5.611 -9.931 -11.500 1.00 42.23 101 A 1 ATOM 798 C CG . TYR A 1 101 ? -5.904 -8.787 -12.451 1.00 38.86 101 A 1 ATOM 799 C CD1 . TYR A 1 101 ? -4.885 -7.876 -12.781 1.00 36.01 101 A 1 ATOM 800 C CD2 . TYR A 1 101 ? -7.182 -8.629 -13.020 1.00 35.74 101 A 1 ATOM 801 C CE1 . TYR A 1 101 ? -5.137 -6.814 -13.674 1.00 32.93 101 A 1 ATOM 802 C CE2 . TYR A 1 101 ? -7.446 -7.578 -13.913 1.00 34.51 101 A 1 ATOM 803 C CZ . TYR A 1 101 ? -6.423 -6.671 -14.236 1.00 34.31 101 A 1 ATOM 804 O OH . TYR A 1 101 ? -6.677 -5.641 -15.091 1.00 33.57 101 A 1 ATOM 805 N N . THR A 1 102 ? -4.446 -12.802 -10.480 1.00 49.06 102 A 1 ATOM 806 C CA . THR A 1 102 ? -3.587 -13.606 -9.605 1.00 50.37 102 A 1 ATOM 807 C C . THR A 1 102 ? -2.701 -14.545 -10.427 1.00 49.80 102 A 1 ATOM 808 O O . THR A 1 102 ? -1.492 -14.563 -10.224 1.00 47.23 102 A 1 ATOM 809 C CB . THR A 1 102 ? -4.417 -14.381 -8.566 1.00 48.86 102 A 1 ATOM 810 O OG1 . THR A 1 102 ? -5.352 -13.540 -7.945 1.00 44.46 102 A 1 ATOM 811 C CG2 . THR A 1 102 ? -3.568 -14.919 -7.424 1.00 45.20 102 A 1 ATOM 812 N N . ASP A 1 103 ? -3.234 -15.232 -11.435 1.00 45.70 103 A 1 ATOM 813 C CA . ASP A 1 103 ? -2.479 -16.140 -12.304 1.00 48.25 103 A 1 ATOM 814 C C . ASP A 1 103 ? -1.488 -15.388 -13.207 1.00 47.20 103 A 1 ATOM 815 O O . ASP A 1 103 ? -0.371 -15.852 -13.445 1.00 46.00 103 A 1 ATOM 816 C CB . ASP A 1 103 ? -3.458 -16.992 -13.138 1.00 48.44 103 A 1 ATOM 817 C CG . ASP A 1 103 ? -4.317 -17.956 -12.302 1.00 44.72 103 A 1 ATOM 818 O OD1 . ASP A 1 103 ? -3.920 -18.286 -11.164 1.00 43.35 103 A 1 ATOM 819 O OD2 . ASP A 1 103 ? -5.394 -18.372 -12.804 1.00 43.50 103 A 1 ATOM 820 N N . SER A 1 104 ? -1.841 -14.173 -13.648 1.00 40.42 104 A 1 ATOM 821 C CA . SER A 1 104 ? -0.928 -13.315 -14.426 1.00 41.72 104 A 1 ATOM 822 C C . SER A 1 104 ? 0.231 -12.738 -13.600 1.00 41.01 104 A 1 ATOM 823 O O . SER A 1 104 ? 1.298 -12.485 -14.150 1.00 38.79 104 A 1 ATOM 824 C CB . SER A 1 104 ? -1.729 -12.169 -15.054 1.00 38.65 104 A 1 ATOM 825 O OG . SER A 1 104 ? -0.888 -11.357 -15.867 1.00 35.14 104 A 1 ATOM 826 N N . VAL A 1 105 ? 0.020 -12.518 -12.297 1.00 36.09 105 A 1 ATOM 827 C CA . VAL A 1 105 ? 1.034 -11.978 -11.375 1.00 37.67 105 A 1 ATOM 828 C C . VAL A 1 105 ? 1.892 -13.100 -10.776 1.00 37.73 105 A 1 ATOM 829 O O . VAL A 1 105 ? 3.108 -12.948 -10.673 1.00 35.78 105 A 1 ATOM 830 C CB . VAL A 1 105 ? 0.358 -11.105 -10.301 1.00 35.39 105 A 1 ATOM 831 C CG1 . VAL A 1 105 ? 1.328 -10.642 -9.206 1.00 31.42 105 A 1 ATOM 832 C CG2 . VAL A 1 105 ? -0.235 -9.833 -10.927 1.00 32.02 105 A 1 ATOM 833 N N . ILE A 1 106 ? 1.305 -14.272 -10.467 1.00 30.94 106 A 1 ATOM 834 C CA . ILE A 1 106 ? 2.024 -15.434 -9.910 1.00 31.87 106 A 1 ATOM 835 C C . ILE A 1 106 ? 3.028 -16.024 -10.912 1.00 32.58 106 A 1 ATOM 836 O O . ILE A 1 106 ? 4.073 -16.524 -10.499 1.00 30.53 106 A 1 ATOM 837 C CB . ILE A 1 106 ? 1.012 -16.496 -9.398 1.00 29.71 106 A 1 ATOM 838 C CG1 . ILE A 1 106 ? 0.356 -15.980 -8.097 1.00 27.10 106 A 1 ATOM 839 C CG2 . ILE A 1 106 ? 1.674 -17.860 -9.125 1.00 26.91 106 A 1 ATOM 840 C CD1 . ILE A 1 106 ? -0.816 -16.842 -7.595 1.00 25.56 106 A 1 ATOM 841 N N . ASN A 1 107 ? 2.781 -15.914 -12.229 1.00 28.99 107 A 1 ATOM 842 C CA . ASN A 1 107 ? 3.682 -16.491 -13.247 1.00 30.51 107 A 1 ATOM 843 C C . ASN A 1 107 ? 4.988 -15.710 -13.482 1.00 31.33 107 A 1 ATOM 844 O O . ASN A 1 107 ? 5.790 -16.150 -14.302 1.00 29.54 107 A 1 ATOM 845 C CB . ASN A 1 107 ? 2.888 -16.744 -14.543 1.00 28.97 107 A 1 ATOM 846 C CG . ASN A 1 107 ? 2.492 -18.204 -14.713 1.00 26.27 107 A 1 ATOM 847 O OD1 . ASN A 1 107 ? 3.063 -19.112 -14.152 1.00 24.34 107 A 1 ATOM 848 N ND2 . ASN A 1 107 ? 1.510 -18.477 -15.531 1.00 24.17 107 A 1 ATOM 849 N N . LYS A 1 108 ? 5.232 -14.579 -12.800 1.00 29.41 108 A 1 ATOM 850 C CA . LYS A 1 108 ? 6.469 -13.809 -12.975 1.00 30.27 108 A 1 ATOM 851 C C . LYS A 1 108 ? 7.297 -13.557 -11.717 1.00 30.78 108 A 1 ATOM 852 O O . LYS A 1 108 ? 8.484 -13.334 -11.871 1.00 29.09 108 A 1 ATOM 853 C CB . LYS A 1 108 ? 6.205 -12.531 -13.785 1.00 28.35 108 A 1 ATOM 854 C CG . LYS A 1 108 ? 6.169 -12.878 -15.280 1.00 26.11 108 A 1 ATOM 855 C CD . LYS A 1 108 ? 6.104 -11.620 -16.158 1.00 24.18 108 A 1 ATOM 856 C CE . LYS A 1 108 ? 6.190 -12.043 -17.622 1.00 22.35 108 A 1 ATOM 857 N NZ . LYS A 1 108 ? 6.167 -10.871 -18.532 1.00 21.26 108 A 1 ATOM 858 N N . ASP A 1 109 ? 6.730 -13.654 -10.507 1.00 29.61 109 A 1 ATOM 859 C CA . ASP A 1 109 ? 7.509 -13.452 -9.276 1.00 30.31 109 A 1 ATOM 860 C C . ASP A 1 109 ? 6.965 -14.300 -8.119 1.00 30.65 109 A 1 ATOM 861 O O . ASP A 1 109 ? 5.998 -13.939 -7.442 1.00 29.19 109 A 1 ATOM 862 C CB . ASP A 1 109 ? 7.569 -11.959 -8.921 1.00 28.05 109 A 1 ATOM 863 C CG . ASP A 1 109 ? 8.631 -11.177 -9.717 1.00 26.15 109 A 1 ATOM 864 O OD1 . ASP A 1 109 ? 9.781 -11.674 -9.773 1.00 24.27 109 A 1 ATOM 865 O OD2 . ASP A 1 109 ? 8.303 -10.080 -10.204 1.00 23.53 109 A 1 ATOM 866 N N . THR A 1 110 ? 7.620 -15.418 -7.836 1.00 29.04 110 A 1 ATOM 867 C CA . THR A 1 110 ? 7.322 -16.352 -6.734 1.00 29.30 110 A 1 ATOM 868 C C . THR A 1 110 ? 7.601 -15.800 -5.323 1.00 30.04 110 A 1 ATOM 869 O O . THR A 1 110 ? 7.439 -16.514 -4.330 1.00 29.04 110 A 1 ATOM 870 C CB . THR A 1 110 ? 8.086 -17.680 -6.943 1.00 27.41 110 A 1 ATOM 871 O OG1 . THR A 1 110 ? 9.318 -17.446 -7.594 1.00 25.54 110 A 1 ATOM 872 C CG2 . THR A 1 110 ? 7.308 -18.650 -7.835 1.00 24.75 110 A 1 ATOM 873 N N . CYS A 1 111 ? 7.974 -14.530 -5.172 1.00 29.21 111 A 1 ATOM 874 C CA . CYS A 1 111 ? 8.321 -13.903 -3.890 1.00 28.88 111 A 1 ATOM 875 C C . CYS A 1 111 ? 7.124 -13.617 -2.960 1.00 29.09 111 A 1 ATOM 876 O O . CYS A 1 111 ? 7.332 -13.384 -1.773 1.00 28.77 111 A 1 ATOM 877 C CB . CYS A 1 111 ? 9.121 -12.626 -4.162 1.00 27.73 111 A 1 ATOM 878 S SG . CYS A 1 111 ? 10.804 -13.048 -4.713 1.00 26.19 111 A 1 ATOM 879 N N . TRP A 1 112 ? 5.880 -13.664 -3.449 1.00 28.00 112 A 1 ATOM 880 C CA . TRP A 1 112 ? 4.702 -13.264 -2.662 1.00 27.62 112 A 1 ATOM 881 C C . TRP A 1 112 ? 4.131 -14.361 -1.732 1.00 28.14 112 A 1 ATOM 882 O O . TRP A 1 112 ? 3.206 -14.092 -0.969 1.00 26.55 112 A 1 ATOM 883 C CB . TRP A 1 112 ? 3.638 -12.716 -3.612 1.00 25.65 112 A 1 ATOM 884 C CG . TRP A 1 112 ? 4.057 -11.484 -4.345 1.00 24.55 112 A 1 ATOM 885 C CD1 . TRP A 1 112 ? 4.677 -11.444 -5.552 1.00 22.38 112 A 1 ATOM 886 C CD2 . TRP A 1 112 ? 3.926 -10.090 -3.925 1.00 22.16 112 A 1 ATOM 887 N NE1 . TRP A 1 112 ? 4.951 -10.139 -5.892 1.00 21.18 112 A 1 ATOM 888 C CE2 . TRP A 1 112 ? 4.504 -9.263 -4.932 1.00 21.48 112 A 1 ATOM 889 C CE3 . TRP A 1 112 ? 3.377 -9.453 -2.788 1.00 22.42 112 A 1 ATOM 890 C CZ2 . TRP A 1 112 ? 4.529 -7.857 -4.825 1.00 20.71 112 A 1 ATOM 891 C CZ3 . TRP A 1 112 ? 3.401 -8.048 -2.678 1.00 21.07 112 A 1 ATOM 892 C CH2 . TRP A 1 112 ? 3.980 -7.251 -3.689 1.00 20.49 112 A 1 ATOM 893 N N . LYS A 1 113 ? 4.671 -15.582 -1.771 1.00 28.00 113 A 1 ATOM 894 C CA . LYS A 1 113 ? 4.235 -16.717 -0.928 1.00 28.11 113 A 1 ATOM 895 C C . LYS A 1 113 ? 5.132 -16.989 0.285 1.00 28.44 113 A 1 ATOM 896 O O . LYS A 1 113 ? 4.927 -18.007 0.953 1.00 27.28 113 A 1 ATOM 897 C CB . LYS A 1 113 ? 4.026 -17.963 -1.791 1.00 26.99 113 A 1 ATOM 898 C CG . LYS A 1 113 ? 2.601 -18.034 -2.355 1.00 25.25 113 A 1 ATOM 899 C CD . LYS A 1 113 ? 2.394 -19.361 -3.097 1.00 24.00 113 A 1 ATOM 900 C CE . LYS A 1 113 ? 0.959 -19.476 -3.591 1.00 22.02 113 A 1 ATOM 901 N NZ . LYS A 1 113 ? 0.746 -20.746 -4.344 1.00 21.06 113 A 1 ATOM 902 N N . ILE A 1 114 ? 6.110 -16.140 0.585 1.00 28.79 114 A 1 ATOM 903 C CA . ILE A 1 114 ? 7.046 -16.389 1.684 1.00 28.88 114 A 1 ATOM 904 C C . ILE A 1 114 ? 6.401 -15.963 3.007 1.00 29.10 114 A 1 ATOM 905 O O . ILE A 1 114 ? 6.101 -14.798 3.240 1.00 28.10 114 A 1 ATOM 906 C CB . ILE A 1 114 ? 8.430 -15.770 1.385 1.00 27.27 114 A 1 ATOM 907 C CG1 . ILE A 1 114 ? 8.977 -16.353 0.056 1.00 25.40 114 A 1 ATOM 908 C CG2 . ILE A 1 114 ? 9.398 -16.063 2.546 1.00 25.84 114 A 1 ATOM 909 C CD1 . ILE A 1 114 ? 10.331 -15.788 -0.386 1.00 24.70 114 A 1 ATOM 910 N N . SER A 1 115 ? 6.160 -16.946 3.871 1.00 28.33 115 A 1 ATOM 911 C CA . SER A 1 115 ? 5.719 -16.783 5.258 1.00 28.81 115 A 1 ATOM 912 C C . SER A 1 115 ? 6.662 -15.828 6.007 1.00 29.75 115 A 1 ATOM 913 O O . SER A 1 115 ? 7.874 -15.877 5.823 1.00 28.02 115 A 1 ATOM 914 C CB . SER A 1 115 ? 5.684 -18.174 5.918 1.00 26.22 115 A 1 ATOM 915 O OG . SER A 1 115 ? 5.653 -18.088 7.328 1.00 23.94 115 A 1 ATOM 916 N N . ARG A 1 116 ? 6.094 -15.006 6.911 1.00 32.53 116 A 1 ATOM 917 C CA . ARG A 1 116 ? 6.786 -14.011 7.762 1.00 33.29 116 A 1 ATOM 918 C C . ARG A 1 116 ? 8.078 -14.522 8.436 1.00 33.92 116 A 1 ATOM 919 O O . ARG A 1 116 ? 8.932 -13.719 8.773 1.00 32.45 116 A 1 ATOM 920 C CB . ARG A 1 116 ? 5.819 -13.524 8.862 1.00 31.56 116 A 1 ATOM 921 C CG . ARG A 1 116 ? 5.242 -12.131 8.594 1.00 29.43 116 A 1 ATOM 922 C CD . ARG A 1 116 ? 4.291 -11.731 9.729 1.00 27.85 116 A 1 ATOM 923 N NE . ARG A 1 116 ? 3.742 -10.371 9.552 1.00 26.82 116 A 1 ATOM 924 C CZ . ARG A 1 116 ? 2.843 -9.789 10.326 1.00 25.30 116 A 1 ATOM 925 N NH1 . ARG A 1 116 ? 2.323 -10.383 11.359 1.00 24.58 116 A 1 ATOM 926 N NH2 . ARG A 1 116 ? 2.444 -8.569 10.077 1.00 24.43 116 A 1 ATOM 927 N N . ASN A 1 117 ? 8.218 -15.824 8.587 1.00 32.89 117 A 1 ATOM 928 C CA . ASN A 1 117 ? 9.292 -16.477 9.331 1.00 33.86 117 A 1 ATOM 929 C C . ASN A 1 117 ? 10.542 -16.800 8.489 1.00 34.54 117 A 1 ATOM 930 O O . ASN A 1 117 ? 11.502 -17.327 9.035 1.00 32.88 117 A 1 ATOM 931 C CB . ASN A 1 117 ? 8.708 -17.728 10.004 1.00 32.14 117 A 1 ATOM 932 C CG . ASN A 1 117 ? 7.577 -17.435 10.969 1.00 29.91 117 A 1 ATOM 933 O OD1 . ASN A 1 117 ? 7.229 -16.300 11.268 1.00 27.89 117 A 1 ATOM 934 N ND2 . ASN A 1 117 ? 6.917 -18.454 11.472 1.00 27.19 117 A 1 ATOM 935 N N . GLN A 1 118 ? 10.566 -16.509 7.176 1.00 31.23 118 A 1 ATOM 936 C CA . GLN A 1 118 ? 11.679 -16.847 6.275 1.00 31.86 118 A 1 ATOM 937 C C . GLN A 1 118 ? 12.491 -15.627 5.776 1.00 32.43 118 A 1 ATOM 938 O O . GLN A 1 118 ? 13.436 -15.787 5.014 1.00 31.58 118 A 1 ATOM 939 C CB . GLN A 1 118 ? 11.167 -17.702 5.110 1.00 30.62 118 A 1 ATOM 940 C CG . GLN A 1 118 ? 10.797 -19.125 5.563 1.00 28.49 118 A 1 ATOM 941 C CD . GLN A 1 118 ? 10.350 -20.015 4.401 1.00 26.83 118 A 1 ATOM 942 O OE1 . GLN A 1 118 ? 9.925 -19.553 3.354 1.00 25.98 118 A 1 ATOM 943 N NE2 . GLN A 1 118 ? 10.396 -21.319 4.552 1.00 25.86 118 A 1 ATOM 944 N N . CYS A 1 119 ? 12.152 -14.404 6.218 1.00 33.43 119 A 1 ATOM 945 C CA . CYS A 1 119 ? 12.905 -13.199 5.863 1.00 33.42 119 A 1 ATOM 946 C C . CYS A 1 119 ? 14.104 -13.013 6.809 1.00 32.88 119 A 1 ATOM 947 O O . CYS A 1 119 ? 13.988 -12.398 7.871 1.00 32.62 119 A 1 ATOM 948 C CB . CYS A 1 119 ? 11.968 -11.982 5.880 1.00 32.79 119 A 1 ATOM 949 S SG . CYS A 1 119 ? 10.754 -12.089 4.530 1.00 32.10 119 A 1 ATOM 950 N N . THR A 1 120 ? 15.273 -13.493 6.402 1.00 33.29 120 A 1 ATOM 951 C CA . THR A 1 120 ? 16.538 -13.173 7.078 1.00 33.94 120 A 1 ATOM 952 C C . THR A 1 120 ? 17.218 -11.999 6.369 1.00 34.13 120 A 1 ATOM 953 O O . THR A 1 120 ? 17.495 -12.059 5.182 1.00 32.81 120 A 1 ATOM 954 C CB . THR A 1 120 ? 17.455 -14.402 7.191 1.00 32.45 120 A 1 ATOM 955 O OG1 . THR A 1 120 ? 17.558 -15.074 5.971 1.00 30.62 120 A 1 ATOM 956 C CG2 . THR A 1 120 ? 16.913 -15.405 8.217 1.00 29.83 120 A 1 ATOM 957 N N . ASN A 1 121 ? 17.484 -10.940 7.118 1.00 30.32 121 A 1 ATOM 958 C CA . ASN A 1 121 ? 18.077 -9.640 6.754 1.00 31.09 121 A 1 ATOM 959 C C . ASN A 1 121 ? 17.102 -8.569 6.235 1.00 31.73 121 A 1 ATOM 960 O O . ASN A 1 121 ? 16.864 -8.398 5.045 1.00 30.52 121 A 1 ATOM 961 C CB . ASN A 1 121 ? 19.324 -9.795 5.870 1.00 29.01 121 A 1 ATOM 962 C CG . ASN A 1 121 ? 20.460 -10.501 6.580 1.00 26.60 121 A 1 ATOM 963 O OD1 . ASN A 1 121 ? 20.621 -10.404 7.790 1.00 24.93 121 A 1 ATOM 964 N ND2 . ASN A 1 121 ? 21.312 -11.187 5.871 1.00 24.33 121 A 1 ATOM 965 N N . ILE A 1 122 ? 16.633 -7.746 7.182 1.00 32.15 122 A 1 ATOM 966 C CA . ILE A 1 122 ? 15.980 -6.458 6.922 1.00 32.44 122 A 1 ATOM 967 C C . ILE A 1 122 ? 17.072 -5.390 6.875 1.00 32.31 122 A 1 ATOM 968 O O . ILE A 1 122 ? 17.719 -5.110 7.887 1.00 31.51 122 A 1 ATOM 969 C CB . ILE A 1 122 ? 14.929 -6.163 8.028 1.00 31.55 122 A 1 ATOM 970 C CG1 . ILE A 1 122 ? 13.863 -7.282 8.116 1.00 29.94 122 A 1 ATOM 971 C CG2 . ILE A 1 122 ? 14.268 -4.800 7.777 1.00 30.11 122 A 1 ATOM 972 C CD1 . ILE A 1 122 ? 12.919 -7.165 9.309 1.00 28.92 122 A 1 ATOM 973 N N . THR A 1 123 ? 17.277 -4.772 5.710 1.00 31.48 123 A 1 ATOM 974 C CA . THR A 1 123 ? 18.159 -3.603 5.593 1.00 32.66 123 A 1 ATOM 975 C C . THR A 1 123 ? 17.292 -2.361 5.479 1.00 33.28 123 A 1 ATOM 976 O O . THR A 1 123 ? 16.598 -2.157 4.484 1.00 32.30 123 A 1 ATOM 977 C CB . THR A 1 123 ? 19.168 -3.701 4.436 1.00 31.74 123 A 1 ATOM 978 O OG1 . THR A 1 123 ? 19.451 -5.027 4.063 1.00 29.62 123 A 1 ATOM 979 C CG2 . THR A 1 123 ? 20.509 -3.088 4.844 1.00 29.22 123 A 1 ATOM 980 N N . THR A 1 124 ? 17.287 -1.528 6.522 1.00 33.56 124 A 1 ATOM 981 C CA . THR A 1 124 ? 16.541 -0.277 6.570 1.00 33.84 124 A 1 ATOM 982 C C . THR A 1 124 ? 17.355 0.852 5.949 1.00 33.58 124 A 1 ATOM 983 O O . THR A 1 124 ? 18.425 1.196 6.451 1.00 32.80 124 A 1 ATOM 984 C CB . THR A 1 124 ? 16.131 0.106 8.009 1.00 33.24 124 A 1 ATOM 985 O OG1 . THR A 1 124 ? 16.922 -0.537 8.984 1.00 32.23 124 A 1 ATOM 986 C CG2 . THR A 1 124 ? 14.687 -0.304 8.289 1.00 31.73 124 A 1 ATOM 987 N N . TYR A 1 125 ? 16.850 1.462 4.864 1.00 29.53 125 A 1 ATOM 988 C CA . TYR A 1 125 ? 17.458 2.650 4.281 1.00 29.85 125 A 1 ATOM 989 C C . TYR A 1 125 ? 16.636 3.901 4.614 1.00 30.34 125 A 1 ATOM 990 O O . TYR A 1 125 ? 15.476 4.034 4.242 1.00 29.12 125 A 1 ATOM 991 C CB . TYR A 1 125 ? 17.695 2.468 2.774 1.00 28.06 125 A 1 ATOM 992 C CG . TYR A 1 125 ? 18.765 1.426 2.466 1.00 25.98 125 A 1 ATOM 993 C CD1 . TYR A 1 125 ? 20.130 1.778 2.510 1.00 24.00 125 A 1 ATOM 994 C CD2 . TYR A 1 125 ? 18.386 0.113 2.156 1.00 23.32 125 A 1 ATOM 995 C CE1 . TYR A 1 125 ? 21.118 0.810 2.234 1.00 21.87 125 A 1 ATOM 996 C CE2 . TYR A 1 125 ? 19.373 -0.862 1.882 1.00 21.96 125 A 1 ATOM 997 C CZ . TYR A 1 125 ? 20.738 -0.512 1.921 1.00 21.61 125 A 1 ATOM 998 O OH . TYR A 1 125 ? 21.684 -1.451 1.662 1.00 21.01 125 A 1 ATOM 999 N N . LYS A 1 126 ? 17.314 4.824 5.304 1.00 30.03 126 A 1 ATOM 1000 C CA . LYS A 1 126 ? 17.024 6.249 5.513 1.00 30.23 126 A 1 ATOM 1001 C C . LYS A 1 126 ? 15.803 6.602 6.379 1.00 30.33 126 A 1 ATOM 1002 O O . LYS A 1 126 ? 14.659 6.562 5.952 1.00 29.33 126 A 1 ATOM 1003 C CB . LYS A 1 126 ? 17.035 6.959 4.153 1.00 28.83 126 A 1 ATOM 1004 C CG . LYS A 1 126 ? 17.551 8.402 4.243 1.00 26.94 126 A 1 ATOM 1005 C CD . LYS A 1 126 ? 17.683 9.006 2.830 1.00 25.57 126 A 1 ATOM 1006 C CE . LYS A 1 126 ? 18.337 10.377 2.912 1.00 23.98 126 A 1 ATOM 1007 N NZ . LYS A 1 126 ? 18.487 10.998 1.568 1.00 22.58 126 A 1 ATOM 1008 N N . PHE A 1 127 ? 16.094 7.087 7.578 1.00 30.40 127 A 1 ATOM 1009 C CA . PHE A 1 127 ? 15.163 7.757 8.476 1.00 31.19 127 A 1 ATOM 1010 C C . PHE A 1 127 ? 15.150 9.264 8.196 1.00 31.21 127 A 1 ATOM 1011 O O . PHE A 1 127 ? 16.179 9.922 8.347 1.00 30.26 127 A 1 ATOM 1012 C CB . PHE A 1 127 ? 15.589 7.494 9.923 1.00 29.86 127 A 1 ATOM 1013 C CG . PHE A 1 127 ? 15.418 6.059 10.364 1.00 28.05 127 A 1 ATOM 1014 C CD1 . PHE A 1 127 ? 14.192 5.652 10.922 1.00 26.19 127 A 1 ATOM 1015 C CD2 . PHE A 1 127 ? 16.475 5.141 10.239 1.00 26.06 127 A 1 ATOM 1016 C CE1 . PHE A 1 127 ? 14.026 4.329 11.346 1.00 24.75 127 A 1 ATOM 1017 C CE2 . PHE A 1 127 ? 16.306 3.815 10.668 1.00 24.66 127 A 1 ATOM 1018 C CZ . PHE A 1 127 ? 15.083 3.407 11.221 1.00 24.62 127 A 1 ATOM 1019 N N . LEU A 1 128 ? 14.001 9.834 7.834 1.00 29.24 128 A 1 ATOM 1020 C CA . LEU A 1 128 ? 13.843 11.296 7.688 1.00 29.98 128 A 1 ATOM 1021 C C . LEU A 1 128 ? 13.567 12.020 9.015 1.00 30.65 128 A 1 ATOM 1022 O O . LEU A 1 128 ? 13.633 13.239 9.054 1.00 29.24 128 A 1 ATOM 1023 C CB . LEU A 1 128 ? 12.763 11.581 6.621 1.00 27.95 128 A 1 ATOM 1024 C CG . LEU A 1 128 ? 13.335 11.591 5.190 1.00 25.71 128 A 1 ATOM 1025 C CD1 . LEU A 1 128 ? 12.239 11.324 4.156 1.00 23.57 128 A 1 ATOM 1026 C CD2 . LEU A 1 128 ? 13.977 12.940 4.847 1.00 23.96 128 A 1 ATOM 1027 N N . CYS A 1 129 ? 13.314 11.285 10.114 1.00 33.35 129 A 1 ATOM 1028 C CA . CYS A 1 129 ? 12.879 11.851 11.397 1.00 33.75 129 A 1 ATOM 1029 C C . CYS A 1 129 ? 13.785 11.512 12.598 1.00 33.24 129 A 1 ATOM 1030 O O . CYS A 1 129 ? 13.404 11.802 13.730 1.00 32.27 129 A 1 ATOM 1031 C CB . CYS A 1 129 ? 11.418 11.423 11.654 1.00 33.27 129 A 1 ATOM 1032 S SG . CYS A 1 129 ? 10.336 12.064 10.357 1.00 32.00 129 A 1 ATOM 1033 N N . PHE A 1 130 ? 14.957 10.903 12.411 1.00 34.99 130 A 1 ATOM 1034 C CA . PHE A 1 130 ? 15.814 10.476 13.524 1.00 35.12 130 A 1 ATOM 1035 C C . PHE A 1 130 ? 17.259 10.947 13.367 1.00 34.21 130 A 1 ATOM 1036 O O . PHE A 1 130 ? 17.808 10.942 12.266 1.00 32.04 130 A 1 ATOM 1037 C CB . PHE A 1 130 ? 15.726 8.958 13.712 1.00 33.47 130 A 1 ATOM 1038 C CG . PHE A 1 130 ? 14.360 8.504 14.203 1.00 31.69 130 A 1 ATOM 1039 C CD1 . PHE A 1 130 ? 14.063 8.508 15.580 1.00 29.65 130 A 1 ATOM 1040 C CD2 . PHE A 1 130 ? 13.367 8.094 13.286 1.00 29.62 130 A 1 ATOM 1041 C CE1 . PHE A 1 130 ? 12.793 8.126 16.033 1.00 27.99 130 A 1 ATOM 1042 C CE2 . PHE A 1 130 ? 12.090 7.712 13.743 1.00 28.03 130 A 1 ATOM 1043 C CZ . PHE A 1 130 ? 11.809 7.725 15.114 1.00 27.98 130 A 1 ATOM 1044 N N . LYS A 1 131 ? 17.878 11.359 14.484 1.00 31.97 131 A 1 ATOM 1045 C CA . LYS A 1 131 ? 19.310 11.673 14.547 1.00 32.81 131 A 1 ATOM 1046 C C . LYS A 1 131 ? 20.134 10.395 14.298 1.00 32.80 131 A 1 ATOM 1047 O O . LYS A 1 131 ? 19.683 9.306 14.651 1.00 31.31 131 A 1 ATOM 1048 C CB . LYS A 1 131 ? 19.671 12.314 15.901 1.00 31.71 131 A 1 ATOM 1049 C CG . LYS A 1 131 ? 19.239 13.780 15.995 1.00 29.37 131 A 1 ATOM 1050 C CD . LYS A 1 131 ? 19.702 14.399 17.324 1.00 27.61 131 A 1 ATOM 1051 C CE . LYS A 1 131 ? 19.356 15.886 17.413 1.00 25.62 131 A 1 ATOM 1052 N NZ . LYS A 1 131 ? 19.828 16.470 18.693 1.00 24.52 131 A 1 ATOM 1053 N N . PRO A 1 132 ? 21.350 10.503 13.748 1.00 33.11 132 A 1 ATOM 1054 C CA . PRO A 1 132 ? 22.170 9.356 13.348 1.00 34.02 132 A 1 ATOM 1055 C C . PRO A 1 132 ? 22.595 8.415 14.492 1.00 34.74 132 A 1 ATOM 1056 O O . PRO A 1 132 ? 23.094 7.333 14.217 1.00 32.75 132 A 1 ATOM 1057 C CB . PRO A 1 132 ? 23.378 9.961 12.619 1.00 30.98 132 A 1 ATOM 1058 C CG . PRO A 1 132 ? 23.447 11.398 13.116 1.00 30.31 132 A 1 ATOM 1059 C CD . PRO A 1 132 ? 21.991 11.744 13.375 1.00 32.20 132 A 1 ATOM 1060 N N . GLU A 1 133 ? 22.374 8.788 15.759 1.00 32.70 133 A 1 ATOM 1061 C CA . GLU A 1 133 ? 22.711 7.961 16.933 1.00 33.79 133 A 1 ATOM 1062 C C . GLU A 1 133 ? 21.768 6.761 17.151 1.00 34.50 133 A 1 ATOM 1063 O O . GLU A 1 133 ? 22.167 5.788 17.775 1.00 32.65 133 A 1 ATOM 1064 C CB . GLU A 1 133 ? 22.791 8.863 18.167 1.00 32.01 133 A 1 ATOM 1065 C CG . GLU A 1 133 ? 24.022 9.781 18.102 1.00 28.81 133 A 1 ATOM 1066 C CD . GLU A 1 133 ? 24.127 10.785 19.258 1.00 26.49 133 A 1 ATOM 1067 O OE1 . GLU A 1 133 ? 25.239 11.329 19.429 1.00 24.56 133 A 1 ATOM 1068 O OE2 . GLU A 1 133 ? 23.091 11.060 19.903 1.00 26.73 133 A 1 ATOM 1069 N N . ASP A 1 134 ? 20.563 6.750 16.558 1.00 37.91 134 A 1 ATOM 1070 C CA . ASP A 1 134 ? 19.552 5.695 16.724 1.00 40.34 134 A 1 ATOM 1071 C C . ASP A 1 134 ? 19.705 4.515 15.729 1.00 40.59 134 A 1 ATOM 1072 O O . ASP A 1 134 ? 18.795 3.700 15.548 1.00 38.92 134 A 1 ATOM 1073 C CB . ASP A 1 134 ? 18.142 6.314 16.692 1.00 39.15 134 A 1 ATOM 1074 C CG . ASP A 1 134 ? 17.796 7.184 17.915 1.00 36.65 134 A 1 ATOM 1075 O OD1 . ASP A 1 134 ? 18.279 6.873 19.016 1.00 33.91 134 A 1 ATOM 1076 O OD2 . ASP A 1 134 ? 16.979 8.121 17.742 1.00 33.73 134 A 1 ATOM 1077 N N . SER A 1 135 ? 20.852 4.381 15.076 1.00 38.29 135 A 1 ATOM 1078 C CA . SER A 1 135 ? 21.108 3.444 13.967 1.00 40.01 135 A 1 ATOM 1079 C C . SER A 1 135 ? 21.178 1.944 14.335 1.00 41.17 135 A 1 ATOM 1080 O O . SER A 1 135 ? 21.519 1.117 13.487 1.00 38.56 135 A 1 ATOM 1081 C CB . SER A 1 135 ? 22.364 3.880 13.204 1.00 36.41 135 A 1 ATOM 1082 O OG . SER A 1 135 ? 23.494 3.879 14.051 1.00 33.44 135 A 1 ATOM 1083 N N . LYS A 1 136 ? 20.843 1.552 15.581 1.00 40.54 136 A 1 ATOM 1084 C CA . LYS A 1 136 ? 20.905 0.159 16.063 1.00 42.43 136 A 1 ATOM 1085 C C . LYS A 1 136 ? 19.532 -0.485 16.320 1.00 42.85 136 A 1 ATOM 1086 O O . LYS A 1 136 ? 19.423 -1.399 17.138 1.00 40.54 136 A 1 ATOM 1087 C CB . LYS A 1 136 ? 21.828 0.048 17.286 1.00 40.56 136 A 1 ATOM 1088 C CG . LYS A 1 136 ? 23.311 0.226 16.917 1.00 37.02 136 A 1 ATOM 1089 C CD . LYS A 1 136 ? 24.178 -0.062 18.147 1.00 33.83 136 A 1 ATOM 1090 C CE . LYS A 1 136 ? 25.655 0.079 17.803 1.00 30.80 136 A 1 ATOM 1091 N NZ . LYS A 1 136 ? 26.527 -0.168 18.989 1.00 29.00 136 A 1 ATOM 1092 N N . ILE A 1 137 ? 18.479 -0.031 15.648 1.00 38.57 137 A 1 ATOM 1093 C CA . ILE A 1 137 ? 17.137 -0.603 15.838 1.00 39.82 137 A 1 ATOM 1094 C C . ILE A 1 137 ? 16.911 -1.726 14.814 1.00 40.07 137 A 1 ATOM 1095 O O . ILE A 1 137 ? 16.546 -1.477 13.670 1.00 38.09 137 A 1 ATOM 1096 C CB . ILE A 1 137 ? 16.050 0.484 15.815 1.00 38.20 137 A 1 ATOM 1097 C CG1 . ILE A 1 137 ? 16.363 1.604 16.830 1.00 36.22 137 A 1 ATOM 1098 C CG2 . ILE A 1 137 ? 14.698 -0.171 16.155 1.00 36.07 137 A 1 ATOM 1099 C CD1 . ILE A 1 137 ? 15.403 2.800 16.757 1.00 34.52 137 A 1 ATOM 1100 N N . ASN A 1 138 ? 17.114 -2.976 15.254 1.00 37.34 138 A 1 ATOM 1101 C CA . ASN A 1 138 ? 17.070 -4.165 14.402 1.00 39.01 138 A 1 ATOM 1102 C C . ASN A 1 138 ? 15.701 -4.866 14.352 1.00 39.97 138 A 1 ATOM 1103 O O . ASN A 1 138 ? 15.606 -5.961 13.803 1.00 37.62 138 A 1 ATOM 1104 C CB . ASN A 1 138 ? 18.192 -5.129 14.843 1.00 36.10 138 A 1 ATOM 1105 C CG . ASN A 1 138 ? 19.591 -4.583 14.607 1.00 33.36 138 A 1 ATOM 1106 O OD1 . ASN A 1 138 ? 19.810 -3.588 13.939 1.00 30.34 138 A 1 ATOM 1107 N ND2 . ASN A 1 138 ? 20.594 -5.219 15.153 1.00 29.49 138 A 1 ATOM 1108 N N . SER A 1 139 ? 14.628 -4.297 14.937 1.00 41.90 139 A 1 ATOM 1109 C CA . SER A 1 139 ? 13.298 -4.907 14.890 1.00 44.20 139 A 1 ATOM 1110 C C . SER A 1 139 ? 12.210 -3.923 14.455 1.00 46.20 139 A 1 ATOM 1111 O O . SER A 1 139 ? 12.148 -2.780 14.910 1.00 44.98 139 A 1 ATOM 1112 C CB . SER A 1 139 ? 12.941 -5.619 16.204 1.00 41.69 139 A 1 ATOM 1113 O OG . SER A 1 139 ? 12.573 -4.709 17.220 1.00 38.19 139 A 1 ATOM 1114 N N . CYS A 1 140 ? 11.334 -4.379 13.560 1.00 43.89 140 A 1 ATOM 1115 C CA . CYS A 1 140 ? 10.224 -3.606 12.987 1.00 44.25 140 A 1 ATOM 1116 C C . CYS A 1 140 ? 9.207 -3.160 14.059 1.00 44.99 140 A 1 ATOM 1117 O O . CYS A 1 140 ? 8.698 -2.042 14.002 1.00 44.49 140 A 1 ATOM 1118 C CB . CYS A 1 140 ? 9.575 -4.479 11.905 1.00 42.52 140 A 1 ATOM 1119 S SG . CYS A 1 140 ? 8.518 -3.479 10.814 1.00 39.39 140 A 1 ATOM 1120 N N . ASP A 1 141 ? 8.987 -4.001 15.079 1.00 46.65 141 A 1 ATOM 1121 C CA . ASP A 1 141 ? 8.074 -3.698 16.190 1.00 48.96 141 A 1 ATOM 1122 C C . ASP A 1 141 ? 8.575 -2.514 17.021 1.00 49.10 141 A 1 ATOM 1123 O O . ASP A 1 141 ? 7.831 -1.568 17.279 1.00 48.94 141 A 1 ATOM 1124 C CB . ASP A 1 141 ? 7.893 -4.951 17.061 1.00 48.91 141 A 1 ATOM 1125 C CG . ASP A 1 141 ? 7.323 -6.124 16.269 1.00 45.30 141 A 1 ATOM 1126 O OD1 . ASP A 1 141 ? 6.463 -5.870 15.393 1.00 43.08 141 A 1 ATOM 1127 O OD2 . ASP A 1 141 ? 7.819 -7.253 16.472 1.00 42.86 141 A 1 ATOM 1128 N N . ARG A 1 142 ? 9.860 -2.491 17.332 1.00 48.79 142 A 1 ATOM 1129 C CA . ARG A 1 142 ? 10.489 -1.402 18.102 1.00 50.65 142 A 1 ATOM 1130 C C . ARG A 1 142 ? 10.490 -0.078 17.342 1.00 50.40 142 A 1 ATOM 1131 O O . ARG A 1 142 ? 10.321 0.977 17.947 1.00 50.36 142 A 1 ATOM 1132 C CB . ARG A 1 142 ? 11.896 -1.860 18.502 1.00 50.03 142 A 1 ATOM 1133 C CG . ARG A 1 142 ? 12.454 -1.049 19.674 1.00 45.65 142 A 1 ATOM 1134 C CD . ARG A 1 142 ? 13.758 -1.688 20.157 1.00 43.31 142 A 1 ATOM 1135 N NE . ARG A 1 142 ? 14.271 -1.036 21.381 1.00 41.01 142 A 1 ATOM 1136 C CZ . ARG A 1 142 ? 15.260 -1.481 22.144 1.00 38.03 142 A 1 ATOM 1137 N NH1 . ARG A 1 142 ? 15.922 -2.562 21.849 1.00 37.01 142 A 1 ATOM 1138 N NH2 . ARG A 1 142 ? 15.599 -0.827 23.221 1.00 36.39 142 A 1 ATOM 1139 N N . LEU A 1 143 ? 10.629 -0.123 16.008 1.00 46.35 143 A 1 ATOM 1140 C CA . LEU A 1 143 ? 10.494 1.035 15.110 1.00 46.90 143 A 1 ATOM 1141 C C . LEU A 1 143 ? 9.063 1.587 15.089 1.00 47.03 143 A 1 ATOM 1142 O O . LEU A 1 143 ? 8.863 2.802 15.127 1.00 46.86 143 A 1 ATOM 1143 C CB . LEU A 1 143 ? 10.933 0.594 13.711 1.00 45.40 143 A 1 ATOM 1144 C CG . LEU A 1 143 ? 12.272 1.218 13.301 1.00 42.42 143 A 1 ATOM 1145 C CD1 . LEU A 1 143 ? 13.152 0.217 12.568 1.00 39.75 143 A 1 ATOM 1146 C CD2 . LEU A 1 143 ? 12.005 2.412 12.405 1.00 39.29 143 A 1 ATOM 1147 N N . THR A 1 144 ? 8.078 0.692 15.054 1.00 47.41 144 A 1 ATOM 1148 C CA . THR A 1 144 ? 6.653 1.035 15.048 1.00 48.22 144 A 1 ATOM 1149 C C . THR A 1 144 ? 6.248 1.700 16.365 1.00 48.54 144 A 1 ATOM 1150 O O . THR A 1 144 ? 5.579 2.733 16.349 1.00 48.29 144 A 1 ATOM 1151 C CB . THR A 1 144 ? 5.803 -0.212 14.783 1.00 46.78 144 A 1 ATOM 1152 O OG1 . THR A 1 144 ? 6.210 -0.823 13.581 1.00 43.10 144 A 1 ATOM 1153 C CG2 . THR A 1 144 ? 4.324 0.127 14.624 1.00 41.90 144 A 1 ATOM 1154 N N . ASP A 1 145 ? 6.721 1.179 17.494 1.00 47.81 145 A 1 ATOM 1155 C CA . ASP A 1 145 ? 6.473 1.758 18.819 1.00 49.71 145 A 1 ATOM 1156 C C . ASP A 1 145 ? 7.167 3.112 19.016 1.00 49.09 145 A 1 ATOM 1157 O O . ASP A 1 145 ? 6.566 4.034 19.569 1.00 49.07 145 A 1 ATOM 1158 C CB . ASP A 1 145 ? 6.882 0.762 19.908 1.00 50.35 145 A 1 ATOM 1159 C CG . ASP A 1 145 ? 5.904 -0.405 20.040 1.00 46.27 145 A 1 ATOM 1160 O OD1 . ASP A 1 145 ? 4.706 -0.228 19.660 1.00 44.49 145 A 1 ATOM 1161 O OD2 . ASP A 1 145 ? 6.338 -1.448 20.572 1.00 45.03 145 A 1 ATOM 1162 N N . LEU A 1 146 ? 8.367 3.289 18.480 1.00 48.99 146 A 1 ATOM 1163 C CA . LEU A 1 146 ? 9.057 4.587 18.493 1.00 49.68 146 A 1 ATOM 1164 C C . LEU A 1 146 ? 8.328 5.649 17.669 1.00 49.22 146 A 1 ATOM 1165 O O . LEU A 1 146 ? 8.175 6.780 18.134 1.00 49.11 146 A 1 ATOM 1166 C CB . LEU A 1 146 ? 10.507 4.410 18.008 1.00 48.35 146 A 1 ATOM 1167 C CG . LEU A 1 146 ? 11.532 4.628 19.136 1.00 44.96 146 A 1 ATOM 1168 C CD1 . LEU A 1 146 ? 12.550 3.484 19.198 1.00 42.42 146 A 1 ATOM 1169 C CD2 . LEU A 1 146 ? 12.300 5.930 18.912 1.00 41.94 146 A 1 ATOM 1170 N N . CYS A 1 147 ? 7.820 5.299 16.482 1.00 46.20 147 A 1 ATOM 1171 C CA . CYS A 1 147 ? 6.990 6.202 15.672 1.00 45.83 147 A 1 ATOM 1172 C C . CYS A 1 147 ? 5.677 6.540 16.385 1.00 44.60 147 A 1 ATOM 1173 O O . CYS A 1 147 ? 5.283 7.699 16.403 1.00 43.87 147 A 1 ATOM 1174 C CB . CYS A 1 147 ? 6.720 5.603 14.272 1.00 44.63 147 A 1 ATOM 1175 S SG . CYS A 1 147 ? 7.897 6.094 12.959 1.00 42.08 147 A 1 ATOM 1176 N N . ARG A 1 148 ? 5.025 5.570 17.022 1.00 50.26 148 A 1 ATOM 1177 C CA . ARG A 1 148 ? 3.769 5.761 17.756 1.00 51.32 148 A 1 ATOM 1178 C C . ARG A 1 148 ? 3.953 6.655 18.988 1.00 50.34 148 A 1 ATOM 1179 O O . ARG A 1 148 ? 3.089 7.496 19.264 1.00 49.24 148 A 1 ATOM 1180 C CB . ARG A 1 148 ? 3.203 4.384 18.139 1.00 50.94 148 A 1 ATOM 1181 C CG . ARG A 1 148 ? 1.788 4.471 18.727 1.00 48.16 148 A 1 ATOM 1182 C CD . ARG A 1 148 ? 1.296 3.102 19.202 1.00 47.19 148 A 1 ATOM 1183 N NE . ARG A 1 148 ? 0.985 2.184 18.094 1.00 44.97 148 A 1 ATOM 1184 C CZ . ARG A 1 148 ? 1.136 0.858 18.088 1.00 41.27 148 A 1 ATOM 1185 N NH1 . ARG A 1 148 ? 1.640 0.220 19.104 1.00 40.70 148 A 1 ATOM 1186 N NH2 . ARG A 1 148 ? 0.777 0.158 17.063 1.00 40.11 148 A 1 ATOM 1187 N N . ASN A 1 149 ? 5.052 6.517 19.711 1.00 49.96 149 A 1 ATOM 1188 C CA . ASN A 1 149 ? 5.329 7.311 20.908 1.00 50.94 149 A 1 ATOM 1189 C C . ASN A 1 149 ? 5.770 8.746 20.570 1.00 48.50 149 A 1 ATOM 1190 O O . ASN A 1 149 ? 5.307 9.691 21.213 1.00 46.57 149 A 1 ATOM 1191 C CB . ASN A 1 149 ? 6.346 6.562 21.777 1.00 50.93 149 A 1 ATOM 1192 C CG . ASN A 1 149 ? 5.744 5.337 22.449 1.00 48.41 149 A 1 ATOM 1193 O OD1 . ASN A 1 149 ? 4.535 5.185 22.583 1.00 46.82 149 A 1 ATOM 1194 N ND2 . ASN A 1 149 ? 6.561 4.425 22.918 1.00 45.86 149 A 1 ATOM 1195 N N . LYS A 1 150 ? 6.570 8.943 19.507 1.00 44.70 150 A 1 ATOM 1196 C CA . LYS A 1 150 ? 6.963 10.288 19.059 1.00 44.97 150 A 1 ATOM 1197 C C . LYS A 1 150 ? 5.836 11.042 18.353 1.00 43.14 150 A 1 ATOM 1198 O O . LYS A 1 150 ? 5.798 12.263 18.474 1.00 40.99 150 A 1 ATOM 1199 C CB . LYS A 1 150 ? 8.227 10.252 18.190 1.00 43.27 150 A 1 ATOM 1200 C CG . LYS A 1 150 ? 9.504 10.127 19.046 1.00 39.91 150 A 1 ATOM 1201 C CD . LYS A 1 150 ? 10.751 10.535 18.241 1.00 37.75 150 A 1 ATOM 1202 C CE . LYS A 1 150 ? 11.995 10.465 19.133 1.00 35.11 150 A 1 ATOM 1203 N NZ . LYS A 1 150 ? 13.246 10.890 18.421 1.00 33.28 150 A 1 ATOM 1204 N N . SER A 1 151 ? 4.905 10.378 17.653 1.00 40.00 151 A 1 ATOM 1205 C CA . SER A 1 151 ? 3.748 11.060 17.067 1.00 40.58 151 A 1 ATOM 1206 C C . SER A 1 151 ? 2.835 11.631 18.148 1.00 40.18 151 A 1 ATOM 1207 O O . SER A 1 151 ? 2.351 12.752 17.989 1.00 37.90 151 A 1 ATOM 1208 C CB . SER A 1 151 ? 2.967 10.157 16.113 1.00 37.87 151 A 1 ATOM 1209 O OG . SER A 1 151 ? 2.257 9.140 16.796 1.00 36.09 151 A 1 ATOM 1210 N N . LYS A 1 152 ? 2.661 10.933 19.277 1.00 39.03 152 A 1 ATOM 1211 C CA . LYS A 1 152 ? 1.896 11.440 20.426 1.00 40.83 152 A 1 ATOM 1212 C C . LYS A 1 152 ? 2.557 12.666 21.065 1.00 40.06 152 A 1 ATOM 1213 O O . LYS A 1 152 ? 1.895 13.686 21.218 1.00 38.35 152 A 1 ATOM 1214 C CB . LYS A 1 152 ? 1.680 10.332 21.468 1.00 40.64 152 A 1 ATOM 1215 C CG . LYS A 1 152 ? 0.631 9.329 21.019 1.00 37.65 152 A 1 ATOM 1216 C CD . LYS A 1 152 ? 0.410 8.281 22.118 1.00 36.77 152 A 1 ATOM 1217 C CE . LYS A 1 152 ? -0.702 7.310 21.728 1.00 33.63 152 A 1 ATOM 1218 N NZ . LYS A 1 152 ? -1.005 6.395 22.858 1.00 31.75 152 A 1 ATOM 1219 N N . SER A 1 153 ? 3.855 12.622 21.336 1.00 33.10 153 A 1 ATOM 1220 C CA . SER A 1 153 ? 4.557 13.760 21.950 1.00 35.38 153 A 1 ATOM 1221 C C . SER A 1 153 ? 4.708 14.969 21.021 1.00 35.42 153 A 1 ATOM 1222 O O . SER A 1 153 ? 4.703 16.103 21.488 1.00 33.39 153 A 1 ATOM 1223 C CB . SER A 1 153 ? 5.929 13.311 22.473 1.00 32.85 153 A 1 ATOM 1224 O OG . SER A 1 153 ? 6.775 12.884 21.429 1.00 30.08 153 A 1 ATOM 1225 N N . ALA A 1 154 ? 4.816 14.767 19.703 1.00 31.08 154 A 1 ATOM 1226 C CA . ALA A 1 154 ? 4.889 15.842 18.722 1.00 31.91 154 A 1 ATOM 1227 C C . ALA A 1 154 ? 3.515 16.475 18.432 1.00 32.37 154 A 1 ATOM 1228 O O . ALA A 1 154 ? 3.440 17.679 18.218 1.00 30.91 154 A 1 ATOM 1229 C CB . ALA A 1 154 ? 5.547 15.316 17.446 1.00 29.75 154 A 1 ATOM 1230 N N . ALA A 1 155 ? 2.430 15.690 18.473 1.00 29.70 155 A 1 ATOM 1231 C CA . ALA A 1 155 ? 1.064 16.191 18.340 1.00 30.96 155 A 1 ATOM 1232 C C . ALA A 1 155 ? 0.634 17.041 19.549 1.00 31.12 155 A 1 ATOM 1233 O O . ALA A 1 155 ? -0.090 18.015 19.378 1.00 29.88 155 A 1 ATOM 1234 C CB . ALA A 1 155 ? 0.118 15.009 18.127 1.00 29.20 155 A 1 ATOM 1235 N N . GLU A 1 156 ? 1.122 16.728 20.758 1.00 30.13 156 A 1 ATOM 1236 C CA . GLU A 1 156 ? 0.897 17.547 21.955 1.00 31.22 156 A 1 ATOM 1237 C C . GLU A 1 156 ? 1.693 18.864 21.939 1.00 31.15 156 A 1 ATOM 1238 O O . GLU A 1 156 ? 1.220 19.872 22.447 1.00 30.35 156 A 1 ATOM 1239 C CB . GLU A 1 156 ? 1.247 16.723 23.214 1.00 30.81 156 A 1 ATOM 1240 C CG . GLU A 1 156 ? 0.164 15.693 23.550 1.00 28.25 156 A 1 ATOM 1241 C CD . GLU A 1 156 ? 0.528 14.771 24.734 1.00 26.67 156 A 1 ATOM 1242 O OE1 . GLU A 1 156 ? -0.369 13.985 25.136 1.00 24.87 156 A 1 ATOM 1243 O OE2 . GLU A 1 156 ? 1.690 14.797 25.198 1.00 26.63 156 A 1 ATOM 1244 N N . ALA A 1 157 ? 2.883 18.885 21.327 1.00 29.21 157 A 1 ATOM 1245 C CA . ALA A 1 157 ? 3.746 20.072 21.283 1.00 29.99 157 A 1 ATOM 1246 C C . ALA A 1 157 ? 3.446 21.018 20.103 1.00 30.10 157 A 1 ATOM 1247 O O . ALA A 1 157 ? 3.682 22.227 20.209 1.00 29.02 157 A 1 ATOM 1248 C CB . ALA A 1 157 ? 5.201 19.600 21.287 1.00 28.13 157 A 1 ATOM 1249 N N . TYR A 1 158 ? 2.926 20.504 18.983 1.00 25.71 158 A 1 ATOM 1250 C CA . TYR A 1 158 ? 2.687 21.262 17.760 1.00 26.41 158 A 1 ATOM 1251 C C . TYR A 1 158 ? 1.384 20.796 17.094 1.00 26.70 158 A 1 ATOM 1252 O O . TYR A 1 158 ? 1.375 19.830 16.336 1.00 25.63 158 A 1 ATOM 1253 C CB . TYR A 1 158 ? 3.881 21.116 16.807 1.00 24.90 158 A 1 ATOM 1254 C CG . TYR A 1 158 ? 5.191 21.649 17.330 1.00 23.02 158 A 1 ATOM 1255 C CD1 . TYR A 1 158 ? 5.485 23.024 17.236 1.00 21.18 158 A 1 ATOM 1256 C CD2 . TYR A 1 158 ? 6.122 20.778 17.938 1.00 20.44 158 A 1 ATOM 1257 C CE1 . TYR A 1 158 ? 6.703 23.526 17.749 1.00 19.68 158 A 1 ATOM 1258 C CE2 . TYR A 1 158 ? 7.332 21.275 18.452 1.00 20.02 158 A 1 ATOM 1259 C CZ . TYR A 1 158 ? 7.626 22.653 18.360 1.00 19.59 158 A 1 ATOM 1260 O OH . TYR A 1 158 ? 8.792 23.134 18.864 1.00 18.74 158 A 1 ATOM 1261 N N . HIS A 1 159 ? 0.298 21.516 17.322 1.00 26.18 159 A 1 ATOM 1262 C CA . HIS A 1 159 ? -1.061 21.193 16.860 1.00 27.36 159 A 1 ATOM 1263 C C . HIS A 1 159 ? -1.258 21.021 15.325 1.00 27.72 159 A 1 ATOM 1264 O O . HIS A 1 159 ? -2.366 20.717 14.900 1.00 26.32 159 A 1 ATOM 1265 C CB . HIS A 1 159 ? -2.031 22.262 17.403 1.00 25.63 159 A 1 ATOM 1266 C CG . HIS A 1 159 ? -2.468 22.020 18.826 1.00 23.58 159 A 1 ATOM 1267 N ND1 . HIS A 1 159 ? -3.203 20.937 19.256 1.00 21.38 159 A 1 ATOM 1268 C CD2 . HIS A 1 159 ? -2.271 22.823 19.911 1.00 20.67 159 A 1 ATOM 1269 C CE1 . HIS A 1 159 ? -3.436 21.084 20.577 1.00 20.32 159 A 1 ATOM 1270 N NE2 . HIS A 1 159 ? -2.894 22.226 21.011 1.00 20.43 159 A 1 ATOM 1271 N N . THR A 1 160 ? -0.226 21.198 14.499 1.00 28.58 160 A 1 ATOM 1272 C CA . THR A 1 160 ? -0.332 21.193 13.027 1.00 29.84 160 A 1 ATOM 1273 C C . THR A 1 160 ? 0.750 20.390 12.299 1.00 30.32 160 A 1 ATOM 1274 O O . THR A 1 160 ? 0.807 20.427 11.073 1.00 29.00 160 A 1 ATOM 1275 C CB . THR A 1 160 ? -0.366 22.634 12.486 1.00 28.00 160 A 1 ATOM 1276 O OG1 . THR A 1 160 ? 0.723 23.364 12.994 1.00 25.67 160 A 1 ATOM 1277 C CG2 . THR A 1 160 ? -1.638 23.378 12.891 1.00 25.63 160 A 1 ATOM 1278 N N . VAL A 1 161 ? 1.609 19.651 13.003 1.00 29.04 161 A 1 ATOM 1279 C CA . VAL A 1 161 ? 2.678 18.875 12.359 1.00 29.85 161 A 1 ATOM 1280 C C . VAL A 1 161 ? 2.256 17.404 12.241 1.00 30.44 161 A 1 ATOM 1281 O O . VAL A 1 161 ? 2.377 16.623 13.180 1.00 29.22 161 A 1 ATOM 1282 C CB . VAL A 1 161 ? 4.035 19.059 13.063 1.00 27.99 161 A 1 ATOM 1283 C CG1 . VAL A 1 161 ? 5.163 18.329 12.310 1.00 25.15 161 A 1 ATOM 1284 C CG2 . VAL A 1 161 ? 4.428 20.543 13.130 1.00 25.10 161 A 1 ATOM 1285 N N . GLU A 1 162 ? 1.778 17.007 11.046 1.00 29.80 162 A 1 ATOM 1286 C CA . GLU A 1 162 ? 1.611 15.593 10.701 1.00 30.31 162 A 1 ATOM 1287 C C . GLU A 1 162 ? 2.988 14.917 10.592 1.00 30.80 162 A 1 ATOM 1288 O O . GLU A 1 162 ? 3.731 15.115 9.635 1.00 30.52 162 A 1 ATOM 1289 C CB . GLU A 1 162 ? 0.824 15.432 9.392 1.00 29.57 162 A 1 ATOM 1290 C CG . GLU A 1 162 ? -0.685 15.669 9.565 1.00 27.48 162 A 1 ATOM 1291 C CD . GLU A 1 162 ? -1.458 15.419 8.253 1.00 26.01 162 A 1 ATOM 1292 O OE1 . GLU A 1 162 ? -2.652 15.053 8.354 1.00 24.12 162 A 1 ATOM 1293 O OE2 . GLU A 1 162 ? -0.854 15.581 7.172 1.00 25.22 162 A 1 ATOM 1294 N N . CYS A 1 163 ? 3.327 14.087 11.586 1.00 33.37 163 A 1 ATOM 1295 C CA . CYS A 1 163 ? 4.528 13.260 11.533 1.00 33.46 163 A 1 ATOM 1296 C C . CYS A 1 163 ? 4.340 12.116 10.527 1.00 33.15 163 A 1 ATOM 1297 O O . CYS A 1 163 ? 3.767 11.072 10.838 1.00 33.15 163 A 1 ATOM 1298 C CB . CYS A 1 163 ? 4.853 12.740 12.941 1.00 32.63 163 A 1 ATOM 1299 S SG . CYS A 1 163 ? 5.663 14.048 13.917 1.00 31.25 163 A 1 ATOM 1300 N N . HIS A 1 164 ? 4.881 12.288 9.314 1.00 31.31 164 A 1 ATOM 1301 C CA . HIS A 1 164 ? 4.928 11.231 8.311 1.00 32.07 164 A 1 ATOM 1302 C C . HIS A 1 164 ? 6.171 10.359 8.537 1.00 32.31 164 A 1 ATOM 1303 O O . HIS A 1 164 ? 7.290 10.741 8.192 1.00 31.83 164 A 1 ATOM 1304 C CB . HIS A 1 164 ? 4.895 11.851 6.908 1.00 30.92 164 A 1 ATOM 1305 C CG . HIS A 1 164 ? 3.535 12.387 6.522 1.00 28.99 164 A 1 ATOM 1306 N ND1 . HIS A 1 164 ? 2.867 13.455 7.081 1.00 26.68 164 A 1 ATOM 1307 C CD2 . HIS A 1 164 ? 2.736 11.884 5.540 1.00 26.31 164 A 1 ATOM 1308 C CE1 . HIS A 1 164 ? 1.695 13.586 6.462 1.00 24.63 164 A 1 ATOM 1309 N NE2 . HIS A 1 164 ? 1.564 12.651 5.496 1.00 24.71 164 A 1 ATOM 1310 N N . CYS A 1 165 ? 5.991 9.163 9.101 1.00 34.93 165 A 1 ATOM 1311 C CA . CYS A 1 165 ? 7.036 8.142 9.138 1.00 35.02 165 A 1 ATOM 1312 C C . CYS A 1 165 ? 7.148 7.485 7.756 1.00 34.54 165 A 1 ATOM 1313 O O . CYS A 1 165 ? 6.497 6.485 7.463 1.00 34.30 165 A 1 ATOM 1314 C CB . CYS A 1 165 ? 6.749 7.120 10.258 1.00 34.58 165 A 1 ATOM 1315 S SG . CYS A 1 165 ? 7.150 7.676 11.951 1.00 32.63 165 A 1 ATOM 1316 N N . ILE A 1 166 ? 8.009 8.035 6.894 1.00 30.37 166 A 1 ATOM 1317 C CA . ILE A 1 166 ? 8.356 7.420 5.611 1.00 30.37 166 A 1 ATOM 1318 C C . ILE A 1 166 ? 9.541 6.484 5.861 1.00 30.41 166 A 1 ATOM 1319 O O . ILE A 1 166 ? 10.656 6.933 6.131 1.00 29.62 166 A 1 ATOM 1320 C CB . ILE A 1 166 ? 8.650 8.480 4.528 1.00 28.85 166 A 1 ATOM 1321 C CG1 . ILE A 1 166 ? 7.452 9.449 4.355 1.00 26.99 166 A 1 ATOM 1322 C CG2 . ILE A 1 166 ? 8.974 7.768 3.181 1.00 27.41 166 A 1 ATOM 1323 C CD1 . ILE A 1 166 ? 7.700 10.606 3.375 1.00 25.86 166 A 1 ATOM 1324 N N . TYR A 1 167 ? 9.304 5.174 5.776 1.00 31.90 167 A 1 ATOM 1325 C CA . TYR A 1 167 ? 10.346 4.156 5.788 1.00 32.87 167 A 1 ATOM 1326 C C . TYR A 1 167 ? 10.284 3.356 4.489 1.00 32.99 167 A 1 ATOM 1327 O O . TYR A 1 167 ? 9.216 2.972 4.018 1.00 31.83 167 A 1 ATOM 1328 C CB . TYR A 1 167 ? 10.239 3.275 7.048 1.00 31.72 167 A 1 ATOM 1329 C CG . TYR A 1 167 ? 8.902 2.592 7.252 1.00 29.71 167 A 1 ATOM 1330 C CD1 . TYR A 1 167 ? 7.890 3.217 8.015 1.00 27.52 167 A 1 ATOM 1331 C CD2 . TYR A 1 167 ? 8.648 1.335 6.676 1.00 27.10 167 A 1 ATOM 1332 C CE1 . TYR A 1 167 ? 6.646 2.600 8.199 1.00 25.61 167 A 1 ATOM 1333 C CE2 . TYR A 1 167 ? 7.402 0.709 6.855 1.00 26.16 167 A 1 ATOM 1334 C CZ . TYR A 1 167 ? 6.396 1.339 7.612 1.00 25.50 167 A 1 ATOM 1335 O OH . TYR A 1 167 ? 5.188 0.735 7.770 1.00 24.62 167 A 1 ATOM 1336 N N . THR A 1 168 ? 11.451 3.088 3.902 1.00 29.51 168 A 1 ATOM 1337 C CA . THR A 1 168 ? 11.583 2.182 2.752 1.00 30.07 168 A 1 ATOM 1338 C C . THR A 1 168 ? 12.231 0.902 3.263 1.00 30.30 168 A 1 ATOM 1339 O O . THR A 1 168 ? 13.365 0.933 3.738 1.00 29.18 168 A 1 ATOM 1340 C CB . THR A 1 168 ? 12.392 2.802 1.597 1.00 28.58 168 A 1 ATOM 1341 O OG1 . THR A 1 168 ? 12.108 4.182 1.449 1.00 26.89 168 A 1 ATOM 1342 C CG2 . THR A 1 168 ? 12.044 2.133 0.261 1.00 26.57 168 A 1 ATOM 1343 N N . ILE A 1 169 ? 11.490 -0.211 3.225 1.00 30.44 169 A 1 ATOM 1344 C CA . ILE A 1 169 ? 12.005 -1.535 3.592 1.00 31.58 169 A 1 ATOM 1345 C C . ILE A 1 169 ? 12.353 -2.256 2.293 1.00 31.41 169 A 1 ATOM 1346 O O . ILE A 1 169 ? 11.465 -2.550 1.502 1.00 30.55 169 A 1 ATOM 1347 C CB . ILE A 1 169 ? 10.999 -2.328 4.449 1.00 30.76 169 A 1 ATOM 1348 C CG1 . ILE A 1 169 ? 10.546 -1.532 5.693 1.00 29.30 169 A 1 ATOM 1349 C CG2 . ILE A 1 169 ? 11.648 -3.660 4.897 1.00 29.35 169 A 1 ATOM 1350 C CD1 . ILE A 1 169 ? 9.470 -2.225 6.550 1.00 27.81 169 A 1 ATOM 1351 N N . GLU A 1 170 ? 13.639 -2.538 2.072 1.00 29.57 170 A 1 ATOM 1352 C CA . GLU A 1 170 ? 14.046 -3.478 1.039 1.00 30.28 170 A 1 ATOM 1353 C C . GLU A 1 170 ? 14.107 -4.887 1.635 1.00 30.38 170 A 1 ATOM 1354 O O . GLU A 1 170 ? 14.881 -5.164 2.562 1.00 29.82 170 A 1 ATOM 1355 C CB . GLU A 1 170 ? 15.380 -3.090 0.392 1.00 30.08 170 A 1 ATOM 1356 C CG . GLU A 1 170 ? 15.214 -1.954 -0.642 1.00 28.18 170 A 1 ATOM 1357 C CD . GLU A 1 170 ? 16.496 -1.654 -1.429 1.00 26.95 170 A 1 ATOM 1358 O OE1 . GLU A 1 170 ? 16.378 -0.942 -2.461 1.00 25.06 170 A 1 ATOM 1359 O OE2 . GLU A 1 170 ? 17.581 -2.135 -1.036 1.00 26.37 170 A 1 ATOM 1360 N N . TRP A 1 171 ? 13.280 -5.791 1.115 1.00 28.76 171 A 1 ATOM 1361 C CA . TRP A 1 171 ? 13.279 -7.205 1.487 1.00 29.21 171 A 1 ATOM 1362 C C . TRP A 1 171 ? 14.191 -7.950 0.508 1.00 29.09 171 A 1 ATOM 1363 O O . TRP A 1 171 ? 13.900 -8.015 -0.681 1.00 28.02 171 A 1 ATOM 1364 C CB . TRP A 1 171 ? 11.847 -7.744 1.457 1.00 27.97 171 A 1 ATOM 1365 C CG . TRP A 1 171 ? 10.858 -6.990 2.297 1.00 26.91 171 A 1 ATOM 1366 C CD1 . TRP A 1 171 ? 10.149 -5.910 1.897 1.00 24.92 171 A 1 ATOM 1367 C CD2 . TRP A 1 171 ? 10.480 -7.223 3.693 1.00 25.24 171 A 1 ATOM 1368 N NE1 . TRP A 1 171 ? 9.367 -5.457 2.941 1.00 24.27 171 A 1 ATOM 1369 C CE2 . TRP A 1 171 ? 9.524 -6.228 4.073 1.00 24.53 171 A 1 ATOM 1370 C CE3 . TRP A 1 171 ? 10.841 -8.172 4.672 1.00 25.61 171 A 1 ATOM 1371 C CZ2 . TRP A 1 171 ? 8.962 -6.175 5.361 1.00 23.40 171 A 1 ATOM 1372 C CZ3 . TRP A 1 171 ? 10.276 -8.131 5.971 1.00 23.46 171 A 1 ATOM 1373 C CH2 . TRP A 1 171 ? 9.343 -7.133 6.317 1.00 22.99 171 A 1 ATOM 1374 N N . LYS A 1 172 ? 15.288 -8.537 0.994 1.00 29.53 172 A 1 ATOM 1375 C CA . LYS A 1 172 ? 16.068 -9.510 0.227 1.00 30.52 172 A 1 ATOM 1376 C C . LYS A 1 172 ? 15.581 -10.911 0.582 1.00 30.41 172 A 1 ATOM 1377 O O . LYS A 1 172 ? 15.865 -11.410 1.664 1.00 29.79 172 A 1 ATOM 1378 C CB . LYS A 1 172 ? 17.575 -9.344 0.453 1.00 30.34 172 A 1 ATOM 1379 C CG . LYS A 1 172 ? 18.134 -8.159 -0.342 1.00 28.39 172 A 1 ATOM 1380 C CD . LYS A 1 172 ? 19.670 -8.107 -0.221 1.00 26.79 172 A 1 ATOM 1381 C CE . LYS A 1 172 ? 20.229 -6.956 -1.061 1.00 24.55 172 A 1 ATOM 1382 N NZ . LYS A 1 172 ? 21.697 -6.880 -0.947 1.00 23.36 172 A 1 ATOM 1383 N N . CYS A 1 173 ? 14.864 -11.540 -0.343 1.00 31.37 173 A 1 ATOM 1384 C CA . CYS A 1 173 ? 14.485 -12.942 -0.240 1.00 31.65 173 A 1 ATOM 1385 C C . CYS A 1 173 ? 15.615 -13.801 -0.822 1.00 31.06 173 A 1 ATOM 1386 O O . CYS A 1 173 ? 15.895 -13.712 -2.014 1.00 30.31 173 A 1 ATOM 1387 C CB . CYS A 1 173 ? 13.153 -13.166 -0.965 1.00 31.01 173 A 1 ATOM 1388 S SG . CYS A 1 173 ? 11.820 -12.202 -0.184 1.00 29.65 173 A 1 ATOM 1389 N N . TYR A 1 174 ? 16.262 -14.619 0.005 1.00 28.55 174 A 1 ATOM 1390 C CA . TYR A 1 174 ? 17.154 -15.663 -0.484 1.00 29.21 174 A 1 ATOM 1391 C C . TYR A 1 174 ? 16.331 -16.896 -0.850 1.00 29.15 174 A 1 ATOM 1392 O O . TYR A 1 174 ? 15.611 -17.450 -0.024 1.00 28.21 174 A 1 ATOM 1393 C CB . TYR A 1 174 ? 18.267 -15.979 0.533 1.00 28.44 174 A 1 ATOM 1394 C CG . TYR A 1 174 ? 19.463 -15.055 0.402 1.00 27.04 174 A 1 ATOM 1395 C CD1 . TYR A 1 174 ? 20.525 -15.401 -0.467 1.00 24.79 174 A 1 ATOM 1396 C CD2 . TYR A 1 174 ? 19.516 -13.847 1.120 1.00 24.41 174 A 1 ATOM 1397 C CE1 . TYR A 1 174 ? 21.635 -14.547 -0.608 1.00 23.19 174 A 1 ATOM 1398 C CE2 . TYR A 1 174 ? 20.624 -12.983 0.977 1.00 24.25 174 A 1 ATOM 1399 C CZ . TYR A 1 174 ? 21.683 -13.340 0.114 1.00 23.50 174 A 1 ATOM 1400 O OH . TYR A 1 174 ? 22.755 -12.515 -0.016 1.00 23.04 174 A 1 ATOM 1401 N N . HIS A 1 175 ? 16.435 -17.327 -2.103 1.00 27.84 175 A 1 ATOM 1402 C CA . HIS A 1 175 ? 15.909 -18.612 -2.532 1.00 28.97 175 A 1 ATOM 1403 C C . HIS A 1 175 ? 16.935 -19.687 -2.147 1.00 29.23 175 A 1 ATOM 1404 O O . HIS A 1 175 ? 18.009 -19.742 -2.742 1.00 27.75 175 A 1 ATOM 1405 C CB . HIS A 1 175 ? 15.614 -18.567 -4.045 1.00 27.62 175 A 1 ATOM 1406 C CG . HIS A 1 175 ? 14.584 -19.572 -4.517 1.00 25.35 175 A 1 ATOM 1407 N ND1 . HIS A 1 175 ? 13.413 -19.911 -3.878 1.00 23.13 175 A 1 ATOM 1408 C CD2 . HIS A 1 175 ? 14.605 -20.250 -5.714 1.00 22.95 175 A 1 ATOM 1409 C CE1 . HIS A 1 175 ? 12.749 -20.775 -4.659 1.00 22.41 175 A 1 ATOM 1410 N NE2 . HIS A 1 175 ? 13.433 -20.996 -5.787 1.00 22.95 175 A 1 ATOM 1411 N N . HIS A 1 176 ? 16.636 -20.508 -1.139 1.00 29.00 176 A 1 ATOM 1412 C CA . HIS A 1 176 ? 17.328 -21.782 -0.997 1.00 31.35 176 A 1 ATOM 1413 C C . HIS A 1 176 ? 16.701 -22.737 -2.009 1.00 31.16 176 A 1 ATOM 1414 O O . HIS A 1 176 ? 15.546 -23.121 -1.867 1.00 29.75 176 A 1 ATOM 1415 C CB . HIS A 1 176 ? 17.292 -22.311 0.453 1.00 31.02 176 A 1 ATOM 1416 C CG . HIS A 1 176 ? 18.633 -22.235 1.146 1.00 29.01 176 A 1 ATOM 1417 N ND1 . HIS A 1 176 ? 19.606 -21.272 0.950 1.00 26.66 176 A 1 ATOM 1418 C CD2 . HIS A 1 176 ? 19.134 -23.130 2.060 1.00 26.29 176 A 1 ATOM 1419 C CE1 . HIS A 1 176 ? 20.658 -21.574 1.726 1.00 26.17 176 A 1 ATOM 1420 N NE2 . HIS A 1 176 ? 20.420 -22.700 2.424 1.00 26.30 176 A 1 ATOM 1421 N N . SER A 1 177 ? 17.448 -23.070 -3.065 1.00 29.26 177 A 1 ATOM 1422 C CA . SER A 1 177 ? 17.171 -24.254 -3.865 1.00 31.92 177 A 1 ATOM 1423 C C . SER A 1 177 ? 17.284 -25.449 -2.925 1.00 31.64 177 A 1 ATOM 1424 O O . SER A 1 177 ? 18.341 -25.667 -2.336 1.00 30.22 177 A 1 ATOM 1425 C CB . SER A 1 177 ? 18.183 -24.380 -5.010 1.00 30.86 177 A 1 ATOM 1426 O OG . SER A 1 177 ? 17.780 -25.382 -5.911 1.00 28.13 177 A 1 ATOM 1427 N N . ILE A 1 178 ? 16.177 -26.149 -2.705 1.00 32.61 178 A 1 ATOM 1428 C CA . ILE A 1 178 ? 16.205 -27.482 -2.118 1.00 38.02 178 A 1 ATOM 1429 C C . ILE A 1 178 ? 16.490 -28.403 -3.306 1.00 38.08 178 A 1 ATOM 1430 O O . ILE A 1 178 ? 15.595 -28.617 -4.115 1.00 35.54 178 A 1 ATOM 1431 C CB . ILE A 1 178 ? 14.883 -27.802 -1.384 1.00 37.37 178 A 1 ATOM 1432 C CG1 . ILE A 1 178 ? 14.589 -26.754 -0.281 1.00 34.54 178 A 1 ATOM 1433 C CG2 . ILE A 1 178 ? 14.950 -29.220 -0.774 1.00 35.61 178 A 1 ATOM 1434 C CD1 . ILE A 1 178 ? 13.209 -26.896 0.386 1.00 33.94 178 A 1 ATOM 1435 N N . ASP A 1 179 ? 17.750 -28.818 -3.439 1.00 31.83 179 A 1 ATOM 1436 C CA . ASP A 1 179 ? 18.123 -29.973 -4.260 1.00 36.33 179 A 1 ATOM 1437 C C . ASP A 1 179 ? 17.658 -31.272 -3.571 1.00 33.31 179 A 1 ATOM 1438 O O . ASP A 1 179 ? 17.745 -31.342 -2.324 1.00 30.57 179 A 1 ATOM 1439 C CB . ASP A 1 179 ? 19.648 -29.985 -4.528 1.00 34.34 179 A 1 ATOM 1440 C CG . ASP A 1 179 ? 20.163 -28.899 -5.488 1.00 31.12 179 A 1 ATOM 1441 O OD1 . ASP A 1 179 ? 19.399 -28.397 -6.351 1.00 29.00 179 A 1 ATOM 1442 O OD2 . ASP A 1 179 ? 21.372 -28.560 -5.375 1.00 26.79 179 A 1 ATOM 1443 O OXT . ASP A 1 179 ? 17.230 -32.168 -4.331 1.00 28.87 179 A 1 #