# By using this file you agree to the legally binding terms of use found at # https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. # To request access to the AlphaFold 3 model parameters, follow the process set # out at https://github.com/google-deepmind/alphafold3. You may only use these if # received directly from Google. Use is subject to terms of use available at # https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. data_fole # _entry.id fole # loop_ _atom_type.symbol C N O S # loop_ _audit_author.name _audit_author.pdbx_ordinal "Google DeepMind" 1 "Isomorphic Labs" 2 # _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 # loop_ _chem_comp.formula _chem_comp.formula_weight _chem_comp.id _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_smiles _chem_comp.pdbx_synonyms _chem_comp.type "C3 H7 N O2" 89.093 ALA y ALANINE C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N ? "L-PEPTIDE LINKING" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" # _citation.book_publisher ? _citation.country UK _citation.id primary _citation.journal_full Nature _citation.journal_id_ASTM NATUAS _citation.journal_id_CSD 0006 _citation.journal_id_ISSN 0028-0836 _citation.journal_volume 630 _citation.page_first 493 _citation.page_last 500 _citation.pdbx_database_id_DOI 10.1038/s41586-024-07487-w _citation.pdbx_database_id_PubMed 38718835 _citation.title "Accurate structure prediction of biomolecular interactions with AlphaFold 3" _citation.year 2024 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary "Google DeepMind" 1 primary "Isomorphic Labs" 2 # _entity.id 1 _entity.pdbx_description . _entity.type polymer # _entity_poly.entity_id 1 _entity_poly.pdbx_strand_id A _entity_poly.type polypeptide(L) # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 1 n MET 1 1 n ILE 2 1 n GLY 3 1 n PHE 4 1 n LEU 5 1 n LYS 6 1 n SER 7 1 n TRP 8 1 n ASP 9 1 n GLY 10 1 n PHE 11 1 n GLY 12 1 n ILE 13 1 n LYS 14 1 n CYS 15 1 n MET 16 1 n LYS 17 1 n THR 18 1 n GLN 19 1 n LEU 20 1 n SER 21 1 n THR 22 1 n MET 23 1 n PHE 24 1 n ASP 25 1 n LEU 26 1 n TYR 27 1 n ARG 28 1 n ASN 29 1 n PHE 30 1 n ILE 31 1 n HIS 32 1 n LEU 33 1 n PHE 34 1 n MET 35 1 n ILE 36 1 n ILE 37 1 n LYS 38 1 n GLU 39 1 n GLU 40 1 n TYR 41 1 n LYS 42 1 n MET 43 1 n LYS 44 1 n ILE 45 1 n GLU 46 1 n HIS 47 1 n LEU 48 1 n ASP 49 1 n LYS 50 1 n ILE 51 1 n GLY 52 1 n ASN 53 1 n VAL 54 1 n LEU 55 1 n GLY 56 1 n ARG 57 1 n GLU 58 1 n ASN 59 1 n GLY 60 1 n TRP 61 1 n ALA 62 1 n SER 63 1 n LEU 64 1 n LYS 65 1 n PRO 66 1 n ASP 67 1 n GLU 68 1 n ILE 69 1 n VAL 70 1 n THR 71 1 n LEU 72 1 n ASP 73 1 n ASN 74 1 n THR 75 1 n GLU 76 1 n ALA 77 1 n ALA 78 1 n VAL 79 1 n GLN 80 1 n ARG 81 1 n LEU 82 1 n PHE 83 1 n GLY 84 1 n LEU 85 1 n LEU 86 1 n GLY 87 1 n GLU 88 1 n ASP 89 1 n ALA 90 1 n GLU 91 1 n ARG 92 1 n ASP 93 1 n GLY 94 1 n LEU 95 1 n GLN 96 1 n ASP 97 1 n THR 98 1 n PRO 99 1 n PHE 100 1 n ARG 101 1 n PHE 102 1 n VAL 103 1 n LYS 104 1 n ALA 105 1 n LEU 106 1 n ALA 107 1 n GLU 108 1 n HIS 109 1 n THR 110 1 n VAL 111 1 n GLY 112 1 n TYR 113 1 n ARG 114 1 n GLU 115 1 n ASP 116 1 n PRO 117 1 n LYS 118 1 n LEU 119 1 n HIS 120 1 n LEU 121 1 n GLU 122 1 n LYS 123 1 n THR 124 1 n PHE 125 1 n ASP 126 1 n VAL 127 1 n ASP 128 1 n HIS 129 1 n GLU 130 1 n ASP 131 1 n LEU 132 1 n VAL 133 1 n LEU 134 1 n VAL 135 1 n LYS 136 1 n ASP 137 1 n ILE 138 1 n PRO 139 1 n PHE 140 1 n ASN 141 1 n SER 142 1 n LEU 143 1 n CYS 144 1 n GLU 145 1 n HIS 146 1 n HIS 147 1 n LEU 148 1 n ALA 149 1 n PRO 150 1 n PHE 151 1 n VAL 152 1 n GLY 153 1 n LYS 154 1 n VAL 155 1 n HIS 156 1 n ILE 157 1 n ALA 158 1 n TYR 159 1 n ILE 160 1 n PRO 161 1 n LYS 162 1 n ASP 163 1 n LYS 164 1 n ILE 165 1 n THR 166 1 n GLY 167 1 n LEU 168 1 n SER 169 1 n LYS 170 1 n PHE 171 1 n GLY 172 1 n ARG 173 1 n VAL 174 1 n VAL 175 1 n GLU 176 1 n GLY 177 1 n TYR 178 1 n ALA 179 1 n LYS 180 1 n ARG 181 1 n LEU 182 1 n GLN 183 1 n VAL 184 1 n GLN 185 1 n GLU 186 1 n ARG 187 1 n LEU 188 1 n THR 189 1 n GLN 190 1 n GLN 191 1 n ILE 192 1 n ALA 193 1 n ASP 194 1 n ALA 195 1 n ILE 196 1 n GLN 197 1 n GLU 198 1 n VAL 199 1 n LEU 200 1 n ASN 201 1 n PRO 202 1 n GLN 203 1 n ALA 204 1 n VAL 205 1 n ALA 206 1 n VAL 207 1 n ILE 208 1 n VAL 209 1 n GLU 210 1 n ALA 211 1 n GLU 212 1 n HIS 213 1 n THR 214 1 n CYS 215 1 n MET 216 1 n SER 217 1 n GLY 218 1 n ARG 219 1 n GLY 220 1 n ILE 221 1 n LYS 222 1 n LYS 223 1 n HIS 224 1 n GLY 225 1 n ALA 226 1 n THR 227 1 n THR 228 1 n VAL 229 1 n THR 230 1 n SER 231 1 n THR 232 1 n MET 233 1 n ARG 234 1 n GLY 235 1 n LEU 236 1 n PHE 237 1 n GLN 238 1 n ASP 239 1 n ASP 240 1 n ALA 241 1 n SER 242 1 n ALA 243 1 n ARG 244 1 n ALA 245 1 n GLU 246 1 n LEU 247 1 n LEU 248 1 n GLN 249 1 n LEU 250 1 n ILE 251 1 n LYS 252 1 n LYS 253 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.1 @ 2025-04-07 01:34:19)" _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 83.65 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # loop_ _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value _ma_qa_metric_local.model_id _ma_qa_metric_local.ordinal_id A MET 1 2 31.03 1 1 A ILE 2 2 34.61 1 2 A GLY 3 2 42.71 1 3 A PHE 4 2 35.99 1 4 A LEU 5 2 38.93 1 5 A LYS 6 2 38.64 1 6 A SER 7 2 45.05 1 7 A TRP 8 2 39.94 1 8 A ASP 9 2 44.37 1 9 A GLY 10 2 48.25 1 10 A PHE 11 2 41.50 1 11 A GLY 12 2 50.25 1 12 A ILE 13 2 43.95 1 13 A LYS 14 2 42.18 1 14 A CYS 15 2 50.62 1 15 A MET 16 2 46.19 1 16 A LYS 17 2 49.03 1 17 A THR 18 2 48.08 1 18 A GLN 19 2 49.26 1 19 A LEU 20 2 53.46 1 20 A SER 21 2 57.53 1 21 A THR 22 2 55.86 1 22 A MET 23 2 53.36 1 23 A PHE 24 2 50.83 1 24 A ASP 25 2 56.94 1 25 A LEU 26 2 59.56 1 26 A TYR 27 2 50.36 1 27 A ARG 28 2 48.01 1 28 A ASN 29 2 59.43 1 29 A PHE 30 2 51.40 1 30 A ILE 31 2 57.52 1 31 A HIS 32 2 48.85 1 32 A LEU 33 2 50.52 1 33 A PHE 34 2 50.43 1 34 A MET 35 2 48.42 1 35 A ILE 36 2 57.18 1 36 A ILE 37 2 58.12 1 37 A LYS 38 2 60.33 1 38 A GLU 39 2 59.84 1 39 A GLU 40 2 65.40 1 40 A TYR 41 2 63.59 1 41 A LYS 42 2 67.67 1 42 A MET 43 2 69.35 1 43 A LYS 44 2 75.01 1 44 A ILE 45 2 77.07 1 45 A GLU 46 2 75.81 1 46 A HIS 47 2 81.82 1 47 A LEU 48 2 82.92 1 48 A ASP 49 2 81.66 1 49 A LYS 50 2 85.51 1 50 A ILE 51 2 85.45 1 51 A GLY 52 2 85.62 1 52 A ASN 53 2 81.87 1 53 A VAL 54 2 85.18 1 54 A LEU 55 2 84.36 1 55 A GLY 56 2 83.73 1 56 A ARG 57 2 74.57 1 57 A GLU 58 2 64.18 1 58 A ASN 59 2 70.01 1 59 A GLY 60 2 75.08 1 60 A TRP 61 2 67.34 1 61 A ALA 62 2 77.16 1 62 A SER 63 2 77.19 1 63 A LEU 64 2 79.88 1 64 A LYS 65 2 77.24 1 65 A PRO 66 2 80.33 1 66 A ASP 67 2 79.46 1 67 A GLU 68 2 83.67 1 68 A ILE 69 2 82.44 1 69 A VAL 70 2 82.79 1 70 A THR 71 2 88.14 1 71 A LEU 72 2 85.42 1 72 A ASP 73 2 83.72 1 73 A ASN 74 2 89.04 1 74 A THR 75 2 92.25 1 75 A GLU 76 2 89.15 1 76 A ALA 77 2 94.07 1 77 A ALA 78 2 95.68 1 78 A VAL 79 2 95.56 1 79 A GLN 80 2 88.74 1 80 A ARG 81 2 87.10 1 81 A LEU 82 2 93.74 1 82 A PHE 83 2 94.24 1 83 A GLY 84 2 95.18 1 84 A LEU 85 2 91.93 1 85 A LEU 86 2 94.16 1 86 A GLY 87 2 95.42 1 87 A GLU 88 2 91.40 1 88 A ASP 89 2 93.66 1 89 A ALA 90 2 93.94 1 90 A GLU 91 2 87.44 1 91 A ARG 92 2 91.37 1 92 A ASP 93 2 89.14 1 93 A GLY 94 2 94.87 1 94 A LEU 95 2 94.67 1 95 A GLN 96 2 88.90 1 96 A ASP 97 2 89.96 1 97 A THR 98 2 95.33 1 98 A PRO 99 2 94.37 1 99 A PHE 100 2 88.01 1 100 A ARG 101 2 93.62 1 101 A PHE 102 2 94.18 1 102 A VAL 103 2 93.42 1 103 A LYS 104 2 90.45 1 104 A ALA 105 2 95.36 1 105 A LEU 106 2 91.77 1 106 A ALA 107 2 93.37 1 107 A GLU 108 2 91.57 1 108 A HIS 109 2 92.64 1 109 A THR 110 2 94.52 1 110 A VAL 111 2 91.30 1 111 A GLY 112 2 95.74 1 112 A TYR 113 2 94.77 1 113 A ARG 114 2 82.81 1 114 A GLU 115 2 89.42 1 115 A ASP 116 2 95.45 1 116 A PRO 117 2 97.35 1 117 A LYS 118 2 94.09 1 118 A LEU 119 2 95.65 1 119 A HIS 120 2 94.97 1 120 A LEU 121 2 96.75 1 121 A GLU 122 2 91.71 1 122 A LYS 123 2 84.31 1 123 A THR 124 2 93.25 1 124 A PHE 125 2 88.41 1 125 A ASP 126 2 86.43 1 126 A VAL 127 2 82.18 1 127 A ASP 128 2 84.23 1 128 A HIS 129 2 85.87 1 129 A GLU 130 2 86.23 1 130 A ASP 131 2 93.29 1 131 A LEU 132 2 94.46 1 132 A VAL 133 2 97.08 1 133 A LEU 134 2 97.12 1 134 A VAL 135 2 97.85 1 135 A LYS 136 2 94.77 1 136 A ASP 137 2 96.86 1 137 A ILE 138 2 98.22 1 138 A PRO 139 2 98.20 1 139 A PHE 140 2 98.26 1 140 A ASN 141 2 90.75 1 141 A SER 142 2 97.97 1 142 A LEU 143 2 95.44 1 143 A CYS 144 2 95.54 1 144 A GLU 145 2 95.19 1 145 A HIS 146 2 93.43 1 146 A HIS 147 2 93.91 1 147 A LEU 148 2 94.33 1 148 A ALA 149 2 95.63 1 149 A PRO 150 2 96.30 1 150 A PHE 151 2 97.15 1 151 A VAL 152 2 94.76 1 152 A GLY 153 2 97.98 1 153 A LYS 154 2 94.64 1 154 A VAL 155 2 98.34 1 155 A HIS 156 2 97.48 1 156 A ILE 157 2 98.16 1 157 A ALA 158 2 98.31 1 158 A TYR 159 2 96.86 1 159 A ILE 160 2 96.18 1 160 A PRO 161 2 95.73 1 161 A LYS 162 2 87.88 1 162 A ASP 163 2 86.50 1 163 A LYS 164 2 84.41 1 164 A ILE 165 2 92.18 1 165 A THR 166 2 95.33 1 166 A GLY 167 2 96.92 1 167 A LEU 168 2 96.24 1 168 A SER 169 2 96.73 1 169 A LYS 170 2 94.88 1 170 A PHE 171 2 97.63 1 171 A GLY 172 2 98.14 1 172 A ARG 173 2 89.41 1 173 A VAL 174 2 97.70 1 174 A VAL 175 2 98.40 1 175 A GLU 176 2 90.65 1 176 A GLY 177 2 97.91 1 177 A TYR 178 2 98.10 1 178 A ALA 179 2 98.16 1 179 A LYS 180 2 94.17 1 180 A ARG 181 2 96.49 1 181 A LEU 182 2 97.31 1 182 A GLN 183 2 96.78 1 183 A VAL 184 2 96.67 1 184 A GLN 185 2 97.52 1 185 A GLU 186 2 97.06 1 186 A ARG 187 2 96.52 1 187 A LEU 188 2 98.12 1 188 A THR 189 2 97.82 1 189 A GLN 190 2 91.26 1 190 A GLN 191 2 97.55 1 191 A ILE 192 2 98.33 1 192 A ALA 193 2 98.34 1 193 A ASP 194 2 96.11 1 194 A ALA 195 2 97.89 1 195 A ILE 196 2 97.60 1 196 A GLN 197 2 94.36 1 197 A GLU 198 2 91.75 1 198 A VAL 199 2 96.06 1 199 A LEU 200 2 95.73 1 200 A ASN 201 2 91.38 1 201 A PRO 202 2 96.42 1 202 A GLN 203 2 90.52 1 203 A ALA 204 2 97.04 1 204 A VAL 205 2 95.73 1 205 A ALA 206 2 98.40 1 206 A VAL 207 2 98.25 1 207 A ILE 208 2 97.35 1 208 A VAL 209 2 98.29 1 209 A GLU 210 2 92.49 1 210 A ALA 211 2 97.30 1 211 A GLU 212 2 91.76 1 212 A HIS 213 2 95.44 1 213 A THR 214 2 91.93 1 214 A CYS 215 2 90.19 1 215 A MET 216 2 87.44 1 216 A SER 217 2 84.48 1 217 A GLY 218 2 81.93 1 218 A ARG 219 2 81.71 1 219 A GLY 220 2 81.79 1 220 A ILE 221 2 80.94 1 221 A LYS 222 2 80.21 1 222 A LYS 223 2 83.84 1 223 A HIS 224 2 79.39 1 224 A GLY 225 2 88.91 1 225 A ALA 226 2 91.77 1 226 A THR 227 2 91.47 1 227 A THR 228 2 96.33 1 228 A VAL 229 2 97.37 1 229 A THR 230 2 98.28 1 230 A SER 231 2 97.21 1 231 A THR 232 2 97.30 1 232 A MET 233 2 94.98 1 233 A ARG 234 2 94.30 1 234 A GLY 235 2 95.80 1 235 A LEU 236 2 91.24 1 236 A PHE 237 2 95.96 1 237 A GLN 238 2 91.93 1 238 A ASP 239 2 93.61 1 239 A ASP 240 2 93.25 1 240 A ALA 241 2 95.55 1 241 A SER 242 2 92.25 1 242 A ALA 243 2 94.47 1 243 A ARG 244 2 89.55 1 244 A ALA 245 2 96.02 1 245 A GLU 246 2 88.76 1 246 A LEU 247 2 95.81 1 247 A LEU 248 2 94.47 1 248 A GLN 249 2 86.53 1 249 A LEU 250 2 94.94 1 250 A ILE 251 2 94.20 1 251 A LYS 252 2 81.14 1 252 A LYS 253 2 75.49 1 253 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # _ma_target_entity.data_id 1 _ma_target_entity.entity_id 1 _ma_target_entity.origin . # _ma_target_entity_instance.asym_id A _ma_target_entity_instance.details . _ma_target_entity_instance.entity_id 1 # loop_ _pdbx_data_usage.details _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.url ;Non-commercial use only, by using this file you agree to the terms of use found at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. To request access to the AlphaFold 3 model parameters, follow the process set out at https://github.com/google-deepmind/alphafold3. You may only use these if received directly from Google. Use is subject to terms of use available at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. ; 1 license https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md ;AlphaFold 3 and its output are not intended for, have not been validated for, and are not approved for clinical use. They are provided "as-is" without any warranty of any kind, whether expressed or implied. No warranty is given that use shall not infringe the rights of any third party. ; 2 disclaimer ? # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.hetero _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.seq_id A 1 1 n MET . 1 A 1 A 2 1 n ILE . 2 A 2 A 3 1 n GLY . 3 A 3 A 4 1 n PHE . 4 A 4 A 5 1 n LEU . 5 A 5 A 6 1 n LYS . 6 A 6 A 7 1 n SER . 7 A 7 A 8 1 n TRP . 8 A 8 A 9 1 n ASP . 9 A 9 A 10 1 n GLY . 10 A 10 A 11 1 n PHE . 11 A 11 A 12 1 n GLY . 12 A 12 A 13 1 n ILE . 13 A 13 A 14 1 n LYS . 14 A 14 A 15 1 n CYS . 15 A 15 A 16 1 n MET . 16 A 16 A 17 1 n LYS . 17 A 17 A 18 1 n THR . 18 A 18 A 19 1 n GLN . 19 A 19 A 20 1 n LEU . 20 A 20 A 21 1 n SER . 21 A 21 A 22 1 n THR . 22 A 22 A 23 1 n MET . 23 A 23 A 24 1 n PHE . 24 A 24 A 25 1 n ASP . 25 A 25 A 26 1 n LEU . 26 A 26 A 27 1 n TYR . 27 A 27 A 28 1 n ARG . 28 A 28 A 29 1 n ASN . 29 A 29 A 30 1 n PHE . 30 A 30 A 31 1 n ILE . 31 A 31 A 32 1 n HIS . 32 A 32 A 33 1 n LEU . 33 A 33 A 34 1 n PHE . 34 A 34 A 35 1 n MET . 35 A 35 A 36 1 n ILE . 36 A 36 A 37 1 n ILE . 37 A 37 A 38 1 n LYS . 38 A 38 A 39 1 n GLU . 39 A 39 A 40 1 n GLU . 40 A 40 A 41 1 n TYR . 41 A 41 A 42 1 n LYS . 42 A 42 A 43 1 n MET . 43 A 43 A 44 1 n LYS . 44 A 44 A 45 1 n ILE . 45 A 45 A 46 1 n GLU . 46 A 46 A 47 1 n HIS . 47 A 47 A 48 1 n LEU . 48 A 48 A 49 1 n ASP . 49 A 49 A 50 1 n LYS . 50 A 50 A 51 1 n ILE . 51 A 51 A 52 1 n GLY . 52 A 52 A 53 1 n ASN . 53 A 53 A 54 1 n VAL . 54 A 54 A 55 1 n LEU . 55 A 55 A 56 1 n GLY . 56 A 56 A 57 1 n ARG . 57 A 57 A 58 1 n GLU . 58 A 58 A 59 1 n ASN . 59 A 59 A 60 1 n GLY . 60 A 60 A 61 1 n TRP . 61 A 61 A 62 1 n ALA . 62 A 62 A 63 1 n SER . 63 A 63 A 64 1 n LEU . 64 A 64 A 65 1 n LYS . 65 A 65 A 66 1 n PRO . 66 A 66 A 67 1 n ASP . 67 A 67 A 68 1 n GLU . 68 A 68 A 69 1 n ILE . 69 A 69 A 70 1 n VAL . 70 A 70 A 71 1 n THR . 71 A 71 A 72 1 n LEU . 72 A 72 A 73 1 n ASP . 73 A 73 A 74 1 n ASN . 74 A 74 A 75 1 n THR . 75 A 75 A 76 1 n GLU . 76 A 76 A 77 1 n ALA . 77 A 77 A 78 1 n ALA . 78 A 78 A 79 1 n VAL . 79 A 79 A 80 1 n GLN . 80 A 80 A 81 1 n ARG . 81 A 81 A 82 1 n LEU . 82 A 82 A 83 1 n PHE . 83 A 83 A 84 1 n GLY . 84 A 84 A 85 1 n LEU . 85 A 85 A 86 1 n LEU . 86 A 86 A 87 1 n GLY . 87 A 87 A 88 1 n GLU . 88 A 88 A 89 1 n ASP . 89 A 89 A 90 1 n ALA . 90 A 90 A 91 1 n GLU . 91 A 91 A 92 1 n ARG . 92 A 92 A 93 1 n ASP . 93 A 93 A 94 1 n GLY . 94 A 94 A 95 1 n LEU . 95 A 95 A 96 1 n GLN . 96 A 96 A 97 1 n ASP . 97 A 97 A 98 1 n THR . 98 A 98 A 99 1 n PRO . 99 A 99 A 100 1 n PHE . 100 A 100 A 101 1 n ARG . 101 A 101 A 102 1 n PHE . 102 A 102 A 103 1 n VAL . 103 A 103 A 104 1 n LYS . 104 A 104 A 105 1 n ALA . 105 A 105 A 106 1 n LEU . 106 A 106 A 107 1 n ALA . 107 A 107 A 108 1 n GLU . 108 A 108 A 109 1 n HIS . 109 A 109 A 110 1 n THR . 110 A 110 A 111 1 n VAL . 111 A 111 A 112 1 n GLY . 112 A 112 A 113 1 n TYR . 113 A 113 A 114 1 n ARG . 114 A 114 A 115 1 n GLU . 115 A 115 A 116 1 n ASP . 116 A 116 A 117 1 n PRO . 117 A 117 A 118 1 n LYS . 118 A 118 A 119 1 n LEU . 119 A 119 A 120 1 n HIS . 120 A 120 A 121 1 n LEU . 121 A 121 A 122 1 n GLU . 122 A 122 A 123 1 n LYS . 123 A 123 A 124 1 n THR . 124 A 124 A 125 1 n PHE . 125 A 125 A 126 1 n ASP . 126 A 126 A 127 1 n VAL . 127 A 127 A 128 1 n ASP . 128 A 128 A 129 1 n HIS . 129 A 129 A 130 1 n GLU . 130 A 130 A 131 1 n ASP . 131 A 131 A 132 1 n LEU . 132 A 132 A 133 1 n VAL . 133 A 133 A 134 1 n LEU . 134 A 134 A 135 1 n VAL . 135 A 135 A 136 1 n LYS . 136 A 136 A 137 1 n ASP . 137 A 137 A 138 1 n ILE . 138 A 138 A 139 1 n PRO . 139 A 139 A 140 1 n PHE . 140 A 140 A 141 1 n ASN . 141 A 141 A 142 1 n SER . 142 A 142 A 143 1 n LEU . 143 A 143 A 144 1 n CYS . 144 A 144 A 145 1 n GLU . 145 A 145 A 146 1 n HIS . 146 A 146 A 147 1 n HIS . 147 A 147 A 148 1 n LEU . 148 A 148 A 149 1 n ALA . 149 A 149 A 150 1 n PRO . 150 A 150 A 151 1 n PHE . 151 A 151 A 152 1 n VAL . 152 A 152 A 153 1 n GLY . 153 A 153 A 154 1 n LYS . 154 A 154 A 155 1 n VAL . 155 A 155 A 156 1 n HIS . 156 A 156 A 157 1 n ILE . 157 A 157 A 158 1 n ALA . 158 A 158 A 159 1 n TYR . 159 A 159 A 160 1 n ILE . 160 A 160 A 161 1 n PRO . 161 A 161 A 162 1 n LYS . 162 A 162 A 163 1 n ASP . 163 A 163 A 164 1 n LYS . 164 A 164 A 165 1 n ILE . 165 A 165 A 166 1 n THR . 166 A 166 A 167 1 n GLY . 167 A 167 A 168 1 n LEU . 168 A 168 A 169 1 n SER . 169 A 169 A 170 1 n LYS . 170 A 170 A 171 1 n PHE . 171 A 171 A 172 1 n GLY . 172 A 172 A 173 1 n ARG . 173 A 173 A 174 1 n VAL . 174 A 174 A 175 1 n VAL . 175 A 175 A 176 1 n GLU . 176 A 176 A 177 1 n GLY . 177 A 177 A 178 1 n TYR . 178 A 178 A 179 1 n ALA . 179 A 179 A 180 1 n LYS . 180 A 180 A 181 1 n ARG . 181 A 181 A 182 1 n LEU . 182 A 182 A 183 1 n GLN . 183 A 183 A 184 1 n VAL . 184 A 184 A 185 1 n GLN . 185 A 185 A 186 1 n GLU . 186 A 186 A 187 1 n ARG . 187 A 187 A 188 1 n LEU . 188 A 188 A 189 1 n THR . 189 A 189 A 190 1 n GLN . 190 A 190 A 191 1 n GLN . 191 A 191 A 192 1 n ILE . 192 A 192 A 193 1 n ALA . 193 A 193 A 194 1 n ASP . 194 A 194 A 195 1 n ALA . 195 A 195 A 196 1 n ILE . 196 A 196 A 197 1 n GLN . 197 A 197 A 198 1 n GLU . 198 A 198 A 199 1 n VAL . 199 A 199 A 200 1 n LEU . 200 A 200 A 201 1 n ASN . 201 A 201 A 202 1 n PRO . 202 A 202 A 203 1 n GLN . 203 A 203 A 204 1 n ALA . 204 A 204 A 205 1 n VAL . 205 A 205 A 206 1 n ALA . 206 A 206 A 207 1 n VAL . 207 A 207 A 208 1 n ILE . 208 A 208 A 209 1 n VAL . 209 A 209 A 210 1 n GLU . 210 A 210 A 211 1 n ALA . 211 A 211 A 212 1 n GLU . 212 A 212 A 213 1 n HIS . 213 A 213 A 214 1 n THR . 214 A 214 A 215 1 n CYS . 215 A 215 A 216 1 n MET . 216 A 216 A 217 1 n SER . 217 A 217 A 218 1 n GLY . 218 A 218 A 219 1 n ARG . 219 A 219 A 220 1 n GLY . 220 A 220 A 221 1 n ILE . 221 A 221 A 222 1 n LYS . 222 A 222 A 223 1 n LYS . 223 A 223 A 224 1 n HIS . 224 A 224 A 225 1 n GLY . 225 A 225 A 226 1 n ALA . 226 A 226 A 227 1 n THR . 227 A 227 A 228 1 n THR . 228 A 228 A 229 1 n VAL . 229 A 229 A 230 1 n THR . 230 A 230 A 231 1 n SER . 231 A 231 A 232 1 n THR . 232 A 232 A 233 1 n MET . 233 A 233 A 234 1 n ARG . 234 A 234 A 235 1 n GLY . 235 A 235 A 236 1 n LEU . 236 A 236 A 237 1 n PHE . 237 A 237 A 238 1 n GLN . 238 A 238 A 239 1 n ASP . 239 A 239 A 240 1 n ASP . 240 A 240 A 241 1 n ALA . 241 A 241 A 242 1 n SER . 242 A 242 A 243 1 n ALA . 243 A 243 A 244 1 n ARG . 244 A 244 A 245 1 n ALA . 245 A 245 A 246 1 n GLU . 246 A 246 A 247 1 n LEU . 247 A 247 A 248 1 n LEU . 248 A 248 A 249 1 n GLN . 249 A 249 A 250 1 n LEU . 250 A 250 A 251 1 n ILE . 251 A 251 A 252 1 n LYS . 252 A 252 A 253 1 n LYS . 253 A 253 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (fa08f1a239cfd4fd49a5c37bef32bd41139da97e359ba389d3209450484ef018)" # _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 ? -48.280 76.506 0.291 1.00 29.15 1 A 1 ATOM 2 C CA . MET A 1 1 ? -46.838 76.183 0.386 1.00 34.25 1 A 1 ATOM 3 C C . MET A 1 1 ? -46.571 74.930 1.245 1.00 34.85 1 A 1 ATOM 4 O O . MET A 1 1 ? -45.659 74.930 2.052 1.00 33.77 1 A 1 ATOM 5 C CB . MET A 1 1 ? -46.086 77.438 0.884 1.00 33.87 1 A 1 ATOM 6 C CG . MET A 1 1 ? -44.618 77.484 0.471 1.00 30.22 1 A 1 ATOM 7 S SD . MET A 1 1 ? -43.853 79.093 0.849 1.00 27.25 1 A 1 ATOM 8 C CE . MET A 1 1 ? -43.606 78.949 2.641 1.00 24.85 1 A 1 ATOM 9 N N . ILE A 1 2 ? -47.376 73.848 1.113 1.00 34.34 2 A 1 ATOM 10 C CA . ILE A 1 2 ? -47.259 72.584 1.901 1.00 35.77 2 A 1 ATOM 11 C C . ILE A 1 2 ? -47.325 71.326 0.989 1.00 35.92 2 A 1 ATOM 12 O O . ILE A 1 2 ? -47.362 70.195 1.452 1.00 34.76 2 A 1 ATOM 13 C CB . ILE A 1 2 ? -48.286 72.578 3.080 1.00 35.30 2 A 1 ATOM 14 C CG1 . ILE A 1 2 ? -48.087 73.820 3.995 1.00 32.69 2 A 1 ATOM 15 C CG2 . ILE A 1 2 ? -48.221 71.306 3.954 1.00 34.40 2 A 1 ATOM 16 C CD1 . ILE A 1 2 ? -49.075 73.961 5.163 1.00 33.69 2 A 1 ATOM 17 N N . GLY A 1 3 ? -47.293 71.497 -0.376 1.00 40.79 3 A 1 ATOM 18 C CA . GLY A 1 3 ? -47.441 70.376 -1.320 1.00 44.64 3 A 1 ATOM 19 C C . GLY A 1 3 ? -46.149 69.792 -1.912 1.00 43.69 3 A 1 ATOM 20 O O . GLY A 1 3 ? -46.227 68.811 -2.640 1.00 41.71 3 A 1 ATOM 21 N N . PHE A 1 4 ? -44.958 70.352 -1.631 1.00 37.67 4 A 1 ATOM 22 C CA . PHE A 1 4 ? -43.719 70.039 -2.370 1.00 39.19 4 A 1 ATOM 23 C C . PHE A 1 4 ? -42.668 69.204 -1.602 1.00 38.92 4 A 1 ATOM 24 O O . PHE A 1 4 ? -41.637 68.864 -2.162 1.00 37.74 4 A 1 ATOM 25 C CB . PHE A 1 4 ? -43.146 71.336 -2.968 1.00 37.90 4 A 1 ATOM 26 C CG . PHE A 1 4 ? -42.746 71.187 -4.426 1.00 35.19 4 A 1 ATOM 27 C CD1 . PHE A 1 4 ? -41.413 70.897 -4.773 1.00 32.60 4 A 1 ATOM 28 C CD2 . PHE A 1 4 ? -43.717 71.322 -5.438 1.00 33.73 4 A 1 ATOM 29 C CE1 . PHE A 1 4 ? -41.052 70.743 -6.124 1.00 33.13 4 A 1 ATOM 30 C CE2 . PHE A 1 4 ? -43.358 71.166 -6.789 1.00 33.59 4 A 1 ATOM 31 C CZ . PHE A 1 4 ? -42.026 70.880 -7.132 1.00 36.26 4 A 1 ATOM 32 N N . LEU A 1 5 ? -42.931 68.811 -0.363 1.00 39.42 5 A 1 ATOM 33 C CA . LEU A 1 5 ? -41.947 68.110 0.490 1.00 41.48 5 A 1 ATOM 34 C C . LEU A 1 5 ? -42.202 66.600 0.700 1.00 41.56 5 A 1 ATOM 35 O O . LEU A 1 5 ? -41.411 65.951 1.382 1.00 39.73 5 A 1 ATOM 36 C CB . LEU A 1 5 ? -41.785 68.889 1.813 1.00 39.92 5 A 1 ATOM 37 C CG . LEU A 1 5 ? -40.789 70.058 1.705 1.00 36.59 5 A 1 ATOM 38 C CD1 . LEU A 1 5 ? -41.018 71.059 2.831 1.00 34.44 5 A 1 ATOM 39 C CD2 . LEU A 1 5 ? -39.340 69.568 1.790 1.00 38.32 5 A 1 ATOM 40 N N . LYS A 1 6 ? -43.257 66.004 0.092 1.00 39.91 6 A 1 ATOM 41 C CA . LYS A 1 6 ? -43.571 64.563 0.274 1.00 43.52 6 A 1 ATOM 42 C C . LYS A 1 6 ? -43.023 63.617 -0.816 1.00 43.64 6 A 1 ATOM 43 O O . LYS A 1 6 ? -43.267 62.416 -0.733 1.00 41.61 6 A 1 ATOM 44 C CB . LYS A 1 6 ? -45.076 64.365 0.527 1.00 42.11 6 A 1 ATOM 45 C CG . LYS A 1 6 ? -45.432 64.582 2.006 1.00 38.10 6 A 1 ATOM 46 C CD . LYS A 1 6 ? -46.886 64.174 2.292 1.00 35.55 6 A 1 ATOM 47 C CE . LYS A 1 6 ? -47.185 64.280 3.789 1.00 33.18 6 A 1 ATOM 48 N NZ . LYS A 1 6 ? -48.565 63.847 4.113 1.00 30.13 6 A 1 ATOM 49 N N . SER A 1 7 ? -42.279 64.110 -1.833 1.00 44.13 7 A 1 ATOM 50 C CA . SER A 1 7 ? -41.840 63.300 -2.988 1.00 47.07 7 A 1 ATOM 51 C C . SER A 1 7 ? -40.379 62.820 -2.936 1.00 47.43 7 A 1 ATOM 52 O O . SER A 1 7 ? -39.978 62.047 -3.801 1.00 44.85 7 A 1 ATOM 53 C CB . SER A 1 7 ? -42.119 64.065 -4.290 1.00 45.91 7 A 1 ATOM 54 O OG . SER A 1 7 ? -41.904 63.235 -5.413 1.00 40.94 7 A 1 ATOM 55 N N . TRP A 1 8 ? -39.584 63.256 -1.960 1.00 43.61 8 A 1 ATOM 56 C CA . TRP A 1 8 ? -38.143 62.952 -1.920 1.00 43.83 8 A 1 ATOM 57 C C . TRP A 1 8 ? -37.746 61.806 -0.978 1.00 42.52 8 A 1 ATOM 58 O O . TRP A 1 8 ? -36.698 61.193 -1.184 1.00 39.95 8 A 1 ATOM 59 C CB . TRP A 1 8 ? -37.351 64.247 -1.679 1.00 41.85 8 A 1 ATOM 60 C CG . TRP A 1 8 ? -36.987 64.980 -2.940 1.00 41.77 8 A 1 ATOM 61 C CD1 . TRP A 1 8 ? -37.844 65.514 -3.841 1.00 37.13 8 A 1 ATOM 62 C CD2 . TRP A 1 8 ? -35.653 65.235 -3.476 1.00 37.29 8 A 1 ATOM 63 N NE1 . TRP A 1 8 ? -37.141 66.071 -4.891 1.00 38.22 8 A 1 ATOM 64 C CE2 . TRP A 1 8 ? -35.786 65.932 -4.717 1.00 37.74 8 A 1 ATOM 65 C CE3 . TRP A 1 8 ? -34.348 64.947 -3.035 1.00 40.71 8 A 1 ATOM 66 C CZ2 . TRP A 1 8 ? -34.676 66.317 -5.485 1.00 38.85 8 A 1 ATOM 67 C CZ3 . TRP A 1 8 ? -33.226 65.332 -3.794 1.00 37.95 8 A 1 ATOM 68 C CH2 . TRP A 1 8 ? -33.385 66.015 -5.017 1.00 37.77 8 A 1 ATOM 69 N N . ASP A 1 9 ? -38.603 61.389 -0.039 1.00 47.25 9 A 1 ATOM 70 C CA . ASP A 1 9 ? -38.245 60.365 0.961 1.00 49.55 9 A 1 ATOM 71 C C . ASP A 1 9 ? -38.422 58.910 0.482 1.00 49.26 9 A 1 ATOM 72 O O . ASP A 1 9 ? -37.873 57.978 1.075 1.00 45.24 9 A 1 ATOM 73 C CB . ASP A 1 9 ? -39.035 60.628 2.252 1.00 46.31 9 A 1 ATOM 74 C CG . ASP A 1 9 ? -38.615 61.920 2.958 1.00 41.97 9 A 1 ATOM 75 O OD1 . ASP A 1 9 ? -37.427 62.292 2.837 1.00 38.51 9 A 1 ATOM 76 O OD2 . ASP A 1 9 ? -39.495 62.524 3.601 1.00 36.84 9 A 1 ATOM 77 N N . GLY A 1 10 ? -39.169 58.674 -0.626 1.00 45.29 10 A 1 ATOM 78 C CA . GLY A 1 10 ? -39.462 57.320 -1.114 1.00 50.07 10 A 1 ATOM 79 C C . GLY A 1 10 ? -38.379 56.705 -2.002 1.00 51.24 10 A 1 ATOM 80 O O . GLY A 1 10 ? -38.160 55.491 -1.967 1.00 46.39 10 A 1 ATOM 81 N N . PHE A 1 11 ? -37.684 57.533 -2.814 1.00 44.31 11 A 1 ATOM 82 C CA . PHE A 1 11 ? -36.738 57.047 -3.825 1.00 45.65 11 A 1 ATOM 83 C C . PHE A 1 11 ? -35.360 56.728 -3.226 1.00 46.52 11 A 1 ATOM 84 O O . PHE A 1 11 ? -34.786 55.678 -3.527 1.00 43.19 11 A 1 ATOM 85 C CB . PHE A 1 11 ? -36.672 58.060 -4.983 1.00 43.81 11 A 1 ATOM 86 C CG . PHE A 1 11 ? -36.372 57.425 -6.330 1.00 41.95 11 A 1 ATOM 87 C CD1 . PHE A 1 11 ? -35.053 57.352 -6.808 1.00 37.55 11 A 1 ATOM 88 C CD2 . PHE A 1 11 ? -37.426 56.906 -7.102 1.00 39.64 11 A 1 ATOM 89 C CE1 . PHE A 1 11 ? -34.786 56.769 -8.063 1.00 36.63 11 A 1 ATOM 90 C CE2 . PHE A 1 11 ? -37.161 56.318 -8.355 1.00 36.37 11 A 1 ATOM 91 C CZ . PHE A 1 11 ? -35.843 56.251 -8.835 1.00 40.84 11 A 1 ATOM 92 N N . GLY A 1 12 ? -34.876 57.555 -2.311 1.00 46.05 12 A 1 ATOM 93 C CA . GLY A 1 12 ? -33.596 57.351 -1.617 1.00 52.10 12 A 1 ATOM 94 C C . GLY A 1 12 ? -33.584 56.100 -0.733 1.00 52.84 12 A 1 ATOM 95 O O . GLY A 1 12 ? -32.671 55.277 -0.826 1.00 49.99 12 A 1 ATOM 96 N N . ILE A 1 13 ? -34.658 55.883 0.036 1.00 44.65 13 A 1 ATOM 97 C CA . ILE A 1 13 ? -34.779 54.714 0.928 1.00 45.66 13 A 1 ATOM 98 C C . ILE A 1 13 ? -34.876 53.405 0.128 1.00 46.75 13 A 1 ATOM 99 O O . ILE A 1 13 ? -34.314 52.386 0.536 1.00 44.50 13 A 1 ATOM 100 C CB . ILE A 1 13 ? -35.976 54.901 1.887 1.00 44.39 13 A 1 ATOM 101 C CG1 . ILE A 1 13 ? -35.731 56.115 2.816 1.00 41.61 13 A 1 ATOM 102 C CG2 . ILE A 1 13 ? -36.239 53.635 2.725 1.00 42.56 13 A 1 ATOM 103 C CD1 . ILE A 1 13 ? -36.944 56.516 3.668 1.00 41.47 13 A 1 ATOM 104 N N . LYS A 1 14 ? -35.566 53.403 -1.038 1.00 43.96 14 A 1 ATOM 105 C CA . LYS A 1 14 ? -35.701 52.215 -1.890 1.00 47.09 14 A 1 ATOM 106 C C . LYS A 1 14 ? -34.372 51.853 -2.565 1.00 46.87 14 A 1 ATOM 107 O O . LYS A 1 14 ? -33.995 50.685 -2.546 1.00 45.37 14 A 1 ATOM 108 C CB . LYS A 1 14 ? -36.852 52.434 -2.886 1.00 46.92 14 A 1 ATOM 109 C CG . LYS A 1 14 ? -37.425 51.118 -3.432 1.00 43.83 14 A 1 ATOM 110 C CD . LYS A 1 14 ? -38.662 51.392 -4.307 1.00 39.02 14 A 1 ATOM 111 C CE . LYS A 1 14 ? -39.320 50.084 -4.754 1.00 35.30 14 A 1 ATOM 112 N NZ . LYS A 1 14 ? -40.492 50.325 -5.637 1.00 31.24 14 A 1 ATOM 113 N N . CYS A 1 15 ? -33.636 52.855 -3.069 1.00 50.25 15 A 1 ATOM 114 C CA . CYS A 1 15 ? -32.300 52.673 -3.652 1.00 53.70 15 A 1 ATOM 115 C C . CYS A 1 15 ? -31.293 52.140 -2.614 1.00 52.17 15 A 1 ATOM 116 O O . CYS A 1 15 ? -30.592 51.163 -2.875 1.00 50.97 15 A 1 ATOM 117 C CB . CYS A 1 15 ? -31.859 54.014 -4.259 1.00 52.25 15 A 1 ATOM 118 S SG . CYS A 1 15 ? -30.400 53.770 -5.303 1.00 44.36 15 A 1 ATOM 119 N N . MET A 1 16 ? -31.303 52.694 -1.404 1.00 48.15 16 A 1 ATOM 120 C CA . MET A 1 16 ? -30.432 52.265 -0.303 1.00 48.34 16 A 1 ATOM 121 C C . MET A 1 16 ? -30.756 50.838 0.177 1.00 48.78 16 A 1 ATOM 122 O O . MET A 1 16 ? -29.846 50.052 0.422 1.00 48.37 16 A 1 ATOM 123 C CB . MET A 1 16 ? -30.532 53.294 0.828 1.00 48.92 16 A 1 ATOM 124 C CG . MET A 1 16 ? -29.358 53.217 1.797 1.00 46.69 16 A 1 ATOM 125 S SD . MET A 1 16 ? -29.300 54.598 2.978 1.00 41.74 16 A 1 ATOM 126 C CE . MET A 1 16 ? -30.543 54.065 4.179 1.00 38.54 16 A 1 ATOM 127 N N . LYS A 1 17 ? -32.043 50.450 0.227 1.00 52.78 17 A 1 ATOM 128 C CA . LYS A 1 17 ? -32.456 49.065 0.531 1.00 52.61 17 A 1 ATOM 129 C C . LYS A 1 17 ? -32.000 48.068 -0.535 1.00 50.90 17 A 1 ATOM 130 O O . LYS A 1 17 ? -31.567 46.976 -0.179 1.00 52.59 17 A 1 ATOM 131 C CB . LYS A 1 17 ? -33.975 48.972 0.722 1.00 52.80 17 A 1 ATOM 132 C CG . LYS A 1 17 ? -34.410 49.422 2.121 1.00 50.89 17 A 1 ATOM 133 C CD . LYS A 1 17 ? -35.926 49.260 2.296 1.00 46.69 17 A 1 ATOM 134 C CE . LYS A 1 17 ? -36.327 49.647 3.719 1.00 43.73 17 A 1 ATOM 135 N NZ . LYS A 1 17 ? -37.769 49.416 3.976 1.00 38.29 17 A 1 ATOM 136 N N . THR A 1 18 ? -32.073 48.441 -1.823 1.00 47.91 18 A 1 ATOM 137 C CA . THR A 1 18 ? -31.595 47.591 -2.922 1.00 48.22 18 A 1 ATOM 138 C C . THR A 1 18 ? -30.074 47.426 -2.863 1.00 51.11 18 A 1 ATOM 139 O O . THR A 1 18 ? -29.591 46.299 -2.927 1.00 48.20 18 A 1 ATOM 140 C CB . THR A 1 18 ? -32.036 48.138 -4.288 1.00 48.37 18 A 1 ATOM 141 O OG1 . THR A 1 18 ? -33.437 48.316 -4.300 1.00 46.06 18 A 1 ATOM 142 C CG2 . THR A 1 18 ? -31.726 47.179 -5.433 1.00 46.69 18 A 1 ATOM 143 N N . GLN A 1 19 ? -29.315 48.509 -2.646 1.00 48.12 19 A 1 ATOM 144 C CA . GLN A 1 19 ? -27.854 48.441 -2.485 1.00 51.81 19 A 1 ATOM 145 C C . GLN A 1 19 ? -27.429 47.597 -1.272 1.00 51.87 19 A 1 ATOM 146 O O . GLN A 1 19 ? -26.511 46.783 -1.389 1.00 53.26 19 A 1 ATOM 147 C CB . GLN A 1 19 ? -27.273 49.856 -2.363 1.00 53.69 19 A 1 ATOM 148 C CG . GLN A 1 19 ? -27.180 50.558 -3.725 1.00 50.28 19 A 1 ATOM 149 C CD . GLN A 1 19 ? -26.581 51.957 -3.621 1.00 45.75 19 A 1 ATOM 150 O OE1 . GLN A 1 19 ? -26.599 52.608 -2.590 1.00 43.97 19 A 1 ATOM 151 N NE2 . GLN A 1 19 ? -26.033 52.488 -4.691 1.00 44.56 19 A 1 ATOM 152 N N . LEU A 1 20 ? -28.118 47.738 -0.139 1.00 54.40 20 A 1 ATOM 153 C CA . LEU A 1 20 ? -27.883 46.914 1.044 1.00 52.25 20 A 1 ATOM 154 C C . LEU A 1 20 ? -28.186 45.436 0.771 1.00 51.63 20 A 1 ATOM 155 O O . LEU A 1 20 ? -27.374 44.594 1.133 1.00 52.70 20 A 1 ATOM 156 C CB . LEU A 1 20 ? -28.718 47.449 2.222 1.00 55.15 20 A 1 ATOM 157 C CG . LEU A 1 20 ? -28.093 48.682 2.902 1.00 54.32 20 A 1 ATOM 158 C CD1 . LEU A 1 20 ? -29.138 49.400 3.757 1.00 49.31 20 A 1 ATOM 159 C CD2 . LEU A 1 20 ? -26.929 48.291 3.813 1.00 57.90 20 A 1 ATOM 160 N N . SER A 1 21 ? -29.293 45.114 0.077 1.00 58.53 21 A 1 ATOM 161 C CA . SER A 1 21 ? -29.620 43.735 -0.312 1.00 57.83 21 A 1 ATOM 162 C C . SER A 1 21 ? -28.531 43.119 -1.188 1.00 57.28 21 A 1 ATOM 163 O O . SER A 1 21 ? -28.033 42.044 -0.871 1.00 56.90 21 A 1 ATOM 164 C CB . SER A 1 21 ? -30.961 43.690 -1.047 1.00 59.10 21 A 1 ATOM 165 O OG . SER A 1 21 ? -31.412 42.366 -1.230 1.00 55.55 21 A 1 ATOM 166 N N . THR A 1 22 ? -28.085 43.834 -2.235 1.00 54.54 22 A 1 ATOM 167 C CA . THR A 1 22 ? -27.014 43.358 -3.127 1.00 55.92 22 A 1 ATOM 168 C C . THR A 1 22 ? -25.691 43.159 -2.376 1.00 58.33 22 A 1 ATOM 169 O O . THR A 1 22 ? -24.985 42.182 -2.613 1.00 56.62 22 A 1 ATOM 170 C CB . THR A 1 22 ? -26.805 44.342 -4.288 1.00 56.40 22 A 1 ATOM 171 O OG1 . THR A 1 22 ? -28.028 44.629 -4.925 1.00 54.57 22 A 1 ATOM 172 C CG2 . THR A 1 22 ? -25.880 43.796 -5.370 1.00 54.64 22 A 1 ATOM 173 N N . MET A 1 23 ? -25.360 44.039 -1.441 1.00 57.64 23 A 1 ATOM 174 C CA . MET A 1 23 ? -24.163 43.907 -0.604 1.00 55.57 23 A 1 ATOM 175 C C . MET A 1 23 ? -24.253 42.693 0.337 1.00 54.08 23 A 1 ATOM 176 O O . MET A 1 23 ? -23.271 41.970 0.493 1.00 57.03 23 A 1 ATOM 177 C CB . MET A 1 23 ? -23.954 45.210 0.173 1.00 56.24 23 A 1 ATOM 178 C CG . MET A 1 23 ? -22.584 45.275 0.845 1.00 53.20 23 A 1 ATOM 179 S SD . MET A 1 23 ? -22.290 46.801 1.783 1.00 49.43 23 A 1 ATOM 180 C CE . MET A 1 23 ? -23.356 46.495 3.218 1.00 43.72 23 A 1 ATOM 181 N N . PHE A 1 24 ? -25.433 42.428 0.917 1.00 57.34 24 A 1 ATOM 182 C CA . PHE A 1 24 ? -25.681 41.231 1.729 1.00 52.37 24 A 1 ATOM 183 C C . PHE A 1 24 ? -25.581 39.941 0.907 1.00 54.07 24 A 1 ATOM 184 O O . PHE A 1 24 ? -24.981 38.976 1.380 1.00 54.89 24 A 1 ATOM 185 C CB . PHE A 1 24 ? -27.052 41.327 2.419 1.00 51.83 24 A 1 ATOM 186 C CG . PHE A 1 24 ? -26.994 41.948 3.802 1.00 51.97 24 A 1 ATOM 187 C CD1 . PHE A 1 24 ? -26.471 41.201 4.871 1.00 45.22 24 A 1 ATOM 188 C CD2 . PHE A 1 24 ? -27.464 43.251 4.032 1.00 50.11 24 A 1 ATOM 189 C CE1 . PHE A 1 24 ? -26.407 41.760 6.160 1.00 46.15 24 A 1 ATOM 190 C CE2 . PHE A 1 24 ? -27.399 43.815 5.318 1.00 45.28 24 A 1 ATOM 191 C CZ . PHE A 1 24 ? -26.867 43.071 6.383 1.00 49.94 24 A 1 ATOM 192 N N . ASP A 1 25 ? -26.089 39.924 -0.336 1.00 55.14 25 A 1 ATOM 193 C CA . ASP A 1 25 ? -25.987 38.770 -1.230 1.00 58.38 25 A 1 ATOM 194 C C . ASP A 1 25 ? -24.530 38.498 -1.642 1.00 57.61 25 A 1 ATOM 195 O O . ASP A 1 25 ? -24.075 37.354 -1.586 1.00 59.50 25 A 1 ATOM 196 C CB . ASP A 1 25 ? -26.888 38.980 -2.462 1.00 59.44 25 A 1 ATOM 197 C CG . ASP A 1 25 ? -28.386 38.935 -2.129 1.00 57.69 25 A 1 ATOM 198 O OD1 . ASP A 1 25 ? -28.763 38.182 -1.198 1.00 53.41 25 A 1 ATOM 199 O OD2 . ASP A 1 25 ? -29.151 39.647 -2.813 1.00 54.35 25 A 1 ATOM 200 N N . LEU A 1 26 ? -23.760 39.549 -1.965 1.00 56.35 26 A 1 ATOM 201 C CA . LEU A 1 26 ? -22.321 39.430 -2.243 1.00 58.59 26 A 1 ATOM 202 C C . LEU A 1 26 ? -21.545 38.904 -1.031 1.00 59.32 26 A 1 ATOM 203 O O . LEU A 1 26 ? -20.705 38.014 -1.178 1.00 61.85 26 A 1 ATOM 204 C CB . LEU A 1 26 ? -21.765 40.798 -2.681 1.00 62.63 26 A 1 ATOM 205 C CG . LEU A 1 26 ? -22.159 41.219 -4.106 1.00 60.43 26 A 1 ATOM 206 C CD1 . LEU A 1 26 ? -21.755 42.675 -4.333 1.00 53.61 26 A 1 ATOM 207 C CD2 . LEU A 1 26 ? -21.472 40.361 -5.174 1.00 63.73 26 A 1 ATOM 208 N N . TYR A 1 27 ? -21.850 39.396 0.159 1.00 57.81 27 A 1 ATOM 209 C CA . TYR A 1 27 ? -21.209 38.936 1.397 1.00 51.17 27 A 1 ATOM 210 C C . TYR A 1 27 ? -21.558 37.475 1.717 1.00 51.62 27 A 1 ATOM 211 O O . TYR A 1 27 ? -20.686 36.691 2.099 1.00 53.63 27 A 1 ATOM 212 C CB . TYR A 1 27 ? -21.609 39.879 2.539 1.00 53.77 27 A 1 ATOM 213 C CG . TYR A 1 27 ? -20.810 39.654 3.807 1.00 52.84 27 A 1 ATOM 214 C CD1 . TYR A 1 27 ? -21.411 39.059 4.935 1.00 47.16 27 A 1 ATOM 215 C CD2 . TYR A 1 27 ? -19.459 40.050 3.858 1.00 48.72 27 A 1 ATOM 216 C CE1 . TYR A 1 27 ? -20.663 38.863 6.110 1.00 46.83 27 A 1 ATOM 217 C CE2 . TYR A 1 27 ? -18.705 39.846 5.030 1.00 46.36 27 A 1 ATOM 218 C CZ . TYR A 1 27 ? -19.307 39.251 6.158 1.00 50.88 27 A 1 ATOM 219 O OH . TYR A 1 27 ? -18.576 39.047 7.288 1.00 43.50 27 A 1 ATOM 220 N N . ARG A 1 28 ? -22.819 37.072 1.489 1.00 54.22 28 A 1 ATOM 221 C CA . ARG A 1 28 ? -23.270 35.685 1.651 1.00 54.21 28 A 1 ATOM 222 C C . ARG A 1 28 ? -22.575 34.746 0.667 1.00 56.14 28 A 1 ATOM 223 O O . ARG A 1 28 ? -22.115 33.683 1.077 1.00 59.71 28 A 1 ATOM 224 C CB . ARG A 1 28 ? -24.793 35.642 1.503 1.00 55.31 28 A 1 ATOM 225 C CG . ARG A 1 28 ? -25.355 34.267 1.861 1.00 51.55 28 A 1 ATOM 226 C CD . ARG A 1 28 ? -26.878 34.288 1.713 1.00 48.07 28 A 1 ATOM 227 N NE . ARG A 1 28 ? -27.474 33.014 2.148 1.00 42.30 28 A 1 ATOM 228 C CZ . ARG A 1 28 ? -28.758 32.724 2.168 1.00 38.57 28 A 1 ATOM 229 N NH1 . ARG A 1 28 ? -29.658 33.580 1.762 1.00 33.47 28 A 1 ATOM 230 N NH2 . ARG A 1 28 ? -29.168 31.562 2.599 1.00 34.55 28 A 1 ATOM 231 N N . ASN A 1 29 ? -22.446 35.153 -0.599 1.00 59.18 29 A 1 ATOM 232 C CA . ASN A 1 29 ? -21.724 34.392 -1.622 1.00 61.31 29 A 1 ATOM 233 C C . ASN A 1 29 ? -20.229 34.281 -1.293 1.00 61.18 29 A 1 ATOM 234 O O . ASN A 1 29 ? -19.652 33.205 -1.440 1.00 62.50 29 A 1 ATOM 235 C CB . ASN A 1 29 ? -21.953 35.049 -2.996 1.00 60.75 29 A 1 ATOM 236 C CG . ASN A 1 29 ? -23.366 34.863 -3.522 1.00 60.31 29 A 1 ATOM 237 O OD1 . ASN A 1 29 ? -24.129 34.016 -3.086 1.00 54.72 29 A 1 ATOM 238 N ND2 . ASN A 1 29 ? -23.763 35.643 -4.498 1.00 55.52 29 A 1 ATOM 239 N N . PHE A 1 30 ? -19.615 35.349 -0.787 1.00 52.18 30 A 1 ATOM 240 C CA . PHE A 1 30 ? -18.225 35.329 -0.328 1.00 50.79 30 A 1 ATOM 241 C C . PHE A 1 30 ? -18.016 34.359 0.843 1.00 51.52 30 A 1 ATOM 242 O O . PHE A 1 30 ? -17.093 33.549 0.800 1.00 55.00 30 A 1 ATOM 243 C CB . PHE A 1 30 ? -17.790 36.751 0.046 1.00 52.71 30 A 1 ATOM 244 C CG . PHE A 1 30 ? -16.355 36.819 0.527 1.00 53.46 30 A 1 ATOM 245 C CD1 . PHE A 1 30 ? -16.063 36.794 1.907 1.00 46.39 30 A 1 ATOM 246 C CD2 . PHE A 1 30 ? -15.304 36.857 -0.409 1.00 51.92 30 A 1 ATOM 247 C CE1 . PHE A 1 30 ? -14.730 36.813 2.350 1.00 49.23 30 A 1 ATOM 248 C CE2 . PHE A 1 30 ? -13.969 36.875 0.034 1.00 48.98 30 A 1 ATOM 249 C CZ . PHE A 1 30 ? -13.681 36.854 1.410 1.00 53.26 30 A 1 ATOM 250 N N . ILE A 1 31 ? -18.889 34.384 1.851 1.00 60.79 31 A 1 ATOM 251 C CA . ILE A 1 31 ? -18.828 33.430 2.973 1.00 57.62 31 A 1 ATOM 252 C C . ILE A 1 31 ? -19.015 31.997 2.471 1.00 59.86 31 A 1 ATOM 253 O O . ILE A 1 31 ? -18.279 31.109 2.891 1.00 60.85 31 A 1 ATOM 254 C CB . ILE A 1 31 ? -19.868 33.776 4.063 1.00 56.87 31 A 1 ATOM 255 C CG1 . ILE A 1 31 ? -19.431 35.057 4.806 1.00 56.67 31 A 1 ATOM 256 C CG2 . ILE A 1 31 ? -20.052 32.621 5.069 1.00 55.96 31 A 1 ATOM 257 C CD1 . ILE A 1 31 ? -20.472 35.586 5.794 1.00 51.53 31 A 1 ATOM 258 N N . HIS A 1 32 ? -19.963 31.765 1.568 1.00 50.80 32 A 1 ATOM 259 C CA . HIS A 1 32 ? -20.210 30.436 1.015 1.00 52.15 32 A 1 ATOM 260 C C . HIS A 1 32 ? -18.987 29.910 0.251 1.00 52.57 32 A 1 ATOM 261 O O . HIS A 1 32 ? -18.535 28.800 0.518 1.00 54.66 32 A 1 ATOM 262 C CB . HIS A 1 32 ? -21.461 30.484 0.134 1.00 53.57 32 A 1 ATOM 263 C CG . HIS A 1 32 ? -21.895 29.114 -0.316 1.00 51.89 32 A 1 ATOM 264 N ND1 . HIS A 1 32 ? -22.265 28.073 0.503 1.00 41.07 32 A 1 ATOM 265 C CD2 . HIS A 1 32 ? -22.012 28.676 -1.607 1.00 42.99 32 A 1 ATOM 266 C CE1 . HIS A 1 32 ? -22.589 27.030 -0.282 1.00 45.32 32 A 1 ATOM 267 N NE2 . HIS A 1 32 ? -22.458 27.359 -1.572 1.00 43.48 32 A 1 ATOM 268 N N . LEU A 1 33 ? -18.395 30.734 -0.623 1.00 52.51 33 A 1 ATOM 269 C CA . LEU A 1 33 ? -17.163 30.395 -1.337 1.00 50.29 33 A 1 ATOM 270 C C . LEU A 1 33 ? -16.000 30.127 -0.370 1.00 50.55 33 A 1 ATOM 271 O O . LEU A 1 33 ? -15.285 29.142 -0.527 1.00 52.09 33 A 1 ATOM 272 C CB . LEU A 1 33 ? -16.839 31.543 -2.317 1.00 52.19 33 A 1 ATOM 273 C CG . LEU A 1 33 ? -15.591 31.291 -3.188 1.00 49.99 33 A 1 ATOM 274 C CD1 . LEU A 1 33 ? -15.761 30.074 -4.101 1.00 42.64 33 A 1 ATOM 275 C CD2 . LEU A 1 33 ? -15.322 32.518 -4.058 1.00 53.92 33 A 1 ATOM 276 N N . PHE A 1 34 ? -15.838 30.946 0.655 1.00 53.46 34 A 1 ATOM 277 C CA . PHE A 1 34 ? -14.817 30.741 1.688 1.00 49.94 34 A 1 ATOM 278 C C . PHE A 1 34 ? -15.011 29.417 2.444 1.00 51.15 34 A 1 ATOM 279 O O . PHE A 1 34 ? -14.035 28.719 2.727 1.00 54.17 34 A 1 ATOM 280 C CB . PHE A 1 34 ? -14.836 31.934 2.653 1.00 51.41 34 A 1 ATOM 281 C CG . PHE A 1 34 ? -13.785 31.837 3.741 1.00 52.28 34 A 1 ATOM 282 C CD1 . PHE A 1 34 ? -14.121 31.346 5.021 1.00 45.18 34 A 1 ATOM 283 C CD2 . PHE A 1 34 ? -12.454 32.205 3.462 1.00 50.28 34 A 1 ATOM 284 C CE1 . PHE A 1 34 ? -13.136 31.232 6.015 1.00 48.04 34 A 1 ATOM 285 C CE2 . PHE A 1 34 ? -11.466 32.089 4.458 1.00 47.23 34 A 1 ATOM 286 C CZ . PHE A 1 34 ? -11.805 31.604 5.734 1.00 51.59 34 A 1 ATOM 287 N N . MET A 1 35 ? -16.262 29.040 2.745 1.00 52.49 35 A 1 ATOM 288 C CA . MET A 1 35 ? -16.566 27.757 3.388 1.00 50.97 35 A 1 ATOM 289 C C . MET A 1 35 ? -16.263 26.563 2.480 1.00 52.41 35 A 1 ATOM 290 O O . MET A 1 35 ? -15.695 25.590 2.969 1.00 55.69 35 A 1 ATOM 291 C CB . MET A 1 35 ? -18.022 27.717 3.858 1.00 51.77 35 A 1 ATOM 292 C CG . MET A 1 35 ? -18.248 28.593 5.094 1.00 47.67 35 A 1 ATOM 293 S SD . MET A 1 35 ? -19.900 28.468 5.830 1.00 39.76 35 A 1 ATOM 294 C CE . MET A 1 35 ? -19.800 26.813 6.573 1.00 36.60 35 A 1 ATOM 295 N N . ILE A 1 36 ? -16.578 26.649 1.177 1.00 57.95 36 A 1 ATOM 296 C CA . ILE A 1 36 ? -16.241 25.610 0.186 1.00 56.21 36 A 1 ATOM 297 C C . ILE A 1 36 ? -14.724 25.426 0.127 1.00 56.71 36 A 1 ATOM 298 O O . ILE A 1 36 ? -14.240 24.324 0.364 1.00 59.07 36 A 1 ATOM 299 C CB . ILE A 1 36 ? -16.833 25.951 -1.199 1.00 57.98 36 A 1 ATOM 300 C CG1 . ILE A 1 36 ? -18.374 25.826 -1.163 1.00 57.51 36 A 1 ATOM 301 C CG2 . ILE A 1 36 ? -16.258 25.029 -2.294 1.00 57.56 36 A 1 ATOM 302 C CD1 . ILE A 1 36 ? -19.069 26.444 -2.383 1.00 54.43 36 A 1 ATOM 303 N N . ILE A 1 37 ? -13.978 26.509 -0.085 1.00 60.89 37 A 1 ATOM 304 C CA . ILE A 1 37 ? -12.508 26.479 -0.131 1.00 57.17 37 A 1 ATOM 305 C C . ILE A 1 37 ? -11.949 25.854 1.152 1.00 56.40 37 A 1 ATOM 306 O O . ILE A 1 37 ? -11.084 24.982 1.100 1.00 58.51 37 A 1 ATOM 307 C CB . ILE A 1 37 ? -11.958 27.907 -0.362 1.00 58.82 37 A 1 ATOM 308 C CG1 . ILE A 1 37 ? -12.303 28.395 -1.791 1.00 59.02 37 A 1 ATOM 309 C CG2 . ILE A 1 37 ? -10.437 27.975 -0.141 1.00 57.49 37 A 1 ATOM 310 C CD1 . ILE A 1 37 ? -12.059 29.892 -2.015 1.00 56.66 37 A 1 ATOM 311 N N . LYS A 1 38 ? -12.460 26.241 2.313 1.00 70.99 38 A 1 ATOM 312 C CA . LYS A 1 38 ? -12.013 25.687 3.597 1.00 65.86 38 A 1 ATOM 313 C C . LYS A 1 38 ? -12.245 24.173 3.695 1.00 65.98 38 A 1 ATOM 314 O O . LYS A 1 38 ? -11.381 23.473 4.224 1.00 72.78 38 A 1 ATOM 315 C CB . LYS A 1 38 ? -12.711 26.448 4.731 1.00 64.66 38 A 1 ATOM 316 C CG . LYS A 1 38 ? -12.204 26.008 6.109 1.00 58.70 38 A 1 ATOM 317 C CD . LYS A 1 38 ? -12.949 26.755 7.213 1.00 53.29 38 A 1 ATOM 318 C CE . LYS A 1 38 ? -12.456 26.250 8.571 1.00 48.87 38 A 1 ATOM 319 N NZ . LYS A 1 38 ? -13.213 26.884 9.676 1.00 41.83 38 A 1 ATOM 320 N N . GLU A 1 39 ? -13.395 23.674 3.222 1.00 62.45 39 A 1 ATOM 321 C CA . GLU A 1 39 ? -13.704 22.240 3.268 1.00 64.55 39 A 1 ATOM 322 C C . GLU A 1 39 ? -12.860 21.449 2.252 1.00 65.52 39 A 1 ATOM 323 O O . GLU A 1 39 ? -12.316 20.409 2.610 1.00 65.98 39 A 1 ATOM 324 C CB . GLU A 1 39 ? -15.214 22.009 3.095 1.00 66.12 39 A 1 ATOM 325 C CG . GLU A 1 39 ? -15.679 20.638 3.645 1.00 59.21 39 A 1 ATOM 326 C CD . GLU A 1 39 ? -15.505 20.466 5.176 1.00 53.12 39 A 1 ATOM 327 O OE1 . GLU A 1 39 ? -15.411 19.323 5.679 1.00 48.38 39 A 1 ATOM 328 O OE2 . GLU A 1 39 ? -15.422 21.481 5.904 1.00 53.24 39 A 1 ATOM 329 N N . GLU A 1 40 ? -12.625 21.991 1.043 1.00 70.23 40 A 1 ATOM 330 C CA . GLU A 1 40 ? -11.700 21.413 0.054 1.00 71.52 40 A 1 ATOM 331 C C . GLU A 1 40 ? -10.270 21.301 0.607 1.00 72.55 40 A 1 ATOM 332 O O . GLU A 1 40 ? -9.648 20.239 0.539 1.00 72.84 40 A 1 ATOM 333 C CB . GLU A 1 40 ? -11.679 22.273 -1.218 1.00 70.96 40 A 1 ATOM 334 C CG . GLU A 1 40 ? -12.958 22.156 -2.053 1.00 62.60 40 A 1 ATOM 335 C CD . GLU A 1 40 ? -12.945 23.067 -3.296 1.00 58.41 40 A 1 ATOM 336 O OE1 . GLU A 1 40 ? -13.863 22.917 -4.126 1.00 53.92 40 A 1 ATOM 337 O OE2 . GLU A 1 40 ? -12.037 23.932 -3.395 1.00 55.53 40 A 1 ATOM 338 N N . TYR A 1 41 ? -9.758 22.364 1.232 1.00 72.55 41 A 1 ATOM 339 C CA . TYR A 1 41 ? -8.441 22.336 1.882 1.00 73.08 41 A 1 ATOM 340 C C . TYR A 1 41 ? -8.370 21.305 3.009 1.00 76.04 41 A 1 ATOM 341 O O . TYR A 1 41 ? -7.371 20.592 3.132 1.00 75.45 41 A 1 ATOM 342 C CB . TYR A 1 41 ? -8.080 23.724 2.433 1.00 69.69 41 A 1 ATOM 343 C CG . TYR A 1 41 ? -7.305 24.581 1.458 1.00 64.32 41 A 1 ATOM 344 C CD1 . TYR A 1 41 ? -5.924 24.365 1.288 1.00 60.58 41 A 1 ATOM 345 C CD2 . TYR A 1 41 ? -7.950 25.585 0.719 1.00 59.58 41 A 1 ATOM 346 C CE1 . TYR A 1 41 ? -5.197 25.145 0.371 1.00 53.21 41 A 1 ATOM 347 C CE2 . TYR A 1 41 ? -7.228 26.369 -0.202 1.00 54.02 41 A 1 ATOM 348 C CZ . TYR A 1 41 ? -5.851 26.147 -0.378 1.00 53.76 41 A 1 ATOM 349 O OH . TYR A 1 41 ? -5.153 26.898 -1.275 1.00 50.81 41 A 1 ATOM 350 N N . LYS A 1 42 ? -9.423 21.197 3.818 1.00 74.49 42 A 1 ATOM 351 C CA . LYS A 1 42 ? -9.497 20.214 4.901 1.00 74.43 42 A 1 ATOM 352 C C . LYS A 1 42 ? -9.488 18.782 4.357 1.00 76.21 42 A 1 ATOM 353 O O . LYS A 1 42 ? -8.721 17.965 4.866 1.00 78.76 42 A 1 ATOM 354 C CB . LYS A 1 42 ? -10.743 20.508 5.732 1.00 74.77 42 A 1 ATOM 355 C CG . LYS A 1 42 ? -10.915 19.557 6.921 1.00 66.40 42 A 1 ATOM 356 C CD . LYS A 1 42 ? -12.227 19.914 7.610 1.00 62.22 42 A 1 ATOM 357 C CE . LYS A 1 42 ? -12.724 18.797 8.518 1.00 55.16 42 A 1 ATOM 358 N NZ . LYS A 1 42 ? -14.211 18.818 8.489 1.00 46.60 42 A 1 ATOM 359 N N . MET A 1 43 ? -10.256 18.508 3.304 1.00 76.20 43 A 1 ATOM 360 C CA . MET A 1 43 ? -10.277 17.212 2.627 1.00 76.62 43 A 1 ATOM 361 C C . MET A 1 43 ? -8.901 16.868 2.042 1.00 79.58 43 A 1 ATOM 362 O O . MET A 1 43 ? -8.387 15.773 2.262 1.00 78.60 43 A 1 ATOM 363 C CB . MET A 1 43 ? -11.350 17.249 1.536 1.00 73.94 43 A 1 ATOM 364 C CG . MET A 1 43 ? -11.619 15.871 0.924 1.00 64.51 43 A 1 ATOM 365 S SD . MET A 1 43 ? -12.624 15.904 -0.585 1.00 55.08 43 A 1 ATOM 366 C CE . MET A 1 43 ? -13.996 16.985 -0.109 1.00 50.27 43 A 1 ATOM 367 N N . LYS A 1 44 ? -8.244 17.835 1.374 1.00 81.80 44 A 1 ATOM 368 C CA . LYS A 1 44 ? -6.899 17.634 0.819 1.00 82.17 44 A 1 ATOM 369 C C . LYS A 1 44 ? -5.868 17.320 1.904 1.00 84.97 44 A 1 ATOM 370 O O . LYS A 1 44 ? -5.058 16.414 1.728 1.00 86.42 44 A 1 ATOM 371 C CB . LYS A 1 44 ? -6.495 18.858 -0.025 1.00 80.33 44 A 1 ATOM 372 C CG . LYS A 1 44 ? -5.206 18.639 -0.849 1.00 72.07 44 A 1 ATOM 373 C CD . LYS A 1 44 ? -5.377 17.566 -1.950 1.00 68.98 44 A 1 ATOM 374 C CE . LYS A 1 44 ? -4.121 17.410 -2.804 1.00 63.32 44 A 1 ATOM 375 N NZ . LYS A 1 44 ? -4.332 16.463 -3.941 1.00 55.05 44 A 1 ATOM 376 N N . ILE A 1 45 ? -5.916 18.011 3.043 1.00 78.96 45 A 1 ATOM 377 C CA . ILE A 1 45 ? -5.049 17.716 4.195 1.00 79.91 45 A 1 ATOM 378 C C . ILE A 1 45 ? -5.315 16.303 4.718 1.00 82.33 45 A 1 ATOM 379 O O . ILE A 1 45 ? -4.365 15.571 4.974 1.00 83.15 45 A 1 ATOM 380 C CB . ILE A 1 45 ? -5.214 18.784 5.302 1.00 78.62 45 A 1 ATOM 381 C CG1 . ILE A 1 45 ? -4.569 20.113 4.838 1.00 73.90 45 A 1 ATOM 382 C CG2 . ILE A 1 45 ? -4.581 18.333 6.633 1.00 73.09 45 A 1 ATOM 383 C CD1 . ILE A 1 45 ? -4.925 21.315 5.715 1.00 66.63 45 A 1 ATOM 384 N N . GLU A 1 46 ? -6.578 15.885 4.830 1.00 80.59 46 A 1 ATOM 385 C CA . GLU A 1 46 ? -6.936 14.535 5.274 1.00 82.59 46 A 1 ATOM 386 C C . GLU A 1 46 ? -6.406 13.452 4.314 1.00 84.33 46 A 1 ATOM 387 O O . GLU A 1 46 ? -5.884 12.424 4.755 1.00 85.03 46 A 1 ATOM 388 C CB . GLU A 1 46 ? -8.464 14.445 5.432 1.00 83.48 46 A 1 ATOM 389 C CG . GLU A 1 46 ? -8.880 13.139 6.121 1.00 72.55 46 A 1 ATOM 390 C CD . GLU A 1 46 ? -10.403 12.957 6.225 1.00 69.11 46 A 1 ATOM 391 O OE1 . GLU A 1 46 ? -10.806 11.771 6.341 1.00 61.44 46 A 1 ATOM 392 O OE2 . GLU A 1 46 ? -11.151 13.952 6.188 1.00 63.18 46 A 1 ATOM 393 N N . HIS A 1 47 ? -6.479 13.687 2.999 1.00 87.38 47 A 1 ATOM 394 C CA . HIS A 1 47 ? -5.905 12.796 1.984 1.00 87.01 47 A 1 ATOM 395 C C . HIS A 1 47 ? -4.382 12.682 2.122 1.00 87.87 47 A 1 ATOM 396 O O . HIS A 1 47 ? -3.843 11.573 2.206 1.00 87.92 47 A 1 ATOM 397 C CB . HIS A 1 47 ? -6.288 13.291 0.578 1.00 86.20 47 A 1 ATOM 398 C CG . HIS A 1 47 ? -7.731 13.073 0.189 1.00 82.74 47 A 1 ATOM 399 N ND1 . HIS A 1 47 ? -8.260 13.300 -1.075 1.00 73.41 47 A 1 ATOM 400 C CD2 . HIS A 1 47 ? -8.741 12.581 0.971 1.00 72.43 47 A 1 ATOM 401 C CE1 . HIS A 1 47 ? -9.553 12.948 -1.040 1.00 76.10 47 A 1 ATOM 402 N NE2 . HIS A 1 47 ? -9.889 12.507 0.183 1.00 77.11 47 A 1 ATOM 403 N N . LEU A 1 48 ? -3.692 13.816 2.212 1.00 85.65 48 A 1 ATOM 404 C CA . LEU A 1 48 ? -2.241 13.859 2.400 1.00 84.35 48 A 1 ATOM 405 C C . LEU A 1 48 ? -1.818 13.189 3.710 1.00 84.56 48 A 1 ATOM 406 O O . LEU A 1 48 ? -0.812 12.485 3.730 1.00 84.47 48 A 1 ATOM 407 C CB . LEU A 1 48 ? -1.759 15.319 2.363 1.00 84.52 48 A 1 ATOM 408 C CG . LEU A 1 48 ? -1.823 15.999 0.982 1.00 81.29 48 A 1 ATOM 409 C CD1 . LEU A 1 48 ? -1.468 17.480 1.144 1.00 78.69 48 A 1 ATOM 410 C CD2 . LEU A 1 48 ? -0.854 15.383 -0.023 1.00 79.81 48 A 1 ATOM 411 N N . ASP A 1 49 ? -2.587 13.354 4.780 1.00 85.86 49 A 1 ATOM 412 C CA . ASP A 1 49 ? -2.325 12.718 6.075 1.00 85.89 49 A 1 ATOM 413 C C . ASP A 1 49 ? -2.425 11.187 5.985 1.00 87.13 49 A 1 ATOM 414 O O . ASP A 1 49 ? -1.507 10.464 6.382 1.00 87.06 49 A 1 ATOM 415 C CB . ASP A 1 49 ? -3.298 13.286 7.115 1.00 84.14 49 A 1 ATOM 416 C CG . ASP A 1 49 ? -2.842 12.948 8.529 1.00 77.59 49 A 1 ATOM 417 O OD1 . ASP A 1 49 ? -1.723 13.396 8.876 1.00 73.14 49 A 1 ATOM 418 O OD2 . ASP A 1 49 ? -3.590 12.254 9.237 1.00 72.51 49 A 1 ATOM 419 N N . LYS A 1 50 ? -3.489 10.675 5.363 1.00 87.03 50 A 1 ATOM 420 C CA . LYS A 1 50 ? -3.674 9.231 5.145 1.00 87.69 50 A 1 ATOM 421 C C . LYS A 1 50 ? -2.558 8.627 4.290 1.00 88.80 50 A 1 ATOM 422 O O . LYS A 1 50 ? -2.064 7.550 4.620 1.00 89.37 50 A 1 ATOM 423 C CB . LYS A 1 50 ? -5.041 8.970 4.498 1.00 88.91 50 A 1 ATOM 424 C CG . LYS A 1 50 ? -6.205 9.167 5.482 1.00 88.24 50 A 1 ATOM 425 C CD . LYS A 1 50 ? -7.551 9.110 4.746 1.00 85.10 50 A 1 ATOM 426 C CE . LYS A 1 50 ? -8.685 9.422 5.726 1.00 81.61 50 A 1 ATOM 427 N NZ . LYS A 1 50 ? -9.971 9.704 5.040 1.00 72.84 50 A 1 ATOM 428 N N . ILE A 1 51 ? -2.150 9.299 3.214 1.00 88.28 51 A 1 ATOM 429 C CA . ILE A 1 51 ? -1.039 8.837 2.370 1.00 86.77 51 A 1 ATOM 430 C C . ILE A 1 51 ? 0.286 8.929 3.134 1.00 85.78 51 A 1 ATOM 431 O O . ILE A 1 51 ? 1.049 7.965 3.130 1.00 85.50 51 A 1 ATOM 432 C CB . ILE A 1 51 ? -0.998 9.601 1.027 1.00 87.91 51 A 1 ATOM 433 C CG1 . ILE A 1 51 ? -2.248 9.256 0.183 1.00 85.75 51 A 1 ATOM 434 C CG2 . ILE A 1 51 ? 0.278 9.234 0.243 1.00 85.35 51 A 1 ATOM 435 C CD1 . ILE A 1 51 ? -2.444 10.143 -1.051 1.00 78.29 51 A 1 ATOM 436 N N . GLY A 1 52 ? 0.544 10.031 3.826 1.00 87.71 52 A 1 ATOM 437 C CA . GLY A 1 52 ? 1.741 10.224 4.645 1.00 84.41 52 A 1 ATOM 438 C C . GLY A 1 52 ? 1.925 9.118 5.684 1.00 85.59 52 A 1 ATOM 439 O O . GLY A 1 52 ? 3.004 8.530 5.771 1.00 84.75 52 A 1 ATOM 440 N N . ASN A 1 53 ? 0.855 8.739 6.376 1.00 84.98 53 A 1 ATOM 441 C CA . ASN A 1 53 ? 0.859 7.629 7.332 1.00 85.46 53 A 1 ATOM 442 C C . ASN A 1 53 ? 1.207 6.290 6.656 1.00 86.08 53 A 1 ATOM 443 O O . ASN A 1 53 ? 2.059 5.552 7.147 1.00 86.11 53 A 1 ATOM 444 C CB . ASN A 1 53 ? -0.507 7.582 8.038 1.00 85.77 53 A 1 ATOM 445 C CG . ASN A 1 53 ? -0.711 8.751 8.993 1.00 79.13 53 A 1 ATOM 446 O OD1 . ASN A 1 53 ? 0.218 9.242 9.608 1.00 74.49 53 A 1 ATOM 447 N ND2 . ASN A 1 53 ? -1.917 9.225 9.158 1.00 72.97 53 A 1 ATOM 448 N N . VAL A 1 54 ? 0.621 5.989 5.488 1.00 85.81 54 A 1 ATOM 449 C CA . VAL A 1 54 ? 0.980 4.781 4.715 1.00 85.41 54 A 1 ATOM 450 C C . VAL A 1 54 ? 2.439 4.824 4.258 1.00 85.93 54 A 1 ATOM 451 O O . VAL A 1 54 ? 3.110 3.793 4.253 1.00 86.06 54 A 1 ATOM 452 C CB . VAL A 1 54 ? 0.043 4.585 3.510 1.00 86.65 54 A 1 ATOM 453 C CG1 . VAL A 1 54 ? 0.470 3.409 2.621 1.00 81.70 54 A 1 ATOM 454 C CG2 . VAL A 1 54 ? -1.387 4.287 3.977 1.00 84.68 54 A 1 ATOM 455 N N . LEU A 1 55 ? 2.962 5.999 3.913 1.00 87.83 55 A 1 ATOM 456 C CA . LEU A 1 55 ? 4.366 6.199 3.548 1.00 85.68 55 A 1 ATOM 457 C C . LEU A 1 55 ? 5.334 6.142 4.748 1.00 84.46 55 A 1 ATOM 458 O O . LEU A 1 55 ? 6.540 6.270 4.548 1.00 81.43 55 A 1 ATOM 459 C CB . LEU A 1 55 ? 4.514 7.508 2.746 1.00 86.26 55 A 1 ATOM 460 C CG . LEU A 1 55 ? 3.850 7.500 1.354 1.00 84.51 55 A 1 ATOM 461 C CD1 . LEU A 1 55 ? 3.997 8.879 0.716 1.00 82.06 55 A 1 ATOM 462 C CD2 . LEU A 1 55 ? 4.469 6.471 0.406 1.00 82.65 55 A 1 ATOM 463 N N . GLY A 1 56 ? 4.828 5.918 5.971 1.00 85.85 56 A 1 ATOM 464 C CA . GLY A 1 56 ? 5.641 5.815 7.185 1.00 83.74 56 A 1 ATOM 465 C C . GLY A 1 56 ? 6.072 7.170 7.754 1.00 84.18 56 A 1 ATOM 466 O O . GLY A 1 56 ? 7.091 7.256 8.433 1.00 81.17 56 A 1 ATOM 467 N N . ARG A 1 57 ? 5.326 8.233 7.452 1.00 82.73 57 A 1 ATOM 468 C CA . ARG A 1 57 ? 5.566 9.572 8.001 1.00 79.36 57 A 1 ATOM 469 C C . ARG A 1 57 ? 4.839 9.712 9.340 1.00 77.55 57 A 1 ATOM 470 O O . ARG A 1 57 ? 3.619 9.783 9.362 1.00 72.56 57 A 1 ATOM 471 C CB . ARG A 1 57 ? 5.124 10.644 6.991 1.00 78.77 57 A 1 ATOM 472 C CG . ARG A 1 57 ? 5.774 10.550 5.593 1.00 78.76 57 A 1 ATOM 473 C CD . ARG A 1 57 ? 7.292 10.747 5.653 1.00 74.90 57 A 1 ATOM 474 N NE . ARG A 1 57 ? 7.907 10.755 4.312 1.00 75.03 57 A 1 ATOM 475 C CZ . ARG A 1 57 ? 9.071 10.238 3.975 1.00 70.04 57 A 1 ATOM 476 N NH1 . ARG A 1 57 ? 9.816 9.603 4.836 1.00 64.69 57 A 1 ATOM 477 N NH2 . ARG A 1 57 ? 9.507 10.338 2.755 1.00 65.93 57 A 1 ATOM 478 N N . GLU A 1 58 ? 5.577 9.761 10.450 1.00 75.00 58 A 1 ATOM 479 C CA . GLU A 1 58 ? 5.028 9.737 11.824 1.00 73.04 58 A 1 ATOM 480 C C . GLU A 1 58 ? 3.991 10.839 12.112 1.00 72.01 58 A 1 ATOM 481 O O . GLU A 1 58 ? 3.050 10.623 12.868 1.00 65.19 58 A 1 ATOM 482 C CB . GLU A 1 58 ? 6.167 9.869 12.848 1.00 68.63 58 A 1 ATOM 483 C CG . GLU A 1 58 ? 7.134 8.667 12.847 1.00 61.63 58 A 1 ATOM 484 C CD . GLU A 1 58 ? 8.224 8.770 13.931 1.00 56.69 58 A 1 ATOM 485 O OE1 . GLU A 1 58 ? 8.852 7.727 14.214 1.00 52.40 58 A 1 ATOM 486 O OE2 . GLU A 1 58 ? 8.439 9.888 14.455 1.00 52.99 58 A 1 ATOM 487 N N . ASN A 1 59 ? 4.144 12.014 11.476 1.00 77.16 59 A 1 ATOM 488 C CA . ASN A 1 59 ? 3.232 13.152 11.624 1.00 76.58 59 A 1 ATOM 489 C C . ASN A 1 59 ? 2.379 13.389 10.367 1.00 76.36 59 A 1 ATOM 490 O O . ASN A 1 59 ? 2.041 14.535 10.053 1.00 68.81 59 A 1 ATOM 491 C CB . ASN A 1 59 ? 4.031 14.394 12.056 1.00 72.75 59 A 1 ATOM 492 C CG . ASN A 1 59 ? 4.721 14.222 13.394 1.00 66.91 59 A 1 ATOM 493 O OD1 . ASN A 1 59 ? 4.173 13.718 14.354 1.00 61.52 59 A 1 ATOM 494 N ND2 . ASN A 1 59 ? 5.951 14.656 13.513 1.00 60.01 59 A 1 ATOM 495 N N . GLY A 1 60 ? 2.072 12.331 9.607 1.00 74.89 60 A 1 ATOM 496 C CA . GLY A 1 60 ? 1.234 12.396 8.411 1.00 74.49 60 A 1 ATOM 497 C C . GLY A 1 60 ? 1.731 13.433 7.397 1.00 77.71 60 A 1 ATOM 498 O O . GLY A 1 60 ? 2.915 13.470 7.044 1.00 73.23 60 A 1 ATOM 499 N N . TRP A 1 61 ? 0.822 14.302 6.931 1.00 77.49 61 A 1 ATOM 500 C CA . TRP A 1 61 ? 1.129 15.320 5.920 1.00 76.61 61 A 1 ATOM 501 C C . TRP A 1 61 ? 2.211 16.319 6.358 1.00 78.86 61 A 1 ATOM 502 O O . TRP A 1 61 ? 2.978 16.786 5.517 1.00 76.18 61 A 1 ATOM 503 C CB . TRP A 1 61 ? -0.150 16.076 5.549 1.00 72.76 61 A 1 ATOM 504 C CG . TRP A 1 61 ? -0.573 17.137 6.519 1.00 70.41 61 A 1 ATOM 505 C CD1 . TRP A 1 61 ? -1.328 16.950 7.623 1.00 66.72 61 A 1 ATOM 506 C CD2 . TRP A 1 61 ? -0.226 18.555 6.511 1.00 68.09 61 A 1 ATOM 507 N NE1 . TRP A 1 61 ? -1.470 18.140 8.311 1.00 58.53 61 A 1 ATOM 508 C CE2 . TRP A 1 61 ? -0.807 19.170 7.667 1.00 61.51 61 A 1 ATOM 509 C CE3 . TRP A 1 61 ? 0.523 19.383 5.652 1.00 58.69 61 A 1 ATOM 510 C CZ2 . TRP A 1 61 ? -0.641 20.531 7.963 1.00 60.42 61 A 1 ATOM 511 C CZ3 . TRP A 1 61 ? 0.691 20.751 5.937 1.00 58.97 61 A 1 ATOM 512 C CH2 . TRP A 1 61 ? 0.112 21.325 7.090 1.00 57.55 61 A 1 ATOM 513 N N . ALA A 1 62 ? 2.306 16.624 7.649 1.00 76.76 62 A 1 ATOM 514 C CA . ALA A 1 62 ? 3.265 17.604 8.169 1.00 77.77 62 A 1 ATOM 515 C C . ALA A 1 62 ? 4.728 17.138 8.040 1.00 80.47 62 A 1 ATOM 516 O O . ALA A 1 62 ? 5.642 17.957 8.084 1.00 76.67 62 A 1 ATOM 517 C CB . ALA A 1 62 ? 2.903 17.909 9.628 1.00 74.15 62 A 1 ATOM 518 N N . SER A 1 63 ? 4.951 15.832 7.856 1.00 78.33 63 A 1 ATOM 519 C CA . SER A 1 63 ? 6.264 15.229 7.614 1.00 79.81 63 A 1 ATOM 520 C C . SER A 1 63 ? 6.551 14.946 6.135 1.00 83.38 63 A 1 ATOM 521 O O . SER A 1 63 ? 7.639 14.457 5.815 1.00 81.38 63 A 1 ATOM 522 C CB . SER A 1 63 ? 6.395 13.942 8.426 1.00 74.35 63 A 1 ATOM 523 O OG . SER A 1 63 ? 6.368 14.212 9.815 1.00 65.90 63 A 1 ATOM 524 N N . LEU A 1 64 ? 5.597 15.216 5.232 1.00 79.03 64 A 1 ATOM 525 C CA . LEU A 1 64 ? 5.831 15.139 3.792 1.00 79.95 64 A 1 ATOM 526 C C . LEU A 1 64 ? 6.707 16.310 3.341 1.00 80.61 64 A 1 ATOM 527 O O . LEU A 1 64 ? 6.525 17.451 3.765 1.00 79.87 64 A 1 ATOM 528 C CB . LEU A 1 64 ? 4.506 15.125 3.012 1.00 81.55 64 A 1 ATOM 529 C CG . LEU A 1 64 ? 3.670 13.847 3.180 1.00 80.79 64 A 1 ATOM 530 C CD1 . LEU A 1 64 ? 2.304 14.032 2.514 1.00 78.15 64 A 1 ATOM 531 C CD2 . LEU A 1 64 ? 4.342 12.634 2.525 1.00 79.11 64 A 1 ATOM 532 N N . LYS A 1 65 ? 7.639 16.038 2.428 1.00 82.16 65 A 1 ATOM 533 C CA . LYS A 1 65 ? 8.432 17.096 1.801 1.00 80.88 65 A 1 ATOM 534 C C . LYS A 1 65 ? 7.582 17.860 0.780 1.00 82.52 65 A 1 ATOM 535 O O . LYS A 1 65 ? 6.669 17.281 0.191 1.00 83.43 65 A 1 ATOM 536 C CB . LYS A 1 65 ? 9.678 16.503 1.143 1.00 80.49 65 A 1 ATOM 537 C CG . LYS A 1 65 ? 10.588 15.763 2.129 1.00 78.87 65 A 1 ATOM 538 C CD . LYS A 1 65 ? 11.730 15.141 1.326 1.00 74.60 65 A 1 ATOM 539 C CE . LYS A 1 65 ? 12.640 14.315 2.229 1.00 70.69 65 A 1 ATOM 540 N NZ . LYS A 1 65 ? 13.641 13.609 1.391 1.00 61.49 65 A 1 ATOM 541 N N . PRO A 1 66 ? 7.883 19.139 0.496 1.00 80.21 66 A 1 ATOM 542 C CA . PRO A 1 66 ? 7.138 19.919 -0.501 1.00 80.71 66 A 1 ATOM 543 C C . PRO A 1 66 ? 7.063 19.256 -1.885 1.00 83.69 66 A 1 ATOM 544 O O . PRO A 1 66 ? 6.014 19.277 -2.522 1.00 82.17 66 A 1 ATOM 545 C CB . PRO A 1 66 ? 7.855 21.272 -0.564 1.00 78.22 66 A 1 ATOM 546 C CG . PRO A 1 66 ? 8.454 21.416 0.836 1.00 76.99 66 A 1 ATOM 547 C CD . PRO A 1 66 ? 8.848 19.983 1.190 1.00 80.29 66 A 1 ATOM 548 N N . ASP A 1 67 ? 8.140 18.627 -2.342 1.00 83.62 67 A 1 ATOM 549 C CA . ASP A 1 67 ? 8.202 17.886 -3.606 1.00 84.75 67 A 1 ATOM 550 C C . ASP A 1 67 ? 7.351 16.604 -3.586 1.00 85.82 67 A 1 ATOM 551 O O . ASP A 1 67 ? 6.732 16.268 -4.599 1.00 85.08 67 A 1 ATOM 552 C CB . ASP A 1 67 ? 9.670 17.571 -3.950 1.00 83.96 67 A 1 ATOM 553 C CG . ASP A 1 67 ? 10.383 16.707 -2.897 1.00 75.06 67 A 1 ATOM 554 O OD1 . ASP A 1 67 ? 10.330 17.092 -1.706 1.00 68.64 67 A 1 ATOM 555 O OD2 . ASP A 1 67 ? 11.007 15.696 -3.272 1.00 68.72 67 A 1 ATOM 556 N N . GLU A 1 68 ? 7.242 15.915 -2.441 1.00 85.66 68 A 1 ATOM 557 C CA . GLU A 1 68 ? 6.333 14.779 -2.256 1.00 85.39 68 A 1 ATOM 558 C C . GLU A 1 68 ? 4.871 15.230 -2.375 1.00 86.59 68 A 1 ATOM 559 O O . GLU A 1 68 ? 4.099 14.602 -3.099 1.00 85.97 68 A 1 ATOM 560 C CB . GLU A 1 68 ? 6.572 14.079 -0.899 1.00 84.74 68 A 1 ATOM 561 C CG . GLU A 1 68 ? 7.921 13.343 -0.800 1.00 84.05 68 A 1 ATOM 562 C CD . GLU A 1 68 ? 8.167 12.707 0.587 1.00 85.25 68 A 1 ATOM 563 O OE1 . GLU A 1 68 ? 8.533 11.515 0.671 1.00 76.83 68 A 1 ATOM 564 O OE2 . GLU A 1 68 ? 8.053 13.407 1.620 1.00 78.56 68 A 1 ATOM 565 N N . ILE A 1 69 ? 4.497 16.348 -1.755 1.00 83.30 69 A 1 ATOM 566 C CA . ILE A 1 69 ? 3.139 16.917 -1.843 1.00 83.17 69 A 1 ATOM 567 C C . ILE A 1 69 ? 2.790 17.272 -3.295 1.00 84.92 69 A 1 ATOM 568 O O . ILE A 1 69 ? 1.731 16.882 -3.790 1.00 84.53 69 A 1 ATOM 569 C CB . ILE A 1 69 ? 2.987 18.139 -0.907 1.00 82.97 69 A 1 ATOM 570 C CG1 . ILE A 1 69 ? 3.155 17.707 0.567 1.00 82.21 69 A 1 ATOM 571 C CG2 . ILE A 1 69 ? 1.621 18.827 -1.114 1.00 81.54 69 A 1 ATOM 572 C CD1 . ILE A 1 69 ? 3.225 18.868 1.568 1.00 76.89 69 A 1 ATOM 573 N N . VAL A 1 70 ? 3.692 17.956 -4.010 1.00 83.79 70 A 1 ATOM 574 C CA . VAL A 1 70 ? 3.506 18.297 -5.433 1.00 83.58 70 A 1 ATOM 575 C C . VAL A 1 70 ? 3.398 17.036 -6.294 1.00 85.46 70 A 1 ATOM 576 O O . VAL A 1 70 ? 2.573 16.966 -7.204 1.00 86.47 70 A 1 ATOM 577 C CB . VAL A 1 70 ? 4.659 19.194 -5.924 1.00 83.63 70 A 1 ATOM 578 C CG1 . VAL A 1 70 ? 4.642 19.414 -7.442 1.00 77.29 70 A 1 ATOM 579 C CG2 . VAL A 1 70 ? 4.585 20.579 -5.267 1.00 79.31 70 A 1 ATOM 580 N N . THR A 1 71 ? 4.203 16.013 -6.011 1.00 89.09 71 A 1 ATOM 581 C CA . THR A 1 71 ? 4.163 14.732 -6.732 1.00 88.87 71 A 1 ATOM 582 C C . THR A 1 71 ? 2.830 14.014 -6.528 1.00 89.79 71 A 1 ATOM 583 O O . THR A 1 71 ? 2.255 13.519 -7.498 1.00 90.09 71 A 1 ATOM 584 C CB . THR A 1 71 ? 5.324 13.825 -6.306 1.00 88.65 71 A 1 ATOM 585 O OG1 . THR A 1 71 ? 6.539 14.464 -6.613 1.00 85.63 71 A 1 ATOM 586 C CG2 . THR A 1 71 ? 5.327 12.484 -7.043 1.00 84.84 71 A 1 ATOM 587 N N . LEU A 1 72 ? 2.316 13.981 -5.300 1.00 89.06 72 A 1 ATOM 588 C CA . LEU A 1 72 ? 1.009 13.401 -4.982 1.00 88.52 72 A 1 ATOM 589 C C . LEU A 1 72 ? -0.117 14.126 -5.721 1.00 89.32 72 A 1 ATOM 590 O O . LEU A 1 72 ? -0.911 13.472 -6.397 1.00 89.86 72 A 1 ATOM 591 C CB . LEU A 1 72 ? 0.790 13.435 -3.458 1.00 88.58 72 A 1 ATOM 592 C CG . LEU A 1 72 ? 1.661 12.427 -2.682 1.00 81.80 72 A 1 ATOM 593 C CD1 . LEU A 1 72 ? 1.555 12.696 -1.178 1.00 77.53 72 A 1 ATOM 594 C CD2 . LEU A 1 72 ? 1.236 10.981 -2.941 1.00 78.73 72 A 1 ATOM 595 N N . ASP A 1 73 ? -0.129 15.451 -5.685 1.00 89.24 73 A 1 ATOM 596 C CA . ASP A 1 73 ? -1.133 16.269 -6.369 1.00 88.51 73 A 1 ATOM 597 C C . ASP A 1 73 ? -1.126 16.053 -7.892 1.00 91.26 73 A 1 ATOM 598 O O . ASP A 1 73 ? -2.156 15.764 -8.508 1.00 91.56 73 A 1 ATOM 599 C CB . ASP A 1 73 ? -0.870 17.739 -6.024 1.00 86.44 73 A 1 ATOM 600 C CG . ASP A 1 73 ? -2.057 18.608 -6.417 1.00 78.31 73 A 1 ATOM 601 O OD1 . ASP A 1 73 ? -3.139 18.359 -5.825 1.00 73.22 73 A 1 ATOM 602 O OD2 . ASP A 1 73 ? -1.856 19.512 -7.250 1.00 71.22 73 A 1 ATOM 603 N N . ASN A 1 74 ? 0.062 16.075 -8.504 1.00 89.87 74 A 1 ATOM 604 C CA . ASN A 1 74 ? 0.224 15.799 -9.931 1.00 91.46 74 A 1 ATOM 605 C C . ASN A 1 74 ? -0.206 14.375 -10.306 1.00 93.14 74 A 1 ATOM 606 O O . ASN A 1 74 ? -0.743 14.162 -11.396 1.00 93.27 74 A 1 ATOM 607 C CB . ASN A 1 74 ? 1.693 16.022 -10.315 1.00 91.99 74 A 1 ATOM 608 C CG . ASN A 1 74 ? 2.074 17.488 -10.397 1.00 89.04 74 A 1 ATOM 609 O OD1 . ASN A 1 74 ? 1.285 18.352 -10.736 1.00 82.03 74 A 1 ATOM 610 N ND2 . ASN A 1 74 ? 3.321 17.810 -10.165 1.00 81.50 74 A 1 ATOM 611 N N . THR A 1 75 ? 0.037 13.394 -9.419 1.00 93.33 75 A 1 ATOM 612 C CA . THR A 1 75 ? -0.354 11.997 -9.645 1.00 93.65 75 A 1 ATOM 613 C C . THR A 1 75 ? -1.868 11.839 -9.590 1.00 94.42 75 A 1 ATOM 614 O O . THR A 1 75 ? -2.441 11.240 -10.499 1.00 94.31 75 A 1 ATOM 615 C CB . THR A 1 75 ? 0.323 11.048 -8.649 1.00 93.19 75 A 1 ATOM 616 O OG1 . THR A 1 75 ? 1.718 11.179 -8.743 1.00 88.70 75 A 1 ATOM 617 C CG2 . THR A 1 75 ? 0.006 9.580 -8.949 1.00 88.15 75 A 1 ATOM 618 N N . GLU A 1 76 ? -2.533 12.415 -8.596 1.00 92.54 76 A 1 ATOM 619 C CA . GLU A 1 76 ? -3.998 12.419 -8.514 1.00 92.29 76 A 1 ATOM 620 C C . GLU A 1 76 ? -4.618 13.072 -9.760 1.00 93.29 76 A 1 ATOM 621 O O . GLU A 1 76 ? -5.450 12.457 -10.436 1.00 93.65 76 A 1 ATOM 622 C CB . GLU A 1 76 ? -4.458 13.135 -7.231 1.00 91.61 76 A 1 ATOM 623 C CG . GLU A 1 76 ? -4.184 12.311 -5.957 1.00 89.65 76 A 1 ATOM 624 C CD . GLU A 1 76 ? -4.591 13.022 -4.648 1.00 88.26 76 A 1 ATOM 625 O OE1 . GLU A 1 76 ? -4.302 12.459 -3.568 1.00 80.12 76 A 1 ATOM 626 O OE2 . GLU A 1 76 ? -5.164 14.136 -4.688 1.00 80.91 76 A 1 ATOM 627 N N . ALA A 1 77 ? -4.123 14.243 -10.168 1.00 93.05 77 A 1 ATOM 628 C CA . ALA A 1 77 ? -4.574 14.914 -11.388 1.00 93.62 77 A 1 ATOM 629 C C . ALA A 1 77 ? -4.308 14.082 -12.660 1.00 95.17 77 A 1 ATOM 630 O O . ALA A 1 77 ? -5.097 14.097 -13.610 1.00 95.23 77 A 1 ATOM 631 C CB . ALA A 1 77 ? -3.874 16.278 -11.460 1.00 93.29 77 A 1 ATOM 632 N N . ALA A 1 78 ? -3.204 13.331 -12.719 1.00 94.80 78 A 1 ATOM 633 C CA . ALA A 1 78 ? -2.916 12.425 -13.831 1.00 95.61 78 A 1 ATOM 634 C C . ALA A 1 78 ? -3.897 11.242 -13.883 1.00 96.27 78 A 1 ATOM 635 O O . ALA A 1 78 ? -4.374 10.907 -14.969 1.00 96.06 78 A 1 ATOM 636 C CB . ALA A 1 78 ? -1.460 11.957 -13.753 1.00 95.68 78 A 1 ATOM 637 N N . VAL A 1 79 ? -4.243 10.654 -12.737 1.00 96.29 79 A 1 ATOM 638 C CA . VAL A 1 79 ? -5.251 9.585 -12.641 1.00 96.17 79 A 1 ATOM 639 C C . VAL A 1 79 ? -6.632 10.104 -13.052 1.00 96.58 79 A 1 ATOM 640 O O . VAL A 1 79 ? -7.323 9.437 -13.819 1.00 96.37 79 A 1 ATOM 641 C CB . VAL A 1 79 ? -5.268 8.972 -11.227 1.00 95.63 79 A 1 ATOM 642 C CG1 . VAL A 1 79 ? -6.400 7.950 -11.045 1.00 93.95 79 A 1 ATOM 643 C CG2 . VAL A 1 79 ? -3.955 8.232 -10.934 1.00 93.94 79 A 1 ATOM 644 N N . GLN A 1 80 ? -7.010 11.315 -12.648 1.00 96.38 80 A 1 ATOM 645 C CA . GLN A 1 80 ? -8.269 11.934 -13.080 1.00 95.98 80 A 1 ATOM 646 C C . GLN A 1 80 ? -8.319 12.115 -14.608 1.00 96.52 80 A 1 ATOM 647 O O . GLN A 1 80 ? -9.296 11.725 -15.253 1.00 96.11 80 A 1 ATOM 648 C CB . GLN A 1 80 ? -8.449 13.269 -12.345 1.00 94.76 80 A 1 ATOM 649 C CG . GLN A 1 80 ? -9.862 13.855 -12.527 1.00 87.24 80 A 1 ATOM 650 C CD . GLN A 1 80 ? -10.037 15.193 -11.810 1.00 84.39 80 A 1 ATOM 651 O OE1 . GLN A 1 80 ? -9.077 15.821 -11.389 1.00 76.02 80 A 1 ATOM 652 N NE2 . GLN A 1 80 ? -11.245 15.686 -11.668 1.00 71.23 80 A 1 ATOM 653 N N . ARG A 1 81 ? -7.238 12.615 -15.232 1.00 95.87 81 A 1 ATOM 654 C CA . ARG A 1 81 ? -7.139 12.717 -16.704 1.00 96.08 81 A 1 ATOM 655 C C . ARG A 1 81 ? -7.176 11.353 -17.399 1.00 96.70 81 A 1 ATOM 656 O O . ARG A 1 81 ? -7.722 11.252 -18.498 1.00 96.37 81 A 1 ATOM 657 C CB . ARG A 1 81 ? -5.866 13.471 -17.107 1.00 96.23 81 A 1 ATOM 658 C CG . ARG A 1 81 ? -5.950 14.971 -16.790 1.00 93.00 81 A 1 ATOM 659 C CD . ARG A 1 81 ? -4.751 15.733 -17.385 1.00 91.15 81 A 1 ATOM 660 N NE . ARG A 1 81 ? -3.451 15.283 -16.842 1.00 83.18 81 A 1 ATOM 661 C CZ . ARG A 1 81 ? -2.852 15.725 -15.747 1.00 75.73 81 A 1 ATOM 662 N NH1 . ARG A 1 81 ? -3.397 16.624 -14.976 1.00 67.73 81 A 1 ATOM 663 N NH2 . ARG A 1 81 ? -1.679 15.270 -15.407 1.00 66.02 81 A 1 ATOM 664 N N . LEU A 1 82 ? -6.607 10.316 -16.768 1.00 95.90 82 A 1 ATOM 665 C CA . LEU A 1 82 ? -6.651 8.951 -17.291 1.00 95.82 82 A 1 ATOM 666 C C . LEU A 1 82 ? -8.094 8.447 -17.417 1.00 96.31 82 A 1 ATOM 667 O O . LEU A 1 82 ? -8.405 7.807 -18.416 1.00 95.85 82 A 1 ATOM 668 C CB . LEU A 1 82 ? -5.786 8.033 -16.405 1.00 95.34 82 A 1 ATOM 669 C CG . LEU A 1 82 ? -5.806 6.544 -16.802 1.00 93.36 82 A 1 ATOM 670 C CD1 . LEU A 1 82 ? -5.213 6.309 -18.193 1.00 88.73 82 A 1 ATOM 671 C CD2 . LEU A 1 82 ? -5.000 5.733 -15.786 1.00 88.60 82 A 1 ATOM 672 N N . PHE A 1 83 ? -8.995 8.780 -16.491 1.00 96.47 83 A 1 ATOM 673 C CA . PHE A 1 83 ? -10.409 8.405 -16.613 1.00 96.33 83 A 1 ATOM 674 C C . PHE A 1 83 ? -11.056 9.003 -17.865 1.00 96.46 83 A 1 ATOM 675 O O . PHE A 1 83 ? -11.713 8.280 -18.611 1.00 95.46 83 A 1 ATOM 676 C CB . PHE A 1 83 ? -11.181 8.795 -15.345 1.00 95.86 83 A 1 ATOM 677 C CG . PHE A 1 83 ? -10.706 8.117 -14.071 1.00 95.92 83 A 1 ATOM 678 C CD1 . PHE A 1 83 ? -10.243 6.787 -14.087 1.00 92.40 83 A 1 ATOM 679 C CD2 . PHE A 1 83 ? -10.743 8.825 -12.854 1.00 92.78 83 A 1 ATOM 680 C CE1 . PHE A 1 83 ? -9.786 6.181 -12.906 1.00 91.45 83 A 1 ATOM 681 C CE2 . PHE A 1 83 ? -10.288 8.216 -11.672 1.00 91.47 83 A 1 ATOM 682 C CZ . PHE A 1 83 ? -9.802 6.895 -11.702 1.00 92.03 83 A 1 ATOM 683 N N . GLY A 1 84 ? -10.780 10.274 -18.165 1.00 95.46 84 A 1 ATOM 684 C CA . GLY A 1 84 ? -11.227 10.901 -19.411 1.00 95.00 84 A 1 ATOM 685 C C . GLY A 1 84 ? -10.696 10.184 -20.660 1.00 95.88 84 A 1 ATOM 686 O O . GLY A 1 84 ? -11.449 9.940 -21.598 1.00 94.37 84 A 1 ATOM 687 N N . LEU A 1 85 ? -9.420 9.762 -20.661 1.00 94.84 85 A 1 ATOM 688 C CA . LEU A 1 85 ? -8.840 8.956 -21.748 1.00 94.66 85 A 1 ATOM 689 C C . LEU A 1 85 ? -9.534 7.593 -21.905 1.00 95.20 85 A 1 ATOM 690 O O . LEU A 1 85 ? -9.675 7.100 -23.025 1.00 93.92 85 A 1 ATOM 691 C CB . LEU A 1 85 ? -7.332 8.779 -21.489 1.00 94.81 85 A 1 ATOM 692 C CG . LEU A 1 85 ? -6.594 7.915 -22.537 1.00 90.99 85 A 1 ATOM 693 C CD1 . LEU A 1 85 ? -6.606 8.563 -23.925 1.00 84.87 85 A 1 ATOM 694 C CD2 . LEU A 1 85 ? -5.138 7.715 -22.115 1.00 86.14 85 A 1 ATOM 695 N N . LEU A 1 86 ? -9.964 6.981 -20.796 1.00 95.16 86 A 1 ATOM 696 C CA . LEU A 1 86 ? -10.692 5.710 -20.782 1.00 94.96 86 A 1 ATOM 697 C C . LEU A 1 86 ? -12.182 5.860 -21.142 1.00 95.11 86 A 1 ATOM 698 O O . LEU A 1 86 ? -12.877 4.854 -21.248 1.00 93.56 86 A 1 ATOM 699 C CB . LEU A 1 86 ? -10.493 5.028 -19.414 1.00 95.26 86 A 1 ATOM 700 C CG . LEU A 1 86 ? -9.033 4.641 -19.083 1.00 94.92 86 A 1 ATOM 701 C CD1 . LEU A 1 86 ? -8.960 4.086 -17.660 1.00 92.21 86 A 1 ATOM 702 C CD2 . LEU A 1 86 ? -8.465 3.594 -20.042 1.00 92.07 86 A 1 ATOM 703 N N . GLY A 1 87 ? -12.668 7.089 -21.362 1.00 95.93 87 A 1 ATOM 704 C CA . GLY A 1 87 ? -14.060 7.379 -21.708 1.00 95.59 87 A 1 ATOM 705 C C . GLY A 1 87 ? -14.997 7.507 -20.506 1.00 96.05 87 A 1 ATOM 706 O O . GLY A 1 87 ? -16.209 7.438 -20.684 1.00 94.12 87 A 1 ATOM 707 N N . GLU A 1 88 ? -14.454 7.677 -19.303 1.00 95.77 88 A 1 ATOM 708 C CA . GLU A 1 88 ? -15.224 7.869 -18.070 1.00 95.42 88 A 1 ATOM 709 C C . GLU A 1 88 ? -15.449 9.356 -17.756 1.00 95.81 88 A 1 ATOM 710 O O . GLU A 1 88 ? -14.616 10.213 -18.057 1.00 94.06 88 A 1 ATOM 711 C CB . GLU A 1 88 ? -14.516 7.162 -16.904 1.00 93.62 88 A 1 ATOM 712 C CG . GLU A 1 88 ? -14.919 5.676 -16.777 1.00 86.67 88 A 1 ATOM 713 C CD . GLU A 1 88 ? -16.288 5.491 -16.107 1.00 91.62 88 A 1 ATOM 714 O OE1 . GLU A 1 88 ? -16.651 4.343 -15.770 1.00 83.93 88 A 1 ATOM 715 O OE2 . GLU A 1 88 ? -16.964 6.493 -15.777 1.00 85.71 88 A 1 ATOM 716 N N . ASP A 1 89 ? -16.563 9.640 -17.092 1.00 95.59 89 A 1 ATOM 717 C CA . ASP A 1 89 ? -16.813 10.937 -16.463 1.00 95.41 89 A 1 ATOM 718 C C . ASP A 1 89 ? -16.135 10.975 -15.085 1.00 95.09 89 A 1 ATOM 719 O O . ASP A 1 89 ? -16.596 10.349 -14.128 1.00 92.68 89 A 1 ATOM 720 C CB . ASP A 1 89 ? -18.323 11.198 -16.377 1.00 94.68 89 A 1 ATOM 721 C CG . ASP A 1 89 ? -18.662 12.511 -15.661 1.00 94.42 89 A 1 ATOM 722 O OD1 . ASP A 1 89 ? -17.729 13.310 -15.412 1.00 90.92 89 A 1 ATOM 723 O OD2 . ASP A 1 89 ? -19.861 12.686 -15.355 1.00 90.49 89 A 1 ATOM 724 N N . ALA A 1 90 ? -15.012 11.693 -15.002 1.00 95.59 90 A 1 ATOM 725 C CA . ALA A 1 90 ? -14.225 11.809 -13.775 1.00 94.33 90 A 1 ATOM 726 C C . ALA A 1 90 ? -14.943 12.576 -12.647 1.00 94.52 90 A 1 ATOM 727 O O . ALA A 1 90 ? -14.560 12.437 -11.488 1.00 92.58 90 A 1 ATOM 728 C CB . ALA A 1 90 ? -12.885 12.464 -14.134 1.00 92.68 90 A 1 ATOM 729 N N . GLU A 1 91 ? -15.983 13.351 -12.983 1.00 94.07 91 A 1 ATOM 730 C CA . GLU A 1 91 ? -16.715 14.189 -12.023 1.00 93.61 91 A 1 ATOM 731 C C . GLU A 1 91 ? -17.897 13.460 -11.369 1.00 94.23 91 A 1 ATOM 732 O O . GLU A 1 91 ? -18.513 13.970 -10.428 1.00 91.93 91 A 1 ATOM 733 C CB . GLU A 1 91 ? -17.189 15.479 -12.722 1.00 92.82 91 A 1 ATOM 734 C CG . GLU A 1 91 ? -16.047 16.316 -13.318 1.00 89.60 91 A 1 ATOM 735 C CD . GLU A 1 91 ? -14.990 16.720 -12.275 1.00 83.24 91 A 1 ATOM 736 O OE1 . GLU A 1 91 ? -13.782 16.582 -12.576 1.00 73.77 91 A 1 ATOM 737 O OE2 . GLU A 1 91 ? -15.400 17.167 -11.184 1.00 73.68 91 A 1 ATOM 738 N N . ARG A 1 92 ? -18.237 12.244 -11.826 1.00 95.14 92 A 1 ATOM 739 C CA . ARG A 1 92 ? -19.305 11.468 -11.187 1.00 95.01 92 A 1 ATOM 740 C C . ARG A 1 92 ? -18.918 11.060 -9.761 1.00 95.75 92 A 1 ATOM 741 O O . ARG A 1 92 ? -17.771 10.700 -9.501 1.00 95.16 92 A 1 ATOM 742 C CB . ARG A 1 92 ? -19.736 10.278 -12.065 1.00 93.57 92 A 1 ATOM 743 C CG . ARG A 1 92 ? -18.746 9.116 -12.078 1.00 91.34 92 A 1 ATOM 744 C CD . ARG A 1 92 ? -19.239 8.038 -13.044 1.00 91.14 92 A 1 ATOM 745 N NE . ARG A 1 92 ? -18.287 6.933 -13.212 1.00 89.31 92 A 1 ATOM 746 C CZ . ARG A 1 92 ? -18.055 5.915 -12.409 1.00 91.20 92 A 1 ATOM 747 N NH1 . ARG A 1 92 ? -18.605 5.807 -11.230 1.00 82.84 92 A 1 ATOM 748 N NH2 . ARG A 1 92 ? -17.245 4.973 -12.809 1.00 84.61 92 A 1 ATOM 749 N N . ASP A 1 93 ? -19.908 11.013 -8.875 1.00 95.01 93 A 1 ATOM 750 C CA . ASP A 1 93 ? -19.749 10.737 -7.435 1.00 94.52 93 A 1 ATOM 751 C C . ASP A 1 93 ? -18.761 9.597 -7.117 1.00 94.79 93 A 1 ATOM 752 O O . ASP A 1 93 ? -17.809 9.761 -6.354 1.00 89.43 93 A 1 ATOM 753 C CB . ASP A 1 93 ? -21.154 10.437 -6.885 1.00 92.89 93 A 1 ATOM 754 C CG . ASP A 1 93 ? -21.158 10.181 -5.377 1.00 87.33 93 A 1 ATOM 755 O OD1 . ASP A 1 93 ? -20.841 11.130 -4.633 1.00 79.49 93 A 1 ATOM 756 O OD2 . ASP A 1 93 ? -21.506 9.040 -4.999 1.00 79.69 93 A 1 ATOM 757 N N . GLY A 1 94 ? -18.896 8.449 -7.778 1.00 95.12 94 A 1 ATOM 758 C CA . GLY A 1 94 ? -18.033 7.287 -7.535 1.00 94.67 94 A 1 ATOM 759 C C . GLY A 1 94 ? -16.547 7.464 -7.883 1.00 95.33 94 A 1 ATOM 760 O O . GLY A 1 94 ? -15.722 6.690 -7.383 1.00 94.34 94 A 1 ATOM 761 N N . LEU A 1 95 ? -16.188 8.428 -8.742 1.00 95.48 95 A 1 ATOM 762 C CA . LEU A 1 95 ? -14.822 8.651 -9.222 1.00 95.76 95 A 1 ATOM 763 C C . LEU A 1 95 ? -14.122 9.862 -8.601 1.00 95.55 95 A 1 ATOM 764 O O . LEU A 1 95 ? -12.897 9.909 -8.681 1.00 94.96 95 A 1 ATOM 765 C CB . LEU A 1 95 ? -14.789 8.726 -10.759 1.00 95.83 95 A 1 ATOM 766 C CG . LEU A 1 95 ? -15.058 7.399 -11.491 1.00 94.95 95 A 1 ATOM 767 C CD1 . LEU A 1 95 ? -14.794 7.586 -12.987 1.00 92.38 95 A 1 ATOM 768 C CD2 . LEU A 1 95 ? -14.169 6.246 -11.018 1.00 92.47 95 A 1 ATOM 769 N N . GLN A 1 96 ? -14.835 10.778 -7.959 1.00 95.32 96 A 1 ATOM 770 C CA . GLN A 1 96 ? -14.260 12.014 -7.400 1.00 93.94 96 A 1 ATOM 771 C C . GLN A 1 96 ? -13.045 11.742 -6.493 1.00 94.22 96 A 1 ATOM 772 O O . GLN A 1 96 ? -11.971 12.298 -6.704 1.00 93.24 96 A 1 ATOM 773 C CB . GLN A 1 96 ? -15.348 12.790 -6.640 1.00 92.68 96 A 1 ATOM 774 C CG . GLN A 1 96 ? -16.392 13.376 -7.606 1.00 89.26 96 A 1 ATOM 775 C CD . GLN A 1 96 ? -17.520 14.135 -6.917 1.00 86.67 96 A 1 ATOM 776 O OE1 . GLN A 1 96 ? -17.644 14.212 -5.709 1.00 78.78 96 A 1 ATOM 777 N NE2 . GLN A 1 96 ? -18.408 14.735 -7.678 1.00 76.03 96 A 1 ATOM 778 N N . ASP A 1 97 ? -13.166 10.794 -5.558 1.00 93.20 97 A 1 ATOM 779 C CA . ASP A 1 97 ? -12.075 10.424 -4.637 1.00 93.48 97 A 1 ATOM 780 C C . ASP A 1 97 ? -11.197 9.262 -5.139 1.00 95.10 97 A 1 ATOM 781 O O . ASP A 1 97 ? -10.332 8.748 -4.417 1.00 94.51 97 A 1 ATOM 782 C CB . ASP A 1 97 ? -12.650 10.075 -3.262 1.00 91.85 97 A 1 ATOM 783 C CG . ASP A 1 97 ? -13.302 11.252 -2.542 1.00 87.50 97 A 1 ATOM 784 O OD1 . ASP A 1 97 ? -12.852 12.396 -2.767 1.00 82.98 97 A 1 ATOM 785 O OD2 . ASP A 1 97 ? -14.199 10.945 -1.727 1.00 81.08 97 A 1 ATOM 786 N N . THR A 1 98 ? -11.433 8.763 -6.362 1.00 94.65 98 A 1 ATOM 787 C CA . THR A 1 98 ? -10.691 7.594 -6.869 1.00 95.69 98 A 1 ATOM 788 C C . THR A 1 98 ? -9.209 7.873 -7.107 1.00 96.11 98 A 1 ATOM 789 O O . THR A 1 98 ? -8.420 6.991 -6.764 1.00 96.11 98 A 1 ATOM 790 C CB . THR A 1 98 ? -11.359 6.961 -8.094 1.00 96.05 98 A 1 ATOM 791 O OG1 . THR A 1 98 ? -12.637 6.520 -7.698 1.00 94.53 98 A 1 ATOM 792 C CG2 . THR A 1 98 ? -10.615 5.735 -8.616 1.00 94.14 98 A 1 ATOM 793 N N . PRO A 1 99 ? -8.787 9.061 -7.583 1.00 95.20 99 A 1 ATOM 794 C CA . PRO A 1 99 ? -7.368 9.409 -7.672 1.00 94.56 99 A 1 ATOM 795 C C . PRO A 1 99 ? -6.627 9.244 -6.338 1.00 94.70 99 A 1 ATOM 796 O O . PRO A 1 99 ? -5.616 8.541 -6.274 1.00 94.49 99 A 1 ATOM 797 C CB . PRO A 1 99 ? -7.347 10.850 -8.181 1.00 94.03 99 A 1 ATOM 798 C CG . PRO A 1 99 ? -8.628 10.962 -8.999 1.00 93.21 99 A 1 ATOM 799 C CD . PRO A 1 99 ? -9.599 10.124 -8.183 1.00 94.43 99 A 1 ATOM 800 N N . PHE A 1 100 ? -7.188 9.786 -5.257 1.00 93.18 100 A 1 ATOM 801 C CA . PHE A 1 100 ? -6.654 9.598 -3.905 1.00 92.74 100 A 1 ATOM 802 C C . PHE A 1 100 ? -6.633 8.119 -3.487 1.00 93.60 100 A 1 ATOM 803 O O . PHE A 1 100 ? -5.596 7.605 -3.057 1.00 93.98 100 A 1 ATOM 804 C CB . PHE A 1 100 ? -7.485 10.426 -2.915 1.00 91.75 100 A 1 ATOM 805 C CG . PHE A 1 100 ? -7.379 9.935 -1.485 1.00 90.03 100 A 1 ATOM 806 C CD1 . PHE A 1 100 ? -8.463 9.267 -0.876 1.00 83.72 100 A 1 ATOM 807 C CD2 . PHE A 1 100 ? -6.166 10.074 -0.791 1.00 83.60 100 A 1 ATOM 808 C CE1 . PHE A 1 100 ? -8.333 8.752 0.423 1.00 80.91 100 A 1 ATOM 809 C CE2 . PHE A 1 100 ? -6.039 9.553 0.511 1.00 80.53 100 A 1 ATOM 810 C CZ . PHE A 1 100 ? -7.123 8.895 1.118 1.00 84.03 100 A 1 ATOM 811 N N . ARG A 1 101 ? -7.754 7.397 -3.636 1.00 94.34 101 A 1 ATOM 812 C CA . ARG A 1 101 ? -7.842 5.970 -3.273 1.00 94.73 101 A 1 ATOM 813 C C . ARG A 1 101 ? -6.836 5.116 -4.043 1.00 95.57 101 A 1 ATOM 814 O O . ARG A 1 101 ? -6.262 4.199 -3.460 1.00 96.07 101 A 1 ATOM 815 C CB . ARG A 1 101 ? -9.266 5.436 -3.499 1.00 95.39 101 A 1 ATOM 816 C CG . ARG A 1 101 ? -10.283 5.974 -2.480 1.00 95.59 101 A 1 ATOM 817 C CD . ARG A 1 101 ? -11.638 5.261 -2.602 1.00 95.02 101 A 1 ATOM 818 N NE . ARG A 1 101 ? -12.276 5.460 -3.918 1.00 92.75 101 A 1 ATOM 819 C CZ . ARG A 1 101 ? -13.227 6.329 -4.226 1.00 92.90 101 A 1 ATOM 820 N NH1 . ARG A 1 101 ? -13.733 7.158 -3.365 1.00 87.90 101 A 1 ATOM 821 N NH2 . ARG A 1 101 ? -13.706 6.381 -5.435 1.00 89.52 101 A 1 ATOM 822 N N . PHE A 1 102 ? -6.602 5.427 -5.319 1.00 95.61 102 A 1 ATOM 823 C CA . PHE A 1 102 ? -5.623 4.739 -6.157 1.00 95.84 102 A 1 ATOM 824 C C . PHE A 1 102 ? -4.196 4.922 -5.628 1.00 96.08 102 A 1 ATOM 825 O O . PHE A 1 102 ? -3.494 3.936 -5.416 1.00 95.79 102 A 1 ATOM 826 C CB . PHE A 1 102 ? -5.756 5.234 -7.604 1.00 95.85 102 A 1 ATOM 827 C CG . PHE A 1 102 ? -4.707 4.656 -8.531 1.00 95.64 102 A 1 ATOM 828 C CD1 . PHE A 1 102 ? -3.507 5.359 -8.772 1.00 92.56 102 A 1 ATOM 829 C CD2 . PHE A 1 102 ? -4.907 3.396 -9.122 1.00 92.91 102 A 1 ATOM 830 C CE1 . PHE A 1 102 ? -2.519 4.803 -9.604 1.00 91.68 102 A 1 ATOM 831 C CE2 . PHE A 1 102 ? -3.919 2.840 -9.955 1.00 91.76 102 A 1 ATOM 832 C CZ . PHE A 1 102 ? -2.725 3.546 -10.197 1.00 92.25 102 A 1 ATOM 833 N N . VAL A 1 103 ? -3.779 6.162 -5.365 1.00 94.72 103 A 1 ATOM 834 C CA . VAL A 1 103 ? -2.431 6.450 -4.840 1.00 94.27 103 A 1 ATOM 835 C C . VAL A 1 103 ? -2.229 5.800 -3.473 1.00 94.52 103 A 1 ATOM 836 O O . VAL A 1 103 ? -1.207 5.150 -3.243 1.00 94.68 103 A 1 ATOM 837 C CB . VAL A 1 103 ? -2.176 7.966 -4.772 1.00 93.84 103 A 1 ATOM 838 C CG1 . VAL A 1 103 ? -0.814 8.284 -4.143 1.00 90.93 103 A 1 ATOM 839 C CG2 . VAL A 1 103 ? -2.172 8.576 -6.177 1.00 90.99 103 A 1 ATOM 840 N N . LYS A 1 104 ? -3.217 5.903 -2.581 1.00 93.02 104 A 1 ATOM 841 C CA . LYS A 1 104 ? -3.182 5.264 -1.259 1.00 92.78 104 A 1 ATOM 842 C C . LYS A 1 104 ? -3.052 3.743 -1.366 1.00 93.15 104 A 1 ATOM 843 O O . LYS A 1 104 ? -2.184 3.170 -0.718 1.00 93.61 104 A 1 ATOM 844 C CB . LYS A 1 104 ? -4.419 5.684 -0.457 1.00 93.15 104 A 1 ATOM 845 C CG . LYS A 1 104 ? -4.401 5.099 0.963 1.00 93.10 104 A 1 ATOM 846 C CD . LYS A 1 104 ? -5.603 5.607 1.770 1.00 90.58 104 A 1 ATOM 847 C CE . LYS A 1 104 ? -5.637 5.020 3.178 1.00 85.17 104 A 1 ATOM 848 N NZ . LYS A 1 104 ? -6.115 3.626 3.200 1.00 79.52 104 A 1 ATOM 849 N N . ALA A 1 105 ? -3.862 3.101 -2.208 1.00 95.06 105 A 1 ATOM 850 C CA . ALA A 1 105 ? -3.807 1.651 -2.410 1.00 95.22 105 A 1 ATOM 851 C C . ALA A 1 105 ? -2.445 1.199 -2.962 1.00 95.51 105 A 1 ATOM 852 O O . ALA A 1 105 ? -1.876 0.219 -2.487 1.00 95.34 105 A 1 ATOM 853 C CB . ALA A 1 105 ? -4.949 1.240 -3.347 1.00 95.69 105 A 1 ATOM 854 N N . LEU A 1 106 ? -1.870 1.937 -3.915 1.00 95.80 106 A 1 ATOM 855 C CA . LEU A 1 106 ? -0.539 1.636 -4.444 1.00 95.28 106 A 1 ATOM 856 C C . LEU A 1 106 ? 0.549 1.779 -3.368 1.00 95.32 106 A 1 ATOM 857 O O . LEU A 1 106 ? 1.446 0.939 -3.279 1.00 94.59 106 A 1 ATOM 858 C CB . LEU A 1 106 ? -0.276 2.537 -5.664 1.00 94.70 106 A 1 ATOM 859 C CG . LEU A 1 106 ? 1.037 2.215 -6.404 1.00 88.55 106 A 1 ATOM 860 C CD1 . LEU A 1 106 ? 1.045 0.799 -6.985 1.00 84.65 106 A 1 ATOM 861 C CD2 . LEU A 1 106 ? 1.231 3.201 -7.553 1.00 85.24 106 A 1 ATOM 862 N N . ALA A 1 107 ? 0.458 2.795 -2.511 1.00 94.35 107 A 1 ATOM 863 C CA . ALA A 1 107 ? 1.360 2.966 -1.373 1.00 93.24 107 A 1 ATOM 864 C C . ALA A 1 107 ? 1.241 1.809 -0.358 1.00 93.71 107 A 1 ATOM 865 O O . ALA A 1 107 ? 2.259 1.323 0.134 1.00 93.07 107 A 1 ATOM 866 C CB . ALA A 1 107 ? 1.094 4.331 -0.729 1.00 92.48 107 A 1 ATOM 867 N N . GLU A 1 108 ? 0.030 1.310 -0.085 1.00 93.29 108 A 1 ATOM 868 C CA . GLU A 1 108 ? -0.229 0.137 0.771 1.00 93.69 108 A 1 ATOM 869 C C . GLU A 1 108 ? 0.342 -1.156 0.170 1.00 94.63 108 A 1 ATOM 870 O O . GLU A 1 108 ? 1.008 -1.925 0.860 1.00 94.53 108 A 1 ATOM 871 C CB . GLU A 1 108 ? -1.741 -0.019 1.012 1.00 93.87 108 A 1 ATOM 872 C CG . GLU A 1 108 ? -2.297 1.061 1.947 1.00 92.16 108 A 1 ATOM 873 C CD . GLU A 1 108 ? -3.833 1.096 2.041 1.00 91.37 108 A 1 ATOM 874 O OE1 . GLU A 1 108 ? -4.335 1.854 2.906 1.00 84.62 108 A 1 ATOM 875 O OE2 . GLU A 1 108 ? -4.537 0.449 1.242 1.00 85.97 108 A 1 ATOM 876 N N . HIS A 1 109 ? 0.155 -1.367 -1.134 1.00 96.14 109 A 1 ATOM 877 C CA . HIS A 1 109 ? 0.732 -2.518 -1.841 1.00 96.32 109 A 1 ATOM 878 C C . HIS A 1 109 ? 2.264 -2.494 -1.918 1.00 96.82 109 A 1 ATOM 879 O O . HIS A 1 109 ? 2.868 -3.514 -2.243 1.00 96.11 109 A 1 ATOM 880 C CB . HIS A 1 109 ? 0.140 -2.602 -3.253 1.00 96.10 109 A 1 ATOM 881 C CG . HIS A 1 109 ? -1.247 -3.192 -3.275 1.00 95.13 109 A 1 ATOM 882 N ND1 . HIS A 1 109 ? -1.601 -4.437 -2.809 1.00 86.21 109 A 1 ATOM 883 C CD2 . HIS A 1 109 ? -2.382 -2.616 -3.779 1.00 86.96 109 A 1 ATOM 884 C CE1 . HIS A 1 109 ? -2.914 -4.603 -3.027 1.00 87.46 109 A 1 ATOM 885 N NE2 . HIS A 1 109 ? -3.434 -3.521 -3.623 1.00 89.17 109 A 1 ATOM 886 N N . THR A 1 110 ? 2.884 -1.356 -1.635 1.00 95.54 110 A 1 ATOM 887 C CA . THR A 1 110 ? 4.343 -1.175 -1.702 1.00 95.44 110 A 1 ATOM 888 C C . THR A 1 110 ? 4.974 -0.824 -0.350 1.00 95.18 110 A 1 ATOM 889 O O . THR A 1 110 ? 6.105 -0.353 -0.290 1.00 94.05 110 A 1 ATOM 890 C CB . THR A 1 110 ? 4.722 -0.179 -2.808 1.00 95.16 110 A 1 ATOM 891 O OG1 . THR A 1 110 ? 4.108 1.068 -2.589 1.00 93.59 110 A 1 ATOM 892 C CG2 . THR A 1 110 ? 4.315 -0.668 -4.201 1.00 92.69 110 A 1 ATOM 893 N N . VAL A 1 111 ? 4.268 -1.086 0.762 1.00 94.83 111 A 1 ATOM 894 C CA . VAL A 1 111 ? 4.750 -0.773 2.125 1.00 94.27 111 A 1 ATOM 895 C C . VAL A 1 111 ? 6.078 -1.460 2.466 1.00 94.95 111 A 1 ATOM 896 O O . VAL A 1 111 ? 6.900 -0.879 3.170 1.00 93.53 111 A 1 ATOM 897 C CB . VAL A 1 111 ? 3.651 -1.067 3.168 1.00 92.15 111 A 1 ATOM 898 C CG1 . VAL A 1 111 ? 3.380 -2.557 3.390 1.00 84.59 111 A 1 ATOM 899 C CG2 . VAL A 1 111 ? 3.958 -0.413 4.518 1.00 84.78 111 A 1 ATOM 900 N N . GLY A 1 112 ? 6.354 -2.624 1.881 1.00 95.66 112 A 1 ATOM 901 C CA . GLY A 1 112 ? 7.582 -3.387 2.122 1.00 95.81 112 A 1 ATOM 902 C C . GLY A 1 112 ? 8.886 -2.725 1.655 1.00 96.10 112 A 1 ATOM 903 O O . GLY A 1 112 ? 9.964 -3.216 1.978 1.00 95.38 112 A 1 ATOM 904 N N . TYR A 1 113 ? 8.841 -1.604 0.919 1.00 96.27 113 A 1 ATOM 905 C CA . TYR A 1 113 ? 10.046 -0.804 0.641 1.00 95.30 113 A 1 ATOM 906 C C . TYR A 1 113 ? 10.549 -0.015 1.859 1.00 94.40 113 A 1 ATOM 907 O O . TYR A 1 113 ? 11.667 0.489 1.825 1.00 91.61 113 A 1 ATOM 908 C CB . TYR A 1 113 ? 9.787 0.161 -0.521 1.00 95.08 113 A 1 ATOM 909 C CG . TYR A 1 113 ? 9.748 -0.496 -1.886 1.00 96.15 113 A 1 ATOM 910 C CD1 . TYR A 1 113 ? 10.903 -1.130 -2.389 1.00 94.67 113 A 1 ATOM 911 C CD2 . TYR A 1 113 ? 8.580 -0.443 -2.672 1.00 94.82 113 A 1 ATOM 912 C CE1 . TYR A 1 113 ? 10.887 -1.714 -3.669 1.00 93.87 113 A 1 ATOM 913 C CE2 . TYR A 1 113 ? 8.562 -1.027 -3.954 1.00 94.23 113 A 1 ATOM 914 C CZ . TYR A 1 113 ? 9.719 -1.662 -4.457 1.00 95.83 113 A 1 ATOM 915 O OH . TYR A 1 113 ? 9.708 -2.225 -5.694 1.00 95.06 113 A 1 ATOM 916 N N . ARG A 1 114 ? 9.722 0.122 2.900 1.00 94.54 114 A 1 ATOM 917 C CA . ARG A 1 114 ? 10.000 0.944 4.087 1.00 92.90 114 A 1 ATOM 918 C C . ARG A 1 114 ? 10.574 0.144 5.248 1.00 93.42 114 A 1 ATOM 919 O O . ARG A 1 114 ? 10.769 0.701 6.323 1.00 91.24 114 A 1 ATOM 920 C CB . ARG A 1 114 ? 8.726 1.711 4.484 1.00 91.29 114 A 1 ATOM 921 C CG . ARG A 1 114 ? 8.356 2.742 3.405 1.00 88.47 114 A 1 ATOM 922 C CD . ARG A 1 114 ? 7.032 3.442 3.691 1.00 83.35 114 A 1 ATOM 923 N NE . ARG A 1 114 ? 5.850 2.672 3.254 1.00 78.36 114 A 1 ATOM 924 C CZ . ARG A 1 114 ? 5.406 2.510 2.020 1.00 70.15 114 A 1 ATOM 925 N NH1 . ARG A 1 114 ? 6.052 2.925 0.977 1.00 62.92 114 A 1 ATOM 926 N NH2 . ARG A 1 114 ? 4.270 1.927 1.801 1.00 64.22 114 A 1 ATOM 927 N N . GLU A 1 115 ? 10.855 -1.132 5.037 1.00 92.82 115 A 1 ATOM 928 C CA . GLU A 1 115 ? 11.505 -1.996 6.018 1.00 93.82 115 A 1 ATOM 929 C C . GLU A 1 115 ? 12.564 -2.885 5.352 1.00 95.68 115 A 1 ATOM 930 O O . GLU A 1 115 ? 12.509 -3.153 4.144 1.00 95.20 115 A 1 ATOM 931 C CB . GLU A 1 115 ? 10.462 -2.826 6.783 1.00 90.71 115 A 1 ATOM 932 C CG . GLU A 1 115 ? 9.661 -3.806 5.907 1.00 87.51 115 A 1 ATOM 933 C CD . GLU A 1 115 ? 8.691 -4.695 6.705 1.00 87.56 115 A 1 ATOM 934 O OE1 . GLU A 1 115 ? 8.209 -5.685 6.113 1.00 79.61 115 A 1 ATOM 935 O OE2 . GLU A 1 115 ? 8.441 -4.421 7.900 1.00 81.87 115 A 1 ATOM 936 N N . ASP A 1 116 ? 13.515 -3.354 6.147 1.00 94.93 116 A 1 ATOM 937 C CA . ASP A 1 116 ? 14.358 -4.489 5.788 1.00 96.47 116 A 1 ATOM 938 C C . ASP A 1 116 ? 13.743 -5.772 6.373 1.00 97.26 116 A 1 ATOM 939 O O . ASP A 1 116 ? 13.779 -5.957 7.595 1.00 96.78 116 A 1 ATOM 940 C CB . ASP A 1 116 ? 15.804 -4.278 6.262 1.00 96.17 116 A 1 ATOM 941 C CG . ASP A 1 116 ? 16.730 -5.426 5.818 1.00 95.88 116 A 1 ATOM 942 O OD1 . ASP A 1 116 ? 16.233 -6.415 5.219 1.00 93.60 116 A 1 ATOM 943 O OD2 . ASP A 1 116 ? 17.950 -5.300 6.038 1.00 92.53 116 A 1 ATOM 944 N N . PRO A 1 117 ? 13.192 -6.684 5.545 1.00 97.58 117 A 1 ATOM 945 C CA . PRO A 1 117 ? 12.550 -7.901 6.042 1.00 97.66 117 A 1 ATOM 946 C C . PRO A 1 117 ? 13.492 -8.833 6.807 1.00 97.83 117 A 1 ATOM 947 O O . PRO A 1 117 ? 13.026 -9.627 7.626 1.00 97.24 117 A 1 ATOM 948 C CB . PRO A 1 117 ? 11.966 -8.589 4.806 1.00 97.27 117 A 1 ATOM 949 C CG . PRO A 1 117 ? 11.799 -7.449 3.806 1.00 96.38 117 A 1 ATOM 950 C CD . PRO A 1 117 ? 12.999 -6.569 4.110 1.00 97.47 117 A 1 ATOM 951 N N . LYS A 1 118 ? 14.806 -8.734 6.598 1.00 97.67 118 A 1 ATOM 952 C CA . LYS A 1 118 ? 15.811 -9.541 7.309 1.00 97.69 118 A 1 ATOM 953 C C . LYS A 1 118 ? 15.792 -9.297 8.816 1.00 97.71 118 A 1 ATOM 954 O O . LYS A 1 118 ? 15.934 -10.247 9.585 1.00 97.04 118 A 1 ATOM 955 C CB . LYS A 1 118 ? 17.214 -9.247 6.765 1.00 97.12 118 A 1 ATOM 956 C CG . LYS A 1 118 ? 17.407 -9.694 5.312 1.00 95.40 118 A 1 ATOM 957 C CD . LYS A 1 118 ? 18.838 -9.363 4.891 1.00 93.75 118 A 1 ATOM 958 C CE . LYS A 1 118 ? 19.101 -9.731 3.439 1.00 88.19 118 A 1 ATOM 959 N NZ . LYS A 1 118 ? 20.509 -9.435 3.097 1.00 82.28 118 A 1 ATOM 960 N N . LEU A 1 119 ? 15.520 -8.059 9.245 1.00 97.43 119 A 1 ATOM 961 C CA . LEU A 1 119 ? 15.483 -7.679 10.662 1.00 97.25 119 A 1 ATOM 962 C C . LEU A 1 119 ? 14.446 -8.489 11.458 1.00 97.32 119 A 1 ATOM 963 O O . LEU A 1 119 ? 14.582 -8.699 12.663 1.00 96.46 119 A 1 ATOM 964 C CB . LEU A 1 119 ? 15.174 -6.176 10.780 1.00 97.07 119 A 1 ATOM 965 C CG . LEU A 1 119 ? 16.210 -5.236 10.126 1.00 95.61 119 A 1 ATOM 966 C CD1 . LEU A 1 119 ? 15.747 -3.787 10.280 1.00 91.78 119 A 1 ATOM 967 C CD2 . LEU A 1 119 ? 17.593 -5.365 10.758 1.00 92.29 119 A 1 ATOM 968 N N . HIS A 1 120 ? 13.405 -9.008 10.797 1.00 97.69 120 A 1 ATOM 969 C CA . HIS A 1 120 ? 12.424 -9.860 11.466 1.00 97.34 120 A 1 ATOM 970 C C . HIS A 1 120 ? 13.032 -11.186 11.939 1.00 97.20 120 A 1 ATOM 971 O O . HIS A 1 120 ? 12.553 -11.717 12.941 1.00 95.83 120 A 1 ATOM 972 C CB . HIS A 1 120 ? 11.212 -10.093 10.558 1.00 97.12 120 A 1 ATOM 973 C CG . HIS A 1 120 ? 10.415 -8.838 10.311 1.00 97.05 120 A 1 ATOM 974 N ND1 . HIS A 1 120 ? 9.861 -8.014 11.291 1.00 90.77 120 A 1 ATOM 975 C CD2 . HIS A 1 120 ? 10.128 -8.310 9.079 1.00 91.91 120 A 1 ATOM 976 C CE1 . HIS A 1 120 ? 9.268 -7.003 10.640 1.00 91.98 120 A 1 ATOM 977 N NE2 . HIS A 1 120 ? 9.398 -7.156 9.308 1.00 92.82 120 A 1 ATOM 978 N N . LEU A 1 121 ? 14.063 -11.699 11.277 1.00 97.36 121 A 1 ATOM 979 C CA . LEU A 1 121 ? 14.708 -12.985 11.572 1.00 97.29 121 A 1 ATOM 980 C C . LEU A 1 121 ? 15.756 -12.903 12.694 1.00 97.06 121 A 1 ATOM 981 O O . LEU A 1 121 ? 16.115 -13.940 13.240 1.00 95.92 121 A 1 ATOM 982 C CB . LEU A 1 121 ? 15.333 -13.556 10.287 1.00 97.27 121 A 1 ATOM 983 C CG . LEU A 1 121 ? 14.328 -13.869 9.165 1.00 97.13 121 A 1 ATOM 984 C CD1 . LEU A 1 121 ? 15.076 -14.227 7.885 1.00 96.00 121 A 1 ATOM 985 C CD2 . LEU A 1 121 ? 13.414 -15.038 9.539 1.00 95.99 121 A 1 ATOM 986 N N . GLU A 1 122 ? 16.201 -11.712 13.093 1.00 96.33 122 A 1 ATOM 987 C CA . GLU A 1 122 ? 17.275 -11.538 14.091 1.00 95.49 122 A 1 ATOM 988 C C . GLU A 1 122 ? 16.914 -12.081 15.481 1.00 95.16 122 A 1 ATOM 989 O O . GLU A 1 122 ? 17.785 -12.486 16.252 1.00 92.39 122 A 1 ATOM 990 C CB . GLU A 1 122 ? 17.619 -10.054 14.236 1.00 95.03 122 A 1 ATOM 991 C CG . GLU A 1 122 ? 18.248 -9.449 12.973 1.00 93.25 122 A 1 ATOM 992 C CD . GLU A 1 122 ? 18.665 -7.984 13.177 1.00 90.20 122 A 1 ATOM 993 O OE1 . GLU A 1 122 ? 19.410 -7.483 12.313 1.00 83.46 122 A 1 ATOM 994 O OE2 . GLU A 1 122 ? 18.237 -7.379 14.191 1.00 84.06 122 A 1 ATOM 995 N N . LYS A 1 123 ? 15.613 -12.112 15.827 1.00 94.58 123 A 1 ATOM 996 C CA . LYS A 1 123 ? 15.166 -12.694 17.092 1.00 93.57 123 A 1 ATOM 997 C C . LYS A 1 123 ? 15.172 -14.220 16.995 1.00 94.40 123 A 1 ATOM 998 O O . LYS A 1 123 ? 14.199 -14.821 16.533 1.00 92.01 123 A 1 ATOM 999 C CB . LYS A 1 123 ? 13.818 -12.104 17.531 1.00 91.72 123 A 1 ATOM 1000 C CG . LYS A 1 123 ? 13.486 -12.602 18.945 1.00 82.74 123 A 1 ATOM 1001 C CD . LYS A 1 123 ? 12.249 -11.923 19.545 1.00 78.01 123 A 1 ATOM 1002 C CE . LYS A 1 123 ? 12.059 -12.491 20.954 1.00 71.10 123 A 1 ATOM 1003 N NZ . LYS A 1 123 ? 10.958 -11.836 21.703 1.00 60.68 123 A 1 ATOM 1004 N N . THR A 1 124 ? 16.245 -14.818 17.499 1.00 95.64 124 A 1 ATOM 1005 C CA . THR A 1 124 ? 16.465 -16.265 17.542 1.00 95.30 124 A 1 ATOM 1006 C C . THR A 1 124 ? 16.370 -16.823 18.961 1.00 94.93 124 A 1 ATOM 1007 O O . THR A 1 124 ? 16.379 -16.081 19.949 1.00 92.44 124 A 1 ATOM 1008 C CB . THR A 1 124 ? 17.809 -16.634 16.892 1.00 94.19 124 A 1 ATOM 1009 O OG1 . THR A 1 124 ? 18.880 -15.975 17.536 1.00 90.74 124 A 1 ATOM 1010 C CG2 . THR A 1 124 ? 17.848 -16.236 15.417 1.00 89.51 124 A 1 ATOM 1011 N N . PHE A 1 125 ? 16.256 -18.145 19.049 1.00 94.34 125 A 1 ATOM 1012 C CA . PHE A 1 125 ? 16.260 -18.930 20.275 1.00 92.96 125 A 1 ATOM 1013 C C . PHE A 1 125 ? 17.233 -20.099 20.102 1.00 92.75 125 A 1 ATOM 1014 O O . PHE A 1 125 ? 17.243 -20.725 19.040 1.00 90.00 125 A 1 ATOM 1015 C CB . PHE A 1 125 ? 14.847 -19.447 20.579 1.00 91.42 125 A 1 ATOM 1016 C CG . PHE A 1 125 ? 13.765 -18.379 20.612 1.00 90.47 125 A 1 ATOM 1017 C CD1 . PHE A 1 125 ? 13.495 -17.679 21.802 1.00 84.42 125 A 1 ATOM 1018 C CD2 . PHE A 1 125 ? 13.033 -18.074 19.446 1.00 86.57 125 A 1 ATOM 1019 C CE1 . PHE A 1 125 ? 12.494 -16.687 21.828 1.00 82.16 125 A 1 ATOM 1020 C CE2 . PHE A 1 125 ? 12.038 -17.080 19.472 1.00 83.05 125 A 1 ATOM 1021 C CZ . PHE A 1 125 ? 11.765 -16.388 20.666 1.00 84.41 125 A 1 ATOM 1022 N N . ASP A 1 126 ? 17.995 -20.387 21.152 1.00 92.38 126 A 1 ATOM 1023 C CA . ASP A 1 126 ? 18.866 -21.555 21.188 1.00 90.89 126 A 1 ATOM 1024 C C . ASP A 1 126 ? 18.007 -22.782 21.527 1.00 90.65 126 A 1 ATOM 1025 O O . ASP A 1 126 ? 17.405 -22.856 22.601 1.00 87.03 126 A 1 ATOM 1026 C CB . ASP A 1 126 ? 20.011 -21.339 22.191 1.00 88.42 126 A 1 ATOM 1027 C CG . ASP A 1 126 ? 20.849 -20.083 21.900 1.00 83.88 126 A 1 ATOM 1028 O OD1 . ASP A 1 126 ? 21.088 -19.761 20.712 1.00 78.67 126 A 1 ATOM 1029 O OD2 . ASP A 1 126 ? 21.197 -19.389 22.885 1.00 79.48 126 A 1 ATOM 1030 N N . VAL A 1 127 ? 17.871 -23.697 20.583 1.00 87.70 127 A 1 ATOM 1031 C CA . VAL A 1 127 ? 17.120 -24.950 20.736 1.00 86.36 127 A 1 ATOM 1032 C C . VAL A 1 127 ? 17.924 -26.060 20.070 1.00 87.62 127 A 1 ATOM 1033 O O . VAL A 1 127 ? 18.341 -25.907 18.925 1.00 84.80 127 A 1 ATOM 1034 C CB . VAL A 1 127 ? 15.697 -24.861 20.136 1.00 81.95 127 A 1 ATOM 1035 C CG1 . VAL A 1 127 ? 14.929 -26.185 20.250 1.00 73.06 127 A 1 ATOM 1036 C CG2 . VAL A 1 127 ? 14.859 -23.794 20.867 1.00 73.80 127 A 1 ATOM 1037 N N . ASP A 1 128 ? 18.088 -27.159 20.790 1.00 90.51 128 A 1 ATOM 1038 C CA . ASP A 1 128 ? 18.703 -28.385 20.271 1.00 90.62 128 A 1 ATOM 1039 C C . ASP A 1 128 ? 17.702 -29.103 19.351 1.00 91.14 128 A 1 ATOM 1040 O O . ASP A 1 128 ? 16.932 -29.962 19.779 1.00 86.47 128 A 1 ATOM 1041 C CB . ASP A 1 128 ? 19.177 -29.235 21.465 1.00 87.87 128 A 1 ATOM 1042 C CG . ASP A 1 128 ? 20.061 -30.425 21.062 1.00 79.46 128 A 1 ATOM 1043 O OD1 . ASP A 1 128 ? 20.587 -30.403 19.934 1.00 73.00 128 A 1 ATOM 1044 O OD2 . ASP A 1 128 ? 20.247 -31.298 21.946 1.00 74.79 128 A 1 ATOM 1045 N N . HIS A 1 129 ? 17.599 -28.635 18.113 1.00 90.74 129 A 1 ATOM 1046 C CA . HIS A 1 129 ? 16.701 -29.165 17.092 1.00 91.00 129 A 1 ATOM 1047 C C . HIS A 1 129 ? 17.359 -29.047 15.714 1.00 91.75 129 A 1 ATOM 1048 O O . HIS A 1 129 ? 17.531 -27.944 15.194 1.00 89.41 129 A 1 ATOM 1049 C CB . HIS A 1 129 ? 15.359 -28.423 17.136 1.00 88.97 129 A 1 ATOM 1050 C CG . HIS A 1 129 ? 14.325 -29.013 16.205 1.00 89.12 129 A 1 ATOM 1051 N ND1 . HIS A 1 129 ? 13.642 -30.196 16.404 1.00 77.96 129 A 1 ATOM 1052 C CD2 . HIS A 1 129 ? 13.890 -28.480 15.023 1.00 78.77 129 A 1 ATOM 1053 C CE1 . HIS A 1 129 ? 12.815 -30.370 15.359 1.00 80.13 129 A 1 ATOM 1054 N NE2 . HIS A 1 129 ? 12.925 -29.348 14.497 1.00 80.88 129 A 1 ATOM 1055 N N . GLU A 1 130 ? 17.681 -30.177 15.139 1.00 93.21 130 A 1 ATOM 1056 C CA . GLU A 1 130 ? 18.348 -30.291 13.834 1.00 93.36 130 A 1 ATOM 1057 C C . GLU A 1 130 ? 17.443 -30.926 12.760 1.00 94.36 130 A 1 ATOM 1058 O O . GLU A 1 130 ? 17.884 -31.202 11.644 1.00 91.88 130 A 1 ATOM 1059 C CB . GLU A 1 130 ? 19.667 -31.066 13.981 1.00 90.60 130 A 1 ATOM 1060 C CG . GLU A 1 130 ? 20.673 -30.388 14.931 1.00 85.14 130 A 1 ATOM 1061 C CD . GLU A 1 130 ? 22.054 -31.070 14.928 1.00 80.89 130 A 1 ATOM 1062 O OE1 . GLU A 1 130 ? 23.000 -30.458 15.474 1.00 73.05 130 A 1 ATOM 1063 O OE2 . GLU A 1 130 ? 22.192 -32.171 14.341 1.00 73.55 130 A 1 ATOM 1064 N N . ASP A 1 131 ? 16.152 -31.146 13.087 1.00 95.49 131 A 1 ATOM 1065 C CA . ASP A 1 131 ? 15.178 -31.722 12.166 1.00 95.71 131 A 1 ATOM 1066 C C . ASP A 1 131 ? 14.476 -30.647 11.317 1.00 96.36 131 A 1 ATOM 1067 O O . ASP A 1 131 ? 14.513 -29.446 11.581 1.00 95.57 131 A 1 ATOM 1068 C CB . ASP A 1 131 ? 14.146 -32.567 12.933 1.00 94.64 131 A 1 ATOM 1069 C CG . ASP A 1 131 ? 14.736 -33.808 13.606 1.00 92.79 131 A 1 ATOM 1070 O OD1 . ASP A 1 131 ? 15.492 -34.529 12.923 1.00 88.15 131 A 1 ATOM 1071 O OD2 . ASP A 1 131 ? 14.360 -34.059 14.776 1.00 87.61 131 A 1 ATOM 1072 N N . LEU A 1 132 ? 13.769 -31.102 10.285 1.00 96.34 132 A 1 ATOM 1073 C CA . LEU A 1 132 ? 13.017 -30.252 9.371 1.00 96.64 132 A 1 ATOM 1074 C C . LEU A 1 132 ? 11.926 -29.440 10.089 1.00 96.98 132 A 1 ATOM 1075 O O . LEU A 1 132 ? 10.997 -29.988 10.677 1.00 96.13 132 A 1 ATOM 1076 C CB . LEU A 1 132 ? 12.407 -31.150 8.277 1.00 95.85 132 A 1 ATOM 1077 C CG . LEU A 1 132 ? 11.518 -30.407 7.267 1.00 94.94 132 A 1 ATOM 1078 C CD1 . LEU A 1 132 ? 12.321 -29.445 6.401 1.00 89.64 132 A 1 ATOM 1079 C CD2 . LEU A 1 132 ? 10.844 -31.411 6.333 1.00 89.15 132 A 1 ATOM 1080 N N . VAL A 1 133 ? 11.949 -28.128 9.912 1.00 97.31 133 A 1 ATOM 1081 C CA . VAL A 1 133 ? 10.849 -27.214 10.243 1.00 97.41 133 A 1 ATOM 1082 C C . VAL A 1 133 ? 10.195 -26.746 8.945 1.00 97.77 133 A 1 ATOM 1083 O O . VAL A 1 133 ? 10.842 -26.122 8.105 1.00 97.68 133 A 1 ATOM 1084 C CB . VAL A 1 133 ? 11.339 -26.026 11.088 1.00 97.10 133 A 1 ATOM 1085 C CG1 . VAL A 1 133 ? 10.183 -25.087 11.447 1.00 96.12 133 A 1 ATOM 1086 C CG2 . VAL A 1 133 ? 11.994 -26.496 12.395 1.00 96.18 133 A 1 ATOM 1087 N N . LEU A 1 134 ? 8.887 -27.018 8.791 1.00 97.59 134 A 1 ATOM 1088 C CA . LEU A 1 134 ? 8.086 -26.617 7.628 1.00 97.80 134 A 1 ATOM 1089 C C . LEU A 1 134 ? 6.938 -25.693 8.048 1.00 97.95 134 A 1 ATOM 1090 O O . LEU A 1 134 ? 6.060 -26.078 8.815 1.00 97.55 134 A 1 ATOM 1091 C CB . LEU A 1 134 ? 7.596 -27.877 6.890 1.00 97.66 134 A 1 ATOM 1092 C CG . LEU A 1 134 ? 6.595 -27.621 5.744 1.00 97.28 134 A 1 ATOM 1093 C CD1 . LEU A 1 134 ? 7.189 -26.793 4.605 1.00 95.46 134 A 1 ATOM 1094 C CD2 . LEU A 1 134 ? 6.126 -28.955 5.160 1.00 95.69 134 A 1 ATOM 1095 N N . VAL A 1 135 ? 6.898 -24.494 7.476 1.00 98.16 135 A 1 ATOM 1096 C CA . VAL A 1 135 ? 5.776 -23.549 7.555 1.00 98.23 135 A 1 ATOM 1097 C C . VAL A 1 135 ? 5.174 -23.432 6.161 1.00 98.36 135 A 1 ATOM 1098 O O . VAL A 1 135 ? 5.761 -22.813 5.272 1.00 98.17 135 A 1 ATOM 1099 C CB . VAL A 1 135 ? 6.212 -22.176 8.096 1.00 98.04 135 A 1 ATOM 1100 C CG1 . VAL A 1 135 ? 4.980 -21.307 8.380 1.00 97.00 135 A 1 ATOM 1101 C CG2 . VAL A 1 135 ? 7.007 -22.298 9.402 1.00 97.02 135 A 1 ATOM 1102 N N . LYS A 1 136 ? 4.005 -24.040 5.960 1.00 97.87 136 A 1 ATOM 1103 C CA . LYS A 1 136 ? 3.324 -24.054 4.660 1.00 97.62 136 A 1 ATOM 1104 C C . LYS A 1 136 ? 2.088 -23.162 4.631 1.00 98.03 136 A 1 ATOM 1105 O O . LYS A 1 136 ? 1.605 -22.738 5.673 1.00 97.62 136 A 1 ATOM 1106 C CB . LYS A 1 136 ? 3.050 -25.500 4.216 1.00 95.65 136 A 1 ATOM 1107 C CG . LYS A 1 136 ? 2.009 -26.246 5.060 1.00 93.89 136 A 1 ATOM 1108 C CD . LYS A 1 136 ? 1.754 -27.610 4.401 1.00 93.53 136 A 1 ATOM 1109 C CE . LYS A 1 136 ? 0.662 -28.409 5.114 1.00 90.24 136 A 1 ATOM 1110 N NZ . LYS A 1 136 ? 0.382 -29.648 4.355 1.00 88.49 136 A 1 ATOM 1111 N N . ASP A 1 137 ? 1.609 -22.895 3.423 1.00 98.16 137 A 1 ATOM 1112 C CA . ASP A 1 137 ? 0.387 -22.147 3.142 1.00 98.14 137 A 1 ATOM 1113 C C . ASP A 1 137 ? 0.374 -20.718 3.718 1.00 98.37 137 A 1 ATOM 1114 O O . ASP A 1 137 ? -0.668 -20.205 4.119 1.00 97.80 137 A 1 ATOM 1115 C CB . ASP A 1 137 ? -0.855 -22.984 3.515 1.00 97.55 137 A 1 ATOM 1116 C CG . ASP A 1 137 ? -0.909 -24.324 2.767 1.00 96.74 137 A 1 ATOM 1117 O OD1 . ASP A 1 137 ? -0.884 -24.294 1.515 1.00 94.27 137 A 1 ATOM 1118 O OD2 . ASP A 1 137 ? -1.000 -25.377 3.437 1.00 93.85 137 A 1 ATOM 1119 N N . ILE A 1 138 ? 1.524 -20.037 3.739 1.00 98.30 138 A 1 ATOM 1120 C CA . ILE A 1 138 ? 1.611 -18.622 4.128 1.00 98.44 138 A 1 ATOM 1121 C C . ILE A 1 138 ? 0.997 -17.780 2.999 1.00 98.49 138 A 1 ATOM 1122 O O . ILE A 1 138 ? 1.611 -17.678 1.933 1.00 98.33 138 A 1 ATOM 1123 C CB . ILE A 1 138 ? 3.070 -18.191 4.406 1.00 98.52 138 A 1 ATOM 1124 C CG1 . ILE A 1 138 ? 3.751 -19.101 5.460 1.00 98.20 138 A 1 ATOM 1125 C CG2 . ILE A 1 138 ? 3.094 -16.720 4.866 1.00 98.22 138 A 1 ATOM 1126 C CD1 . ILE A 1 138 ? 5.254 -18.836 5.624 1.00 97.22 138 A 1 ATOM 1127 N N . PRO A 1 139 ? -0.194 -17.170 3.192 1.00 98.60 139 A 1 ATOM 1128 C CA . PRO A 1 139 ? -0.824 -16.399 2.129 1.00 98.52 139 A 1 ATOM 1129 C C . PRO A 1 139 ? -0.043 -15.115 1.854 1.00 98.55 139 A 1 ATOM 1130 O O . PRO A 1 139 ? 0.492 -14.490 2.770 1.00 98.27 139 A 1 ATOM 1131 C CB . PRO A 1 139 ? -2.243 -16.114 2.623 1.00 98.18 139 A 1 ATOM 1132 C CG . PRO A 1 139 ? -2.069 -16.054 4.142 1.00 96.97 139 A 1 ATOM 1133 C CD . PRO A 1 139 ? -0.977 -17.089 4.410 1.00 98.33 139 A 1 ATOM 1134 N N . PHE A 1 140 ? -0.010 -14.689 0.597 1.00 98.47 140 A 1 ATOM 1135 C CA . PHE A 1 140 ? 0.562 -13.401 0.219 1.00 98.45 140 A 1 ATOM 1136 C C . PHE A 1 140 ? -0.168 -12.791 -0.974 1.00 98.43 140 A 1 ATOM 1137 O O . PHE A 1 140 ? -0.814 -13.479 -1.769 1.00 98.07 140 A 1 ATOM 1138 C CB . PHE A 1 140 ? 2.070 -13.537 -0.064 1.00 98.36 140 A 1 ATOM 1139 C CG . PHE A 1 140 ? 2.398 -14.055 -1.450 1.00 98.61 140 A 1 ATOM 1140 C CD1 . PHE A 1 140 ? 2.310 -15.430 -1.735 1.00 98.22 140 A 1 ATOM 1141 C CD2 . PHE A 1 140 ? 2.745 -13.154 -2.476 1.00 98.28 140 A 1 ATOM 1142 C CE1 . PHE A 1 140 ? 2.563 -15.898 -3.036 1.00 97.91 140 A 1 ATOM 1143 C CE2 . PHE A 1 140 ? 2.999 -13.625 -3.776 1.00 97.94 140 A 1 ATOM 1144 C CZ . PHE A 1 140 ? 2.907 -14.997 -4.059 1.00 98.15 140 A 1 ATOM 1145 N N . ASN A 1 141 ? -0.013 -11.481 -1.127 1.00 98.09 141 A 1 ATOM 1146 C CA . ASN A 1 141 ? -0.348 -10.765 -2.348 1.00 97.76 141 A 1 ATOM 1147 C C . ASN A 1 141 ? 0.769 -9.781 -2.695 1.00 98.11 141 A 1 ATOM 1148 O O . ASN A 1 141 ? 1.327 -9.117 -1.819 1.00 97.10 141 A 1 ATOM 1149 C CB . ASN A 1 141 ? -1.726 -10.100 -2.201 1.00 95.55 141 A 1 ATOM 1150 C CG . ASN A 1 141 ? -1.718 -8.878 -1.299 1.00 88.34 141 A 1 ATOM 1151 O OD1 . ASN A 1 141 ? -1.630 -8.934 -0.087 1.00 75.98 141 A 1 ATOM 1152 N ND2 . ASN A 1 141 ? -1.827 -7.705 -1.867 1.00 75.09 141 A 1 ATOM 1153 N N . SER A 1 142 ? 1.087 -9.667 -3.975 1.00 98.14 142 A 1 ATOM 1154 C CA . SER A 1 142 ? 2.120 -8.771 -4.497 1.00 98.20 142 A 1 ATOM 1155 C C . SER A 1 142 ? 1.650 -8.107 -5.793 1.00 98.12 142 A 1 ATOM 1156 O O . SER A 1 142 ? 0.613 -8.477 -6.355 1.00 97.70 142 A 1 ATOM 1157 C CB . SER A 1 142 ? 3.412 -9.566 -4.695 1.00 98.21 142 A 1 ATOM 1158 O OG . SER A 1 142 ? 4.509 -8.703 -4.918 1.00 97.45 142 A 1 ATOM 1159 N N . LEU A 1 143 ? 2.394 -7.111 -6.275 1.00 97.62 143 A 1 ATOM 1160 C CA . LEU A 1 143 ? 2.154 -6.445 -7.554 1.00 97.52 143 A 1 ATOM 1161 C C . LEU A 1 143 ? 3.228 -6.830 -8.578 1.00 97.88 143 A 1 ATOM 1162 O O . LEU A 1 143 ? 4.420 -6.621 -8.362 1.00 96.94 143 A 1 ATOM 1163 C CB . LEU A 1 143 ? 2.100 -4.922 -7.372 1.00 96.40 143 A 1 ATOM 1164 C CG . LEU A 1 143 ? 0.859 -4.384 -6.641 1.00 94.22 143 A 1 ATOM 1165 C CD1 . LEU A 1 143 ? 0.965 -2.862 -6.552 1.00 91.32 143 A 1 ATOM 1166 C CD2 . LEU A 1 143 ? -0.442 -4.722 -7.361 1.00 91.59 143 A 1 ATOM 1167 N N . CYS A 1 144 ? 2.791 -7.335 -9.724 1.00 97.23 144 A 1 ATOM 1168 C CA . CYS A 1 144 ? 3.651 -7.573 -10.877 1.00 96.80 144 A 1 ATOM 1169 C C . CYS A 1 144 ? 4.215 -6.242 -11.397 1.00 96.79 144 A 1 ATOM 1170 O O . CYS A 1 144 ? 3.458 -5.384 -11.847 1.00 96.24 144 A 1 ATOM 1171 C CB . CYS A 1 144 ? 2.823 -8.293 -11.945 1.00 95.62 144 A 1 ATOM 1172 S SG . CYS A 1 144 ? 3.775 -8.484 -13.478 1.00 90.57 144 A 1 ATOM 1173 N N . GLU A 1 145 ? 5.542 -6.102 -11.407 1.00 97.14 145 A 1 ATOM 1174 C CA . GLU A 1 145 ? 6.210 -4.862 -11.829 1.00 97.04 145 A 1 ATOM 1175 C C . GLU A 1 145 ? 5.972 -4.488 -13.298 1.00 97.12 145 A 1 ATOM 1176 O O . GLU A 1 145 ? 6.001 -3.316 -13.644 1.00 96.01 145 A 1 ATOM 1177 C CB . GLU A 1 145 ? 7.708 -4.945 -11.499 1.00 96.22 145 A 1 ATOM 1178 C CG . GLU A 1 145 ? 8.511 -5.970 -12.318 1.00 94.62 145 A 1 ATOM 1179 C CD . GLU A 1 145 ? 9.957 -6.128 -11.798 1.00 95.86 145 A 1 ATOM 1180 O OE1 . GLU A 1 145 ? 10.842 -6.615 -12.530 1.00 90.76 145 A 1 ATOM 1181 O OE2 . GLU A 1 145 ? 10.225 -5.849 -10.603 1.00 91.97 145 A 1 ATOM 1182 N N . HIS A 1 146 ? 5.650 -5.467 -14.155 1.00 96.81 146 A 1 ATOM 1183 C CA . HIS A 1 146 ? 5.425 -5.224 -15.584 1.00 96.59 146 A 1 ATOM 1184 C C . HIS A 1 146 ? 4.070 -4.586 -15.908 1.00 96.66 146 A 1 ATOM 1185 O O . HIS A 1 146 ? 3.918 -3.940 -16.941 1.00 95.55 146 A 1 ATOM 1186 C CB . HIS A 1 146 ? 5.546 -6.553 -16.336 1.00 96.40 146 A 1 ATOM 1187 C CG . HIS A 1 146 ? 6.805 -7.329 -16.047 1.00 95.86 146 A 1 ATOM 1188 N ND1 . HIS A 1 146 ? 6.867 -8.595 -15.522 1.00 88.51 146 A 1 ATOM 1189 C CD2 . HIS A 1 146 ? 8.084 -6.916 -16.269 1.00 88.16 146 A 1 ATOM 1190 C CE1 . HIS A 1 146 ? 8.164 -8.940 -15.437 1.00 89.45 146 A 1 ATOM 1191 N NE2 . HIS A 1 146 ? 8.937 -7.950 -15.880 1.00 90.32 146 A 1 ATOM 1192 N N . HIS A 1 147 ? 3.047 -4.824 -15.072 1.00 96.15 147 A 1 ATOM 1193 C CA . HIS A 1 147 ? 1.665 -4.416 -15.360 1.00 95.88 147 A 1 ATOM 1194 C C . HIS A 1 147 ? 0.974 -3.717 -14.188 1.00 95.75 147 A 1 ATOM 1195 O O . HIS A 1 147 ? -0.182 -3.322 -14.344 1.00 94.87 147 A 1 ATOM 1196 C CB . HIS A 1 147 ? 0.845 -5.646 -15.766 1.00 95.97 147 A 1 ATOM 1197 C CG . HIS A 1 147 ? 1.370 -6.395 -16.961 1.00 95.69 147 A 1 ATOM 1198 N ND1 . HIS A 1 147 ? 2.126 -7.537 -16.927 1.00 90.48 147 A 1 ATOM 1199 C CD2 . HIS A 1 147 ? 1.158 -6.093 -18.279 1.00 91.17 147 A 1 ATOM 1200 C CE1 . HIS A 1 147 ? 2.371 -7.915 -18.198 1.00 91.24 147 A 1 ATOM 1201 N NE2 . HIS A 1 147 ? 1.790 -7.068 -19.057 1.00 91.93 147 A 1 ATOM 1202 N N . LEU A 1 148 ? 1.623 -3.624 -13.028 1.00 96.21 148 A 1 ATOM 1203 C CA . LEU A 1 148 ? 1.023 -3.201 -11.755 1.00 95.90 148 A 1 ATOM 1204 C C . LEU A 1 148 ? -0.238 -4.015 -11.402 1.00 96.19 148 A 1 ATOM 1205 O O . LEU A 1 148 ? -1.139 -3.541 -10.722 1.00 94.96 148 A 1 ATOM 1206 C CB . LEU A 1 148 ? 0.803 -1.676 -11.746 1.00 95.27 148 A 1 ATOM 1207 C CG . LEU A 1 148 ? 2.051 -0.839 -12.079 1.00 94.01 148 A 1 ATOM 1208 C CD1 . LEU A 1 148 ? 1.691 0.645 -12.042 1.00 91.13 148 A 1 ATOM 1209 C CD2 . LEU A 1 148 ? 3.191 -1.087 -11.093 1.00 90.98 148 A 1 ATOM 1210 N N . ALA A 1 149 ? -0.312 -5.250 -11.889 1.00 95.45 149 A 1 ATOM 1211 C CA . ALA A 1 149 ? -1.431 -6.154 -11.680 1.00 95.58 149 A 1 ATOM 1212 C C . ALA A 1 149 ? -1.112 -7.111 -10.520 1.00 96.26 149 A 1 ATOM 1213 O O . ALA A 1 149 ? 0.007 -7.630 -10.464 1.00 95.96 149 A 1 ATOM 1214 C CB . ALA A 1 149 ? -1.713 -6.896 -12.991 1.00 94.89 149 A 1 ATOM 1215 N N . PRO A 1 150 ? -2.061 -7.390 -9.610 1.00 96.87 150 A 1 ATOM 1216 C CA . PRO A 1 150 ? -1.822 -8.311 -8.505 1.00 96.87 150 A 1 ATOM 1217 C C . PRO A 1 150 ? -1.475 -9.725 -8.974 1.00 97.25 150 A 1 ATOM 1218 O O . PRO A 1 150 ? -2.038 -10.240 -9.944 1.00 96.76 150 A 1 ATOM 1219 C CB . PRO A 1 150 ? -3.097 -8.292 -7.655 1.00 95.85 150 A 1 ATOM 1220 C CG . PRO A 1 150 ? -3.712 -6.928 -7.970 1.00 94.20 150 A 1 ATOM 1221 C CD . PRO A 1 150 ? -3.336 -6.716 -9.435 1.00 96.27 150 A 1 ATOM 1222 N N . PHE A 1 151 ? -0.592 -10.384 -8.223 1.00 96.66 151 A 1 ATOM 1223 C CA . PHE A 1 151 ? -0.492 -11.839 -8.195 1.00 96.89 151 A 1 ATOM 1224 C C . PHE A 1 151 ? -0.606 -12.310 -6.749 1.00 97.18 151 A 1 ATOM 1225 O O . PHE A 1 151 ? -0.055 -11.692 -5.834 1.00 97.18 151 A 1 ATOM 1226 C CB . PHE A 1 151 ? 0.761 -12.337 -8.924 1.00 97.06 151 A 1 ATOM 1227 C CG . PHE A 1 151 ? 2.084 -11.988 -8.277 1.00 97.69 151 A 1 ATOM 1228 C CD1 . PHE A 1 151 ? 2.683 -10.735 -8.520 1.00 97.22 151 A 1 ATOM 1229 C CD2 . PHE A 1 151 ? 2.753 -12.938 -7.486 1.00 97.28 151 A 1 ATOM 1230 C CE1 . PHE A 1 151 ? 3.944 -10.442 -7.978 1.00 96.84 151 A 1 ATOM 1231 C CE2 . PHE A 1 151 ? 4.014 -12.645 -6.945 1.00 97.00 151 A 1 ATOM 1232 C CZ . PHE A 1 151 ? 4.616 -11.396 -7.195 1.00 97.62 151 A 1 ATOM 1233 N N . VAL A 1 152 ? -1.397 -13.362 -6.531 1.00 97.75 152 A 1 ATOM 1234 C CA . VAL A 1 152 ? -1.838 -13.809 -5.203 1.00 97.58 152 A 1 ATOM 1235 C C . VAL A 1 152 ? -1.616 -15.305 -5.087 1.00 97.78 152 A 1 ATOM 1236 O O . VAL A 1 152 ? -1.868 -16.045 -6.036 1.00 96.93 152 A 1 ATOM 1237 C CB . VAL A 1 152 ? -3.316 -13.467 -4.949 1.00 96.31 152 A 1 ATOM 1238 C CG1 . VAL A 1 152 ? -3.742 -13.825 -3.518 1.00 88.55 152 A 1 ATOM 1239 C CG2 . VAL A 1 152 ? -3.607 -11.975 -5.155 1.00 88.41 152 A 1 ATOM 1240 N N . GLY A 1 153 ? -1.172 -15.752 -3.919 1.00 97.90 153 A 1 ATOM 1241 C CA . GLY A 1 153 ? -0.890 -17.159 -3.707 1.00 97.89 153 A 1 ATOM 1242 C C . GLY A 1 153 ? -0.435 -17.468 -2.296 1.00 98.21 153 A 1 ATOM 1243 O O . GLY A 1 153 ? -0.844 -16.818 -1.333 1.00 97.94 153 A 1 ATOM 1244 N N . LYS A 1 154 ? 0.409 -18.484 -2.188 1.00 98.25 154 A 1 ATOM 1245 C CA . LYS A 1 154 ? 0.957 -18.986 -0.931 1.00 98.26 154 A 1 ATOM 1246 C C . LYS A 1 154 ? 2.447 -19.281 -1.059 1.00 98.49 154 A 1 ATOM 1247 O O . LYS A 1 154 ? 2.932 -19.648 -2.129 1.00 98.16 154 A 1 ATOM 1248 C CB . LYS A 1 154 ? 0.147 -20.209 -0.451 1.00 97.27 154 A 1 ATOM 1249 C CG . LYS A 1 154 ? 0.105 -21.335 -1.494 1.00 96.53 154 A 1 ATOM 1250 C CD . LYS A 1 154 ? -0.745 -22.520 -1.025 1.00 94.31 154 A 1 ATOM 1251 C CE . LYS A 1 154 ? -0.698 -23.573 -2.132 1.00 88.79 154 A 1 ATOM 1252 N NZ . LYS A 1 154 ? -1.038 -24.930 -1.648 1.00 81.68 154 A 1 ATOM 1253 N N . VAL A 1 155 ? 3.140 -19.119 0.062 1.00 98.52 155 A 1 ATOM 1254 C CA . VAL A 1 155 ? 4.559 -19.441 0.215 1.00 98.66 155 A 1 ATOM 1255 C C . VAL A 1 155 ? 4.691 -20.605 1.182 1.00 98.67 155 A 1 ATOM 1256 O O . VAL A 1 155 ? 4.065 -20.615 2.244 1.00 98.39 155 A 1 ATOM 1257 C CB . VAL A 1 155 ? 5.374 -18.229 0.700 1.00 98.58 155 A 1 ATOM 1258 C CG1 . VAL A 1 155 ? 6.875 -18.538 0.718 1.00 97.76 155 A 1 ATOM 1259 C CG2 . VAL A 1 155 ? 5.156 -16.999 -0.181 1.00 97.83 155 A 1 ATOM 1260 N N . HIS A 1 156 ? 5.527 -21.567 0.836 1.00 98.67 156 A 1 ATOM 1261 C CA . HIS A 1 156 ? 5.970 -22.650 1.705 1.00 98.70 156 A 1 ATOM 1262 C C . HIS A 1 156 ? 7.446 -22.427 2.020 1.00 98.72 156 A 1 ATOM 1263 O O . HIS A 1 156 ? 8.251 -22.250 1.105 1.00 98.50 156 A 1 ATOM 1264 C CB . HIS A 1 156 ? 5.743 -24.005 1.036 1.00 98.56 156 A 1 ATOM 1265 C CG . HIS A 1 156 ? 4.367 -24.180 0.442 1.00 98.48 156 A 1 ATOM 1266 N ND1 . HIS A 1 156 ? 3.236 -24.577 1.123 1.00 95.13 156 A 1 ATOM 1267 C CD2 . HIS A 1 156 ? 4.023 -23.980 -0.867 1.00 96.19 156 A 1 ATOM 1268 C CE1 . HIS A 1 156 ? 2.236 -24.626 0.228 1.00 95.54 156 A 1 ATOM 1269 N NE2 . HIS A 1 156 ? 2.667 -24.266 -0.985 1.00 96.31 156 A 1 ATOM 1270 N N . ILE A 1 157 ? 7.784 -22.420 3.306 1.00 98.40 157 A 1 ATOM 1271 C CA . ILE A 1 157 ? 9.150 -22.230 3.792 1.00 98.49 157 A 1 ATOM 1272 C C . ILE A 1 157 ? 9.533 -23.449 4.611 1.00 98.41 157 A 1 ATOM 1273 O O . ILE A 1 157 ? 8.861 -23.774 5.591 1.00 98.01 157 A 1 ATOM 1274 C CB . ILE A 1 157 ? 9.287 -20.929 4.611 1.00 98.48 157 A 1 ATOM 1275 C CG1 . ILE A 1 157 ? 8.931 -19.708 3.735 1.00 97.95 157 A 1 ATOM 1276 C CG2 . ILE A 1 157 ? 10.714 -20.807 5.182 1.00 98.11 157 A 1 ATOM 1277 C CD1 . ILE A 1 157 ? 8.950 -18.367 4.466 1.00 97.40 157 A 1 ATOM 1278 N N . ALA A 1 158 ? 10.627 -24.090 4.243 1.00 98.53 158 A 1 ATOM 1279 C CA . ALA A 1 158 ? 11.234 -25.154 5.018 1.00 98.45 158 A 1 ATOM 1280 C C . ALA A 1 158 ? 12.689 -24.819 5.317 1.00 98.43 158 A 1 ATOM 1281 O O . ALA A 1 158 ? 13.381 -24.257 4.467 1.00 98.02 158 A 1 ATOM 1282 C CB . ALA A 1 158 ? 11.098 -26.471 4.261 1.00 98.14 158 A 1 ATOM 1283 N N . TYR A 1 159 ? 13.154 -25.169 6.506 1.00 98.07 159 A 1 ATOM 1284 C CA . TYR A 1 159 ? 14.572 -25.089 6.837 1.00 97.85 159 A 1 ATOM 1285 C C . TYR A 1 159 ? 14.962 -26.177 7.837 1.00 97.81 159 A 1 ATOM 1286 O O . TYR A 1 159 ? 14.126 -26.672 8.590 1.00 97.33 159 A 1 ATOM 1287 C CB . TYR A 1 159 ? 14.942 -23.678 7.330 1.00 97.58 159 A 1 ATOM 1288 C CG . TYR A 1 159 ? 14.562 -23.346 8.760 1.00 97.64 159 A 1 ATOM 1289 C CD1 . TYR A 1 159 ? 13.208 -23.228 9.137 1.00 96.64 159 A 1 ATOM 1290 C CD2 . TYR A 1 159 ? 15.575 -23.146 9.717 1.00 96.66 159 A 1 ATOM 1291 C CE1 . TYR A 1 159 ? 12.870 -22.928 10.467 1.00 95.88 159 A 1 ATOM 1292 C CE2 . TYR A 1 159 ? 15.239 -22.841 11.051 1.00 95.95 159 A 1 ATOM 1293 C CZ . TYR A 1 159 ? 13.885 -22.737 11.430 1.00 96.22 159 A 1 ATOM 1294 O OH . TYR A 1 159 ? 13.562 -22.459 12.718 1.00 94.72 159 A 1 ATOM 1295 N N . ILE A 1 160 ? 16.241 -26.550 7.823 1.00 97.33 160 A 1 ATOM 1296 C CA . ILE A 1 160 ? 16.861 -27.421 8.823 1.00 97.11 160 A 1 ATOM 1297 C C . ILE A 1 160 ? 17.802 -26.533 9.637 1.00 97.05 160 A 1 ATOM 1298 O O . ILE A 1 160 ? 18.785 -26.038 9.074 1.00 96.52 160 A 1 ATOM 1299 C CB . ILE A 1 160 ? 17.582 -28.615 8.161 1.00 96.78 160 A 1 ATOM 1300 C CG1 . ILE A 1 160 ? 16.587 -29.459 7.330 1.00 95.89 160 A 1 ATOM 1301 C CG2 . ILE A 1 160 ? 18.259 -29.477 9.239 1.00 95.66 160 A 1 ATOM 1302 C CD1 . ILE A 1 160 ? 17.228 -30.611 6.545 1.00 93.09 160 A 1 ATOM 1303 N N . PRO A 1 161 ? 17.492 -26.264 10.923 1.00 96.85 161 A 1 ATOM 1304 C CA . PRO A 1 161 ? 18.332 -25.431 11.772 1.00 96.48 161 A 1 ATOM 1305 C C . PRO A 1 161 ? 19.754 -25.982 11.879 1.00 96.34 161 A 1 ATOM 1306 O O . PRO A 1 161 ? 20.000 -27.164 11.641 1.00 95.61 161 A 1 ATOM 1307 C CB . PRO A 1 161 ? 17.644 -25.393 13.143 1.00 95.50 161 A 1 ATOM 1308 C CG . PRO A 1 161 ? 16.199 -25.752 12.840 1.00 93.34 161 A 1 ATOM 1309 C CD . PRO A 1 161 ? 16.319 -26.707 11.657 1.00 96.01 161 A 1 ATOM 1310 N N . LYS A 1 162 ? 20.692 -25.124 12.271 1.00 94.93 162 A 1 ATOM 1311 C CA . LYS A 1 162 ? 22.047 -25.530 12.642 1.00 94.11 162 A 1 ATOM 1312 C C . LYS A 1 162 ? 22.295 -25.259 14.123 1.00 93.34 162 A 1 ATOM 1313 O O . LYS A 1 162 ? 22.492 -26.187 14.882 1.00 86.33 162 A 1 ATOM 1314 C CB . LYS A 1 162 ? 23.050 -24.840 11.715 1.00 92.15 162 A 1 ATOM 1315 C CG . LYS A 1 162 ? 24.467 -25.338 11.995 1.00 89.56 162 A 1 ATOM 1316 C CD . LYS A 1 162 ? 25.456 -24.616 11.089 1.00 87.77 162 A 1 ATOM 1317 C CE . LYS A 1 162 ? 26.859 -25.080 11.461 1.00 80.12 162 A 1 ATOM 1318 N NZ . LYS A 1 162 ? 27.862 -24.321 10.693 1.00 72.65 162 A 1 ATOM 1319 N N . ASP A 1 163 ? 22.222 -23.991 14.522 1.00 91.75 163 A 1 ATOM 1320 C CA . ASP A 1 163 ? 22.487 -23.573 15.904 1.00 90.49 163 A 1 ATOM 1321 C C . ASP A 1 163 ? 21.286 -22.830 16.525 1.00 90.62 163 A 1 ATOM 1322 O O . ASP A 1 163 ? 21.183 -22.684 17.737 1.00 86.18 163 A 1 ATOM 1323 C CB . ASP A 1 163 ? 23.735 -22.664 15.927 1.00 87.74 163 A 1 ATOM 1324 C CG . ASP A 1 163 ? 24.975 -23.259 15.242 1.00 84.78 163 A 1 ATOM 1325 O OD1 . ASP A 1 163 ? 25.365 -24.392 15.567 1.00 79.96 163 A 1 ATOM 1326 O OD2 . ASP A 1 163 ? 25.552 -22.559 14.373 1.00 80.44 163 A 1 ATOM 1327 N N . LYS A 1 164 ? 20.380 -22.292 15.689 1.00 91.92 164 A 1 ATOM 1328 C CA . LYS A 1 164 ? 19.328 -21.357 16.100 1.00 91.72 164 A 1 ATOM 1329 C C . LYS A 1 164 ? 18.033 -21.587 15.336 1.00 94.00 164 A 1 ATOM 1330 O O . LYS A 1 164 ? 18.036 -21.785 14.125 1.00 92.73 164 A 1 ATOM 1331 C CB . LYS A 1 164 ? 19.787 -19.904 15.895 1.00 87.21 164 A 1 ATOM 1332 C CG . LYS A 1 164 ? 21.012 -19.546 16.747 1.00 82.21 164 A 1 ATOM 1333 C CD . LYS A 1 164 ? 21.419 -18.092 16.532 1.00 80.59 164 A 1 ATOM 1334 C CE . LYS A 1 164 ? 22.688 -17.818 17.335 1.00 73.43 164 A 1 ATOM 1335 N NZ . LYS A 1 164 ? 23.146 -16.429 17.152 1.00 65.91 164 A 1 ATOM 1336 N N . ILE A 1 165 ? 16.910 -21.413 16.046 1.00 95.19 165 A 1 ATOM 1337 C CA . ILE A 1 165 ? 15.584 -21.306 15.434 1.00 95.70 165 A 1 ATOM 1338 C C . ILE A 1 165 ? 15.044 -19.879 15.569 1.00 96.23 165 A 1 ATOM 1339 O O . ILE A 1 165 ? 15.460 -19.112 16.443 1.00 95.53 165 A 1 ATOM 1340 C CB . ILE A 1 165 ? 14.606 -22.367 15.983 1.00 94.63 165 A 1 ATOM 1341 C CG1 . ILE A 1 165 ? 14.249 -22.139 17.463 1.00 88.32 165 A 1 ATOM 1342 C CG2 . ILE A 1 165 ? 15.164 -23.781 15.735 1.00 86.92 165 A 1 ATOM 1343 C CD1 . ILE A 1 165 ? 13.050 -22.979 17.913 1.00 84.91 165 A 1 ATOM 1344 N N . THR A 1 166 ? 14.080 -19.501 14.731 1.00 96.41 166 A 1 ATOM 1345 C CA . THR A 1 166 ? 13.322 -18.247 14.878 1.00 96.63 166 A 1 ATOM 1346 C C . THR A 1 166 ? 11.836 -18.528 15.103 1.00 96.82 166 A 1 ATOM 1347 O O . THR A 1 166 ? 11.332 -19.618 14.832 1.00 95.93 166 A 1 ATOM 1348 C CB . THR A 1 166 ? 13.573 -17.299 13.695 1.00 96.14 166 A 1 ATOM 1349 O OG1 . THR A 1 166 ? 13.082 -16.011 14.008 1.00 93.17 166 A 1 ATOM 1350 C CG2 . THR A 1 166 ? 12.903 -17.748 12.399 1.00 92.21 166 A 1 ATOM 1351 N N . GLY A 1 167 ? 11.101 -17.544 15.630 1.00 96.84 167 A 1 ATOM 1352 C CA . GLY A 1 167 ? 9.657 -17.678 15.811 1.00 96.73 167 A 1 ATOM 1353 C C . GLY A 1 167 ? 8.925 -17.825 14.473 1.00 97.30 167 A 1 ATOM 1354 O O . GLY A 1 167 ? 9.156 -17.035 13.558 1.00 96.82 167 A 1 ATOM 1355 N N . LEU A 1 168 ? 7.968 -18.760 14.379 1.00 97.14 168 A 1 ATOM 1356 C CA . LEU A 1 168 ? 7.241 -19.066 13.131 1.00 97.26 168 A 1 ATOM 1357 C C . LEU A 1 168 ? 6.572 -17.830 12.491 1.00 97.62 168 A 1 ATOM 1358 O O . LEU A 1 168 ? 6.558 -17.680 11.273 1.00 97.05 168 A 1 ATOM 1359 C CB . LEU A 1 168 ? 6.186 -20.153 13.404 1.00 96.81 168 A 1 ATOM 1360 C CG . LEU A 1 168 ? 6.727 -21.481 13.980 1.00 96.03 168 A 1 ATOM 1361 C CD1 . LEU A 1 168 ? 5.570 -22.454 14.193 1.00 94.02 168 A 1 ATOM 1362 C CD2 . LEU A 1 168 ? 7.771 -22.135 13.077 1.00 94.00 168 A 1 ATOM 1363 N N . SER A 1 169 ? 6.077 -16.887 13.313 1.00 97.65 169 A 1 ATOM 1364 C CA . SER A 1 169 ? 5.479 -15.634 12.820 1.00 97.60 169 A 1 ATOM 1365 C C . SER A 1 169 ? 6.460 -14.723 12.066 1.00 97.89 169 A 1 ATOM 1366 O O . SER A 1 169 ? 6.028 -13.827 11.342 1.00 97.24 169 A 1 ATOM 1367 C CB . SER A 1 169 ? 4.859 -14.861 13.991 1.00 96.83 169 A 1 ATOM 1368 O OG . SER A 1 169 ? 5.841 -14.463 14.936 1.00 93.18 169 A 1 ATOM 1369 N N . LYS A 1 170 ? 7.764 -14.920 12.240 1.00 97.95 170 A 1 ATOM 1370 C CA . LYS A 1 170 ? 8.804 -14.135 11.565 1.00 98.07 170 A 1 ATOM 1371 C C . LYS A 1 170 ? 8.878 -14.463 10.079 1.00 98.35 170 A 1 ATOM 1372 O O . LYS A 1 170 ? 9.049 -13.539 9.294 1.00 98.02 170 A 1 ATOM 1373 C CB . LYS A 1 170 ? 10.166 -14.336 12.256 1.00 97.80 170 A 1 ATOM 1374 C CG . LYS A 1 170 ? 10.165 -13.979 13.757 1.00 96.63 170 A 1 ATOM 1375 C CD . LYS A 1 170 ? 9.661 -12.552 14.001 1.00 93.76 170 A 1 ATOM 1376 C CE . LYS A 1 170 ? 9.918 -12.113 15.437 1.00 91.00 170 A 1 ATOM 1377 N NZ . LYS A 1 170 ? 9.781 -10.645 15.547 1.00 82.32 170 A 1 ATOM 1378 N N . PHE A 1 171 ? 8.628 -15.716 9.705 1.00 98.26 171 A 1 ATOM 1379 C CA . PHE A 1 171 ? 8.554 -16.103 8.298 1.00 98.38 171 A 1 ATOM 1380 C C . PHE A 1 171 ? 7.418 -15.376 7.570 1.00 98.51 171 A 1 ATOM 1381 O O . PHE A 1 171 ? 7.643 -14.824 6.499 1.00 98.21 171 A 1 ATOM 1382 C CB . PHE A 1 171 ? 8.406 -17.623 8.185 1.00 98.19 171 A 1 ATOM 1383 C CG . PHE A 1 171 ? 9.596 -18.388 8.730 1.00 98.17 171 A 1 ATOM 1384 C CD1 . PHE A 1 171 ? 10.861 -18.228 8.136 1.00 97.13 171 A 1 ATOM 1385 C CD2 . PHE A 1 171 ? 9.447 -19.254 9.829 1.00 97.14 171 A 1 ATOM 1386 C CE1 . PHE A 1 171 ? 11.971 -18.929 8.636 1.00 96.55 171 A 1 ATOM 1387 C CE2 . PHE A 1 171 ? 10.558 -19.956 10.326 1.00 96.53 171 A 1 ATOM 1388 C CZ . PHE A 1 171 ? 11.820 -19.794 9.730 1.00 96.84 171 A 1 ATOM 1389 N N . GLY A 1 172 ? 6.234 -15.270 8.198 1.00 98.32 172 A 1 ATOM 1390 C CA . GLY A 1 172 ? 5.125 -14.488 7.634 1.00 98.23 172 A 1 ATOM 1391 C C . GLY A 1 172 ? 5.479 -13.010 7.424 1.00 98.29 172 A 1 ATOM 1392 O O . GLY A 1 172 ? 5.140 -12.438 6.393 1.00 97.72 172 A 1 ATOM 1393 N N . ARG A 1 173 ? 6.223 -12.402 8.360 1.00 98.39 173 A 1 ATOM 1394 C CA . ARG A 1 173 ? 6.686 -11.006 8.224 1.00 98.30 173 A 1 ATOM 1395 C C . ARG A 1 173 ? 7.711 -10.829 7.103 1.00 98.49 173 A 1 ATOM 1396 O O . ARG A 1 173 ? 7.630 -9.855 6.372 1.00 98.18 173 A 1 ATOM 1397 C CB . ARG A 1 173 ? 7.271 -10.499 9.544 1.00 97.92 173 A 1 ATOM 1398 C CG . ARG A 1 173 ? 6.199 -10.361 10.631 1.00 95.49 173 A 1 ATOM 1399 C CD . ARG A 1 173 ? 6.852 -9.855 11.920 1.00 91.31 173 A 1 ATOM 1400 N NE . ARG A 1 173 ? 5.870 -9.760 13.008 1.00 85.11 173 A 1 ATOM 1401 C CZ . ARG A 1 173 ? 6.056 -9.168 14.173 1.00 78.00 173 A 1 ATOM 1402 N NH1 . ARG A 1 173 ? 7.194 -8.620 14.494 1.00 68.86 173 A 1 ATOM 1403 N NH2 . ARG A 1 173 ? 5.086 -9.113 15.046 1.00 73.46 173 A 1 ATOM 1404 N N . VAL A 1 174 ? 8.639 -11.778 6.958 1.00 98.33 174 A 1 ATOM 1405 C CA . VAL A 1 174 ? 9.616 -11.767 5.854 1.00 98.49 174 A 1 ATOM 1406 C C . VAL A 1 174 ? 8.906 -11.875 4.505 1.00 98.63 174 A 1 ATOM 1407 O O . VAL A 1 174 ? 9.200 -11.103 3.591 1.00 98.39 174 A 1 ATOM 1408 C CB . VAL A 1 174 ? 10.645 -12.897 6.032 1.00 98.12 174 A 1 ATOM 1409 C CG1 . VAL A 1 174 ? 11.566 -13.064 4.819 1.00 95.98 174 A 1 ATOM 1410 C CG2 . VAL A 1 174 ? 11.535 -12.611 7.242 1.00 95.93 174 A 1 ATOM 1411 N N . VAL A 1 175 ? 7.937 -12.797 4.394 1.00 98.57 175 A 1 ATOM 1412 C CA . VAL A 1 175 ? 7.105 -12.930 3.191 1.00 98.63 175 A 1 ATOM 1413 C C . VAL A 1 175 ? 6.392 -11.614 2.886 1.00 98.63 175 A 1 ATOM 1414 O O . VAL A 1 175 ? 6.492 -11.127 1.763 1.00 98.48 175 A 1 ATOM 1415 C CB . VAL A 1 175 ? 6.103 -14.093 3.331 1.00 98.58 175 A 1 ATOM 1416 C CG1 . VAL A 1 175 ? 5.068 -14.120 2.198 1.00 98.04 175 A 1 ATOM 1417 C CG2 . VAL A 1 175 ? 6.831 -15.444 3.317 1.00 97.90 175 A 1 ATOM 1418 N N . GLU A 1 176 ? 5.726 -11.010 3.867 1.00 98.34 176 A 1 ATOM 1419 C CA . GLU A 1 176 ? 4.995 -9.752 3.679 1.00 98.07 176 A 1 ATOM 1420 C C . GLU A 1 176 ? 5.925 -8.607 3.248 1.00 98.21 176 A 1 ATOM 1421 O O . GLU A 1 176 ? 5.652 -7.936 2.253 1.00 97.71 176 A 1 ATOM 1422 C CB . GLU A 1 176 ? 4.228 -9.410 4.969 1.00 97.09 176 A 1 ATOM 1423 C CG . GLU A 1 176 ? 3.197 -8.274 4.812 1.00 87.82 176 A 1 ATOM 1424 C CD . GLU A 1 176 ? 1.952 -8.634 3.968 1.00 85.51 176 A 1 ATOM 1425 O OE1 . GLU A 1 176 ? 1.072 -7.754 3.809 1.00 76.02 176 A 1 ATOM 1426 O OE2 . GLU A 1 176 ? 1.868 -9.756 3.430 1.00 77.09 176 A 1 ATOM 1427 N N . GLY A 1 177 ? 7.065 -8.430 3.922 1.00 97.98 177 A 1 ATOM 1428 C CA . GLY A 1 177 ? 8.014 -7.352 3.627 1.00 97.91 177 A 1 ATOM 1429 C C . GLY A 1 177 ? 8.624 -7.424 2.222 1.00 98.15 177 A 1 ATOM 1430 O O . GLY A 1 177 ? 8.882 -6.395 1.594 1.00 97.61 177 A 1 ATOM 1431 N N . TYR A 1 178 ? 8.819 -8.635 1.673 1.00 98.37 178 A 1 ATOM 1432 C CA . TYR A 1 178 ? 9.244 -8.778 0.273 1.00 98.43 178 A 1 ATOM 1433 C C . TYR A 1 178 ? 8.069 -8.741 -0.715 1.00 98.42 178 A 1 ATOM 1434 O O . TYR A 1 178 ? 8.219 -8.184 -1.805 1.00 98.03 178 A 1 ATOM 1435 C CB . TYR A 1 178 ? 10.093 -10.041 0.089 1.00 98.45 178 A 1 ATOM 1436 C CG . TYR A 1 178 ? 11.498 -9.935 0.661 1.00 98.52 178 A 1 ATOM 1437 C CD1 . TYR A 1 178 ? 12.393 -8.967 0.160 1.00 98.05 178 A 1 ATOM 1438 C CD2 . TYR A 1 178 ? 11.917 -10.804 1.682 1.00 98.02 178 A 1 ATOM 1439 C CE1 . TYR A 1 178 ? 13.695 -8.861 0.688 1.00 97.79 178 A 1 ATOM 1440 C CE2 . TYR A 1 178 ? 13.218 -10.705 2.214 1.00 97.79 178 A 1 ATOM 1441 C CZ . TYR A 1 178 ? 14.108 -9.730 1.719 1.00 98.01 178 A 1 ATOM 1442 O OH . TYR A 1 178 ? 15.359 -9.626 2.242 1.00 97.34 178 A 1 ATOM 1443 N N . ALA A 1 179 ? 6.900 -9.290 -0.355 1.00 98.41 179 A 1 ATOM 1444 C CA . ALA A 1 179 ? 5.731 -9.324 -1.233 1.00 98.37 179 A 1 ATOM 1445 C C . ALA A 1 179 ? 5.114 -7.931 -1.447 1.00 98.17 179 A 1 ATOM 1446 O O . ALA A 1 179 ? 4.656 -7.632 -2.552 1.00 97.62 179 A 1 ATOM 1447 C CB . ALA A 1 179 ? 4.705 -10.305 -0.656 1.00 98.25 179 A 1 ATOM 1448 N N . LYS A 1 180 ? 5.133 -7.056 -0.433 1.00 98.15 180 A 1 ATOM 1449 C CA . LYS A 1 180 ? 4.617 -5.675 -0.527 1.00 97.94 180 A 1 ATOM 1450 C C . LYS A 1 180 ? 5.574 -4.727 -1.264 1.00 97.84 180 A 1 ATOM 1451 O O . LYS A 1 180 ? 5.932 -3.655 -0.787 1.00 96.72 180 A 1 ATOM 1452 C CB . LYS A 1 180 ? 4.234 -5.153 0.867 1.00 97.59 180 A 1 ATOM 1453 C CG . LYS A 1 180 ? 3.075 -5.910 1.516 1.00 96.39 180 A 1 ATOM 1454 C CD . LYS A 1 180 ? 1.766 -5.779 0.742 1.00 93.11 180 A 1 ATOM 1455 C CE . LYS A 1 180 ? 0.717 -6.520 1.566 1.00 88.99 180 A 1 ATOM 1456 N NZ . LYS A 1 180 ? -0.560 -6.646 0.882 1.00 80.80 180 A 1 ATOM 1457 N N . ARG A 1 181 ? 6.009 -5.154 -2.442 1.00 97.94 181 A 1 ATOM 1458 C CA . ARG A 1 181 ? 6.868 -4.438 -3.390 1.00 98.02 181 A 1 ATOM 1459 C C . ARG A 1 181 ? 6.381 -4.714 -4.816 1.00 98.19 181 A 1 ATOM 1460 O O . ARG A 1 181 ? 5.575 -5.624 -5.040 1.00 97.83 181 A 1 ATOM 1461 C CB . ARG A 1 181 ? 8.337 -4.880 -3.205 1.00 97.71 181 A 1 ATOM 1462 C CG . ARG A 1 181 ? 8.873 -4.632 -1.782 1.00 97.47 181 A 1 ATOM 1463 C CD . ARG A 1 181 ? 10.350 -5.025 -1.641 1.00 96.95 181 A 1 ATOM 1464 N NE . ARG A 1 181 ? 10.804 -4.816 -0.250 1.00 95.71 181 A 1 ATOM 1465 C CZ . ARG A 1 181 ? 12.028 -4.944 0.228 1.00 95.33 181 A 1 ATOM 1466 N NH1 . ARG A 1 181 ? 13.040 -5.303 -0.511 1.00 93.28 181 A 1 ATOM 1467 N NH2 . ARG A 1 181 ? 12.258 -4.711 1.488 1.00 92.92 181 A 1 ATOM 1468 N N . LEU A 1 182 ? 6.879 -3.966 -5.782 1.00 97.96 182 A 1 ATOM 1469 C CA . LEU A 1 182 ? 6.771 -4.359 -7.188 1.00 98.16 182 A 1 ATOM 1470 C C . LEU A 1 182 ? 7.715 -5.541 -7.433 1.00 98.34 182 A 1 ATOM 1471 O O . LEU A 1 182 ? 8.917 -5.436 -7.162 1.00 97.83 182 A 1 ATOM 1472 C CB . LEU A 1 182 ? 7.074 -3.173 -8.116 1.00 97.90 182 A 1 ATOM 1473 C CG . LEU A 1 182 ? 6.199 -1.925 -7.900 1.00 97.09 182 A 1 ATOM 1474 C CD1 . LEU A 1 182 ? 6.530 -0.874 -8.961 1.00 95.74 182 A 1 ATOM 1475 C CD2 . LEU A 1 182 ? 4.704 -2.230 -7.973 1.00 95.42 182 A 1 ATOM 1476 N N . GLN A 1 183 ? 7.174 -6.670 -7.881 1.00 98.20 183 A 1 ATOM 1477 C CA . GLN A 1 183 ? 7.901 -7.941 -7.903 1.00 98.10 183 A 1 ATOM 1478 C C . GLN A 1 183 ? 7.730 -8.720 -9.209 1.00 98.15 183 A 1 ATOM 1479 O O . GLN A 1 183 ? 6.751 -8.563 -9.945 1.00 97.73 183 A 1 ATOM 1480 C CB . GLN A 1 183 ? 7.464 -8.809 -6.709 1.00 97.78 183 A 1 ATOM 1481 C CG . GLN A 1 183 ? 8.074 -8.400 -5.353 1.00 96.95 183 A 1 ATOM 1482 C CD . GLN A 1 183 ? 9.575 -8.664 -5.230 1.00 98.03 183 A 1 ATOM 1483 O OE1 . GLN A 1 183 ? 10.298 -8.934 -6.185 1.00 92.47 183 A 1 ATOM 1484 N NE2 . GLN A 1 183 ? 10.114 -8.602 -4.034 1.00 93.63 183 A 1 ATOM 1485 N N . VAL A 1 184 ? 8.688 -9.617 -9.429 1.00 98.25 184 A 1 ATOM 1486 C CA . VAL A 1 184 ? 8.501 -10.848 -10.200 1.00 98.27 184 A 1 ATOM 1487 C C . VAL A 1 184 ? 8.583 -12.023 -9.228 1.00 98.56 184 A 1 ATOM 1488 O O . VAL A 1 184 ? 9.305 -11.949 -8.232 1.00 98.29 184 A 1 ATOM 1489 C CB . VAL A 1 184 ? 9.509 -10.989 -11.356 1.00 97.35 184 A 1 ATOM 1490 C CG1 . VAL A 1 184 ? 9.306 -9.872 -12.381 1.00 93.45 184 A 1 ATOM 1491 C CG2 . VAL A 1 184 ? 10.971 -10.982 -10.896 1.00 92.55 184 A 1 ATOM 1492 N N . GLN A 1 185 ? 7.821 -13.091 -9.473 1.00 98.28 185 A 1 ATOM 1493 C CA . GLN A 1 185 ? 7.695 -14.206 -8.529 1.00 98.47 185 A 1 ATOM 1494 C C . GLN A 1 185 ? 9.037 -14.913 -8.265 1.00 98.62 185 A 1 ATOM 1495 O O . GLN A 1 185 ? 9.324 -15.315 -7.140 1.00 98.60 185 A 1 ATOM 1496 C CB . GLN A 1 185 ? 6.640 -15.182 -9.065 1.00 98.37 185 A 1 ATOM 1497 C CG . GLN A 1 185 ? 6.338 -16.318 -8.080 1.00 97.82 185 A 1 ATOM 1498 C CD . GLN A 1 185 ? 5.274 -17.277 -8.593 1.00 98.17 185 A 1 ATOM 1499 O OE1 . GLN A 1 185 ? 4.362 -16.920 -9.322 1.00 95.30 185 A 1 ATOM 1500 N NE2 . GLN A 1 185 ? 5.348 -18.536 -8.233 1.00 94.01 185 A 1 ATOM 1501 N N . GLU A 1 186 ? 9.892 -15.015 -9.273 1.00 98.72 186 A 1 ATOM 1502 C CA . GLU A 1 186 ? 11.231 -15.601 -9.182 1.00 98.73 186 A 1 ATOM 1503 C C . GLU A 1 186 ? 12.103 -14.828 -8.190 1.00 98.79 186 A 1 ATOM 1504 O O . GLU A 1 186 ? 12.693 -15.416 -7.285 1.00 98.62 186 A 1 ATOM 1505 C CB . GLU A 1 186 ? 11.901 -15.609 -10.571 1.00 98.53 186 A 1 ATOM 1506 C CG . GLU A 1 186 ? 11.175 -16.433 -11.648 1.00 97.04 186 A 1 ATOM 1507 C CD . GLU A 1 186 ? 10.064 -15.681 -12.411 1.00 97.22 186 A 1 ATOM 1508 O OE1 . GLU A 1 186 ? 9.695 -16.162 -13.496 1.00 92.49 186 A 1 ATOM 1509 O OE2 . GLU A 1 186 ? 9.570 -14.640 -11.915 1.00 93.41 186 A 1 ATOM 1510 N N . ARG A 1 187 ? 12.123 -13.491 -8.291 1.00 98.73 187 A 1 ATOM 1511 C CA . ARG A 1 187 ? 12.868 -12.614 -7.380 1.00 98.69 187 A 1 ATOM 1512 C C . ARG A 1 187 ? 12.332 -12.702 -5.954 1.00 98.77 187 A 1 ATOM 1513 O O . ARG A 1 187 ? 13.124 -12.829 -5.031 1.00 98.71 187 A 1 ATOM 1514 C CB . ARG A 1 187 ? 12.828 -11.165 -7.894 1.00 98.48 187 A 1 ATOM 1515 C CG . ARG A 1 187 ? 13.750 -10.231 -7.083 1.00 97.95 187 A 1 ATOM 1516 C CD . ARG A 1 187 ? 13.511 -8.753 -7.414 1.00 97.18 187 A 1 ATOM 1517 N NE . ARG A 1 187 ? 13.650 -8.454 -8.856 1.00 95.63 187 A 1 ATOM 1518 C CZ . ARG A 1 187 ? 12.850 -7.668 -9.573 1.00 95.86 187 A 1 ATOM 1519 N NH1 . ARG A 1 187 ? 11.878 -6.991 -9.047 1.00 90.07 187 A 1 ATOM 1520 N NH2 . ARG A 1 187 ? 12.995 -7.549 -10.856 1.00 91.62 187 A 1 ATOM 1521 N N . LEU A 1 188 ? 11.011 -12.668 -5.778 1.00 98.59 188 A 1 ATOM 1522 C CA . LEU A 1 188 ? 10.365 -12.825 -4.471 1.00 98.62 188 A 1 ATOM 1523 C C . LEU A 1 188 ? 10.816 -14.123 -3.791 1.00 98.71 188 A 1 ATOM 1524 O O . LEU A 1 188 ? 11.211 -14.113 -2.625 1.00 98.62 188 A 1 ATOM 1525 C CB . LEU A 1 188 ? 8.835 -12.782 -4.667 1.00 98.57 188 A 1 ATOM 1526 C CG . LEU A 1 188 ? 8.019 -13.058 -3.394 1.00 98.01 188 A 1 ATOM 1527 C CD1 . LEU A 1 188 ? 8.295 -12.030 -2.297 1.00 96.80 188 A 1 ATOM 1528 C CD2 . LEU A 1 188 ? 6.524 -13.026 -3.715 1.00 97.08 188 A 1 ATOM 1529 N N . THR A 1 189 ? 10.802 -15.232 -4.528 1.00 98.60 189 A 1 ATOM 1530 C CA . THR A 1 189 ? 11.203 -16.556 -4.027 1.00 98.64 189 A 1 ATOM 1531 C C . THR A 1 189 ? 12.667 -16.561 -3.577 1.00 98.65 189 A 1 ATOM 1532 O O . THR A 1 189 ? 12.975 -17.021 -2.478 1.00 98.53 189 A 1 ATOM 1533 C CB . THR A 1 189 ? 10.984 -17.635 -5.104 1.00 98.62 189 A 1 ATOM 1534 O OG1 . THR A 1 189 ? 9.683 -17.545 -5.633 1.00 95.58 189 A 1 ATOM 1535 C CG2 . THR A 1 189 ? 11.119 -19.050 -4.549 1.00 96.13 189 A 1 ATOM 1536 N N . GLN A 1 190 ? 13.559 -16.000 -4.394 1.00 98.71 190 A 1 ATOM 1537 C CA . GLN A 1 190 ? 14.989 -15.900 -4.089 1.00 98.60 190 A 1 ATOM 1538 C C . GLN A 1 190 ? 15.254 -15.008 -2.874 1.00 98.61 190 A 1 ATOM 1539 O O . GLN A 1 190 ? 15.963 -15.424 -1.968 1.00 98.31 190 A 1 ATOM 1540 C CB . GLN A 1 190 ? 15.744 -15.365 -5.309 1.00 98.13 190 A 1 ATOM 1541 C CG . GLN A 1 190 ? 15.836 -16.405 -6.436 1.00 88.97 190 A 1 ATOM 1542 C CD . GLN A 1 190 ? 16.421 -15.840 -7.731 1.00 87.19 190 A 1 ATOM 1543 O OE1 . GLN A 1 190 ? 16.762 -14.675 -7.862 1.00 78.62 190 A 1 ATOM 1544 N NE2 . GLN A 1 190 ? 16.555 -16.652 -8.757 1.00 74.16 190 A 1 ATOM 1545 N N . GLN A 1 191 ? 14.643 -13.817 -2.807 1.00 98.67 191 A 1 ATOM 1546 C CA . GLN A 1 191 ? 14.845 -12.869 -1.707 1.00 98.60 191 A 1 ATOM 1547 C C . GLN A 1 191 ? 14.466 -13.464 -0.347 1.00 98.64 191 A 1 ATOM 1548 O O . GLN A 1 191 ? 15.175 -13.242 0.631 1.00 98.52 191 A 1 ATOM 1549 C CB . GLN A 1 191 ? 14.015 -11.603 -1.959 1.00 98.52 191 A 1 ATOM 1550 C CG . GLN A 1 191 ? 14.641 -10.690 -3.020 1.00 98.04 191 A 1 ATOM 1551 C CD . GLN A 1 191 ? 13.787 -9.458 -3.308 1.00 98.02 191 A 1 ATOM 1552 O OE1 . GLN A 1 191 ? 12.566 -9.484 -3.386 1.00 94.88 191 A 1 ATOM 1553 N NE2 . GLN A 1 191 ? 14.402 -8.308 -3.481 1.00 94.06 191 A 1 ATOM 1554 N N . ILE A 1 192 ? 13.365 -14.226 -0.275 1.00 98.55 192 A 1 ATOM 1555 C CA . ILE A 1 192 ? 12.947 -14.892 0.964 1.00 98.56 192 A 1 ATOM 1556 C C . ILE A 1 192 ? 13.973 -15.962 1.365 1.00 98.50 192 A 1 ATOM 1557 O O . ILE A 1 192 ? 14.398 -15.996 2.519 1.00 98.32 192 A 1 ATOM 1558 C CB . ILE A 1 192 ? 11.525 -15.478 0.813 1.00 98.66 192 A 1 ATOM 1559 C CG1 . ILE A 1 192 ? 10.478 -14.352 0.609 1.00 98.30 192 A 1 ATOM 1560 C CG2 . ILE A 1 192 ? 11.138 -16.307 2.058 1.00 98.16 192 A 1 ATOM 1561 C CD1 . ILE A 1 192 ? 9.140 -14.866 0.062 1.00 97.62 192 A 1 ATOM 1562 N N . ALA A 1 193 ? 14.401 -16.809 0.431 1.00 98.57 193 A 1 ATOM 1563 C CA . ALA A 1 193 ? 15.376 -17.865 0.704 1.00 98.47 193 A 1 ATOM 1564 C C . ALA A 1 193 ? 16.738 -17.299 1.136 1.00 98.30 193 A 1 ATOM 1565 O O . ALA A 1 193 ? 17.312 -17.764 2.120 1.00 97.97 193 A 1 ATOM 1566 C CB . ALA A 1 193 ? 15.514 -18.746 -0.542 1.00 98.38 193 A 1 ATOM 1567 N N . ASP A 1 194 ? 17.216 -16.271 0.448 1.00 98.00 194 A 1 ATOM 1568 C CA . ASP A 1 194 ? 18.507 -15.645 0.727 1.00 97.59 194 A 1 ATOM 1569 C C . ASP A 1 194 ? 18.498 -14.919 2.080 1.00 97.63 194 A 1 ATOM 1570 O O . ASP A 1 194 ? 19.456 -15.036 2.837 1.00 97.16 194 A 1 ATOM 1571 C CB . ASP A 1 194 ? 18.891 -14.699 -0.425 1.00 97.07 194 A 1 ATOM 1572 C CG . ASP A 1 194 ? 19.148 -15.407 -1.769 1.00 95.75 194 A 1 ATOM 1573 O OD1 . ASP A 1 194 ? 19.411 -16.639 -1.800 1.00 93.02 194 A 1 ATOM 1574 O OD2 . ASP A 1 194 ? 19.098 -14.709 -2.810 1.00 92.68 194 A 1 ATOM 1575 N N . ALA A 1 195 ? 17.388 -14.254 2.451 1.00 98.02 195 A 1 ATOM 1576 C CA . ALA A 1 195 ? 17.238 -13.632 3.768 1.00 97.99 195 A 1 ATOM 1577 C C . ALA A 1 195 ? 17.316 -14.662 4.909 1.00 97.90 195 A 1 ATOM 1578 O O . ALA A 1 195 ? 17.987 -14.430 5.914 1.00 97.50 195 A 1 ATOM 1579 C CB . ALA A 1 195 ? 15.908 -12.875 3.810 1.00 98.05 195 A 1 ATOM 1580 N N . ILE A 1 196 ? 16.650 -15.815 4.755 1.00 98.11 196 A 1 ATOM 1581 C CA . ILE A 1 196 ? 16.693 -16.902 5.743 1.00 98.03 196 A 1 ATOM 1582 C C . ILE A 1 196 ? 18.101 -17.502 5.814 1.00 97.67 196 A 1 ATOM 1583 O O . ILE A 1 196 ? 18.624 -17.696 6.911 1.00 97.12 196 A 1 ATOM 1584 C CB . ILE A 1 196 ? 15.624 -17.969 5.416 1.00 98.18 196 A 1 ATOM 1585 C CG1 . ILE A 1 196 ? 14.205 -17.372 5.566 1.00 97.73 196 A 1 ATOM 1586 C CG2 . ILE A 1 196 ? 15.762 -19.201 6.338 1.00 97.55 196 A 1 ATOM 1587 C CD1 . ILE A 1 196 ? 13.113 -18.229 4.918 1.00 96.38 196 A 1 ATOM 1588 N N . GLN A 1 197 ? 18.730 -17.754 4.671 1.00 98.04 197 A 1 ATOM 1589 C CA . GLN A 1 197 ? 20.081 -18.311 4.605 1.00 97.69 197 A 1 ATOM 1590 C C . GLN A 1 197 ? 21.109 -17.383 5.260 1.00 97.41 197 A 1 ATOM 1591 O O . GLN A 1 197 ? 21.959 -17.846 6.010 1.00 96.76 197 A 1 ATOM 1592 C CB . GLN A 1 197 ? 20.445 -18.592 3.134 1.00 97.19 197 A 1 ATOM 1593 C CG . GLN A 1 197 ? 21.822 -19.270 2.974 1.00 95.05 197 A 1 ATOM 1594 C CD . GLN A 1 197 ? 21.877 -20.642 3.644 1.00 94.77 197 A 1 ATOM 1595 O OE1 . GLN A 1 197 ? 21.177 -21.558 3.250 1.00 87.01 197 A 1 ATOM 1596 N NE2 . GLN A 1 197 ? 22.670 -20.833 4.677 1.00 85.32 197 A 1 ATOM 1597 N N . GLU A 1 198 ? 21.022 -16.081 4.998 1.00 97.35 198 A 1 ATOM 1598 C CA . GLU A 1 198 ? 21.974 -15.085 5.505 1.00 96.93 198 A 1 ATOM 1599 C C . GLU A 1 198 ? 21.845 -14.869 7.016 1.00 96.72 198 A 1 ATOM 1600 O O . GLU A 1 198 ? 22.853 -14.833 7.716 1.00 95.64 198 A 1 ATOM 1601 C CB . GLU A 1 198 ? 21.750 -13.781 4.727 1.00 96.68 198 A 1 ATOM 1602 C CG . GLU A 1 198 ? 22.765 -12.668 5.046 1.00 90.49 198 A 1 ATOM 1603 C CD . GLU A 1 198 ? 22.456 -11.403 4.217 1.00 88.91 198 A 1 ATOM 1604 O OE1 . GLU A 1 198 ? 22.583 -10.265 4.721 1.00 80.56 198 A 1 ATOM 1605 O OE2 . GLU A 1 198 ? 21.973 -11.523 3.067 1.00 82.51 198 A 1 ATOM 1606 N N . VAL A 1 199 ? 20.619 -14.752 7.539 1.00 97.01 199 A 1 ATOM 1607 C CA . VAL A 1 199 ? 20.403 -14.385 8.953 1.00 96.60 199 A 1 ATOM 1608 C C . VAL A 1 199 ? 20.449 -15.601 9.879 1.00 96.24 199 A 1 ATOM 1609 O O . VAL A 1 199 ? 21.029 -15.527 10.965 1.00 95.19 199 A 1 ATOM 1610 C CB . VAL A 1 199 ? 19.087 -13.608 9.127 1.00 96.57 199 A 1 ATOM 1611 C CG1 . VAL A 1 199 ? 18.869 -13.187 10.591 1.00 95.30 199 A 1 ATOM 1612 C CG2 . VAL A 1 199 ? 19.067 -12.331 8.278 1.00 95.49 199 A 1 ATOM 1613 N N . LEU A 1 200 ? 19.831 -16.715 9.494 1.00 96.63 200 A 1 ATOM 1614 C CA . LEU A 1 200 ? 19.754 -17.915 10.337 1.00 96.21 200 A 1 ATOM 1615 C C . LEU A 1 200 ? 20.901 -18.897 10.082 1.00 95.88 200 A 1 ATOM 1616 O O . LEU A 1 200 ? 21.131 -19.754 10.929 1.00 94.88 200 A 1 ATOM 1617 C CB . LEU A 1 200 ? 18.386 -18.610 10.185 1.00 96.40 200 A 1 ATOM 1618 C CG . LEU A 1 200 ? 17.154 -17.729 10.465 1.00 96.08 200 A 1 ATOM 1619 C CD1 . LEU A 1 200 ? 15.886 -18.584 10.373 1.00 94.92 200 A 1 ATOM 1620 C CD2 . LEU A 1 200 ? 17.190 -17.089 11.859 1.00 94.86 200 A 1 ATOM 1621 N N . ASN A 1 201 ? 21.593 -18.775 8.950 1.00 96.07 201 A 1 ATOM 1622 C CA . ASN A 1 201 ? 22.661 -19.683 8.514 1.00 95.72 201 A 1 ATOM 1623 C C . ASN A 1 201 ? 22.321 -21.182 8.737 1.00 96.05 201 A 1 ATOM 1624 O O . ASN A 1 201 ? 23.100 -21.898 9.375 1.00 95.12 201 A 1 ATOM 1625 C CB . ASN A 1 201 ? 23.980 -19.227 9.157 1.00 94.61 201 A 1 ATOM 1626 C CG . ASN A 1 201 ? 25.178 -19.997 8.635 1.00 90.60 201 A 1 ATOM 1627 O OD1 . ASN A 1 201 ? 25.315 -20.297 7.460 1.00 82.59 201 A 1 ATOM 1628 N ND2 . ASN A 1 201 ? 26.106 -20.337 9.498 1.00 80.31 201 A 1 ATOM 1629 N N . PRO A 1 202 ? 21.143 -21.669 8.283 1.00 96.50 202 A 1 ATOM 1630 C CA . PRO A 1 202 ? 20.711 -23.040 8.514 1.00 96.56 202 A 1 ATOM 1631 C C . PRO A 1 202 ? 21.526 -24.027 7.666 1.00 96.54 202 A 1 ATOM 1632 O O . PRO A 1 202 ? 22.173 -23.649 6.682 1.00 95.90 202 A 1 ATOM 1633 C CB . PRO A 1 202 ? 19.223 -23.040 8.146 1.00 96.54 202 A 1 ATOM 1634 C CG . PRO A 1 202 ? 19.165 -22.034 7.002 1.00 96.17 202 A 1 ATOM 1635 C CD . PRO A 1 202 ? 20.177 -20.977 7.428 1.00 96.73 202 A 1 ATOM 1636 N N . GLN A 1 203 ? 21.424 -25.322 8.003 1.00 95.97 203 A 1 ATOM 1637 C CA . GLN A 1 203 ? 21.995 -26.400 7.187 1.00 95.95 203 A 1 ATOM 1638 C C . GLN A 1 203 ? 21.338 -26.464 5.800 1.00 96.58 203 A 1 ATOM 1639 O O . GLN A 1 203 ? 21.988 -26.795 4.804 1.00 95.87 203 A 1 ATOM 1640 C CB . GLN A 1 203 ? 21.804 -27.754 7.891 1.00 95.36 203 A 1 ATOM 1641 C CG . GLN A 1 203 ? 22.434 -27.845 9.288 1.00 91.33 203 A 1 ATOM 1642 C CD . GLN A 1 203 ? 22.347 -29.265 9.853 1.00 88.69 203 A 1 ATOM 1643 O OE1 . GLN A 1 203 ? 22.572 -30.237 9.147 1.00 78.89 203 A 1 ATOM 1644 N NE2 . GLN A 1 203 ? 22.041 -29.436 11.120 1.00 76.04 203 A 1 ATOM 1645 N N . ALA A 1 204 ? 20.040 -26.142 5.743 1.00 96.95 204 A 1 ATOM 1646 C CA . ALA A 1 204 ? 19.284 -26.107 4.502 1.00 97.19 204 A 1 ATOM 1647 C C . ALA A 1 204 ? 18.112 -25.128 4.586 1.00 97.60 204 A 1 ATOM 1648 O O . ALA A 1 204 ? 17.491 -24.986 5.637 1.00 97.06 204 A 1 ATOM 1649 C CB . ALA A 1 204 ? 18.783 -27.517 4.192 1.00 96.39 204 A 1 ATOM 1650 N N . VAL A 1 205 ? 17.744 -24.513 3.462 1.00 97.61 205 A 1 ATOM 1651 C CA . VAL A 1 205 ? 16.506 -23.741 3.304 1.00 98.04 205 A 1 ATOM 1652 C C . VAL A 1 205 ? 15.878 -24.015 1.942 1.00 98.36 205 A 1 ATOM 1653 O O . VAL A 1 205 ? 16.565 -24.127 0.926 1.00 97.81 205 A 1 ATOM 1654 C CB . VAL A 1 205 ? 16.718 -22.238 3.575 1.00 96.75 205 A 1 ATOM 1655 C CG1 . VAL A 1 205 ? 17.697 -21.567 2.618 1.00 90.96 205 A 1 ATOM 1656 C CG2 . VAL A 1 205 ? 15.400 -21.451 3.520 1.00 90.55 205 A 1 ATOM 1657 N N . ALA A 1 206 ? 14.546 -24.114 1.937 1.00 98.38 206 A 1 ATOM 1658 C CA . ALA A 1 206 ? 13.738 -24.220 0.738 1.00 98.48 206 A 1 ATOM 1659 C C . ALA A 1 206 ? 12.573 -23.238 0.806 1.00 98.63 206 A 1 ATOM 1660 O O . ALA A 1 206 ? 11.855 -23.183 1.803 1.00 98.36 206 A 1 ATOM 1661 C CB . ALA A 1 206 ? 13.251 -25.661 0.584 1.00 98.13 206 A 1 ATOM 1662 N N . VAL A 1 207 ? 12.369 -22.491 -0.266 1.00 98.45 207 A 1 ATOM 1663 C CA . VAL A 1 207 ? 11.213 -21.610 -0.442 1.00 98.58 207 A 1 ATOM 1664 C C . VAL A 1 207 ? 10.514 -21.988 -1.738 1.00 98.57 207 A 1 ATOM 1665 O O . VAL A 1 207 ? 11.140 -22.009 -2.800 1.00 98.27 207 A 1 ATOM 1666 C CB . VAL A 1 207 ? 11.616 -20.125 -0.420 1.00 98.51 207 A 1 ATOM 1667 C CG1 . VAL A 1 207 ? 10.396 -19.211 -0.605 1.00 97.80 207 A 1 ATOM 1668 C CG2 . VAL A 1 207 ? 12.274 -19.765 0.918 1.00 97.60 207 A 1 ATOM 1669 N N . ILE A 1 208 ? 9.216 -22.296 -1.648 1.00 98.60 208 A 1 ATOM 1670 C CA . ILE A 1 208 ? 8.360 -22.593 -2.792 1.00 98.58 208 A 1 ATOM 1671 C C . ILE A 1 208 ? 7.206 -21.597 -2.794 1.00 98.60 208 A 1 ATOM 1672 O O . ILE A 1 208 ? 6.531 -21.422 -1.782 1.00 98.37 208 A 1 ATOM 1673 C CB . ILE A 1 208 ? 7.861 -24.058 -2.790 1.00 98.35 208 A 1 ATOM 1674 C CG1 . ILE A 1 208 ? 9.015 -25.097 -2.750 1.00 97.05 208 A 1 ATOM 1675 C CG2 . ILE A 1 208 ? 7.006 -24.324 -4.040 1.00 97.08 208 A 1 ATOM 1676 C CD1 . ILE A 1 208 ? 9.469 -25.492 -1.341 1.00 92.20 208 A 1 ATOM 1677 N N . VAL A 1 209 ? 6.972 -20.934 -3.922 1.00 98.50 209 A 1 ATOM 1678 C CA . VAL A 1 209 ? 5.890 -19.964 -4.106 1.00 98.56 209 A 1 ATOM 1679 C C . VAL A 1 209 ? 4.953 -20.462 -5.196 1.00 98.51 209 A 1 ATOM 1680 O O . VAL A 1 209 ? 5.389 -20.757 -6.306 1.00 98.19 209 A 1 ATOM 1681 C CB . VAL A 1 209 ? 6.433 -18.561 -4.432 1.00 98.51 209 A 1 ATOM 1682 C CG1 . VAL A 1 209 ? 5.299 -17.536 -4.541 1.00 97.87 209 A 1 ATOM 1683 C CG2 . VAL A 1 209 ? 7.409 -18.070 -3.357 1.00 97.86 209 A 1 ATOM 1684 N N . GLU A 1 210 ? 3.660 -20.543 -4.871 1.00 98.22 210 A 1 ATOM 1685 C CA . GLU A 1 210 ? 2.581 -20.861 -5.806 1.00 97.99 210 A 1 ATOM 1686 C C . GLU A 1 210 ? 1.687 -19.629 -5.942 1.00 98.08 210 A 1 ATOM 1687 O O . GLU A 1 210 ? 1.187 -19.132 -4.933 1.00 97.56 210 A 1 ATOM 1688 C CB . GLU A 1 210 ? 1.748 -22.048 -5.294 1.00 97.02 210 A 1 ATOM 1689 C CG . GLU A 1 210 ? 2.532 -23.356 -5.126 1.00 90.11 210 A 1 ATOM 1690 C CD . GLU A 1 210 ? 1.647 -24.475 -4.543 1.00 90.68 210 A 1 ATOM 1691 O OE1 . GLU A 1 210 ? 2.123 -25.216 -3.655 1.00 80.01 210 A 1 ATOM 1692 O OE2 . GLU A 1 210 ? 0.454 -24.568 -4.916 1.00 82.74 210 A 1 ATOM 1693 N N . ALA A 1 211 ? 1.457 -19.129 -7.160 1.00 97.44 211 A 1 ATOM 1694 C CA . ALA A 1 211 ? 0.618 -17.951 -7.362 1.00 97.45 211 A 1 ATOM 1695 C C . ALA A 1 211 ? -0.128 -17.935 -8.699 1.00 97.27 211 A 1 ATOM 1696 O O . ALA A 1 211 ? 0.372 -18.391 -9.728 1.00 96.86 211 A 1 ATOM 1697 C CB . ALA A 1 211 ? 1.470 -16.686 -7.200 1.00 97.48 211 A 1 ATOM 1698 N N . GLU A 1 212 ? -1.321 -17.320 -8.678 1.00 95.89 212 A 1 ATOM 1699 C CA . GLU A 1 212 ? -2.052 -16.920 -9.879 1.00 95.69 212 A 1 ATOM 1700 C C . GLU A 1 212 ? -1.763 -15.445 -10.189 1.00 95.86 212 A 1 ATOM 1701 O O . GLU A 1 212 ? -1.813 -14.577 -9.318 1.00 95.32 212 A 1 ATOM 1702 C CB . GLU A 1 212 ? -3.556 -17.189 -9.729 1.00 94.90 212 A 1 ATOM 1703 C CG . GLU A 1 212 ? -4.290 -16.909 -11.057 1.00 90.72 212 A 1 ATOM 1704 C CD . GLU A 1 212 ? -5.800 -17.170 -11.044 1.00 90.66 212 A 1 ATOM 1705 O OE1 . GLU A 1 212 ? -6.474 -16.576 -11.930 1.00 82.27 212 A 1 ATOM 1706 O OE2 . GLU A 1 212 ? -6.272 -17.978 -10.222 1.00 84.50 212 A 1 ATOM 1707 N N . HIS A 1 213 ? -1.485 -15.155 -11.464 1.00 95.80 213 A 1 ATOM 1708 C CA . HIS A 1 213 ? -1.131 -13.822 -11.952 1.00 95.95 213 A 1 ATOM 1709 C C . HIS A 1 213 ? -2.304 -13.201 -12.714 1.00 95.57 213 A 1 ATOM 1710 O O . HIS A 1 213 ? -2.636 -13.630 -13.823 1.00 94.08 213 A 1 ATOM 1711 C CB . HIS A 1 213 ? 0.110 -13.925 -12.847 1.00 96.49 213 A 1 ATOM 1712 C CG . HIS A 1 213 ? 1.381 -14.214 -12.101 1.00 97.00 213 A 1 ATOM 1713 N ND1 . HIS A 1 213 ? 2.391 -13.300 -11.856 1.00 94.33 213 A 1 ATOM 1714 C CD2 . HIS A 1 213 ? 1.742 -15.405 -11.536 1.00 95.14 213 A 1 ATOM 1715 C CE1 . HIS A 1 213 ? 3.337 -13.939 -11.153 1.00 94.73 213 A 1 ATOM 1716 N NE2 . HIS A 1 213 ? 2.979 -15.214 -10.939 1.00 95.34 213 A 1 ATOM 1717 N N . THR A 1 214 ? -2.900 -12.138 -12.172 1.00 94.92 214 A 1 ATOM 1718 C CA . THR A 1 214 ? -4.055 -11.480 -12.806 1.00 93.97 214 A 1 ATOM 1719 C C . THR A 1 214 ? -3.700 -10.800 -14.132 1.00 93.43 214 A 1 ATOM 1720 O O . THR A 1 214 ? -4.569 -10.609 -14.984 1.00 90.77 214 A 1 ATOM 1721 C CB . THR A 1 214 ? -4.736 -10.474 -11.871 1.00 93.89 214 A 1 ATOM 1722 O OG1 . THR A 1 214 ? -3.862 -9.416 -11.596 1.00 89.54 214 A 1 ATOM 1723 C CG2 . THR A 1 214 ? -5.183 -11.088 -10.543 1.00 87.01 214 A 1 ATOM 1724 N N . CYS A 1 215 ? -2.422 -10.505 -14.381 1.00 93.36 215 A 1 ATOM 1725 C CA . CYS A 1 215 ? -1.953 -10.045 -15.691 1.00 91.05 215 A 1 ATOM 1726 C C . CYS A 1 215 ? -2.084 -11.108 -16.799 1.00 89.53 215 A 1 ATOM 1727 O O . CYS A 1 215 ? -2.118 -10.747 -17.979 1.00 86.20 215 A 1 ATOM 1728 C CB . CYS A 1 215 ? -0.512 -9.525 -15.568 1.00 91.09 215 A 1 ATOM 1729 S SG . CYS A 1 215 ? 0.640 -10.860 -15.100 1.00 89.91 215 A 1 ATOM 1730 N N . MET A 1 216 ? -2.194 -12.395 -16.424 1.00 92.62 216 A 1 ATOM 1731 C CA . MET A 1 216 ? -2.441 -13.526 -17.325 1.00 92.05 216 A 1 ATOM 1732 C C . MET A 1 216 ? -3.885 -14.033 -17.269 1.00 92.43 216 A 1 ATOM 1733 O O . MET A 1 216 ? -4.415 -14.436 -18.302 1.00 88.35 216 A 1 ATOM 1734 C CB . MET A 1 216 ? -1.498 -14.686 -16.996 1.00 90.36 216 A 1 ATOM 1735 C CG . MET A 1 216 ? -0.034 -14.390 -17.341 1.00 84.81 216 A 1 ATOM 1736 S SD . MET A 1 216 ? 1.108 -15.753 -17.013 1.00 84.24 216 A 1 ATOM 1737 C CE . MET A 1 216 ? 0.477 -17.064 -18.086 1.00 74.62 216 A 1 ATOM 1738 N N . SER A 1 217 ? -4.532 -14.032 -16.079 1.00 88.12 217 A 1 ATOM 1739 C CA . SER A 1 217 ? -5.906 -14.522 -15.943 1.00 85.25 217 A 1 ATOM 1740 C C . SER A 1 217 ? -6.955 -13.460 -16.271 1.00 84.62 217 A 1 ATOM 1741 O O . SER A 1 217 ? -7.877 -13.729 -17.048 1.00 79.35 217 A 1 ATOM 1742 C CB . SER A 1 217 ? -6.121 -15.158 -14.563 1.00 85.58 217 A 1 ATOM 1743 O OG . SER A 1 217 ? -5.969 -14.258 -13.493 1.00 83.95 217 A 1 ATOM 1744 N N . GLY A 1 218 ? -6.792 -12.224 -15.792 1.00 85.25 218 A 1 ATOM 1745 C CA . GLY A 1 218 ? -7.777 -11.147 -15.960 1.00 81.57 218 A 1 ATOM 1746 C C . GLY A 1 218 ? -7.727 -10.403 -17.303 1.00 83.20 218 A 1 ATOM 1747 O O . GLY A 1 218 ? -8.684 -9.726 -17.672 1.00 77.70 218 A 1 ATOM 1748 N N . ARG A 1 219 ? -6.619 -10.499 -18.063 1.00 87.06 219 A 1 ATOM 1749 C CA . ARG A 1 219 ? -6.401 -9.779 -19.331 1.00 85.57 219 A 1 ATOM 1750 C C . ARG A 1 219 ? -5.544 -10.572 -20.317 1.00 85.48 219 A 1 ATOM 1751 O O . ARG A 1 219 ? -5.011 -11.631 -19.986 1.00 78.84 219 A 1 ATOM 1752 C CB . ARG A 1 219 ? -5.801 -8.378 -19.049 1.00 84.94 219 A 1 ATOM 1753 C CG . ARG A 1 219 ? -4.411 -8.420 -18.378 1.00 81.66 219 A 1 ATOM 1754 C CD . ARG A 1 219 ? -3.766 -7.018 -18.289 1.00 81.24 219 A 1 ATOM 1755 N NE . ARG A 1 219 ? -3.381 -6.487 -19.610 1.00 81.16 219 A 1 ATOM 1756 C CZ . ARG A 1 219 ? -2.286 -6.787 -20.297 1.00 83.22 219 A 1 ATOM 1757 N NH1 . ARG A 1 219 ? -1.393 -7.638 -19.861 1.00 74.27 219 A 1 ATOM 1758 N NH2 . ARG A 1 219 ? -2.070 -6.221 -21.448 1.00 75.41 219 A 1 ATOM 1759 N N . GLY A 1 220 ? -5.385 -10.047 -21.528 1.00 83.17 220 A 1 ATOM 1760 C CA . GLY A 1 220 ? -4.490 -10.637 -22.528 1.00 81.32 220 A 1 ATOM 1761 C C . GLY A 1 220 ? -4.903 -12.066 -22.886 1.00 83.37 220 A 1 ATOM 1762 O O . GLY A 1 220 ? -5.977 -12.271 -23.452 1.00 79.29 220 A 1 ATOM 1763 N N . ILE A 1 221 ? -4.067 -13.057 -22.529 1.00 83.86 221 A 1 ATOM 1764 C CA . ILE A 1 221 ? -4.297 -14.474 -22.863 1.00 84.82 221 A 1 ATOM 1765 C C . ILE A 1 221 ? -5.444 -15.142 -22.071 1.00 85.76 221 A 1 ATOM 1766 O O . ILE A 1 221 ? -5.920 -16.202 -22.481 1.00 81.48 221 A 1 ATOM 1767 C CB . ILE A 1 221 ? -2.961 -15.244 -22.745 1.00 83.32 221 A 1 ATOM 1768 C CG1 . ILE A 1 221 ? -3.020 -16.583 -23.512 1.00 76.94 221 A 1 ATOM 1769 C CG2 . ILE A 1 221 ? -2.542 -15.449 -21.270 1.00 77.08 221 A 1 ATOM 1770 C CD1 . ILE A 1 221 ? -1.658 -17.239 -23.736 1.00 74.24 221 A 1 ATOM 1771 N N . LYS A 1 222 ? -5.909 -14.552 -20.969 1.00 80.91 222 A 1 ATOM 1772 C CA . LYS A 1 222 ? -7.065 -14.980 -20.151 1.00 83.23 222 A 1 ATOM 1773 C C . LYS A 1 222 ? -7.026 -16.454 -19.704 1.00 84.82 222 A 1 ATOM 1774 O O . LYS A 1 222 ? -8.007 -17.189 -19.851 1.00 81.14 222 A 1 ATOM 1775 C CB . LYS A 1 222 ? -8.381 -14.605 -20.859 1.00 82.86 222 A 1 ATOM 1776 C CG . LYS A 1 222 ? -8.511 -13.098 -21.128 1.00 85.33 222 A 1 ATOM 1777 C CD . LYS A 1 222 ? -9.850 -12.802 -21.812 1.00 79.93 222 A 1 ATOM 1778 C CE . LYS A 1 222 ? -9.976 -11.305 -22.092 1.00 77.75 222 A 1 ATOM 1779 N NZ . LYS A 1 222 ? -11.268 -10.983 -22.743 1.00 65.96 222 A 1 ATOM 1780 N N . LYS A 1 223 ? -5.887 -16.899 -19.153 1.00 86.22 223 A 1 ATOM 1781 C CA . LYS A 1 223 ? -5.709 -18.267 -18.629 1.00 84.48 223 A 1 ATOM 1782 C C . LYS A 1 223 ? -6.087 -18.339 -17.145 1.00 86.22 223 A 1 ATOM 1783 O O . LYS A 1 223 ? -5.222 -18.431 -16.285 1.00 84.90 223 A 1 ATOM 1784 C CB . LYS A 1 223 ? -4.285 -18.783 -18.915 1.00 83.40 223 A 1 ATOM 1785 C CG . LYS A 1 223 ? -3.965 -18.910 -20.414 1.00 87.29 223 A 1 ATOM 1786 C CD . LYS A 1 223 ? -4.943 -19.822 -21.162 1.00 83.51 223 A 1 ATOM 1787 C CE . LYS A 1 223 ? -4.533 -19.961 -22.628 1.00 83.02 223 A 1 ATOM 1788 N NZ . LYS A 1 223 ? -5.514 -20.761 -23.395 1.00 75.51 223 A 1 ATOM 1789 N N . HIS A 1 224 ? -7.394 -18.275 -16.861 1.00 90.63 224 A 1 ATOM 1790 C CA . HIS A 1 224 ? -7.943 -18.387 -15.507 1.00 88.65 224 A 1 ATOM 1791 C C . HIS A 1 224 ? -7.550 -19.718 -14.853 1.00 89.16 224 A 1 ATOM 1792 O O . HIS A 1 224 ? -7.611 -20.765 -15.501 1.00 85.00 224 A 1 ATOM 1793 C CB . HIS A 1 224 ? -9.470 -18.249 -15.551 1.00 85.76 224 A 1 ATOM 1794 C CG . HIS A 1 224 ? -9.927 -16.913 -16.080 1.00 81.07 224 A 1 ATOM 1795 N ND1 . HIS A 1 224 ? -9.873 -15.719 -15.405 1.00 68.71 224 A 1 ATOM 1796 C CD2 . HIS A 1 224 ? -10.454 -16.654 -17.321 1.00 68.89 224 A 1 ATOM 1797 C CE1 . HIS A 1 224 ? -10.356 -14.763 -16.219 1.00 67.68 224 A 1 ATOM 1798 N NE2 . HIS A 1 224 ? -10.721 -15.282 -17.399 1.00 68.32 224 A 1 ATOM 1799 N N . GLY A 1 225 ? -7.164 -19.667 -13.575 1.00 88.21 225 A 1 ATOM 1800 C CA . GLY A 1 225 ? -6.735 -20.832 -12.796 1.00 88.03 225 A 1 ATOM 1801 C C . GLY A 1 225 ? -5.332 -21.356 -13.122 1.00 90.88 225 A 1 ATOM 1802 O O . GLY A 1 225 ? -4.912 -22.356 -12.548 1.00 88.51 225 A 1 ATOM 1803 N N . ALA A 1 226 ? -4.594 -20.719 -14.034 1.00 91.49 226 A 1 ATOM 1804 C CA . ALA A 1 226 ? -3.194 -21.067 -14.259 1.00 91.75 226 A 1 ATOM 1805 C C . ALA A 1 226 ? -2.347 -20.623 -13.056 1.00 92.53 226 A 1 ATOM 1806 O O . ALA A 1 226 ? -2.273 -19.434 -12.743 1.00 91.95 226 A 1 ATOM 1807 C CB . ALA A 1 226 ? -2.698 -20.439 -15.570 1.00 91.14 226 A 1 ATOM 1808 N N . THR A 1 227 ? -1.685 -21.589 -12.412 1.00 95.91 227 A 1 ATOM 1809 C CA . THR A 1 227 ? -0.794 -21.346 -11.274 1.00 95.97 227 A 1 ATOM 1810 C C . THR A 1 227 ? 0.659 -21.469 -11.713 1.00 96.61 227 A 1 ATOM 1811 O O . THR A 1 227 ? 1.044 -22.454 -12.344 1.00 95.43 227 A 1 ATOM 1812 C CB . THR A 1 227 ? -1.101 -22.312 -10.122 1.00 94.28 227 A 1 ATOM 1813 O OG1 . THR A 1 227 ? -2.460 -22.218 -9.769 1.00 81.75 227 A 1 ATOM 1814 C CG2 . THR A 1 227 ? -0.302 -21.998 -8.856 1.00 80.32 227 A 1 ATOM 1815 N N . THR A 1 228 ? 1.467 -20.478 -11.355 1.00 97.04 228 A 1 ATOM 1816 C CA . THR A 1 228 ? 2.923 -20.515 -11.517 1.00 97.20 228 A 1 ATOM 1817 C C . THR A 1 228 ? 3.559 -20.979 -10.215 1.00 97.50 228 A 1 ATOM 1818 O O . THR A 1 228 ? 3.206 -20.489 -9.146 1.00 97.40 228 A 1 ATOM 1819 C CB . THR A 1 228 ? 3.469 -19.143 -11.937 1.00 96.94 228 A 1 ATOM 1820 O OG1 . THR A 1 228 ? 2.858 -18.753 -13.147 1.00 94.18 228 A 1 ATOM 1821 C CG2 . THR A 1 228 ? 4.976 -19.152 -12.190 1.00 94.04 228 A 1 ATOM 1822 N N . VAL A 1 229 ? 4.509 -21.914 -10.312 1.00 97.95 229 A 1 ATOM 1823 C CA . VAL A 1 229 ? 5.301 -22.398 -9.174 1.00 97.96 229 A 1 ATOM 1824 C C . VAL A 1 229 ? 6.757 -22.012 -9.392 1.00 98.20 229 A 1 ATOM 1825 O O . VAL A 1 229 ? 7.330 -22.315 -10.437 1.00 97.95 229 A 1 ATOM 1826 C CB . VAL A 1 229 ? 5.152 -23.921 -8.966 1.00 97.45 229 A 1 ATOM 1827 C CG1 . VAL A 1 229 ? 5.903 -24.384 -7.708 1.00 96.07 229 A 1 ATOM 1828 C CG2 . VAL A 1 229 ? 3.679 -24.328 -8.817 1.00 96.01 229 A 1 ATOM 1829 N N . THR A 1 230 ? 7.355 -21.363 -8.398 1.00 98.44 230 A 1 ATOM 1830 C CA . THR A 1 230 ? 8.795 -21.078 -8.353 1.00 98.58 230 A 1 ATOM 1831 C C . THR A 1 230 ? 9.390 -21.671 -7.086 1.00 98.58 230 A 1 ATOM 1832 O O . THR A 1 230 ? 8.717 -21.756 -6.059 1.00 98.47 230 A 1 ATOM 1833 C CB . THR A 1 230 ? 9.103 -19.576 -8.435 1.00 98.58 230 A 1 ATOM 1834 O OG1 . THR A 1 230 ? 8.409 -18.872 -7.435 1.00 97.86 230 A 1 ATOM 1835 C CG2 . THR A 1 230 ? 8.691 -18.989 -9.778 1.00 97.46 230 A 1 ATOM 1836 N N . SER A 1 231 ? 10.640 -22.094 -7.136 1.00 98.26 231 A 1 ATOM 1837 C CA . SER A 1 231 ? 11.326 -22.664 -5.979 1.00 98.03 231 A 1 ATOM 1838 C C . SER A 1 231 ? 12.781 -22.221 -5.917 1.00 98.24 231 A 1 ATOM 1839 O O . SER A 1 231 ? 13.460 -22.156 -6.943 1.00 97.79 231 A 1 ATOM 1840 C CB . SER A 1 231 ? 11.227 -24.194 -5.980 1.00 96.94 231 A 1 ATOM 1841 O OG . SER A 1 231 ? 11.935 -24.746 -7.075 1.00 94.00 231 A 1 ATOM 1842 N N . THR A 1 232 ? 13.264 -21.974 -4.706 1.00 98.19 232 A 1 ATOM 1843 C CA . THR A 1 232 ? 14.676 -21.715 -4.423 1.00 98.32 232 A 1 ATOM 1844 C C . THR A 1 232 ? 15.127 -22.622 -3.286 1.00 98.40 232 A 1 ATOM 1845 O O . THR A 1 232 ? 14.502 -22.654 -2.230 1.00 98.03 232 A 1 ATOM 1846 C CB . THR A 1 232 ? 14.907 -20.239 -4.085 1.00 98.09 232 A 1 ATOM 1847 O OG1 . THR A 1 232 ? 14.644 -19.454 -5.226 1.00 95.22 232 A 1 ATOM 1848 C CG2 . THR A 1 232 ? 16.352 -19.944 -3.706 1.00 94.84 232 A 1 ATOM 1849 N N . MET A 1 233 ? 16.210 -23.355 -3.504 1.00 97.79 233 A 1 ATOM 1850 C CA . MET A 1 233 ? 16.808 -24.300 -2.565 1.00 97.39 233 A 1 ATOM 1851 C C . MET A 1 233 ? 18.235 -23.851 -2.224 1.00 97.37 233 A 1 ATOM 1852 O O . MET A 1 233 ? 18.947 -23.323 -3.088 1.00 96.00 233 A 1 ATOM 1853 C CB . MET A 1 233 ? 16.815 -25.716 -3.169 1.00 96.00 233 A 1 ATOM 1854 C CG . MET A 1 233 ? 15.441 -26.207 -3.660 1.00 93.76 233 A 1 ATOM 1855 S SD . MET A 1 233 ? 14.184 -26.378 -2.368 1.00 93.76 233 A 1 ATOM 1856 C CE . MET A 1 233 ? 12.752 -26.844 -3.368 1.00 87.81 233 A 1 ATOM 1857 N N . ARG A 1 234 ? 18.652 -24.049 -0.969 1.00 97.37 234 A 1 ATOM 1858 C CA . ARG A 1 234 ? 20.020 -23.810 -0.480 1.00 96.90 234 A 1 ATOM 1859 C C . ARG A 1 234 ? 20.451 -24.951 0.441 1.00 97.07 234 A 1 ATOM 1860 O O . ARG A 1 234 ? 19.603 -25.593 1.059 1.00 96.10 234 A 1 ATOM 1861 C CB . ARG A 1 234 ? 20.106 -22.469 0.287 1.00 96.28 234 A 1 ATOM 1862 C CG . ARG A 1 234 ? 19.660 -21.219 -0.491 1.00 95.15 234 A 1 ATOM 1863 C CD . ARG A 1 234 ? 20.652 -20.803 -1.567 1.00 93.73 234 A 1 ATOM 1864 N NE . ARG A 1 234 ? 20.196 -19.596 -2.273 1.00 93.57 234 A 1 ATOM 1865 C CZ . ARG A 1 234 ? 19.598 -19.528 -3.448 1.00 93.25 234 A 1 ATOM 1866 N NH1 . ARG A 1 234 ? 19.323 -20.594 -4.153 1.00 88.25 234 A 1 ATOM 1867 N NH2 . ARG A 1 234 ? 19.266 -18.368 -3.933 1.00 89.65 234 A 1 ATOM 1868 N N . GLY A 1 235 ? 21.750 -25.167 0.553 1.00 95.86 235 A 1 ATOM 1869 C CA . GLY A 1 235 ? 22.336 -26.198 1.417 1.00 95.74 235 A 1 ATOM 1870 C C . GLY A 1 235 ? 21.853 -27.608 1.061 1.00 96.38 235 A 1 ATOM 1871 O O . GLY A 1 235 ? 21.701 -27.933 -0.118 1.00 95.20 235 A 1 ATOM 1872 N N . LEU A 1 236 ? 21.547 -28.426 2.075 1.00 95.80 236 A 1 ATOM 1873 C CA . LEU A 1 236 ? 21.163 -29.830 1.884 1.00 95.61 236 A 1 ATOM 1874 C C . LEU A 1 236 ? 20.009 -30.010 0.879 1.00 96.29 236 A 1 ATOM 1875 O O . LEU A 1 236 ? 20.038 -30.933 0.072 1.00 95.24 236 A 1 ATOM 1876 C CB . LEU A 1 236 ? 20.797 -30.436 3.254 1.00 94.48 236 A 1 ATOM 1877 C CG . LEU A 1 236 ? 20.560 -31.961 3.230 1.00 89.10 236 A 1 ATOM 1878 C CD1 . LEU A 1 236 ? 21.856 -32.722 2.957 1.00 81.37 236 A 1 ATOM 1879 C CD2 . LEU A 1 236 ? 20.009 -32.419 4.578 1.00 82.02 236 A 1 ATOM 1880 N N . PHE A 1 237 ? 19.006 -29.100 0.859 1.00 96.48 237 A 1 ATOM 1881 C CA . PHE A 1 237 ? 17.923 -29.187 -0.132 1.00 96.62 237 A 1 ATOM 1882 C C . PHE A 1 237 ? 18.388 -28.909 -1.569 1.00 96.66 237 A 1 ATOM 1883 O O . PHE A 1 237 ? 17.722 -29.333 -2.512 1.00 95.62 237 A 1 ATOM 1884 C CB . PHE A 1 237 ? 16.774 -28.240 0.228 1.00 96.41 237 A 1 ATOM 1885 C CG . PHE A 1 237 ? 16.026 -28.574 1.502 1.00 96.85 237 A 1 ATOM 1886 C CD1 . PHE A 1 237 ? 15.561 -29.881 1.741 1.00 95.40 237 A 1 ATOM 1887 C CD2 . PHE A 1 237 ? 15.762 -27.560 2.437 1.00 95.83 237 A 1 ATOM 1888 C CE1 . PHE A 1 237 ? 14.865 -30.178 2.923 1.00 94.80 237 A 1 ATOM 1889 C CE2 . PHE A 1 237 ? 15.064 -27.852 3.615 1.00 95.08 237 A 1 ATOM 1890 C CZ . PHE A 1 237 ? 14.626 -29.162 3.866 1.00 95.83 237 A 1 ATOM 1891 N N . GLN A 1 238 ? 19.485 -28.197 -1.768 1.00 96.65 238 A 1 ATOM 1892 C CA . GLN A 1 238 ? 20.081 -28.017 -3.086 1.00 96.30 238 A 1 ATOM 1893 C C . GLN A 1 238 ? 20.852 -29.271 -3.520 1.00 96.48 238 A 1 ATOM 1894 O O . GLN A 1 238 ? 20.708 -29.703 -4.669 1.00 95.25 238 A 1 ATOM 1895 C CB . GLN A 1 238 ? 20.962 -26.761 -3.067 1.00 95.38 238 A 1 ATOM 1896 C CG . GLN A 1 238 ? 21.545 -26.444 -4.447 1.00 92.91 238 A 1 ATOM 1897 C CD . GLN A 1 238 ? 22.301 -25.121 -4.482 1.00 90.79 238 A 1 ATOM 1898 O OE1 . GLN A 1 238 ? 22.203 -24.264 -3.617 1.00 83.03 238 A 1 ATOM 1899 N NE2 . GLN A 1 238 ? 23.061 -24.878 -5.519 1.00 80.59 238 A 1 ATOM 1900 N N . ASP A 1 239 ? 21.577 -29.873 -2.590 1.00 96.14 239 A 1 ATOM 1901 C CA . ASP A 1 239 ? 22.573 -30.906 -2.884 1.00 95.90 239 A 1 ATOM 1902 C C . ASP A 1 239 ? 21.985 -32.329 -2.852 1.00 96.33 239 A 1 ATOM 1903 O O . ASP A 1 239 ? 22.332 -33.161 -3.694 1.00 94.66 239 A 1 ATOM 1904 C CB . ASP A 1 239 ? 23.757 -30.722 -1.919 1.00 94.90 239 A 1 ATOM 1905 C CG . ASP A 1 239 ? 24.426 -29.338 -2.032 1.00 92.92 239 A 1 ATOM 1906 O OD1 . ASP A 1 239 ? 24.339 -28.716 -3.121 1.00 88.79 239 A 1 ATOM 1907 O OD2 . ASP A 1 239 ? 25.013 -28.893 -1.022 1.00 89.26 239 A 1 ATOM 1908 N N . ASP A 1 240 ? 21.012 -32.617 -1.950 1.00 95.68 240 A 1 ATOM 1909 C CA . ASP A 1 240 ? 20.406 -33.937 -1.766 1.00 95.56 240 A 1 ATOM 1910 C C . ASP A 1 240 ? 19.002 -34.047 -2.392 1.00 95.80 240 A 1 ATOM 1911 O O . ASP A 1 240 ? 18.031 -33.383 -2.013 1.00 94.67 240 A 1 ATOM 1912 C CB . ASP A 1 240 ? 20.432 -34.317 -0.275 1.00 94.62 240 A 1 ATOM 1913 C CG . ASP A 1 240 ? 20.012 -35.774 -0.018 1.00 93.73 240 A 1 ATOM 1914 O OD1 . ASP A 1 240 ? 19.413 -36.403 -0.924 1.00 88.42 240 A 1 ATOM 1915 O OD2 . ASP A 1 240 ? 20.266 -36.266 1.097 1.00 87.49 240 A 1 ATOM 1916 N N . ALA A 1 241 ? 18.865 -34.930 -3.371 1.00 96.15 241 A 1 ATOM 1917 C CA . ALA A 1 241 ? 17.599 -35.217 -4.040 1.00 95.91 241 A 1 ATOM 1918 C C . ALA A 1 241 ? 16.586 -35.949 -3.143 1.00 95.99 241 A 1 ATOM 1919 O O . ALA A 1 241 ? 15.381 -35.768 -3.330 1.00 94.78 241 A 1 ATOM 1920 C CB . ALA A 1 241 ? 17.890 -36.022 -5.315 1.00 94.92 241 A 1 ATOM 1921 N N . SER A 1 242 ? 17.038 -36.762 -2.181 1.00 95.49 242 A 1 ATOM 1922 C CA . SER A 1 242 ? 16.169 -37.481 -1.242 1.00 94.94 242 A 1 ATOM 1923 C C . SER A 1 242 ? 15.515 -36.509 -0.262 1.00 95.06 242 A 1 ATOM 1924 O O . SER A 1 242 ? 14.291 -36.505 -0.134 1.00 93.77 242 A 1 ATOM 1925 C CB . SER A 1 242 ? 16.965 -38.551 -0.488 1.00 93.88 242 A 1 ATOM 1926 O OG . SER A 1 242 ? 16.081 -39.384 0.231 1.00 80.35 242 A 1 ATOM 1927 N N . ALA A 1 243 ? 16.294 -35.599 0.325 1.00 94.76 243 A 1 ATOM 1928 C CA . ALA A 1 243 ? 15.790 -34.544 1.205 1.00 94.38 243 A 1 ATOM 1929 C C . ALA A 1 243 ? 14.765 -33.638 0.492 1.00 95.10 243 A 1 ATOM 1930 O O . ALA A 1 243 ? 13.701 -33.329 1.037 1.00 94.52 243 A 1 ATOM 1931 C CB . ALA A 1 243 ? 16.993 -33.738 1.715 1.00 93.60 243 A 1 ATOM 1932 N N . ARG A 1 244 ? 15.015 -33.272 -0.767 1.00 96.08 244 A 1 ATOM 1933 C CA . ARG A 1 244 ? 14.028 -32.544 -1.588 1.00 95.97 244 A 1 ATOM 1934 C C . ARG A 1 244 ? 12.744 -33.335 -1.808 1.00 96.53 244 A 1 ATOM 1935 O O . ARG A 1 244 ? 11.658 -32.760 -1.750 1.00 96.38 244 A 1 ATOM 1936 C CB . ARG A 1 244 ? 14.604 -32.172 -2.960 1.00 94.36 244 A 1 ATOM 1937 C CG . ARG A 1 244 ? 15.593 -31.018 -2.889 1.00 89.76 244 A 1 ATOM 1938 C CD . ARG A 1 244 ? 15.881 -30.454 -4.278 1.00 90.50 244 A 1 ATOM 1939 N NE . ARG A 1 244 ? 16.442 -31.450 -5.225 1.00 86.19 244 A 1 ATOM 1940 C CZ . ARG A 1 244 ? 17.707 -31.816 -5.320 1.00 87.27 244 A 1 ATOM 1941 N NH1 . ARG A 1 244 ? 18.619 -31.389 -4.518 1.00 75.26 244 A 1 ATOM 1942 N NH2 . ARG A 1 244 ? 18.094 -32.630 -6.254 1.00 76.76 244 A 1 ATOM 1943 N N . ALA A 1 245 ? 12.839 -34.622 -2.102 1.00 96.30 245 A 1 ATOM 1944 C CA . ALA A 1 245 ? 11.675 -35.465 -2.353 1.00 96.08 245 A 1 ATOM 1945 C C . ALA A 1 245 ? 10.793 -35.596 -1.104 1.00 96.30 245 A 1 ATOM 1946 O O . ALA A 1 245 ? 9.570 -35.474 -1.214 1.00 95.75 245 A 1 ATOM 1947 C CB . ALA A 1 245 ? 12.141 -36.827 -2.877 1.00 95.66 245 A 1 ATOM 1948 N N . GLU A 1 246 ? 11.391 -35.775 0.073 1.00 95.52 246 A 1 ATOM 1949 C CA . GLU A 1 246 ? 10.688 -35.792 1.360 1.00 95.19 246 A 1 ATOM 1950 C C . GLU A 1 246 ? 9.943 -34.475 1.608 1.00 95.86 246 A 1 ATOM 1951 O O . GLU A 1 246 ? 8.726 -34.477 1.830 1.00 95.47 246 A 1 ATOM 1952 C CB . GLU A 1 246 ? 11.696 -36.079 2.482 1.00 94.35 246 A 1 ATOM 1953 C CG . GLU A 1 246 ? 10.998 -36.187 3.846 1.00 87.91 246 A 1 ATOM 1954 C CD . GLU A 1 246 ? 11.969 -36.419 5.011 1.00 83.90 246 A 1 ATOM 1955 O OE1 . GLU A 1 246 ? 11.467 -36.376 6.157 1.00 73.93 246 A 1 ATOM 1956 O OE2 . GLU A 1 246 ? 13.170 -36.642 4.748 1.00 76.73 246 A 1 ATOM 1957 N N . LEU A 1 247 ? 10.624 -33.334 1.473 1.00 96.26 247 A 1 ATOM 1958 C CA . LEU A 1 247 ? 10.015 -32.010 1.617 1.00 96.70 247 A 1 ATOM 1959 C C . LEU A 1 247 ? 8.804 -31.827 0.691 1.00 97.11 247 A 1 ATOM 1960 O O . LEU A 1 247 ? 7.730 -31.405 1.130 1.00 96.69 247 A 1 ATOM 1961 C CB . LEU A 1 247 ? 11.089 -30.939 1.340 1.00 96.54 247 A 1 ATOM 1962 C CG . LEU A 1 247 ? 10.516 -29.515 1.262 1.00 96.14 247 A 1 ATOM 1963 C CD1 . LEU A 1 247 ? 9.857 -29.087 2.571 1.00 93.34 247 A 1 ATOM 1964 C CD2 . LEU A 1 247 ? 11.624 -28.529 0.914 1.00 93.71 247 A 1 ATOM 1965 N N . LEU A 1 248 ? 8.939 -32.158 -0.587 1.00 96.72 248 A 1 ATOM 1966 C CA . LEU A 1 248 ? 7.853 -32.009 -1.560 1.00 96.14 248 A 1 ATOM 1967 C C . LEU A 1 248 ? 6.656 -32.917 -1.244 1.00 96.33 248 A 1 ATOM 1968 O O . LEU A 1 248 ? 5.520 -32.552 -1.544 1.00 95.55 248 A 1 ATOM 1969 C CB . LEU A 1 248 ? 8.391 -32.284 -2.974 1.00 95.56 248 A 1 ATOM 1970 C CG . LEU A 1 248 ? 9.356 -31.215 -3.521 1.00 94.00 248 A 1 ATOM 1971 C CD1 . LEU A 1 248 ? 9.916 -31.687 -4.864 1.00 90.47 248 A 1 ATOM 1972 C CD2 . LEU A 1 248 ? 8.678 -29.861 -3.734 1.00 91.02 248 A 1 ATOM 1973 N N . GLN A 1 249 ? 6.870 -34.089 -0.626 1.00 97.00 249 A 1 ATOM 1974 C CA . GLN A 1 249 ? 5.783 -34.946 -0.145 1.00 96.52 249 A 1 ATOM 1975 C C . GLN A 1 249 ? 5.046 -34.325 1.048 1.00 96.43 249 A 1 ATOM 1976 O O . GLN A 1 249 ? 3.824 -34.427 1.110 1.00 95.02 249 A 1 ATOM 1977 C CB . GLN A 1 249 ? 6.316 -36.326 0.248 1.00 96.27 249 A 1 ATOM 1978 C CG . GLN A 1 249 ? 6.687 -37.196 -0.963 1.00 85.52 249 A 1 ATOM 1979 C CD . GLN A 1 249 ? 7.233 -38.561 -0.544 1.00 77.12 249 A 1 ATOM 1980 O OE1 . GLN A 1 249 ? 7.223 -38.949 0.613 1.00 69.65 249 A 1 ATOM 1981 N NE2 . GLN A 1 249 ? 7.692 -39.366 -1.470 1.00 65.22 249 A 1 ATOM 1982 N N . LEU A 1 250 ? 5.747 -33.669 1.974 1.00 96.52 250 A 1 ATOM 1983 C CA . LEU A 1 250 ? 5.148 -32.985 3.123 1.00 96.05 250 A 1 ATOM 1984 C C . LEU A 1 250 ? 4.334 -31.750 2.715 1.00 95.98 250 A 1 ATOM 1985 O O . LEU A 1 250 ? 3.284 -31.488 3.301 1.00 94.64 250 A 1 ATOM 1986 C CB . LEU A 1 250 ? 6.258 -32.596 4.116 1.00 96.14 250 A 1 ATOM 1987 C CG . LEU A 1 250 ? 6.937 -33.785 4.820 1.00 95.08 250 A 1 ATOM 1988 C CD1 . LEU A 1 250 ? 8.111 -33.272 5.644 1.00 92.39 250 A 1 ATOM 1989 C CD2 . LEU A 1 250 ? 5.974 -34.519 5.758 1.00 92.73 250 A 1 ATOM 1990 N N . ILE A 1 251 ? 4.769 -31.018 1.689 1.00 96.48 251 A 1 ATOM 1991 C CA . ILE A 1 251 ? 4.027 -29.858 1.165 1.00 95.72 251 A 1 ATOM 1992 C C . ILE A 1 251 ? 2.713 -30.286 0.500 1.00 94.65 251 A 1 ATOM 1993 O O . ILE A 1 251 ? 1.704 -29.601 0.652 1.00 92.00 251 A 1 ATOM 1994 C CB . ILE A 1 251 ? 4.928 -29.031 0.221 1.00 95.59 251 A 1 ATOM 1995 C CG1 . ILE A 1 251 ? 6.045 -28.350 1.043 1.00 94.04 251 A 1 ATOM 1996 C CG2 . ILE A 1 251 ? 4.115 -27.969 -0.547 1.00 93.58 251 A 1 ATOM 1997 C CD1 . ILE A 1 251 ? 7.139 -27.701 0.194 1.00 91.57 251 A 1 ATOM 1998 N N . LYS A 1 252 ? 2.695 -31.428 -0.204 1.00 93.70 252 A 1 ATOM 1999 C CA . LYS A 1 252 ? 1.507 -31.931 -0.922 1.00 90.14 252 A 1 ATOM 2000 C C . LYS A 1 252 ? 0.382 -32.440 -0.014 1.00 87.74 252 A 1 ATOM 2001 O O . LYS A 1 252 ? -0.745 -32.560 -0.491 1.00 81.08 252 A 1 ATOM 2002 C CB . LYS A 1 252 ? 1.921 -33.062 -1.870 1.00 88.16 252 A 1 ATOM 2003 C CG . LYS A 1 252 ? 2.600 -32.535 -3.136 1.00 81.26 252 A 1 ATOM 2004 C CD . LYS A 1 252 ? 3.052 -33.719 -3.995 1.00 75.97 252 A 1 ATOM 2005 C CE . LYS A 1 252 ? 3.751 -33.201 -5.253 1.00 70.27 252 A 1 ATOM 2006 N NZ . LYS A 1 252 ? 4.166 -34.321 -6.133 1.00 61.94 252 A 1 ATOM 2007 N N . LYS A 1 253 ? 0.676 -32.810 1.241 1.00 90.47 253 A 1 ATOM 2008 C CA . LYS A 1 253 ? -0.309 -33.235 2.249 1.00 85.50 253 A 1 ATOM 2009 C C . LYS A 1 253 ? -1.010 -32.026 2.869 1.00 76.76 253 A 1 ATOM 2010 O O . LYS A 1 253 ? -2.208 -32.147 3.158 1.00 69.91 253 A 1 ATOM 2011 C CB . LYS A 1 253 ? 0.382 -34.053 3.343 1.00 82.05 253 A 1 ATOM 2012 C CG . LYS A 1 253 ? 0.849 -35.437 2.878 1.00 77.50 253 A 1 ATOM 2013 C CD . LYS A 1 253 ? 1.578 -36.139 4.025 1.00 71.88 253 A 1 ATOM 2014 C CE . LYS A 1 253 ? 2.096 -37.509 3.592 1.00 68.75 253 A 1 ATOM 2015 N NZ . LYS A 1 253 ? 2.826 -38.179 4.697 1.00 59.44 253 A 1 ATOM 2016 O OXT . LYS A 1 253 ? -0.311 -31.026 3.091 1.00 72.67 253 A 1 #