# 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_vcrx089 # _entry.id vcrx089 # 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" "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 SER 2 1 n GLN 3 1 n TYR 4 1 n SER 5 1 n GLN 6 1 n PHE 7 1 n SER 8 1 n VAL 9 1 n SER 10 1 n LYS 11 1 n VAL 12 1 n PHE 13 1 n GLY 14 1 n MET 15 1 n PRO 16 1 n SER 17 1 n ILE 18 1 n PRO 19 1 n GLU 20 1 n LYS 21 1 n VAL 22 1 n THR 23 1 n ALA 24 1 n ILE 25 1 n GLY 26 1 n TYR 27 1 n ALA 28 1 n ASP 29 1 n GLY 30 1 n SER 31 1 n ASN 32 1 n PRO 33 1 n PHE 34 1 n ILE 35 1 n PRO 36 1 n ALA 37 1 n THR 38 1 n ASP 39 1 n THR 40 1 n ASN 41 1 n TYR 42 1 n VAL 43 1 n PHE 44 1 n ARG 45 1 n LYS 46 1 n GLU 47 1 n PHE 48 1 n LEU 49 1 n ARG 50 1 n GLU 51 1 n VAL 52 1 n LEU 53 1 n ALA 54 1 n TYR 55 1 n LEU 56 1 n LYS 57 1 n GLU 58 1 n PRO 59 1 n GLY 60 1 n GLY 61 1 n ASP 62 1 n ALA 63 1 n LEU 64 1 n PHE 65 1 n VAL 66 1 n THR 67 1 n GLY 68 1 n PRO 69 1 n THR 70 1 n GLY 71 1 n SER 72 1 n GLY 73 1 n LYS 74 1 n THR 75 1 n SER 76 1 n GLY 77 1 n ILE 78 1 n THR 79 1 n GLU 80 1 n ILE 81 1 n ALA 82 1 n GLY 83 1 n ARG 84 1 n LEU 85 1 n ASN 86 1 n TRP 87 1 n PRO 88 1 n VAL 89 1 n GLN 90 1 n GLN 91 1 n ILE 92 1 n THR 93 1 n ALA 94 1 n HIS 95 1 n GLY 96 1 n ARG 97 1 n MET 98 1 n GLU 99 1 n LEU 100 1 n THR 101 1 n ASP 102 1 n LEU 103 1 n ILE 104 1 n GLY 105 1 n HIS 106 1 n HIS 107 1 n ALA 108 1 n LEU 109 1 n VAL 110 1 n ALA 111 1 n GLU 112 1 n LYS 113 1 n PRO 114 1 n GLY 115 1 n GLN 116 1 n PRO 117 1 n PRO 118 1 n VAL 119 1 n MET 120 1 n LYS 121 1 n PHE 122 1 n MET 123 1 n TYR 124 1 n GLY 125 1 n PRO 126 1 n LEU 127 1 n ALA 128 1 n VAL 129 1 n ALA 130 1 n MET 131 1 n ARG 132 1 n GLU 133 1 n GLY 134 1 n HIS 135 1 n LEU 136 1 n PHE 137 1 n LEU 138 1 n ILE 139 1 n ASN 140 1 n GLU 141 1 n VAL 142 1 n ASP 143 1 n LEU 144 1 n ALA 145 1 n ASP 146 1 n PRO 147 1 n ALA 148 1 n GLU 149 1 n LEU 150 1 n ALA 151 1 n GLY 152 1 n LEU 153 1 n ASN 154 1 n ASP 155 1 n VAL 156 1 n LEU 157 1 n GLU 158 1 n GLY 159 1 n ARG 160 1 n PRO 161 1 n LEU 162 1 n VAL 163 1 n ILE 164 1 n ALA 165 1 n GLN 166 1 n ASN 167 1 n GLY 168 1 n GLY 169 1 n GLU 170 1 n ILE 171 1 n ILE 172 1 n LYS 173 1 n PRO 174 1 n HIS 175 1 n PRO 176 1 n MET 177 1 n PHE 178 1 n ARG 179 1 n VAL 180 1 n VAL 181 1 n VAL 182 1 n THR 183 1 n GLY 184 1 n ASN 185 1 n SER 186 1 n THR 187 1 n GLY 188 1 n SER 189 1 n GLY 190 1 n ASP 191 1 n ALA 192 1 n SER 193 1 n GLY 194 1 n LEU 195 1 n TYR 196 1 n GLN 197 1 n GLY 198 1 n VAL 199 1 n MET 200 1 n MET 201 1 n GLN 202 1 n ASN 203 1 n LEU 204 1 n ALA 205 1 n ALA 206 1 n MET 207 1 n ASP 208 1 n ARG 209 1 n TYR 210 1 n ARG 211 1 n PHE 212 1 n THR 213 1 n LYS 214 1 n VAL 215 1 n GLY 216 1 n TYR 217 1 n ALA 218 1 n ASP 219 1 n GLU 220 1 n GLU 221 1 n ALA 222 1 n GLU 223 1 n LEU 224 1 n SER 225 1 n ILE 226 1 n LEU 227 1 n GLY 228 1 n ARG 229 1 n VAL 230 1 n THR 231 1 n PRO 232 1 n LYS 233 1 n LEU 234 1 n PRO 235 1 n GLU 236 1 n ASN 237 1 n VAL 238 1 n ARG 239 1 n LYS 240 1 n GLY 241 1 n MET 242 1 n VAL 243 1 n ARG 244 1 n ILE 245 1 n ALA 246 1 n ASN 247 1 n GLN 248 1 n VAL 249 1 n ARG 250 1 n LYS 251 1 n LEU 252 1 n PHE 253 1 n LEU 254 1 n GLY 255 1 n GLU 256 1 n ASN 257 1 n GLY 258 1 n GLU 259 1 n ASP 260 1 n GLY 261 1 n GLN 262 1 n ILE 263 1 n SER 264 1 n VAL 265 1 n THR 266 1 n MET 267 1 n SER 268 1 n THR 269 1 n ARG 270 1 n THR 271 1 n LEU 272 1 n VAL 273 1 n ARG 274 1 n TRP 275 1 n ALA 276 1 n LYS 277 1 n LEU 278 1 n SER 279 1 n LEU 280 1 n ALA 281 1 n PHE 282 1 n ARG 283 1 n GLY 284 1 n ALA 285 1 n PRO 286 1 n ASN 287 1 n ALA 288 1 n LEU 289 1 n GLU 290 1 n TYR 291 1 n ALA 292 1 n LEU 293 1 n ASP 294 1 n GLN 295 1 n ALA 296 1 n LEU 297 1 n LEU 298 1 n ILE 299 1 n ARG 300 1 n ALA 301 1 n ALA 302 1 n LYS 303 1 n GLU 304 1 n GLU 305 1 n ARG 306 1 n GLU 307 1 n ALA 308 1 n ILE 309 1 n LEU 310 1 n ARG 311 1 n VAL 312 1 n ALA 313 1 n LYS 314 1 n ASP 315 1 n VAL 316 1 n PHE 317 1 n GLY 318 1 n ASP 319 1 n GLN 320 1 n TRP 321 1 n ARG 322 # _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 01:36:29)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 87.79 _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 59.22 1 1 A SER 2 2 77.74 1 2 A GLN 3 2 81.27 1 3 A TYR 4 2 92.36 1 4 A SER 5 2 93.83 1 5 A GLN 6 2 92.01 1 6 A PHE 7 2 97.49 1 7 A SER 8 2 97.03 1 8 A VAL 9 2 97.17 1 9 A SER 10 2 95.54 1 10 A LYS 11 2 89.94 1 11 A VAL 12 2 95.05 1 12 A PHE 13 2 97.26 1 13 A GLY 14 2 94.55 1 14 A MET 15 2 91.36 1 15 A PRO 16 2 93.72 1 16 A SER 17 2 93.29 1 17 A ILE 18 2 93.55 1 18 A PRO 19 2 94.89 1 19 A GLU 20 2 87.14 1 20 A LYS 21 2 85.88 1 21 A VAL 22 2 95.35 1 22 A THR 23 2 96.18 1 23 A ALA 24 2 97.29 1 24 A ILE 25 2 92.58 1 25 A GLY 26 2 97.48 1 26 A TYR 27 2 97.34 1 27 A ALA 28 2 96.36 1 28 A ASP 29 2 92.75 1 29 A GLY 30 2 95.87 1 30 A SER 31 2 96.08 1 31 A ASN 32 2 96.24 1 32 A PRO 33 2 97.11 1 33 A PHE 34 2 96.66 1 34 A ILE 35 2 97.74 1 35 A PRO 36 2 97.89 1 36 A ALA 37 2 97.35 1 37 A THR 38 2 95.23 1 38 A ASP 39 2 92.40 1 39 A THR 40 2 90.50 1 40 A ASN 41 2 88.25 1 41 A TYR 42 2 94.12 1 42 A VAL 43 2 93.04 1 43 A PHE 44 2 94.99 1 44 A ARG 45 2 87.10 1 45 A LYS 46 2 86.90 1 46 A GLU 47 2 84.33 1 47 A PHE 48 2 96.44 1 48 A LEU 49 2 97.32 1 49 A ARG 50 2 89.14 1 50 A GLU 51 2 95.09 1 51 A VAL 52 2 98.27 1 52 A LEU 53 2 97.92 1 53 A ALA 54 2 97.86 1 54 A TYR 55 2 97.51 1 55 A LEU 56 2 97.51 1 56 A LYS 57 2 92.02 1 57 A GLU 58 2 87.27 1 58 A PRO 59 2 93.75 1 59 A GLY 60 2 91.66 1 60 A GLY 61 2 90.35 1 61 A ASP 62 2 89.96 1 62 A ALA 63 2 93.82 1 63 A LEU 64 2 95.87 1 64 A PHE 65 2 90.73 1 65 A VAL 66 2 94.69 1 66 A THR 67 2 89.00 1 67 A GLY 68 2 88.80 1 68 A PRO 69 2 86.09 1 69 A THR 70 2 82.84 1 70 A GLY 71 2 85.83 1 71 A SER 72 2 88.12 1 72 A GLY 73 2 93.39 1 73 A LYS 74 2 93.94 1 74 A THR 75 2 96.71 1 75 A SER 76 2 96.06 1 76 A GLY 77 2 97.90 1 77 A ILE 78 2 97.84 1 78 A THR 79 2 97.39 1 79 A GLU 80 2 95.97 1 80 A ILE 81 2 98.28 1 81 A ALA 82 2 98.52 1 82 A GLY 83 2 98.43 1 83 A ARG 84 2 94.70 1 84 A LEU 85 2 98.05 1 85 A ASN 86 2 96.68 1 86 A TRP 87 2 97.69 1 87 A PRO 88 2 98.24 1 88 A VAL 89 2 98.23 1 89 A GLN 90 2 96.50 1 90 A GLN 91 2 94.56 1 91 A ILE 92 2 90.33 1 92 A THR 93 2 94.63 1 93 A ALA 94 2 92.15 1 94 A HIS 95 2 88.10 1 95 A GLY 96 2 86.88 1 96 A ARG 97 2 76.25 1 97 A MET 98 2 86.40 1 98 A GLU 99 2 84.80 1 99 A LEU 100 2 87.82 1 100 A THR 101 2 88.07 1 101 A ASP 102 2 88.60 1 102 A LEU 103 2 93.08 1 103 A ILE 104 2 93.16 1 104 A GLY 105 2 94.48 1 105 A HIS 106 2 88.31 1 106 A HIS 107 2 87.98 1 107 A ALA 108 2 91.41 1 108 A LEU 109 2 87.72 1 109 A VAL 110 2 87.19 1 110 A ALA 111 2 88.14 1 111 A GLU 112 2 77.92 1 112 A LYS 113 2 83.03 1 113 A PRO 114 2 88.28 1 114 A GLY 115 2 90.31 1 115 A GLN 116 2 86.38 1 116 A PRO 117 2 91.88 1 117 A PRO 118 2 91.04 1 118 A VAL 119 2 88.57 1 119 A MET 120 2 85.64 1 120 A LYS 121 2 84.11 1 121 A PHE 122 2 94.12 1 122 A MET 123 2 89.98 1 123 A TYR 124 2 95.75 1 124 A GLY 125 2 97.07 1 125 A PRO 126 2 97.08 1 126 A LEU 127 2 96.30 1 127 A ALA 128 2 97.49 1 128 A VAL 129 2 97.35 1 129 A ALA 130 2 97.78 1 130 A MET 131 2 93.40 1 131 A ARG 132 2 86.12 1 132 A GLU 133 2 93.03 1 133 A GLY 134 2 97.37 1 134 A HIS 135 2 96.73 1 135 A LEU 136 2 95.70 1 136 A PHE 137 2 96.88 1 137 A LEU 138 2 97.65 1 138 A ILE 139 2 94.74 1 139 A ASN 140 2 93.48 1 140 A GLU 141 2 87.58 1 141 A VAL 142 2 86.90 1 142 A ASP 143 2 82.50 1 143 A LEU 144 2 83.52 1 144 A ALA 145 2 86.08 1 145 A ASP 146 2 83.16 1 146 A PRO 147 2 82.36 1 147 A ALA 148 2 84.57 1 148 A GLU 149 2 82.91 1 149 A LEU 150 2 83.11 1 150 A ALA 151 2 85.51 1 151 A GLY 152 2 86.21 1 152 A LEU 153 2 86.42 1 153 A ASN 154 2 85.43 1 154 A ASP 155 2 87.69 1 155 A VAL 156 2 90.05 1 156 A LEU 157 2 87.16 1 157 A GLU 158 2 83.46 1 158 A GLY 159 2 90.19 1 159 A ARG 160 2 83.00 1 160 A PRO 161 2 94.24 1 161 A LEU 162 2 93.88 1 162 A VAL 163 2 93.14 1 163 A ILE 164 2 92.81 1 164 A ALA 165 2 91.18 1 165 A GLN 166 2 83.12 1 166 A ASN 167 2 91.69 1 167 A GLY 168 2 93.55 1 168 A GLY 169 2 95.32 1 169 A GLU 170 2 93.79 1 170 A ILE 171 2 95.53 1 171 A ILE 172 2 95.85 1 172 A LYS 173 2 91.51 1 173 A PRO 174 2 95.43 1 174 A HIS 175 2 95.32 1 175 A PRO 176 2 95.93 1 176 A MET 177 2 95.29 1 177 A PHE 178 2 97.22 1 178 A ARG 179 2 95.80 1 179 A VAL 180 2 96.60 1 180 A VAL 181 2 97.26 1 181 A VAL 182 2 93.74 1 182 A THR 183 2 93.85 1 183 A GLY 184 2 89.71 1 184 A ASN 185 2 76.53 1 185 A SER 186 2 63.97 1 186 A THR 187 2 49.53 1 187 A GLY 188 2 43.41 1 188 A SER 189 2 39.78 1 189 A GLY 190 2 42.29 1 190 A ASP 191 2 41.72 1 191 A ALA 192 2 43.16 1 192 A SER 193 2 43.20 1 193 A GLY 194 2 38.69 1 194 A LEU 195 2 36.29 1 195 A TYR 196 2 39.92 1 196 A GLN 197 2 36.53 1 197 A GLY 198 2 41.48 1 198 A VAL 199 2 42.60 1 199 A MET 200 2 42.19 1 200 A MET 201 2 40.37 1 201 A GLN 202 2 48.96 1 202 A ASN 203 2 57.68 1 203 A LEU 204 2 55.58 1 204 A ALA 205 2 71.04 1 205 A ALA 206 2 76.77 1 206 A MET 207 2 74.62 1 207 A ASP 208 2 79.80 1 208 A ARG 209 2 79.93 1 209 A TYR 210 2 87.86 1 210 A ARG 211 2 85.70 1 211 A PHE 212 2 88.28 1 212 A THR 213 2 89.61 1 213 A LYS 214 2 84.30 1 214 A VAL 215 2 90.96 1 215 A GLY 216 2 89.28 1 216 A TYR 217 2 85.53 1 217 A ALA 218 2 91.51 1 218 A ASP 219 2 90.79 1 219 A GLU 220 2 89.65 1 220 A GLU 221 2 85.34 1 221 A ALA 222 2 94.75 1 222 A GLU 223 2 93.84 1 223 A LEU 224 2 94.30 1 224 A SER 225 2 93.43 1 225 A ILE 226 2 94.90 1 226 A LEU 227 2 96.50 1 227 A GLY 228 2 96.59 1 228 A ARG 229 2 88.00 1 229 A VAL 230 2 93.46 1 230 A THR 231 2 96.04 1 231 A PRO 232 2 96.62 1 232 A LYS 233 2 91.70 1 233 A LEU 234 2 94.67 1 234 A PRO 235 2 96.05 1 235 A GLU 236 2 92.34 1 236 A ASN 237 2 90.87 1 237 A VAL 238 2 96.45 1 238 A ARG 239 2 93.82 1 239 A LYS 240 2 93.56 1 240 A GLY 241 2 97.72 1 241 A MET 242 2 97.21 1 242 A VAL 243 2 97.18 1 243 A ARG 244 2 84.83 1 244 A ILE 245 2 96.27 1 245 A ALA 246 2 95.67 1 246 A ASN 247 2 91.15 1 247 A GLN 248 2 88.46 1 248 A VAL 249 2 92.61 1 249 A ARG 250 2 86.39 1 250 A LYS 251 2 80.73 1 251 A LEU 252 2 82.62 1 252 A PHE 253 2 76.07 1 253 A LEU 254 2 68.20 1 254 A GLY 255 2 71.80 1 255 A GLU 256 2 60.37 1 256 A ASN 257 2 59.92 1 257 A GLY 258 2 64.15 1 258 A GLU 259 2 59.23 1 259 A ASP 260 2 66.35 1 260 A GLY 261 2 76.82 1 261 A GLN 262 2 71.39 1 262 A ILE 263 2 81.80 1 263 A SER 264 2 86.20 1 264 A VAL 265 2 88.38 1 265 A THR 266 2 87.46 1 266 A MET 267 2 90.63 1 267 A SER 268 2 91.52 1 268 A THR 269 2 92.35 1 269 A ARG 270 2 83.87 1 270 A THR 271 2 95.23 1 271 A LEU 272 2 96.41 1 272 A VAL 273 2 95.72 1 273 A ARG 274 2 92.27 1 274 A TRP 275 2 97.89 1 275 A ALA 276 2 97.92 1 276 A LYS 277 2 95.03 1 277 A LEU 278 2 97.10 1 278 A SER 279 2 96.68 1 279 A LEU 280 2 95.68 1 280 A ALA 281 2 96.18 1 281 A PHE 282 2 92.59 1 282 A ARG 283 2 77.52 1 283 A GLY 284 2 89.17 1 284 A ALA 285 2 89.63 1 285 A PRO 286 2 87.34 1 286 A ASN 287 2 88.04 1 287 A ALA 288 2 95.37 1 288 A LEU 289 2 95.68 1 289 A GLU 290 2 93.36 1 290 A TYR 291 2 93.11 1 291 A ALA 292 2 97.18 1 292 A LEU 293 2 96.77 1 293 A ASP 294 2 92.12 1 294 A GLN 295 2 89.37 1 295 A ALA 296 2 95.09 1 296 A LEU 297 2 94.41 1 297 A LEU 298 2 95.15 1 298 A ILE 299 2 91.69 1 299 A ARG 300 2 83.31 1 300 A ALA 301 2 92.13 1 301 A ALA 302 2 92.48 1 302 A LYS 303 2 85.36 1 303 A GLU 304 2 82.05 1 304 A GLU 305 2 89.33 1 305 A ARG 306 2 86.12 1 306 A GLU 307 2 86.59 1 307 A ALA 308 2 93.59 1 308 A ILE 309 2 94.83 1 309 A LEU 310 2 95.03 1 310 A ARG 311 2 80.50 1 311 A VAL 312 2 93.88 1 312 A ALA 313 2 95.54 1 313 A LYS 314 2 84.66 1 314 A ASP 315 2 91.92 1 315 A VAL 316 2 93.85 1 316 A PHE 317 2 94.10 1 317 A GLY 318 2 91.75 1 318 A ASP 319 2 84.12 1 319 A GLN 320 2 80.45 1 320 A TRP 321 2 87.06 1 321 A ARG 322 2 67.36 1 322 # _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 SER . 2 A 2 A 3 1 n GLN . 3 A 3 A 4 1 n TYR . 4 A 4 A 5 1 n SER . 5 A 5 A 6 1 n GLN . 6 A 6 A 7 1 n PHE . 7 A 7 A 8 1 n SER . 8 A 8 A 9 1 n VAL . 9 A 9 A 10 1 n SER . 10 A 10 A 11 1 n LYS . 11 A 11 A 12 1 n VAL . 12 A 12 A 13 1 n PHE . 13 A 13 A 14 1 n GLY . 14 A 14 A 15 1 n MET . 15 A 15 A 16 1 n PRO . 16 A 16 A 17 1 n SER . 17 A 17 A 18 1 n ILE . 18 A 18 A 19 1 n PRO . 19 A 19 A 20 1 n GLU . 20 A 20 A 21 1 n LYS . 21 A 21 A 22 1 n VAL . 22 A 22 A 23 1 n THR . 23 A 23 A 24 1 n ALA . 24 A 24 A 25 1 n ILE . 25 A 25 A 26 1 n GLY . 26 A 26 A 27 1 n TYR . 27 A 27 A 28 1 n ALA . 28 A 28 A 29 1 n ASP . 29 A 29 A 30 1 n GLY . 30 A 30 A 31 1 n SER . 31 A 31 A 32 1 n ASN . 32 A 32 A 33 1 n PRO . 33 A 33 A 34 1 n PHE . 34 A 34 A 35 1 n ILE . 35 A 35 A 36 1 n PRO . 36 A 36 A 37 1 n ALA . 37 A 37 A 38 1 n THR . 38 A 38 A 39 1 n ASP . 39 A 39 A 40 1 n THR . 40 A 40 A 41 1 n ASN . 41 A 41 A 42 1 n TYR . 42 A 42 A 43 1 n VAL . 43 A 43 A 44 1 n PHE . 44 A 44 A 45 1 n ARG . 45 A 45 A 46 1 n LYS . 46 A 46 A 47 1 n GLU . 47 A 47 A 48 1 n PHE . 48 A 48 A 49 1 n LEU . 49 A 49 A 50 1 n ARG . 50 A 50 A 51 1 n GLU . 51 A 51 A 52 1 n VAL . 52 A 52 A 53 1 n LEU . 53 A 53 A 54 1 n ALA . 54 A 54 A 55 1 n TYR . 55 A 55 A 56 1 n LEU . 56 A 56 A 57 1 n LYS . 57 A 57 A 58 1 n GLU . 58 A 58 A 59 1 n PRO . 59 A 59 A 60 1 n GLY . 60 A 60 A 61 1 n GLY . 61 A 61 A 62 1 n ASP . 62 A 62 A 63 1 n ALA . 63 A 63 A 64 1 n LEU . 64 A 64 A 65 1 n PHE . 65 A 65 A 66 1 n VAL . 66 A 66 A 67 1 n THR . 67 A 67 A 68 1 n GLY . 68 A 68 A 69 1 n PRO . 69 A 69 A 70 1 n THR . 70 A 70 A 71 1 n GLY . 71 A 71 A 72 1 n SER . 72 A 72 A 73 1 n GLY . 73 A 73 A 74 1 n LYS . 74 A 74 A 75 1 n THR . 75 A 75 A 76 1 n SER . 76 A 76 A 77 1 n GLY . 77 A 77 A 78 1 n ILE . 78 A 78 A 79 1 n THR . 79 A 79 A 80 1 n GLU . 80 A 80 A 81 1 n ILE . 81 A 81 A 82 1 n ALA . 82 A 82 A 83 1 n GLY . 83 A 83 A 84 1 n ARG . 84 A 84 A 85 1 n LEU . 85 A 85 A 86 1 n ASN . 86 A 86 A 87 1 n TRP . 87 A 87 A 88 1 n PRO . 88 A 88 A 89 1 n VAL . 89 A 89 A 90 1 n GLN . 90 A 90 A 91 1 n GLN . 91 A 91 A 92 1 n ILE . 92 A 92 A 93 1 n THR . 93 A 93 A 94 1 n ALA . 94 A 94 A 95 1 n HIS . 95 A 95 A 96 1 n GLY . 96 A 96 A 97 1 n ARG . 97 A 97 A 98 1 n MET . 98 A 98 A 99 1 n GLU . 99 A 99 A 100 1 n LEU . 100 A 100 A 101 1 n THR . 101 A 101 A 102 1 n ASP . 102 A 102 A 103 1 n LEU . 103 A 103 A 104 1 n ILE . 104 A 104 A 105 1 n GLY . 105 A 105 A 106 1 n HIS . 106 A 106 A 107 1 n HIS . 107 A 107 A 108 1 n ALA . 108 A 108 A 109 1 n LEU . 109 A 109 A 110 1 n VAL . 110 A 110 A 111 1 n ALA . 111 A 111 A 112 1 n GLU . 112 A 112 A 113 1 n LYS . 113 A 113 A 114 1 n PRO . 114 A 114 A 115 1 n GLY . 115 A 115 A 116 1 n GLN . 116 A 116 A 117 1 n PRO . 117 A 117 A 118 1 n PRO . 118 A 118 A 119 1 n VAL . 119 A 119 A 120 1 n MET . 120 A 120 A 121 1 n LYS . 121 A 121 A 122 1 n PHE . 122 A 122 A 123 1 n MET . 123 A 123 A 124 1 n TYR . 124 A 124 A 125 1 n GLY . 125 A 125 A 126 1 n PRO . 126 A 126 A 127 1 n LEU . 127 A 127 A 128 1 n ALA . 128 A 128 A 129 1 n VAL . 129 A 129 A 130 1 n ALA . 130 A 130 A 131 1 n MET . 131 A 131 A 132 1 n ARG . 132 A 132 A 133 1 n GLU . 133 A 133 A 134 1 n GLY . 134 A 134 A 135 1 n HIS . 135 A 135 A 136 1 n LEU . 136 A 136 A 137 1 n PHE . 137 A 137 A 138 1 n LEU . 138 A 138 A 139 1 n ILE . 139 A 139 A 140 1 n ASN . 140 A 140 A 141 1 n GLU . 141 A 141 A 142 1 n VAL . 142 A 142 A 143 1 n ASP . 143 A 143 A 144 1 n LEU . 144 A 144 A 145 1 n ALA . 145 A 145 A 146 1 n ASP . 146 A 146 A 147 1 n PRO . 147 A 147 A 148 1 n ALA . 148 A 148 A 149 1 n GLU . 149 A 149 A 150 1 n LEU . 150 A 150 A 151 1 n ALA . 151 A 151 A 152 1 n GLY . 152 A 152 A 153 1 n LEU . 153 A 153 A 154 1 n ASN . 154 A 154 A 155 1 n ASP . 155 A 155 A 156 1 n VAL . 156 A 156 A 157 1 n LEU . 157 A 157 A 158 1 n GLU . 158 A 158 A 159 1 n GLY . 159 A 159 A 160 1 n ARG . 160 A 160 A 161 1 n PRO . 161 A 161 A 162 1 n LEU . 162 A 162 A 163 1 n VAL . 163 A 163 A 164 1 n ILE . 164 A 164 A 165 1 n ALA . 165 A 165 A 166 1 n GLN . 166 A 166 A 167 1 n ASN . 167 A 167 A 168 1 n GLY . 168 A 168 A 169 1 n GLY . 169 A 169 A 170 1 n GLU . 170 A 170 A 171 1 n ILE . 171 A 171 A 172 1 n ILE . 172 A 172 A 173 1 n LYS . 173 A 173 A 174 1 n PRO . 174 A 174 A 175 1 n HIS . 175 A 175 A 176 1 n PRO . 176 A 176 A 177 1 n MET . 177 A 177 A 178 1 n PHE . 178 A 178 A 179 1 n ARG . 179 A 179 A 180 1 n VAL . 180 A 180 A 181 1 n VAL . 181 A 181 A 182 1 n VAL . 182 A 182 A 183 1 n THR . 183 A 183 A 184 1 n GLY . 184 A 184 A 185 1 n ASN . 185 A 185 A 186 1 n SER . 186 A 186 A 187 1 n THR . 187 A 187 A 188 1 n GLY . 188 A 188 A 189 1 n SER . 189 A 189 A 190 1 n GLY . 190 A 190 A 191 1 n ASP . 191 A 191 A 192 1 n ALA . 192 A 192 A 193 1 n SER . 193 A 193 A 194 1 n GLY . 194 A 194 A 195 1 n LEU . 195 A 195 A 196 1 n TYR . 196 A 196 A 197 1 n GLN . 197 A 197 A 198 1 n GLY . 198 A 198 A 199 1 n VAL . 199 A 199 A 200 1 n MET . 200 A 200 A 201 1 n MET . 201 A 201 A 202 1 n GLN . 202 A 202 A 203 1 n ASN . 203 A 203 A 204 1 n LEU . 204 A 204 A 205 1 n ALA . 205 A 205 A 206 1 n ALA . 206 A 206 A 207 1 n MET . 207 A 207 A 208 1 n ASP . 208 A 208 A 209 1 n ARG . 209 A 209 A 210 1 n TYR . 210 A 210 A 211 1 n ARG . 211 A 211 A 212 1 n PHE . 212 A 212 A 213 1 n THR . 213 A 213 A 214 1 n LYS . 214 A 214 A 215 1 n VAL . 215 A 215 A 216 1 n GLY . 216 A 216 A 217 1 n TYR . 217 A 217 A 218 1 n ALA . 218 A 218 A 219 1 n ASP . 219 A 219 A 220 1 n GLU . 220 A 220 A 221 1 n GLU . 221 A 221 A 222 1 n ALA . 222 A 222 A 223 1 n GLU . 223 A 223 A 224 1 n LEU . 224 A 224 A 225 1 n SER . 225 A 225 A 226 1 n ILE . 226 A 226 A 227 1 n LEU . 227 A 227 A 228 1 n GLY . 228 A 228 A 229 1 n ARG . 229 A 229 A 230 1 n VAL . 230 A 230 A 231 1 n THR . 231 A 231 A 232 1 n PRO . 232 A 232 A 233 1 n LYS . 233 A 233 A 234 1 n LEU . 234 A 234 A 235 1 n PRO . 235 A 235 A 236 1 n GLU . 236 A 236 A 237 1 n ASN . 237 A 237 A 238 1 n VAL . 238 A 238 A 239 1 n ARG . 239 A 239 A 240 1 n LYS . 240 A 240 A 241 1 n GLY . 241 A 241 A 242 1 n MET . 242 A 242 A 243 1 n VAL . 243 A 243 A 244 1 n ARG . 244 A 244 A 245 1 n ILE . 245 A 245 A 246 1 n ALA . 246 A 246 A 247 1 n ASN . 247 A 247 A 248 1 n GLN . 248 A 248 A 249 1 n VAL . 249 A 249 A 250 1 n ARG . 250 A 250 A 251 1 n LYS . 251 A 251 A 252 1 n LEU . 252 A 252 A 253 1 n PHE . 253 A 253 A 254 1 n LEU . 254 A 254 A 255 1 n GLY . 255 A 255 A 256 1 n GLU . 256 A 256 A 257 1 n ASN . 257 A 257 A 258 1 n GLY . 258 A 258 A 259 1 n GLU . 259 A 259 A 260 1 n ASP . 260 A 260 A 261 1 n GLY . 261 A 261 A 262 1 n GLN . 262 A 262 A 263 1 n ILE . 263 A 263 A 264 1 n SER . 264 A 264 A 265 1 n VAL . 265 A 265 A 266 1 n THR . 266 A 266 A 267 1 n MET . 267 A 267 A 268 1 n SER . 268 A 268 A 269 1 n THR . 269 A 269 A 270 1 n ARG . 270 A 270 A 271 1 n THR . 271 A 271 A 272 1 n LEU . 272 A 272 A 273 1 n VAL . 273 A 273 A 274 1 n ARG . 274 A 274 A 275 1 n TRP . 275 A 275 A 276 1 n ALA . 276 A 276 A 277 1 n LYS . 277 A 277 A 278 1 n LEU . 278 A 278 A 279 1 n SER . 279 A 279 A 280 1 n LEU . 280 A 280 A 281 1 n ALA . 281 A 281 A 282 1 n PHE . 282 A 282 A 283 1 n ARG . 283 A 283 A 284 1 n GLY . 284 A 284 A 285 1 n ALA . 285 A 285 A 286 1 n PRO . 286 A 286 A 287 1 n ASN . 287 A 287 A 288 1 n ALA . 288 A 288 A 289 1 n LEU . 289 A 289 A 290 1 n GLU . 290 A 290 A 291 1 n TYR . 291 A 291 A 292 1 n ALA . 292 A 292 A 293 1 n LEU . 293 A 293 A 294 1 n ASP . 294 A 294 A 295 1 n GLN . 295 A 295 A 296 1 n ALA . 296 A 296 A 297 1 n LEU . 297 A 297 A 298 1 n LEU . 298 A 298 A 299 1 n ILE . 299 A 299 A 300 1 n ARG . 300 A 300 A 301 1 n ALA . 301 A 301 A 302 1 n ALA . 302 A 302 A 303 1 n LYS . 303 A 303 A 304 1 n GLU . 304 A 304 A 305 1 n GLU . 305 A 305 A 306 1 n ARG . 306 A 306 A 307 1 n GLU . 307 A 307 A 308 1 n ALA . 308 A 308 A 309 1 n ILE . 309 A 309 A 310 1 n LEU . 310 A 310 A 311 1 n ARG . 311 A 311 A 312 1 n VAL . 312 A 312 A 313 1 n ALA . 313 A 313 A 314 1 n LYS . 314 A 314 A 315 1 n ASP . 315 A 315 A 316 1 n VAL . 316 A 316 A 317 1 n PHE . 317 A 317 A 318 1 n GLY . 318 A 318 A 319 1 n ASP . 319 A 319 A 320 1 n GLN . 320 A 320 A 321 1 n TRP . 321 A 321 A 322 1 n ARG . 322 A 322 # _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 ? -11.370 32.842 8.229 1.00 55.07 1 A 1 ATOM 2 C CA . MET A 1 1 ? -10.577 32.274 7.113 1.00 69.23 1 A 1 ATOM 3 C C . MET A 1 1 ? -11.279 31.004 6.653 1.00 73.61 1 A 1 ATOM 4 O O . MET A 1 1 ? -11.928 30.378 7.483 1.00 68.73 1 A 1 ATOM 5 C CB . MET A 1 1 ? -9.136 31.978 7.550 1.00 63.54 1 A 1 ATOM 6 C CG . MET A 1 1 ? -8.348 33.265 7.833 1.00 55.98 1 A 1 ATOM 7 S SD . MET A 1 1 ? -6.668 32.964 8.434 1.00 48.95 1 A 1 ATOM 8 C CE . MET A 1 1 ? -6.177 34.631 8.954 1.00 38.66 1 A 1 ATOM 9 N N . SER A 1 2 ? -11.236 30.667 5.369 1.00 75.26 2 A 1 ATOM 10 C CA . SER A 1 2 ? -11.822 29.400 4.907 1.00 82.55 2 A 1 ATOM 11 C C . SER A 1 2 ? -11.099 28.226 5.570 1.00 86.23 2 A 1 ATOM 12 O O . SER A 1 2 ? -9.869 28.230 5.620 1.00 82.86 2 A 1 ATOM 13 C CB . SER A 1 2 ? -11.718 29.272 3.378 1.00 74.43 2 A 1 ATOM 14 O OG . SER A 1 2 ? -12.309 28.059 2.960 1.00 65.10 2 A 1 ATOM 15 N N . GLN A 1 3 ? -11.843 27.235 6.048 1.00 89.71 3 A 1 ATOM 16 C CA . GLN A 1 3 ? -11.283 25.996 6.609 1.00 92.15 3 A 1 ATOM 17 C C . GLN A 1 3 ? -10.521 25.171 5.547 1.00 94.75 3 A 1 ATOM 18 O O . GLN A 1 3 ? -9.626 24.397 5.879 1.00 93.39 3 A 1 ATOM 19 C CB . GLN A 1 3 ? -12.449 25.198 7.219 1.00 87.99 3 A 1 ATOM 20 C CG . GLN A 1 3 ? -12.005 23.962 8.016 1.00 74.38 3 A 1 ATOM 21 C CD . GLN A 1 3 ? -13.179 23.205 8.628 1.00 71.59 3 A 1 ATOM 22 O OE1 . GLN A 1 3 ? -14.337 23.530 8.421 1.00 65.28 3 A 1 ATOM 23 N NE2 . GLN A 1 3 ? -12.930 22.164 9.389 1.00 62.20 3 A 1 ATOM 24 N N . TYR A 1 4 ? -10.852 25.367 4.268 1.00 94.49 4 A 1 ATOM 25 C CA . TYR A 1 4 ? -10.302 24.607 3.147 1.00 94.86 4 A 1 ATOM 26 C C . TYR A 1 4 ? -9.540 25.499 2.164 1.00 95.50 4 A 1 ATOM 27 O O . TYR A 1 4 ? -9.850 26.680 1.997 1.00 93.02 4 A 1 ATOM 28 C CB . TYR A 1 4 ? -11.423 23.838 2.431 1.00 93.22 4 A 1 ATOM 29 C CG . TYR A 1 4 ? -12.362 23.089 3.355 1.00 94.45 4 A 1 ATOM 30 C CD1 . TYR A 1 4 ? -11.858 22.139 4.264 1.00 90.75 4 A 1 ATOM 31 C CD2 . TYR A 1 4 ? -13.743 23.375 3.339 1.00 91.85 4 A 1 ATOM 32 C CE1 . TYR A 1 4 ? -12.725 21.489 5.162 1.00 89.84 4 A 1 ATOM 33 C CE2 . TYR A 1 4 ? -14.616 22.724 4.232 1.00 90.86 4 A 1 ATOM 34 C CZ . TYR A 1 4 ? -14.106 21.785 5.146 1.00 90.95 4 A 1 ATOM 35 O OH . TYR A 1 4 ? -14.947 21.169 6.020 1.00 88.50 4 A 1 ATOM 36 N N . SER A 1 5 ? -8.581 24.901 1.468 1.00 96.34 5 A 1 ATOM 37 C CA . SER A 1 5 ? -7.776 25.518 0.416 1.00 96.24 5 A 1 ATOM 38 C C . SER A 1 5 ? -7.770 24.665 -0.852 1.00 96.87 5 A 1 ATOM 39 O O . SER A 1 5 ? -7.951 23.449 -0.809 1.00 95.33 5 A 1 ATOM 40 C CB . SER A 1 5 ? -6.353 25.766 0.912 1.00 94.43 5 A 1 ATOM 41 O OG . SER A 1 5 ? -6.357 26.845 1.824 1.00 83.75 5 A 1 ATOM 42 N N . GLN A 1 6 ? -7.550 25.331 -1.989 1.00 97.60 6 A 1 ATOM 43 C CA . GLN A 1 6 ? -7.322 24.676 -3.274 1.00 97.51 6 A 1 ATOM 44 C C . GLN A 1 6 ? -5.815 24.602 -3.543 1.00 97.70 6 A 1 ATOM 45 O O . GLN A 1 6 ? -5.133 25.627 -3.599 1.00 96.61 6 A 1 ATOM 46 C CB . GLN A 1 6 ? -8.055 25.433 -4.393 1.00 96.52 6 A 1 ATOM 47 C CG . GLN A 1 6 ? -9.585 25.362 -4.261 1.00 92.55 6 A 1 ATOM 48 C CD . GLN A 1 6 ? -10.149 23.953 -4.430 1.00 90.55 6 A 1 ATOM 49 O OE1 . GLN A 1 6 ? -9.596 23.096 -5.097 1.00 80.79 6 A 1 ATOM 50 N NE2 . GLN A 1 6 ? -11.290 23.658 -3.845 1.00 78.25 6 A 1 ATOM 51 N N . PHE A 1 7 ? -5.306 23.402 -3.733 1.00 97.82 7 A 1 ATOM 52 C CA . PHE A 1 7 ? -3.893 23.128 -3.960 1.00 97.93 7 A 1 ATOM 53 C C . PHE A 1 7 ? -3.652 22.829 -5.443 1.00 98.09 7 A 1 ATOM 54 O O . PHE A 1 7 ? -4.289 21.939 -6.004 1.00 97.22 7 A 1 ATOM 55 C CB . PHE A 1 7 ? -3.470 21.955 -3.070 1.00 97.74 7 A 1 ATOM 56 C CG . PHE A 1 7 ? -3.479 22.269 -1.582 1.00 98.06 7 A 1 ATOM 57 C CD1 . PHE A 1 7 ? -2.303 22.703 -0.947 1.00 97.16 7 A 1 ATOM 58 C CD2 . PHE A 1 7 ? -4.658 22.126 -0.830 1.00 97.31 7 A 1 ATOM 59 C CE1 . PHE A 1 7 ? -2.298 22.982 0.431 1.00 96.83 7 A 1 ATOM 60 C CE2 . PHE A 1 7 ? -4.656 22.412 0.548 1.00 96.97 7 A 1 ATOM 61 C CZ . PHE A 1 7 ? -3.474 22.835 1.177 1.00 97.27 7 A 1 ATOM 62 N N . SER A 1 8 ? -2.715 23.541 -6.082 1.00 97.86 8 A 1 ATOM 63 C CA . SER A 1 8 ? -2.305 23.223 -7.460 1.00 97.82 8 A 1 ATOM 64 C C . SER A 1 8 ? -1.634 21.849 -7.496 1.00 97.98 8 A 1 ATOM 65 O O . SER A 1 8 ? -0.576 21.657 -6.892 1.00 97.39 8 A 1 ATOM 66 C CB . SER A 1 8 ? -1.355 24.295 -8.005 1.00 97.22 8 A 1 ATOM 67 O OG . SER A 1 8 ? -0.826 23.906 -9.263 1.00 93.91 8 A 1 ATOM 68 N N . VAL A 1 9 ? -2.212 20.913 -8.246 1.00 97.69 9 A 1 ATOM 69 C CA . VAL A 1 9 ? -1.685 19.545 -8.380 1.00 97.76 9 A 1 ATOM 70 C C . VAL A 1 9 ? -0.266 19.562 -8.948 1.00 97.72 9 A 1 ATOM 71 O O . VAL A 1 9 ? 0.614 18.866 -8.444 1.00 96.94 9 A 1 ATOM 72 C CB . VAL A 1 9 ? -2.628 18.687 -9.249 1.00 97.49 9 A 1 ATOM 73 C CG1 . VAL A 1 9 ? -2.072 17.281 -9.510 1.00 96.34 9 A 1 ATOM 74 C CG2 . VAL A 1 9 ? -3.994 18.522 -8.564 1.00 96.27 9 A 1 ATOM 75 N N . SER A 1 10 ? -0.018 20.413 -9.950 1.00 98.04 10 A 1 ATOM 76 C CA . SER A 1 10 ? 1.312 20.596 -10.542 1.00 97.65 10 A 1 ATOM 77 C C . SER A 1 10 ? 2.379 20.948 -9.499 1.00 97.44 10 A 1 ATOM 78 O O . SER A 1 10 ? 3.402 20.270 -9.400 1.00 95.71 10 A 1 ATOM 79 C CB . SER A 1 10 ? 1.231 21.696 -11.600 1.00 96.52 10 A 1 ATOM 80 O OG . SER A 1 10 ? 2.473 21.869 -12.246 1.00 87.87 10 A 1 ATOM 81 N N . LYS A 1 11 ? 2.106 21.975 -8.675 1.00 97.58 11 A 1 ATOM 82 C CA . LYS A 1 11 ? 3.067 22.499 -7.686 1.00 97.03 11 A 1 ATOM 83 C C . LYS A 1 11 ? 3.246 21.553 -6.503 1.00 97.16 11 A 1 ATOM 84 O O . LYS A 1 11 ? 4.371 21.231 -6.143 1.00 96.00 11 A 1 ATOM 85 C CB . LYS A 1 11 ? 2.631 23.903 -7.218 1.00 96.44 11 A 1 ATOM 86 C CG . LYS A 1 11 ? 2.762 24.931 -8.355 1.00 91.70 11 A 1 ATOM 87 C CD . LYS A 1 11 ? 2.330 26.355 -7.957 1.00 85.69 11 A 1 ATOM 88 C CE . LYS A 1 11 ? 2.534 27.216 -9.208 1.00 79.76 11 A 1 ATOM 89 N NZ . LYS A 1 11 ? 1.876 28.534 -9.198 1.00 68.10 11 A 1 ATOM 90 N N . VAL A 1 12 ? 2.146 21.096 -5.930 1.00 97.63 12 A 1 ATOM 91 C CA . VAL A 1 12 ? 2.154 20.324 -4.674 1.00 97.67 12 A 1 ATOM 92 C C . VAL A 1 12 ? 2.706 18.911 -4.862 1.00 97.76 12 A 1 ATOM 93 O O . VAL A 1 12 ? 3.416 18.404 -3.995 1.00 96.58 12 A 1 ATOM 94 C CB . VAL A 1 12 ? 0.742 20.325 -4.063 1.00 96.68 12 A 1 ATOM 95 C CG1 . VAL A 1 12 ? 0.596 19.373 -2.880 1.00 89.97 12 A 1 ATOM 96 C CG2 . VAL A 1 12 ? 0.417 21.738 -3.554 1.00 89.05 12 A 1 ATOM 97 N N . PHE A 1 13 ? 2.438 18.286 -6.005 1.00 97.18 13 A 1 ATOM 98 C CA . PHE A 1 13 ? 2.887 16.922 -6.297 1.00 97.17 13 A 1 ATOM 99 C C . PHE A 1 13 ? 4.097 16.860 -7.242 1.00 96.72 13 A 1 ATOM 100 O O . PHE A 1 13 ? 4.539 15.769 -7.597 1.00 95.03 13 A 1 ATOM 101 C CB . PHE A 1 13 ? 1.696 16.086 -6.780 1.00 97.45 13 A 1 ATOM 102 C CG . PHE A 1 13 ? 0.556 16.037 -5.777 1.00 98.01 13 A 1 ATOM 103 C CD1 . PHE A 1 13 ? 0.652 15.210 -4.643 1.00 97.58 13 A 1 ATOM 104 C CD2 . PHE A 1 13 ? -0.580 16.843 -5.950 1.00 97.69 13 A 1 ATOM 105 C CE1 . PHE A 1 13 ? -0.386 15.189 -3.695 1.00 97.57 13 A 1 ATOM 106 C CE2 . PHE A 1 13 ? -1.618 16.822 -4.999 1.00 97.53 13 A 1 ATOM 107 C CZ . PHE A 1 13 ? -1.522 15.995 -3.872 1.00 97.90 13 A 1 ATOM 108 N N . GLY A 1 14 ? 4.653 18.011 -7.645 1.00 96.04 14 A 1 ATOM 109 C CA . GLY A 1 14 ? 5.838 18.066 -8.509 1.00 94.91 14 A 1 ATOM 110 C C . GLY A 1 14 ? 5.594 17.501 -9.912 1.00 94.95 14 A 1 ATOM 111 O O . GLY A 1 14 ? 6.442 16.782 -10.442 1.00 92.30 14 A 1 ATOM 112 N N . MET A 1 15 ? 4.434 17.794 -10.502 1.00 95.07 15 A 1 ATOM 113 C CA . MET A 1 15 ? 4.019 17.313 -11.826 1.00 94.80 15 A 1 ATOM 114 C C . MET A 1 15 ? 3.842 18.474 -12.818 1.00 95.41 15 A 1 ATOM 115 O O . MET A 1 15 ? 2.707 18.871 -13.107 1.00 93.00 15 A 1 ATOM 116 C CB . MET A 1 15 ? 2.736 16.480 -11.701 1.00 92.70 15 A 1 ATOM 117 C CG . MET A 1 15 ? 2.969 15.176 -10.948 1.00 89.14 15 A 1 ATOM 118 S SD . MET A 1 15 ? 1.583 14.025 -11.120 1.00 89.12 15 A 1 ATOM 119 C CE . MET A 1 15 ? 2.319 12.585 -10.317 1.00 81.67 15 A 1 ATOM 120 N N . PRO A 1 16 ? 4.937 19.033 -13.380 1.00 95.24 16 A 1 ATOM 121 C CA . PRO A 1 16 ? 4.885 20.222 -14.241 1.00 94.40 16 A 1 ATOM 122 C C . PRO A 1 16 ? 4.102 20.012 -15.547 1.00 94.92 16 A 1 ATOM 123 O O . PRO A 1 16 ? 3.654 20.978 -16.152 1.00 92.76 16 A 1 ATOM 124 C CB . PRO A 1 16 ? 6.350 20.578 -14.515 1.00 93.09 16 A 1 ATOM 125 C CG . PRO A 1 16 ? 7.081 19.245 -14.374 1.00 91.46 16 A 1 ATOM 126 C CD . PRO A 1 16 ? 6.307 18.558 -13.252 1.00 94.15 16 A 1 ATOM 127 N N . SER A 1 17 ? 3.890 18.764 -15.972 1.00 94.65 17 A 1 ATOM 128 C CA . SER A 1 17 ? 3.058 18.434 -17.138 1.00 94.45 17 A 1 ATOM 129 C C . SER A 1 17 ? 1.550 18.631 -16.910 1.00 95.39 17 A 1 ATOM 130 O O . SER A 1 17 ? 0.777 18.606 -17.868 1.00 93.80 17 A 1 ATOM 131 C CB . SER A 1 17 ? 3.333 16.989 -17.568 1.00 93.07 17 A 1 ATOM 132 O OG . SER A 1 17 ? 3.030 16.077 -16.523 1.00 88.37 17 A 1 ATOM 133 N N . ILE A 1 18 ? 1.117 18.809 -15.663 1.00 94.71 18 A 1 ATOM 134 C CA . ILE A 1 18 ? -0.287 19.058 -15.313 1.00 95.41 18 A 1 ATOM 135 C C . ILE A 1 18 ? -0.526 20.577 -15.278 1.00 96.19 18 A 1 ATOM 136 O O . ILE A 1 18 ? 0.223 21.291 -14.609 1.00 95.59 18 A 1 ATOM 137 C CB . ILE A 1 18 ? -0.666 18.366 -13.983 1.00 94.93 18 A 1 ATOM 138 C CG1 . ILE A 1 18 ? -0.442 16.838 -14.104 1.00 92.54 18 A 1 ATOM 139 C CG2 . ILE A 1 18 ? -2.127 18.679 -13.608 1.00 92.62 18 A 1 ATOM 140 C CD1 . ILE A 1 18 ? -0.845 16.029 -12.863 1.00 86.44 18 A 1 ATOM 141 N N . PRO A 1 19 ? -1.574 21.106 -15.951 1.00 95.66 19 A 1 ATOM 142 C CA . PRO A 1 19 ? -1.895 22.532 -15.907 1.00 95.30 19 A 1 ATOM 143 C C . PRO A 1 19 ? -2.147 23.035 -14.478 1.00 95.66 19 A 1 ATOM 144 O O . PRO A 1 19 ? -2.865 22.390 -13.715 1.00 94.68 19 A 1 ATOM 145 C CB . PRO A 1 19 ? -3.144 22.703 -16.782 1.00 94.62 19 A 1 ATOM 146 C CG . PRO A 1 19 ? -3.078 21.518 -17.738 1.00 93.39 19 A 1 ATOM 147 C CD . PRO A 1 19 ? -2.454 20.418 -16.890 1.00 94.89 19 A 1 ATOM 148 N N . GLU A 1 20 ? -1.654 24.230 -14.133 1.00 95.03 20 A 1 ATOM 149 C CA . GLU A 1 20 ? -1.806 24.799 -12.778 1.00 94.25 20 A 1 ATOM 150 C C . GLU A 1 20 ? -3.269 24.976 -12.329 1.00 94.81 20 A 1 ATOM 151 O O . GLU A 1 20 ? -3.557 24.942 -11.134 1.00 92.13 20 A 1 ATOM 152 C CB . GLU A 1 20 ? -1.117 26.169 -12.668 1.00 92.20 20 A 1 ATOM 153 C CG . GLU A 1 20 ? 0.409 26.120 -12.794 1.00 85.00 20 A 1 ATOM 154 C CD . GLU A 1 20 ? 1.100 27.355 -12.181 1.00 81.82 20 A 1 ATOM 155 O OE1 . GLU A 1 20 ? 2.345 27.355 -12.097 1.00 74.07 20 A 1 ATOM 156 O OE2 . GLU A 1 20 ? 0.425 28.234 -11.598 1.00 74.92 20 A 1 ATOM 157 N N . LYS A 1 21 ? -4.186 25.133 -13.276 1.00 95.73 21 A 1 ATOM 158 C CA . LYS A 1 21 ? -5.631 25.225 -13.022 1.00 95.57 21 A 1 ATOM 159 C C . LYS A 1 21 ? -6.256 23.935 -12.476 1.00 96.53 21 A 1 ATOM 160 O O . LYS A 1 21 ? -7.392 23.967 -12.023 1.00 94.88 21 A 1 ATOM 161 C CB . LYS A 1 21 ? -6.358 25.697 -14.295 1.00 93.90 21 A 1 ATOM 162 C CG . LYS A 1 21 ? -6.320 24.664 -15.443 1.00 85.70 21 A 1 ATOM 163 C CD . LYS A 1 21 ? -7.081 25.178 -16.672 1.00 79.89 21 A 1 ATOM 164 C CE . LYS A 1 21 ? -7.071 24.126 -17.784 1.00 71.53 21 A 1 ATOM 165 N NZ . LYS A 1 21 ? -7.824 24.587 -18.981 1.00 59.17 21 A 1 ATOM 166 N N . VAL A 1 22 ? -5.552 22.814 -12.576 1.00 95.71 22 A 1 ATOM 167 C CA . VAL A 1 22 ? -5.985 21.550 -11.972 1.00 96.26 22 A 1 ATOM 168 C C . VAL A 1 22 ? -5.638 21.594 -10.489 1.00 97.18 22 A 1 ATOM 169 O O . VAL A 1 22 ? -4.462 21.591 -10.114 1.00 96.51 22 A 1 ATOM 170 C CB . VAL A 1 22 ? -5.360 20.329 -12.668 1.00 95.46 22 A 1 ATOM 171 C CG1 . VAL A 1 22 ? -5.875 19.021 -12.045 1.00 93.16 22 A 1 ATOM 172 C CG2 . VAL A 1 22 ? -5.711 20.298 -14.161 1.00 93.17 22 A 1 ATOM 173 N N . THR A 1 23 ? -6.670 21.649 -9.653 1.00 97.65 23 A 1 ATOM 174 C CA . THR A 1 23 ? -6.529 21.768 -8.199 1.00 97.49 23 A 1 ATOM 175 C C . THR A 1 23 ? -7.139 20.577 -7.468 1.00 97.55 23 A 1 ATOM 176 O O . THR A 1 23 ? -8.058 19.923 -7.966 1.00 96.69 23 A 1 ATOM 177 C CB . THR A 1 23 ? -7.118 23.086 -7.664 1.00 96.84 23 A 1 ATOM 178 O OG1 . THR A 1 23 ? -8.491 23.192 -7.976 1.00 94.07 23 A 1 ATOM 179 C CG2 . THR A 1 23 ? -6.421 24.313 -8.249 1.00 92.95 23 A 1 ATOM 180 N N . ALA A 1 24 ? -6.631 20.324 -6.269 1.00 97.51 24 A 1 ATOM 181 C CA . ALA A 1 24 ? -7.195 19.403 -5.293 1.00 97.57 24 A 1 ATOM 182 C C . ALA A 1 24 ? -7.603 20.179 -4.038 1.00 97.64 24 A 1 ATOM 183 O O . ALA A 1 24 ? -6.938 21.144 -3.662 1.00 96.59 24 A 1 ATOM 184 C CB . ALA A 1 24 ? -6.161 18.314 -4.988 1.00 97.14 24 A 1 ATOM 185 N N . ILE A 1 25 ? -8.701 19.777 -3.406 1.00 97.66 25 A 1 ATOM 186 C CA . ILE A 1 25 ? -9.122 20.341 -2.120 1.00 97.37 25 A 1 ATOM 187 C C . ILE A 1 25 ? -8.279 19.744 -0.989 1.00 97.89 25 A 1 ATOM 188 O O . ILE A 1 25 ? -7.898 18.579 -1.046 1.00 97.64 25 A 1 ATOM 189 C CB . ILE A 1 25 ? -10.644 20.169 -1.919 1.00 95.87 25 A 1 ATOM 190 C CG1 . ILE A 1 25 ? -11.125 20.997 -0.707 1.00 87.18 25 A 1 ATOM 191 C CG2 . ILE A 1 25 ? -11.050 18.690 -1.798 1.00 87.22 25 A 1 ATOM 192 C CD1 . ILE A 1 25 ? -12.650 21.096 -0.591 1.00 79.78 25 A 1 ATOM 193 N N . GLY A 1 26 ? -8.001 20.544 0.031 1.00 97.41 26 A 1 ATOM 194 C CA . GLY A 1 26 ? -7.373 20.111 1.275 1.00 97.60 26 A 1 ATOM 195 C C . GLY A 1 26 ? -7.646 21.110 2.396 1.00 97.83 26 A 1 ATOM 196 O O . GLY A 1 26 ? -8.402 22.069 2.213 1.00 97.09 26 A 1 ATOM 197 N N . TYR A 1 27 ? -7.041 20.909 3.557 1.00 98.25 27 A 1 ATOM 198 C CA . TYR A 1 27 ? -7.198 21.804 4.700 1.00 98.22 27 A 1 ATOM 199 C C . TYR A 1 27 ? -6.256 23.010 4.599 1.00 98.16 27 A 1 ATOM 200 O O . TYR A 1 27 ? -5.108 22.890 4.178 1.00 97.37 27 A 1 ATOM 201 C CB . TYR A 1 27 ? -7.013 21.021 5.999 1.00 97.98 27 A 1 ATOM 202 C CG . TYR A 1 27 ? -8.179 20.095 6.296 1.00 98.05 27 A 1 ATOM 203 C CD1 . TYR A 1 27 ? -9.236 20.547 7.111 1.00 96.91 27 A 1 ATOM 204 C CD2 . TYR A 1 27 ? -8.216 18.794 5.760 1.00 97.03 27 A 1 ATOM 205 C CE1 . TYR A 1 27 ? -10.313 19.692 7.409 1.00 96.50 27 A 1 ATOM 206 C CE2 . TYR A 1 27 ? -9.297 17.940 6.050 1.00 96.68 27 A 1 ATOM 207 C CZ . TYR A 1 27 ? -10.342 18.388 6.885 1.00 97.03 27 A 1 ATOM 208 O OH . TYR A 1 27 ? -11.370 17.560 7.192 1.00 95.93 27 A 1 ATOM 209 N N . ALA A 1 28 ? -6.748 24.187 4.974 1.00 97.30 28 A 1 ATOM 210 C CA . ALA A 1 28 ? -5.937 25.406 4.989 1.00 96.87 28 A 1 ATOM 211 C C . ALA A 1 28 ? -4.906 25.397 6.125 1.00 96.88 28 A 1 ATOM 212 O O . ALA A 1 28 ? -3.803 25.916 5.958 1.00 94.91 28 A 1 ATOM 213 C CB . ALA A 1 28 ? -6.879 26.610 5.104 1.00 95.83 28 A 1 ATOM 214 N N . ASP A 1 29 ? -5.268 24.811 7.267 1.00 96.32 29 A 1 ATOM 215 C CA . ASP A 1 29 ? -4.396 24.676 8.429 1.00 95.94 29 A 1 ATOM 216 C C . ASP A 1 29 ? -3.520 23.420 8.316 1.00 96.45 29 A 1 ATOM 217 O O . ASP A 1 29 ? -4.024 22.301 8.207 1.00 95.12 29 A 1 ATOM 218 C CB . ASP A 1 29 ? -5.242 24.683 9.711 1.00 93.83 29 A 1 ATOM 219 C CG . ASP A 1 29 ? -4.384 24.595 10.973 1.00 91.28 29 A 1 ATOM 220 O OD1 . ASP A 1 29 ? -3.156 24.837 10.880 1.00 87.35 29 A 1 ATOM 221 O OD2 . ASP A 1 29 ? -4.939 24.261 12.034 1.00 85.71 29 A 1 ATOM 222 N N . GLY A 1 30 ? -2.203 23.623 8.347 1.00 96.19 30 A 1 ATOM 223 C CA . GLY A 1 30 ? -1.201 22.556 8.328 1.00 96.18 30 A 1 ATOM 224 C C . GLY A 1 30 ? -0.659 22.172 9.710 1.00 96.69 30 A 1 ATOM 225 O O . GLY A 1 30 ? 0.314 21.429 9.784 1.00 94.41 30 A 1 ATOM 226 N N . SER A 1 31 ? -1.232 22.700 10.797 1.00 96.98 31 A 1 ATOM 227 C CA . SER A 1 31 ? -0.707 22.497 12.160 1.00 96.70 31 A 1 ATOM 228 C C . SER A 1 31 ? -1.255 21.261 12.878 1.00 96.86 31 A 1 ATOM 229 O O . SER A 1 31 ? -0.743 20.894 13.935 1.00 95.43 31 A 1 ATOM 230 C CB . SER A 1 31 ? -0.944 23.754 13.001 1.00 95.92 31 A 1 ATOM 231 O OG . SER A 1 31 ? -2.307 23.923 13.327 1.00 94.61 31 A 1 ATOM 232 N N . ASN A 1 32 ? -2.281 20.606 12.316 1.00 97.11 32 A 1 ATOM 233 C CA . ASN A 1 32 ? -2.895 19.443 12.949 1.00 97.29 32 A 1 ATOM 234 C C . ASN A 1 32 ? -1.871 18.289 13.093 1.00 97.65 32 A 1 ATOM 235 O O . ASN A 1 32 ? -1.277 17.874 12.094 1.00 97.21 32 A 1 ATOM 236 C CB . ASN A 1 32 ? -4.155 19.045 12.160 1.00 96.97 32 A 1 ATOM 237 C CG . ASN A 1 32 ? -4.945 17.932 12.829 1.00 96.96 32 A 1 ATOM 238 O OD1 . ASN A 1 32 ? -4.410 16.924 13.258 1.00 93.48 32 A 1 ATOM 239 N ND2 . ASN A 1 32 ? -6.247 18.067 12.949 1.00 93.22 32 A 1 ATOM 240 N N . PRO A 1 33 ? -1.672 17.733 14.305 1.00 97.74 33 A 1 ATOM 241 C CA . PRO A 1 33 ? -0.650 16.710 14.559 1.00 97.57 33 A 1 ATOM 242 C C . PRO A 1 33 ? -0.896 15.377 13.840 1.00 97.99 33 A 1 ATOM 243 O O . PRO A 1 33 ? 0.026 14.577 13.711 1.00 97.42 33 A 1 ATOM 244 C CB . PRO A 1 33 ? -0.652 16.523 16.084 1.00 96.79 33 A 1 ATOM 245 C CG . PRO A 1 33 ? -2.077 16.896 16.489 1.00 95.13 33 A 1 ATOM 246 C CD . PRO A 1 33 ? -2.398 18.039 15.530 1.00 97.13 33 A 1 ATOM 247 N N . PHE A 1 34 ? -2.111 15.140 13.360 1.00 97.69 34 A 1 ATOM 248 C CA . PHE A 1 34 ? -2.454 13.952 12.577 1.00 98.12 34 A 1 ATOM 249 C C . PHE A 1 34 ? -2.141 14.087 11.079 1.00 98.49 34 A 1 ATOM 250 O O . PHE A 1 34 ? -2.371 13.138 10.325 1.00 98.35 34 A 1 ATOM 251 C CB . PHE A 1 34 ? -3.925 13.590 12.814 1.00 97.90 34 A 1 ATOM 252 C CG . PHE A 1 34 ? -4.234 13.189 14.242 1.00 97.56 34 A 1 ATOM 253 C CD1 . PHE A 1 34 ? -3.824 11.929 14.714 1.00 95.57 34 A 1 ATOM 254 C CD2 . PHE A 1 34 ? -4.933 14.061 15.097 1.00 95.68 34 A 1 ATOM 255 C CE1 . PHE A 1 34 ? -4.115 11.541 16.035 1.00 94.52 34 A 1 ATOM 256 C CE2 . PHE A 1 34 ? -5.224 13.672 16.417 1.00 94.59 34 A 1 ATOM 257 C CZ . PHE A 1 34 ? -4.818 12.411 16.885 1.00 94.74 34 A 1 ATOM 258 N N . ILE A 1 35 ? -1.625 15.235 10.614 1.00 98.17 35 A 1 ATOM 259 C CA . ILE A 1 35 ? -1.164 15.382 9.228 1.00 98.36 35 A 1 ATOM 260 C C . ILE A 1 35 ? 0.130 14.575 9.049 1.00 98.39 35 A 1 ATOM 261 O O . ILE A 1 35 ? 1.110 14.822 9.755 1.00 98.12 35 A 1 ATOM 262 C CB . ILE A 1 35 ? -0.984 16.867 8.847 1.00 98.28 35 A 1 ATOM 263 C CG1 . ILE A 1 35 ? -2.357 17.581 8.867 1.00 97.40 35 A 1 ATOM 264 C CG2 . ILE A 1 35 ? -0.349 16.993 7.446 1.00 97.63 35 A 1 ATOM 265 C CD1 . ILE A 1 35 ? -2.253 19.101 8.798 1.00 95.60 35 A 1 ATOM 266 N N . PRO A 1 36 ? 0.183 13.627 8.097 1.00 98.30 36 A 1 ATOM 267 C CA . PRO A 1 36 ? 1.390 12.847 7.863 1.00 98.22 36 A 1 ATOM 268 C C . PRO A 1 36 ? 2.568 13.718 7.427 1.00 98.24 36 A 1 ATOM 269 O O . PRO A 1 36 ? 2.421 14.628 6.603 1.00 97.76 36 A 1 ATOM 270 C CB . PRO A 1 36 ? 1.031 11.814 6.790 1.00 97.82 36 A 1 ATOM 271 C CG . PRO A 1 36 ? -0.484 11.693 6.909 1.00 96.74 36 A 1 ATOM 272 C CD . PRO A 1 36 ? -0.907 13.111 7.283 1.00 98.15 36 A 1 ATOM 273 N N . ALA A 1 37 ? 3.760 13.378 7.915 1.00 97.95 37 A 1 ATOM 274 C CA . ALA A 1 37 ? 4.996 13.950 7.391 1.00 97.65 37 A 1 ATOM 275 C C . ALA A 1 37 ? 5.198 13.533 5.924 1.00 97.70 37 A 1 ATOM 276 O O . ALA A 1 37 ? 4.912 12.397 5.539 1.00 96.62 37 A 1 ATOM 277 C CB . ALA A 1 37 ? 6.172 13.513 8.274 1.00 96.81 37 A 1 ATOM 278 N N . THR A 1 38 ? 5.716 14.460 5.108 1.00 97.51 38 A 1 ATOM 279 C CA . THR A 1 38 ? 5.939 14.238 3.672 1.00 97.22 38 A 1 ATOM 280 C C . THR A 1 38 ? 7.422 14.055 3.358 1.00 96.42 38 A 1 ATOM 281 O O . THR A 1 38 ? 8.268 14.776 3.894 1.00 93.86 38 A 1 ATOM 282 C CB . THR A 1 38 ? 5.367 15.386 2.830 1.00 96.56 38 A 1 ATOM 283 O OG1 . THR A 1 38 ? 5.984 16.612 3.165 1.00 93.48 38 A 1 ATOM 284 C CG2 . THR A 1 38 ? 3.859 15.548 3.018 1.00 91.54 38 A 1 ATOM 285 N N . ASP A 1 39 ? 7.748 13.163 2.432 1.00 96.09 39 A 1 ATOM 286 C CA . ASP A 1 39 ? 9.096 12.983 1.888 1.00 94.93 39 A 1 ATOM 287 C C . ASP A 1 39 ? 9.272 13.796 0.595 1.00 94.90 39 A 1 ATOM 288 O O . ASP A 1 39 ? 8.613 13.556 -0.422 1.00 93.65 39 A 1 ATOM 289 C CB . ASP A 1 39 ? 9.395 11.483 1.692 1.00 93.48 39 A 1 ATOM 290 C CG . ASP A 1 39 ? 10.824 11.184 1.193 1.00 91.43 39 A 1 ATOM 291 O OD1 . ASP A 1 39 ? 11.608 12.133 0.941 1.00 88.17 39 A 1 ATOM 292 O OD2 . ASP A 1 39 ? 11.160 9.987 1.048 1.00 86.56 39 A 1 ATOM 293 N N . THR A 1 40 ? 10.211 14.742 0.593 1.00 94.42 40 A 1 ATOM 294 C CA . THR A 1 40 ? 10.545 15.567 -0.582 1.00 93.33 40 A 1 ATOM 295 C C . THR A 1 40 ? 11.081 14.748 -1.762 1.00 93.08 40 A 1 ATOM 296 O O . THR A 1 40 ? 10.989 15.185 -2.910 1.00 90.35 40 A 1 ATOM 297 C CB . THR A 1 40 ? 11.574 16.644 -0.213 1.00 92.21 40 A 1 ATOM 298 O OG1 . THR A 1 40 ? 12.717 16.060 0.372 1.00 86.34 40 A 1 ATOM 299 C CG2 . THR A 1 40 ? 11.013 17.655 0.786 1.00 83.78 40 A 1 ATOM 300 N N . ASN A 1 41 ? 11.606 13.547 -1.510 1.00 92.29 41 A 1 ATOM 301 C CA . ASN A 1 41 ? 12.098 12.632 -2.541 1.00 91.15 41 A 1 ATOM 302 C C . ASN A 1 41 ? 11.011 11.705 -3.103 1.00 92.35 41 A 1 ATOM 303 O O . ASN A 1 41 ? 11.296 10.923 -4.015 1.00 90.78 41 A 1 ATOM 304 C CB . ASN A 1 41 ? 13.279 11.827 -1.980 1.00 89.92 41 A 1 ATOM 305 C CG . ASN A 1 41 ? 14.408 12.729 -1.535 1.00 87.85 41 A 1 ATOM 306 O OD1 . ASN A 1 41 ? 14.999 13.451 -2.319 1.00 81.20 41 A 1 ATOM 307 N ND2 . ASN A 1 41 ? 14.721 12.728 -0.260 1.00 80.45 41 A 1 ATOM 308 N N . TYR A 1 42 ? 9.776 11.787 -2.592 1.00 93.51 42 A 1 ATOM 309 C CA . TYR A 1 42 ? 8.696 10.926 -3.056 1.00 94.48 42 A 1 ATOM 310 C C . TYR A 1 42 ? 8.372 11.174 -4.537 1.00 95.04 42 A 1 ATOM 311 O O . TYR A 1 42 ? 8.257 12.313 -4.999 1.00 94.06 42 A 1 ATOM 312 C CB . TYR A 1 42 ? 7.460 11.092 -2.168 1.00 94.64 42 A 1 ATOM 313 C CG . TYR A 1 42 ? 6.441 9.988 -2.386 1.00 95.16 42 A 1 ATOM 314 C CD1 . TYR A 1 42 ? 5.426 10.129 -3.354 1.00 93.73 42 A 1 ATOM 315 C CD2 . TYR A 1 42 ? 6.536 8.795 -1.642 1.00 93.82 42 A 1 ATOM 316 C CE1 . TYR A 1 42 ? 4.516 9.080 -3.581 1.00 93.65 42 A 1 ATOM 317 C CE2 . TYR A 1 42 ? 5.626 7.744 -1.868 1.00 93.64 42 A 1 ATOM 318 C CZ . TYR A 1 42 ? 4.618 7.882 -2.841 1.00 94.34 42 A 1 ATOM 319 O OH . TYR A 1 42 ? 3.751 6.864 -3.069 1.00 93.40 42 A 1 ATOM 320 N N . VAL A 1 43 ? 8.201 10.081 -5.295 1.00 94.19 43 A 1 ATOM 321 C CA . VAL A 1 43 ? 7.839 10.112 -6.716 1.00 94.12 43 A 1 ATOM 322 C C . VAL A 1 43 ? 6.406 9.619 -6.866 1.00 94.97 43 A 1 ATOM 323 O O . VAL A 1 43 ? 6.109 8.443 -6.651 1.00 94.33 43 A 1 ATOM 324 C CB . VAL A 1 43 ? 8.824 9.290 -7.571 1.00 93.34 43 A 1 ATOM 325 C CG1 . VAL A 1 43 ? 8.437 9.318 -9.058 1.00 90.15 43 A 1 ATOM 326 C CG2 . VAL A 1 43 ? 10.252 9.844 -7.453 1.00 90.16 43 A 1 ATOM 327 N N . PHE A 1 44 ? 5.515 10.522 -7.266 1.00 95.00 44 A 1 ATOM 328 C CA . PHE A 1 44 ? 4.121 10.183 -7.517 1.00 95.07 44 A 1 ATOM 329 C C . PHE A 1 44 ? 3.947 9.509 -8.873 1.00 94.84 44 A 1 ATOM 330 O O . PHE A 1 44 ? 4.464 9.973 -9.889 1.00 93.78 44 A 1 ATOM 331 C CB . PHE A 1 44 ? 3.237 11.429 -7.421 1.00 95.19 44 A 1 ATOM 332 C CG . PHE A 1 44 ? 3.102 11.932 -6.003 1.00 96.07 44 A 1 ATOM 333 C CD1 . PHE A 1 44 ? 2.180 11.318 -5.134 1.00 94.84 44 A 1 ATOM 334 C CD2 . PHE A 1 44 ? 3.930 12.971 -5.540 1.00 95.08 44 A 1 ATOM 335 C CE1 . PHE A 1 44 ? 2.097 11.727 -3.796 1.00 94.72 44 A 1 ATOM 336 C CE2 . PHE A 1 44 ? 3.846 13.376 -4.202 1.00 94.77 44 A 1 ATOM 337 C CZ . PHE A 1 44 ? 2.936 12.747 -3.331 1.00 95.55 44 A 1 ATOM 338 N N . ARG A 1 45 ? 3.140 8.446 -8.888 1.00 95.22 45 A 1 ATOM 339 C CA . ARG A 1 45 ? 2.636 7.838 -10.119 1.00 94.81 45 A 1 ATOM 340 C C . ARG A 1 45 ? 1.365 8.561 -10.536 1.00 95.69 45 A 1 ATOM 341 O O . ARG A 1 45 ? 0.418 8.636 -9.752 1.00 95.14 45 A 1 ATOM 342 C CB . ARG A 1 45 ? 2.397 6.350 -9.902 1.00 92.72 45 A 1 ATOM 343 C CG . ARG A 1 45 ? 3.729 5.610 -9.746 1.00 89.41 45 A 1 ATOM 344 C CD . ARG A 1 45 ? 3.485 4.143 -9.399 1.00 87.37 45 A 1 ATOM 345 N NE . ARG A 1 45 ? 3.036 4.001 -8.010 1.00 82.57 45 A 1 ATOM 346 C CZ . ARG A 1 45 ? 2.796 2.852 -7.404 1.00 81.10 45 A 1 ATOM 347 N NH1 . ARG A 1 45 ? 2.815 1.720 -8.049 1.00 73.89 45 A 1 ATOM 348 N NH2 . ARG A 1 45 ? 2.547 2.827 -6.130 1.00 70.19 45 A 1 ATOM 349 N N . LYS A 1 46 ? 1.343 9.076 -11.765 1.00 94.96 46 A 1 ATOM 350 C CA . LYS A 1 46 ? 0.284 9.958 -12.277 1.00 95.04 46 A 1 ATOM 351 C C . LYS A 1 46 ? -1.110 9.339 -12.169 1.00 95.95 46 A 1 ATOM 352 O O . LYS A 1 46 ? -2.024 10.010 -11.698 1.00 95.75 46 A 1 ATOM 353 C CB . LYS A 1 46 ? 0.628 10.338 -13.721 1.00 93.50 46 A 1 ATOM 354 C CG . LYS A 1 46 ? -0.371 11.339 -14.327 1.00 85.00 46 A 1 ATOM 355 C CD . LYS A 1 46 ? 0.037 11.664 -15.767 1.00 83.26 46 A 1 ATOM 356 C CE . LYS A 1 46 ? -0.987 12.597 -16.427 1.00 73.18 46 A 1 ATOM 357 N NZ . LYS A 1 46 ? -0.644 12.819 -17.854 1.00 65.48 46 A 1 ATOM 358 N N . GLU A 1 47 ? -1.268 8.080 -12.576 1.00 95.02 47 A 1 ATOM 359 C CA . GLU A 1 47 ? -2.566 7.400 -12.570 1.00 95.25 47 A 1 ATOM 360 C C . GLU A 1 47 ? -3.083 7.185 -11.145 1.00 96.52 47 A 1 ATOM 361 O O . GLU A 1 47 ? -4.196 7.603 -10.826 1.00 96.42 47 A 1 ATOM 362 C CB . GLU A 1 47 ? -2.478 6.076 -13.346 1.00 93.77 47 A 1 ATOM 363 C CG . GLU A 1 47 ? -2.041 6.244 -14.810 1.00 80.87 47 A 1 ATOM 364 C CD . GLU A 1 47 ? -2.949 7.220 -15.575 1.00 72.84 47 A 1 ATOM 365 O OE1 . GLU A 1 47 ? -2.500 8.344 -15.935 1.00 65.04 47 A 1 ATOM 366 O OE2 . GLU A 1 47 ? -4.146 6.930 -15.723 1.00 63.21 47 A 1 ATOM 367 N N . PHE A 1 48 ? -2.244 6.671 -10.248 1.00 96.01 48 A 1 ATOM 368 C CA . PHE A 1 48 ? -2.606 6.477 -8.845 1.00 96.98 48 A 1 ATOM 369 C C . PHE A 1 48 ? -2.967 7.801 -8.158 1.00 97.61 48 A 1 ATOM 370 O O . PHE A 1 48 ? -3.990 7.896 -7.486 1.00 97.50 48 A 1 ATOM 371 C CB . PHE A 1 48 ? -1.453 5.780 -8.117 1.00 96.89 48 A 1 ATOM 372 C CG . PHE A 1 48 ? -1.731 5.525 -6.645 1.00 97.12 48 A 1 ATOM 373 C CD1 . PHE A 1 48 ? -0.846 5.999 -5.655 1.00 95.91 48 A 1 ATOM 374 C CD2 . PHE A 1 48 ? -2.892 4.829 -6.258 1.00 95.88 48 A 1 ATOM 375 C CE1 . PHE A 1 48 ? -1.120 5.765 -4.294 1.00 95.40 48 A 1 ATOM 376 C CE2 . PHE A 1 48 ? -3.167 4.604 -4.897 1.00 95.49 48 A 1 ATOM 377 C CZ . PHE A 1 48 ? -2.281 5.069 -3.915 1.00 96.06 48 A 1 ATOM 378 N N . LEU A 1 49 ? -2.166 8.855 -8.369 1.00 97.29 49 A 1 ATOM 379 C CA . LEU A 1 49 ? -2.473 10.188 -7.854 1.00 97.62 49 A 1 ATOM 380 C C . LEU A 1 49 ? -3.834 10.678 -8.361 1.00 97.92 49 A 1 ATOM 381 O O . LEU A 1 49 ? -4.636 11.164 -7.570 1.00 97.88 49 A 1 ATOM 382 C CB . LEU A 1 49 ? -1.339 11.158 -8.239 1.00 97.61 49 A 1 ATOM 383 C CG . LEU A 1 49 ? -1.595 12.614 -7.798 1.00 97.25 49 A 1 ATOM 384 C CD1 . LEU A 1 49 ? -1.647 12.757 -6.279 1.00 96.51 49 A 1 ATOM 385 C CD2 . LEU A 1 49 ? -0.490 13.527 -8.313 1.00 96.45 49 A 1 ATOM 386 N N . ARG A 1 50 ? -4.108 10.542 -9.663 1.00 97.71 50 A 1 ATOM 387 C CA . ARG A 1 50 ? -5.382 10.959 -10.266 1.00 97.74 50 A 1 ATOM 388 C C . ARG A 1 50 ? -6.573 10.255 -9.613 1.00 98.03 50 A 1 ATOM 389 O O . ARG A 1 50 ? -7.547 10.920 -9.274 1.00 97.89 50 A 1 ATOM 390 C CB . ARG A 1 50 ? -5.348 10.684 -11.781 1.00 96.92 50 A 1 ATOM 391 C CG . ARG A 1 50 ? -6.617 11.187 -12.488 1.00 94.52 50 A 1 ATOM 392 C CD . ARG A 1 50 ? -6.638 10.808 -13.977 1.00 92.17 50 A 1 ATOM 393 N NE . ARG A 1 50 ? -6.890 9.372 -14.174 1.00 84.10 50 A 1 ATOM 394 C CZ . ARG A 1 50 ? -6.490 8.625 -15.185 1.00 79.83 50 A 1 ATOM 395 N NH1 . ARG A 1 50 ? -5.923 9.123 -16.242 1.00 71.03 50 A 1 ATOM 396 N NH2 . ARG A 1 50 ? -6.639 7.338 -15.136 1.00 70.62 50 A 1 ATOM 397 N N . GLU A 1 51 ? -6.491 8.941 -9.442 1.00 98.00 51 A 1 ATOM 398 C CA . GLU A 1 51 ? -7.566 8.131 -8.855 1.00 98.10 51 A 1 ATOM 399 C C . GLU A 1 51 ? -7.837 8.506 -7.395 1.00 98.34 51 A 1 ATOM 400 O O . GLU A 1 51 ? -8.987 8.735 -7.023 1.00 98.06 51 A 1 ATOM 401 C CB . GLU A 1 51 ? -7.199 6.652 -8.976 1.00 97.64 51 A 1 ATOM 402 C CG . GLU A 1 51 ? -7.277 6.158 -10.435 1.00 95.91 51 A 1 ATOM 403 C CD . GLU A 1 51 ? -6.714 4.743 -10.618 1.00 94.48 51 A 1 ATOM 404 O OE1 . GLU A 1 51 ? -6.623 4.312 -11.792 1.00 87.21 51 A 1 ATOM 405 O OE2 . GLU A 1 51 ? -6.354 4.115 -9.598 1.00 88.06 51 A 1 ATOM 406 N N . VAL A 1 52 ? -6.775 8.662 -6.588 1.00 98.30 52 A 1 ATOM 407 C CA . VAL A 1 52 ? -6.911 9.078 -5.183 1.00 98.45 52 A 1 ATOM 408 C C . VAL A 1 52 ? -7.480 10.495 -5.076 1.00 98.53 52 A 1 ATOM 409 O O . VAL A 1 52 ? -8.405 10.718 -4.303 1.00 98.37 52 A 1 ATOM 410 C CB . VAL A 1 52 ? -5.572 8.954 -4.431 1.00 98.39 52 A 1 ATOM 411 C CG1 . VAL A 1 52 ? -5.683 9.464 -2.984 1.00 97.91 52 A 1 ATOM 412 C CG2 . VAL A 1 52 ? -5.109 7.496 -4.361 1.00 97.91 52 A 1 ATOM 413 N N . LEU A 1 53 ? -6.992 11.457 -5.867 1.00 98.38 53 A 1 ATOM 414 C CA . LEU A 1 53 ? -7.520 12.826 -5.844 1.00 98.28 53 A 1 ATOM 415 C C . LEU A 1 53 ? -8.985 12.896 -6.295 1.00 98.11 53 A 1 ATOM 416 O O . LEU A 1 53 ? -9.760 13.664 -5.730 1.00 97.72 53 A 1 ATOM 417 C CB . LEU A 1 53 ? -6.655 13.748 -6.718 1.00 98.28 53 A 1 ATOM 418 C CG . LEU A 1 53 ? -5.233 14.023 -6.200 1.00 97.85 53 A 1 ATOM 419 C CD1 . LEU A 1 53 ? -4.549 15.007 -7.152 1.00 97.37 53 A 1 ATOM 420 C CD2 . LEU A 1 53 ? -5.207 14.612 -4.792 1.00 97.34 53 A 1 ATOM 421 N N . ALA A 1 54 ? -9.371 12.089 -7.284 1.00 98.28 54 A 1 ATOM 422 C CA . ALA A 1 54 ? -10.762 11.976 -7.714 1.00 98.00 54 A 1 ATOM 423 C C . ALA A 1 54 ? -11.653 11.427 -6.589 1.00 97.99 54 A 1 ATOM 424 O O . ALA A 1 54 ? -12.715 11.986 -6.333 1.00 97.46 54 A 1 ATOM 425 C CB . ALA A 1 54 ? -10.829 11.102 -8.973 1.00 97.57 54 A 1 ATOM 426 N N . TYR A 1 55 ? -11.195 10.395 -5.875 1.00 98.06 55 A 1 ATOM 427 C CA . TYR A 1 55 ? -11.892 9.851 -4.712 1.00 98.06 55 A 1 ATOM 428 C C . TYR A 1 55 ? -11.997 10.863 -3.561 1.00 98.09 55 A 1 ATOM 429 O O . TYR A 1 55 ? -13.082 11.067 -3.019 1.00 97.71 55 A 1 ATOM 430 C CB . TYR A 1 55 ? -11.191 8.569 -4.255 1.00 97.94 55 A 1 ATOM 431 C CG . TYR A 1 55 ? -11.685 8.097 -2.906 1.00 97.96 55 A 1 ATOM 432 C CD1 . TYR A 1 55 ? -10.900 8.307 -1.753 1.00 97.32 55 A 1 ATOM 433 C CD2 . TYR A 1 55 ? -12.969 7.531 -2.790 1.00 97.49 55 A 1 ATOM 434 C CE1 . TYR A 1 55 ? -11.399 7.953 -0.489 1.00 97.04 55 A 1 ATOM 435 C CE2 . TYR A 1 55 ? -13.473 7.178 -1.527 1.00 97.07 55 A 1 ATOM 436 C CZ . TYR A 1 55 ? -12.689 7.393 -0.376 1.00 97.18 55 A 1 ATOM 437 O OH . TYR A 1 55 ? -13.181 7.070 0.846 1.00 96.23 55 A 1 ATOM 438 N N . LEU A 1 56 ? -10.905 11.549 -3.202 1.00 98.12 56 A 1 ATOM 439 C CA . LEU A 1 56 ? -10.929 12.555 -2.133 1.00 97.92 56 A 1 ATOM 440 C C . LEU A 1 56 ? -11.913 13.687 -2.439 1.00 97.55 56 A 1 ATOM 441 O O . LEU A 1 56 ? -12.628 14.139 -1.544 1.00 96.96 56 A 1 ATOM 442 C CB . LEU A 1 56 ? -9.515 13.116 -1.896 1.00 98.07 56 A 1 ATOM 443 C CG . LEU A 1 56 ? -8.509 12.138 -1.258 1.00 97.65 56 A 1 ATOM 444 C CD1 . LEU A 1 56 ? -7.163 12.844 -1.087 1.00 96.98 56 A 1 ATOM 445 C CD2 . LEU A 1 56 ? -8.960 11.619 0.109 1.00 96.83 56 A 1 ATOM 446 N N . LYS A 1 57 ? -11.986 14.108 -3.703 1.00 97.68 57 A 1 ATOM 447 C CA . LYS A 1 57 ? -12.919 15.139 -4.165 1.00 97.06 57 A 1 ATOM 448 C C . LYS A 1 57 ? -14.371 14.655 -4.131 1.00 96.73 57 A 1 ATOM 449 O O . LYS A 1 57 ? -15.230 15.378 -3.643 1.00 95.57 57 A 1 ATOM 450 C CB . LYS A 1 57 ? -12.506 15.584 -5.575 1.00 96.61 57 A 1 ATOM 451 C CG . LYS A 1 57 ? -13.383 16.739 -6.076 1.00 94.33 57 A 1 ATOM 452 C CD . LYS A 1 57 ? -12.986 17.153 -7.495 1.00 90.96 57 A 1 ATOM 453 C CE . LYS A 1 57 ? -13.948 18.252 -7.951 1.00 84.03 57 A 1 ATOM 454 N NZ . LYS A 1 57 ? -13.687 18.653 -9.355 1.00 75.19 57 A 1 ATOM 455 N N . GLU A 1 58 ? -14.634 13.466 -4.663 1.00 96.06 58 A 1 ATOM 456 C CA . GLU A 1 58 ? -15.981 12.924 -4.854 1.00 95.54 58 A 1 ATOM 457 C C . GLU A 1 58 ? -15.992 11.422 -4.514 1.00 95.77 58 A 1 ATOM 458 O O . GLU A 1 58 ? -15.716 10.583 -5.383 1.00 94.28 58 A 1 ATOM 459 C CB . GLU A 1 58 ? -16.430 13.199 -6.305 1.00 94.11 58 A 1 ATOM 460 C CG . GLU A 1 58 ? -17.924 12.914 -6.531 1.00 84.45 58 A 1 ATOM 461 C CD . GLU A 1 58 ? -18.803 13.837 -5.683 1.00 80.66 58 A 1 ATOM 462 O OE1 . GLU A 1 58 ? -19.647 13.300 -4.944 1.00 71.99 58 A 1 ATOM 463 O OE2 . GLU A 1 58 ? -18.583 15.073 -5.775 1.00 72.54 58 A 1 ATOM 464 N N . PRO A 1 59 ? -16.259 11.051 -3.246 1.00 95.08 59 A 1 ATOM 465 C CA . PRO A 1 59 ? -16.287 9.645 -2.836 1.00 94.52 59 A 1 ATOM 466 C C . PRO A 1 59 ? -17.467 8.889 -3.455 1.00 94.16 59 A 1 ATOM 467 O O . PRO A 1 59 ? -17.329 7.710 -3.755 1.00 91.19 59 A 1 ATOM 468 C CB . PRO A 1 59 ? -16.341 9.666 -1.303 1.00 93.70 59 A 1 ATOM 469 C CG . PRO A 1 59 ? -17.008 11.003 -0.990 1.00 92.84 59 A 1 ATOM 470 C CD . PRO A 1 59 ? -16.509 11.920 -2.109 1.00 94.78 59 A 1 ATOM 471 N N . GLY A 1 60 ? -18.601 9.564 -3.698 1.00 93.25 60 A 1 ATOM 472 C CA . GLY A 1 60 ? -19.774 8.944 -4.322 1.00 92.20 60 A 1 ATOM 473 C C . GLY A 1 60 ? -20.474 7.889 -3.459 1.00 92.44 60 A 1 ATOM 474 O O . GLY A 1 60 ? -21.194 7.066 -4.003 1.00 88.77 60 A 1 ATOM 475 N N . GLY A 1 61 ? -20.256 7.919 -2.144 1.00 90.63 61 A 1 ATOM 476 C CA . GLY A 1 61 ? -20.780 6.908 -1.215 1.00 90.24 61 A 1 ATOM 477 C C . GLY A 1 61 ? -19.901 5.660 -1.075 1.00 91.41 61 A 1 ATOM 478 O O . GLY A 1 61 ? -20.264 4.772 -0.319 1.00 89.14 61 A 1 ATOM 479 N N . ASP A 1 62 ? -18.745 5.613 -1.756 1.00 92.09 62 A 1 ATOM 480 C CA . ASP A 1 62 ? -17.787 4.509 -1.645 1.00 92.83 62 A 1 ATOM 481 C C . ASP A 1 62 ? -16.672 4.824 -0.628 1.00 94.22 62 A 1 ATOM 482 O O . ASP A 1 62 ? -16.267 5.977 -0.432 1.00 93.72 62 A 1 ATOM 483 C CB . ASP A 1 62 ? -17.136 4.197 -3.003 1.00 90.71 62 A 1 ATOM 484 C CG . ASP A 1 62 ? -18.084 3.995 -4.187 1.00 88.01 62 A 1 ATOM 485 O OD1 . ASP A 1 62 ? -19.118 3.324 -4.016 1.00 84.24 62 A 1 ATOM 486 O OD2 . ASP A 1 62 ? -17.714 4.523 -5.277 1.00 83.83 62 A 1 ATOM 487 N N . ALA A 1 63 ? -16.077 3.776 -0.063 1.00 93.79 63 A 1 ATOM 488 C CA . ALA A 1 63 ? -14.713 3.805 0.457 1.00 93.88 63 A 1 ATOM 489 C C . ALA A 1 63 ? -13.697 3.464 -0.658 1.00 94.29 63 A 1 ATOM 490 O O . ALA A 1 63 ? -14.053 2.923 -1.703 1.00 93.90 63 A 1 ATOM 491 C CB . ALA A 1 63 ? -14.625 2.865 1.657 1.00 93.26 63 A 1 ATOM 492 N N . LEU A 1 64 ? -12.414 3.782 -0.460 1.00 95.34 64 A 1 ATOM 493 C CA . LEU A 1 64 ? -11.354 3.450 -1.421 1.00 95.84 64 A 1 ATOM 494 C C . LEU A 1 64 ? -10.577 2.216 -0.959 1.00 95.71 64 A 1 ATOM 495 O O . LEU A 1 64 ? -9.953 2.239 0.100 1.00 95.51 64 A 1 ATOM 496 C CB . LEU A 1 64 ? -10.436 4.669 -1.619 1.00 96.39 64 A 1 ATOM 497 C CG . LEU A 1 64 ? -9.332 4.464 -2.677 1.00 96.34 64 A 1 ATOM 498 C CD1 . LEU A 1 64 ? -9.901 4.373 -4.092 1.00 95.94 64 A 1 ATOM 499 C CD2 . LEU A 1 64 ? -8.347 5.630 -2.644 1.00 95.91 64 A 1 ATOM 500 N N . PHE A 1 65 ? -10.534 1.171 -1.782 1.00 93.86 65 A 1 ATOM 501 C CA . PHE A 1 65 ? -9.687 -0.002 -1.565 1.00 93.24 65 A 1 ATOM 502 C C . PHE A 1 65 ? -8.447 0.074 -2.454 1.00 93.67 65 A 1 ATOM 503 O O . PHE A 1 65 ? -8.525 -0.038 -3.679 1.00 93.47 65 A 1 ATOM 504 C CB . PHE A 1 65 ? -10.490 -1.289 -1.796 1.00 91.85 65 A 1 ATOM 505 C CG . PHE A 1 65 ? -9.884 -2.542 -1.183 1.00 90.83 65 A 1 ATOM 506 C CD1 . PHE A 1 65 ? -8.583 -2.969 -1.506 1.00 88.90 65 A 1 ATOM 507 C CD2 . PHE A 1 65 ? -10.641 -3.295 -0.261 1.00 88.84 65 A 1 ATOM 508 C CE1 . PHE A 1 65 ? -8.038 -4.121 -0.907 1.00 87.98 65 A 1 ATOM 509 C CE2 . PHE A 1 65 ? -10.102 -4.454 0.330 1.00 87.87 65 A 1 ATOM 510 C CZ . PHE A 1 65 ? -8.798 -4.866 0.009 1.00 87.47 65 A 1 ATOM 511 N N . VAL A 1 66 ? -7.274 0.224 -1.845 1.00 94.51 66 A 1 ATOM 512 C CA . VAL A 1 66 ? -5.985 0.235 -2.544 1.00 94.87 66 A 1 ATOM 513 C C . VAL A 1 66 ? -5.343 -1.148 -2.455 1.00 93.99 66 A 1 ATOM 514 O O . VAL A 1 66 ? -4.812 -1.536 -1.415 1.00 93.21 66 A 1 ATOM 515 C CB . VAL A 1 66 ? -5.060 1.334 -2.008 1.00 95.54 66 A 1 ATOM 516 C CG1 . VAL A 1 66 ? -3.800 1.431 -2.874 1.00 95.37 66 A 1 ATOM 517 C CG2 . VAL A 1 66 ? -5.739 2.709 -2.012 1.00 95.34 66 A 1 ATOM 518 N N . THR A 1 67 ? -5.350 -1.885 -3.558 1.00 93.08 67 A 1 ATOM 519 C CA . THR A 1 67 ? -4.807 -3.247 -3.629 1.00 92.10 67 A 1 ATOM 520 C C . THR A 1 67 ? -3.500 -3.317 -4.416 1.00 91.52 67 A 1 ATOM 521 O O . THR A 1 67 ? -3.244 -2.514 -5.317 1.00 90.31 67 A 1 ATOM 522 C CB . THR A 1 67 ? -5.852 -4.239 -4.160 1.00 90.50 67 A 1 ATOM 523 O OG1 . THR A 1 67 ? -5.335 -5.550 -4.076 1.00 82.31 67 A 1 ATOM 524 C CG2 . THR A 1 67 ? -6.247 -3.996 -5.614 1.00 83.16 67 A 1 ATOM 525 N N . GLY A 1 68 ? -2.649 -4.286 -4.082 1.00 89.67 68 A 1 ATOM 526 C CA . GLY A 1 68 ? -1.405 -4.553 -4.801 1.00 88.77 68 A 1 ATOM 527 C C . GLY A 1 68 ? -0.337 -5.228 -3.944 1.00 88.90 68 A 1 ATOM 528 O O . GLY A 1 68 ? -0.505 -5.353 -2.729 1.00 87.87 68 A 1 ATOM 529 N N . PRO A 1 69 ? 0.795 -5.637 -4.536 1.00 86.99 69 A 1 ATOM 530 C CA . PRO A 1 69 ? 1.813 -6.411 -3.833 1.00 86.30 69 A 1 ATOM 531 C C . PRO A 1 69 ? 2.461 -5.630 -2.679 1.00 87.95 69 A 1 ATOM 532 O O . PRO A 1 69 ? 2.458 -4.390 -2.630 1.00 87.89 69 A 1 ATOM 533 C CB . PRO A 1 69 ? 2.822 -6.826 -4.911 1.00 84.60 69 A 1 ATOM 534 C CG . PRO A 1 69 ? 2.681 -5.738 -5.974 1.00 83.54 69 A 1 ATOM 535 C CD . PRO A 1 69 ? 1.197 -5.395 -5.914 1.00 85.35 69 A 1 ATOM 536 N N . THR A 1 70 ? 3.050 -6.365 -1.736 1.00 86.65 70 A 1 ATOM 537 C CA . THR A 1 70 ? 3.774 -5.754 -0.617 1.00 85.64 70 A 1 ATOM 538 C C . THR A 1 70 ? 4.912 -4.845 -1.098 1.00 85.92 70 A 1 ATOM 539 O O . THR A 1 70 ? 5.620 -5.132 -2.068 1.00 84.62 70 A 1 ATOM 540 C CB . THR A 1 70 ? 4.264 -6.815 0.374 1.00 83.38 70 A 1 ATOM 541 O OG1 . THR A 1 70 ? 4.724 -6.157 1.538 1.00 76.95 70 A 1 ATOM 542 C CG2 . THR A 1 70 ? 5.400 -7.691 -0.141 1.00 76.72 70 A 1 ATOM 543 N N . GLY A 1 71 ? 5.081 -3.704 -0.439 1.00 86.12 71 A 1 ATOM 544 C CA . GLY A 1 71 ? 6.127 -2.735 -0.783 1.00 85.21 71 A 1 ATOM 545 C C . GLY A 1 71 ? 5.926 -1.978 -2.108 1.00 86.77 71 A 1 ATOM 546 O O . GLY A 1 71 ? 6.855 -1.290 -2.534 1.00 85.22 71 A 1 ATOM 547 N N . SER A 1 72 ? 4.740 -2.037 -2.733 1.00 87.78 72 A 1 ATOM 548 C CA . SER A 1 72 ? 4.407 -1.275 -3.953 1.00 88.36 72 A 1 ATOM 549 C C . SER A 1 72 ? 4.108 0.216 -3.721 1.00 89.89 72 A 1 ATOM 550 O O . SER A 1 72 ? 4.034 0.995 -4.674 1.00 89.32 72 A 1 ATOM 551 C CB . SER A 1 72 ? 3.217 -1.921 -4.664 1.00 87.41 72 A 1 ATOM 552 O OG . SER A 1 72 ? 2.075 -1.873 -3.828 1.00 85.98 72 A 1 ATOM 553 N N . GLY A 1 73 ? 3.941 0.631 -2.473 1.00 91.87 73 A 1 ATOM 554 C CA . GLY A 1 73 ? 3.686 2.028 -2.102 1.00 92.90 73 A 1 ATOM 555 C C . GLY A 1 73 ? 2.217 2.386 -1.845 1.00 94.64 73 A 1 ATOM 556 O O . GLY A 1 73 ? 1.890 3.568 -1.869 1.00 94.16 73 A 1 ATOM 557 N N . LYS A 1 74 ? 1.342 1.412 -1.573 1.00 95.32 74 A 1 ATOM 558 C CA . LYS A 1 74 ? -0.090 1.621 -1.256 1.00 95.97 74 A 1 ATOM 559 C C . LYS A 1 74 ? -0.293 2.648 -0.129 1.00 96.84 74 A 1 ATOM 560 O O . LYS A 1 74 ? -0.758 3.760 -0.379 1.00 97.01 74 A 1 ATOM 561 C CB . LYS A 1 74 ? -0.761 0.285 -0.881 1.00 95.23 74 A 1 ATOM 562 C CG . LYS A 1 74 ? -0.615 -0.814 -1.940 1.00 94.33 74 A 1 ATOM 563 C CD . LYS A 1 74 ? -1.436 -2.057 -1.602 1.00 92.68 74 A 1 ATOM 564 C CE . LYS A 1 74 ? -1.000 -2.815 -0.338 1.00 89.95 74 A 1 ATOM 565 N NZ . LYS A 1 74 ? 0.024 -3.850 -0.616 1.00 88.12 74 A 1 ATOM 566 N N . THR A 1 75 ? 0.139 2.304 1.077 1.00 97.26 75 A 1 ATOM 567 C CA . THR A 1 75 ? 0.020 3.157 2.268 1.00 97.44 75 A 1 ATOM 568 C C . THR A 1 75 ? 0.775 4.475 2.114 1.00 97.83 75 A 1 ATOM 569 O O . THR A 1 75 ? 0.202 5.538 2.321 1.00 97.63 75 A 1 ATOM 570 C CB . THR A 1 75 ? 0.556 2.418 3.499 1.00 96.84 75 A 1 ATOM 571 O OG1 . THR A 1 75 ? -0.063 1.159 3.608 1.00 94.91 75 A 1 ATOM 572 C CG2 . THR A 1 75 ? 0.361 3.192 4.796 1.00 95.06 75 A 1 ATOM 573 N N . SER A 1 76 ? 2.050 4.422 1.698 1.00 97.24 76 A 1 ATOM 574 C CA . SER A 1 76 ? 2.872 5.632 1.570 1.00 96.88 76 A 1 ATOM 575 C C . SER A 1 76 ? 2.319 6.605 0.529 1.00 97.54 76 A 1 ATOM 576 O O . SER A 1 76 ? 2.408 7.804 0.725 1.00 97.29 76 A 1 ATOM 577 C CB . SER A 1 76 ? 4.328 5.285 1.235 1.00 95.55 76 A 1 ATOM 578 O OG . SER A 1 76 ? 4.431 4.568 0.022 1.00 91.85 76 A 1 ATOM 579 N N . GLY A 1 77 ? 1.716 6.117 -0.552 1.00 97.35 77 A 1 ATOM 580 C CA . GLY A 1 77 ? 1.075 6.983 -1.533 1.00 97.65 77 A 1 ATOM 581 C C . GLY A 1 77 ? -0.119 7.746 -0.961 1.00 98.32 77 A 1 ATOM 582 O O . GLY A 1 77 ? -0.237 8.943 -1.197 1.00 98.28 77 A 1 ATOM 583 N N . ILE A 1 78 ? -0.965 7.081 -0.166 1.00 98.36 78 A 1 ATOM 584 C CA . ILE A 1 78 ? -2.099 7.727 0.503 1.00 98.59 78 A 1 ATOM 585 C C . ILE A 1 78 ? -1.616 8.761 1.525 1.00 98.68 78 A 1 ATOM 586 O O . ILE A 1 78 ? -2.068 9.904 1.485 1.00 98.60 78 A 1 ATOM 587 C CB . ILE A 1 78 ? -3.026 6.673 1.145 1.00 98.48 78 A 1 ATOM 588 C CG1 . ILE A 1 78 ? -3.659 5.735 0.090 1.00 97.43 78 A 1 ATOM 589 C CG2 . ILE A 1 78 ? -4.130 7.323 1.996 1.00 97.97 78 A 1 ATOM 590 C CD1 . ILE A 1 78 ? -4.533 6.424 -0.964 1.00 94.57 78 A 1 ATOM 591 N N . THR A 1 79 ? -0.668 8.404 2.391 1.00 98.51 79 A 1 ATOM 592 C CA . THR A 1 79 ? -0.168 9.327 3.423 1.00 98.50 79 A 1 ATOM 593 C C . THR A 1 79 ? 0.593 10.512 2.825 1.00 98.53 79 A 1 ATOM 594 O O . THR A 1 79 ? 0.425 11.637 3.276 1.00 98.27 79 A 1 ATOM 595 C CB . THR A 1 79 ? 0.709 8.612 4.464 1.00 98.18 79 A 1 ATOM 596 O OG1 . THR A 1 79 ? 1.798 7.948 3.868 1.00 95.36 79 A 1 ATOM 597 C CG2 . THR A 1 79 ? -0.084 7.567 5.254 1.00 94.36 79 A 1 ATOM 598 N N . GLU A 1 80 ? 1.355 10.311 1.746 1.00 98.38 80 A 1 ATOM 599 C CA . GLU A 1 80 ? 2.061 11.386 1.039 1.00 98.30 80 A 1 ATOM 600 C C . GLU A 1 80 ? 1.097 12.358 0.334 1.00 98.49 80 A 1 ATOM 601 O O . GLU A 1 80 ? 1.364 13.559 0.273 1.00 98.19 80 A 1 ATOM 602 C CB . GLU A 1 80 ? 3.015 10.766 0.012 1.00 97.78 80 A 1 ATOM 603 C CG . GLU A 1 80 ? 4.271 10.143 0.656 1.00 94.99 80 A 1 ATOM 604 C CD . GLU A 1 80 ? 5.335 11.157 1.074 1.00 95.96 80 A 1 ATOM 605 O OE1 . GLU A 1 80 ? 6.184 10.811 1.910 1.00 89.99 80 A 1 ATOM 606 O OE2 . GLU A 1 80 ? 5.378 12.257 0.488 1.00 91.61 80 A 1 ATOM 607 N N . ILE A 1 81 ? -0.023 11.854 -0.202 1.00 98.47 81 A 1 ATOM 608 C CA . ILE A 1 81 ? -1.081 12.702 -0.773 1.00 98.63 81 A 1 ATOM 609 C C . ILE A 1 81 ? -1.771 13.495 0.340 1.00 98.67 81 A 1 ATOM 610 O O . ILE A 1 81 ? -1.875 14.717 0.230 1.00 98.54 81 A 1 ATOM 611 C CB . ILE A 1 81 ? -2.079 11.858 -1.603 1.00 98.60 81 A 1 ATOM 612 C CG1 . ILE A 1 81 ? -1.393 11.346 -2.892 1.00 98.12 81 A 1 ATOM 613 C CG2 . ILE A 1 81 ? -3.329 12.683 -1.983 1.00 98.25 81 A 1 ATOM 614 C CD1 . ILE A 1 81 ? -2.156 10.218 -3.599 1.00 96.92 81 A 1 ATOM 615 N N . ALA A 1 82 ? -2.189 12.824 1.412 1.00 98.59 82 A 1 ATOM 616 C CA . ALA A 1 82 ? -2.855 13.458 2.546 1.00 98.60 82 A 1 ATOM 617 C C . ALA A 1 82 ? -1.974 14.545 3.188 1.00 98.58 82 A 1 ATOM 618 O O . ALA A 1 82 ? -2.423 15.677 3.340 1.00 98.33 82 A 1 ATOM 619 C CB . ALA A 1 82 ? -3.245 12.364 3.542 1.00 98.49 82 A 1 ATOM 620 N N . GLY A 1 83 ? -0.700 14.249 3.444 1.00 98.55 83 A 1 ATOM 621 C CA . GLY A 1 83 ? 0.251 15.201 4.027 1.00 98.51 83 A 1 ATOM 622 C C . GLY A 1 83 ? 0.428 16.472 3.191 1.00 98.53 83 A 1 ATOM 623 O O . GLY A 1 83 ? 0.439 17.575 3.727 1.00 98.13 83 A 1 ATOM 624 N N . ARG A 1 84 ? 0.484 16.348 1.855 1.00 98.50 84 A 1 ATOM 625 C CA . ARG A 1 84 ? 0.591 17.510 0.949 1.00 98.34 84 A 1 ATOM 626 C C . ARG A 1 84 ? -0.685 18.336 0.820 1.00 98.50 84 A 1 ATOM 627 O O . ARG A 1 84 ? -0.614 19.493 0.404 1.00 98.02 84 A 1 ATOM 628 C CB . ARG A 1 84 ? 1.026 17.038 -0.437 1.00 97.52 84 A 1 ATOM 629 C CG . ARG A 1 84 ? 2.522 16.751 -0.457 1.00 94.93 84 A 1 ATOM 630 C CD . ARG A 1 84 ? 2.904 16.170 -1.815 1.00 94.36 84 A 1 ATOM 631 N NE . ARG A 1 84 ? 4.341 15.856 -1.921 1.00 92.86 84 A 1 ATOM 632 C CZ . ARG A 1 84 ? 4.972 14.950 -1.212 1.00 93.41 84 A 1 ATOM 633 N NH1 . ARG A 1 84 ? 4.368 14.303 -0.281 1.00 86.85 84 A 1 ATOM 634 N NH2 . ARG A 1 84 ? 6.221 14.657 -1.406 1.00 88.36 84 A 1 ATOM 635 N N . LEU A 1 85 ? -1.826 17.756 1.143 1.00 98.31 85 A 1 ATOM 636 C CA . LEU A 1 85 ? -3.119 18.437 1.172 1.00 98.38 85 A 1 ATOM 637 C C . LEU A 1 85 ? -3.495 18.918 2.583 1.00 98.43 85 A 1 ATOM 638 O O . LEU A 1 85 ? -4.635 19.324 2.789 1.00 98.02 85 A 1 ATOM 639 C CB . LEU A 1 85 ? -4.188 17.508 0.566 1.00 98.37 85 A 1 ATOM 640 C CG . LEU A 1 85 ? -3.964 17.146 -0.915 1.00 98.05 85 A 1 ATOM 641 C CD1 . LEU A 1 85 ? -5.080 16.204 -1.371 1.00 97.50 85 A 1 ATOM 642 C CD2 . LEU A 1 85 ? -3.954 18.371 -1.835 1.00 97.35 85 A 1 ATOM 643 N N . ASN A 1 86 ? -2.563 18.847 3.536 1.00 98.39 86 A 1 ATOM 644 C CA . ASN A 1 86 ? -2.795 19.074 4.962 1.00 98.36 86 A 1 ATOM 645 C C . ASN A 1 86 ? -3.976 18.248 5.507 1.00 98.48 86 A 1 ATOM 646 O O . ASN A 1 86 ? -4.680 18.687 6.410 1.00 97.94 86 A 1 ATOM 647 C CB . ASN A 1 86 ? -2.947 20.575 5.246 1.00 97.97 86 A 1 ATOM 648 C CG . ASN A 1 86 ? -1.747 21.416 4.869 1.00 97.56 86 A 1 ATOM 649 O OD1 . ASN A 1 86 ? -0.608 20.978 4.840 1.00 92.51 86 A 1 ATOM 650 N ND2 . ASN A 1 86 ? -1.973 22.679 4.589 1.00 92.23 86 A 1 ATOM 651 N N . TRP A 1 87 ? -4.237 17.077 4.944 1.00 98.52 87 A 1 ATOM 652 C CA . TRP A 1 87 ? -5.370 16.245 5.342 1.00 98.60 87 A 1 ATOM 653 C C . TRP A 1 87 ? -4.970 15.347 6.515 1.00 98.68 87 A 1 ATOM 654 O O . TRP A 1 87 ? -4.108 14.476 6.334 1.00 98.37 87 A 1 ATOM 655 C CB . TRP A 1 87 ? -5.878 15.441 4.145 1.00 98.30 87 A 1 ATOM 656 C CG . TRP A 1 87 ? -7.324 15.057 4.194 1.00 98.12 87 A 1 ATOM 657 C CD1 . TRP A 1 87 ? -7.970 14.440 5.218 1.00 97.27 87 A 1 ATOM 658 C CD2 . TRP A 1 87 ? -8.335 15.269 3.160 1.00 97.99 87 A 1 ATOM 659 N NE1 . TRP A 1 87 ? -9.300 14.257 4.887 1.00 97.04 87 A 1 ATOM 660 C CE2 . TRP A 1 87 ? -9.573 14.737 3.623 1.00 97.56 87 A 1 ATOM 661 C CE3 . TRP A 1 87 ? -8.314 15.848 1.872 1.00 96.94 87 A 1 ATOM 662 C CZ2 . TRP A 1 87 ? -10.736 14.760 2.836 1.00 96.79 87 A 1 ATOM 663 C CZ3 . TRP A 1 87 ? -9.472 15.879 1.076 1.00 96.94 87 A 1 ATOM 664 C CH2 . TRP A 1 87 ? -10.679 15.329 1.554 1.00 96.55 87 A 1 ATOM 665 N N . PRO A 1 88 ? -5.559 15.512 7.718 1.00 98.59 88 A 1 ATOM 666 C CA . PRO A 1 88 ? -5.232 14.667 8.858 1.00 98.57 88 A 1 ATOM 667 C C . PRO A 1 88 ? -5.622 13.205 8.610 1.00 98.64 88 A 1 ATOM 668 O O . PRO A 1 88 ? -6.639 12.919 7.973 1.00 98.48 88 A 1 ATOM 669 C CB . PRO A 1 88 ? -5.970 15.260 10.061 1.00 98.29 88 A 1 ATOM 670 C CG . PRO A 1 88 ? -6.305 16.688 9.632 1.00 96.90 88 A 1 ATOM 671 C CD . PRO A 1 88 ? -6.486 16.558 8.125 1.00 98.22 88 A 1 ATOM 672 N N . VAL A 1 89 ? -4.819 12.270 9.117 1.00 98.53 89 A 1 ATOM 673 C CA . VAL A 1 89 ? -5.008 10.827 8.912 1.00 98.62 89 A 1 ATOM 674 C C . VAL A 1 89 ? -5.065 10.104 10.253 1.00 98.56 89 A 1 ATOM 675 O O . VAL A 1 89 ? -4.123 10.161 11.036 1.00 98.08 89 A 1 ATOM 676 C CB . VAL A 1 89 ? -3.903 10.226 8.014 1.00 98.48 89 A 1 ATOM 677 C CG1 . VAL A 1 89 ? -4.139 8.733 7.746 1.00 97.70 89 A 1 ATOM 678 C CG2 . VAL A 1 89 ? -3.830 10.926 6.652 1.00 97.61 89 A 1 ATOM 679 N N . GLN A 1 90 ? -6.147 9.368 10.483 1.00 98.62 90 A 1 ATOM 680 C CA . GLN A 1 90 ? -6.247 8.376 11.550 1.00 98.53 90 A 1 ATOM 681 C C . GLN A 1 90 ? -5.872 7.020 10.960 1.00 98.45 90 A 1 ATOM 682 O O . GLN A 1 90 ? -6.647 6.420 10.218 1.00 97.95 90 A 1 ATOM 683 C CB . GLN A 1 90 ? -7.664 8.375 12.137 1.00 98.27 90 A 1 ATOM 684 C CG . GLN A 1 90 ? -8.033 9.700 12.824 1.00 96.69 90 A 1 ATOM 685 C CD . GLN A 1 90 ? -7.223 9.996 14.079 1.00 97.46 90 A 1 ATOM 686 O OE1 . GLN A 1 90 ? -6.628 9.132 14.700 1.00 91.38 90 A 1 ATOM 687 N NE2 . GLN A 1 90 ? -7.184 11.230 14.515 1.00 91.19 90 A 1 ATOM 688 N N . GLN A 1 91 ? -4.649 6.570 11.234 1.00 98.16 91 A 1 ATOM 689 C CA . GLN A 1 91 ? -4.092 5.358 10.635 1.00 97.87 91 A 1 ATOM 690 C C . GLN A 1 91 ? -4.031 4.217 11.645 1.00 97.64 91 A 1 ATOM 691 O O . GLN A 1 91 ? -3.470 4.366 12.724 1.00 96.57 91 A 1 ATOM 692 C CB . GLN A 1 91 ? -2.716 5.669 10.029 1.00 96.87 91 A 1 ATOM 693 C CG . GLN A 1 91 ? -2.099 4.436 9.351 1.00 94.24 91 A 1 ATOM 694 C CD . GLN A 1 91 ? -0.737 4.711 8.727 1.00 94.67 91 A 1 ATOM 695 O OE1 . GLN A 1 91 ? -0.460 5.739 8.144 1.00 87.72 91 A 1 ATOM 696 N NE2 . GLN A 1 91 ? 0.183 3.773 8.798 1.00 87.28 91 A 1 ATOM 697 N N . ILE A 1 92 ? -4.512 3.048 11.225 1.00 97.55 92 A 1 ATOM 698 C CA . ILE A 1 92 ? -4.363 1.782 11.947 1.00 97.04 92 A 1 ATOM 699 C C . ILE A 1 92 ? -3.813 0.697 11.011 1.00 97.15 92 A 1 ATOM 700 O O . ILE A 1 92 ? -3.902 0.804 9.788 1.00 96.54 92 A 1 ATOM 701 C CB . ILE A 1 92 ? -5.697 1.348 12.596 1.00 95.74 92 A 1 ATOM 702 C CG1 . ILE A 1 92 ? -6.793 1.114 11.536 1.00 82.04 92 A 1 ATOM 703 C CG2 . ILE A 1 92 ? -6.149 2.380 13.647 1.00 81.68 92 A 1 ATOM 704 C CD1 . ILE A 1 92 ? -7.904 0.216 12.048 1.00 74.92 92 A 1 ATOM 705 N N . THR A 1 93 ? -3.253 -0.370 11.596 1.00 96.35 93 A 1 ATOM 706 C CA . THR A 1 93 ? -2.922 -1.597 10.863 1.00 95.74 93 A 1 ATOM 707 C C . THR A 1 93 ? -3.803 -2.716 11.393 1.00 95.31 93 A 1 ATOM 708 O O . THR A 1 93 ? -3.806 -2.969 12.596 1.00 94.26 93 A 1 ATOM 709 C CB . THR A 1 93 ? -1.439 -1.950 10.984 1.00 95.06 93 A 1 ATOM 710 O OG1 . THR A 1 93 ? -0.661 -0.883 10.476 1.00 93.04 93 A 1 ATOM 711 C CG2 . THR A 1 93 ? -1.069 -3.188 10.170 1.00 92.64 93 A 1 ATOM 712 N N . ALA A 1 94 ? -4.570 -3.344 10.506 1.00 93.50 94 A 1 ATOM 713 C CA . ALA A 1 94 ? -5.460 -4.431 10.861 1.00 92.68 94 A 1 ATOM 714 C C . ALA A 1 94 ? -4.673 -5.703 11.214 1.00 92.24 94 A 1 ATOM 715 O O . ALA A 1 94 ? -3.580 -5.953 10.707 1.00 90.60 94 A 1 ATOM 716 C CB . ALA A 1 94 ? -6.445 -4.657 9.714 1.00 91.72 94 A 1 ATOM 717 N N . HIS A 1 95 ? -5.254 -6.509 12.098 1.00 91.39 95 A 1 ATOM 718 C CA . HIS A 1 95 ? -4.760 -7.829 12.464 1.00 90.41 95 A 1 ATOM 719 C C . HIS A 1 95 ? -5.940 -8.717 12.872 1.00 89.70 95 A 1 ATOM 720 O O . HIS A 1 95 ? -6.990 -8.209 13.239 1.00 88.55 95 A 1 ATOM 721 C CB . HIS A 1 95 ? -3.727 -7.697 13.590 1.00 90.10 95 A 1 ATOM 722 C CG . HIS A 1 95 ? -4.242 -7.039 14.856 1.00 90.57 95 A 1 ATOM 723 N ND1 . HIS A 1 95 ? -5.133 -7.562 15.757 1.00 84.33 95 A 1 ATOM 724 C CD2 . HIS A 1 95 ? -3.878 -5.811 15.342 1.00 84.92 95 A 1 ATOM 725 C CE1 . HIS A 1 95 ? -5.310 -6.672 16.752 1.00 84.85 95 A 1 ATOM 726 N NE2 . HIS A 1 95 ? -4.553 -5.591 16.549 1.00 86.16 95 A 1 ATOM 727 N N . GLY A 1 96 ? -5.772 -10.041 12.887 1.00 87.94 96 A 1 ATOM 728 C CA . GLY A 1 96 ? -6.874 -10.989 13.140 1.00 86.84 96 A 1 ATOM 729 C C . GLY A 1 96 ? -7.503 -10.973 14.544 1.00 87.64 96 A 1 ATOM 730 O O . GLY A 1 96 ? -8.385 -11.769 14.817 1.00 85.11 96 A 1 ATOM 731 N N . ARG A 1 97 ? -7.032 -10.124 15.458 1.00 89.34 97 A 1 ATOM 732 C CA . ARG A 1 97 ? -7.617 -9.893 16.796 1.00 89.72 97 A 1 ATOM 733 C C . ARG A 1 97 ? -8.103 -8.455 16.985 1.00 90.82 97 A 1 ATOM 734 O O . ARG A 1 97 ? -8.323 -8.045 18.114 1.00 88.44 97 A 1 ATOM 735 C CB . ARG A 1 97 ? -6.620 -10.262 17.908 1.00 87.89 97 A 1 ATOM 736 C CG . ARG A 1 97 ? -6.217 -11.741 17.908 1.00 82.18 97 A 1 ATOM 737 C CD . ARG A 1 97 ? -5.345 -12.059 19.131 1.00 75.90 97 A 1 ATOM 738 N NE . ARG A 1 97 ? -4.040 -11.365 19.078 1.00 68.40 97 A 1 ATOM 739 C CZ . ARG A 1 97 ? -3.090 -11.416 20.003 1.00 59.50 97 A 1 ATOM 740 N NH1 . ARG A 1 97 ? -3.233 -12.112 21.097 1.00 54.70 97 A 1 ATOM 741 N NH2 . ARG A 1 97 ? -1.976 -10.764 19.840 1.00 51.91 97 A 1 ATOM 742 N N . MET A 1 98 ? -8.166 -7.678 15.917 1.00 90.05 98 A 1 ATOM 743 C CA . MET A 1 98 ? -8.704 -6.322 15.955 1.00 90.51 98 A 1 ATOM 744 C C . MET A 1 98 ? -10.211 -6.398 16.145 1.00 90.69 98 A 1 ATOM 745 O O . MET A 1 98 ? -10.882 -7.074 15.369 1.00 88.95 98 A 1 ATOM 746 C CB . MET A 1 98 ? -8.355 -5.600 14.652 1.00 89.29 98 A 1 ATOM 747 C CG . MET A 1 98 ? -8.808 -4.137 14.638 1.00 85.80 98 A 1 ATOM 748 S SD . MET A 1 98 ? -8.521 -3.314 13.043 1.00 83.12 98 A 1 ATOM 749 C CE . MET A 1 98 ? -9.885 -4.052 12.100 1.00 72.76 98 A 1 ATOM 750 N N . GLU A 1 99 ? -10.727 -5.684 17.135 1.00 90.91 99 A 1 ATOM 751 C CA . GLU A 1 99 ? -12.154 -5.584 17.409 1.00 91.01 99 A 1 ATOM 752 C C . GLU A 1 99 ? -12.697 -4.231 16.932 1.00 91.79 99 A 1 ATOM 753 O O . GLU A 1 99 ? -11.997 -3.214 16.908 1.00 90.38 99 A 1 ATOM 754 C CB . GLU A 1 99 ? -12.422 -5.795 18.911 1.00 89.21 99 A 1 ATOM 755 C CG . GLU A 1 99 ? -12.045 -7.207 19.405 1.00 83.66 99 A 1 ATOM 756 C CD . GLU A 1 99 ? -12.335 -7.434 20.907 1.00 81.53 99 A 1 ATOM 757 O OE1 . GLU A 1 99 ? -11.997 -8.534 21.404 1.00 72.13 99 A 1 ATOM 758 O OE2 . GLU A 1 99 ? -12.880 -6.520 21.574 1.00 72.60 99 A 1 ATOM 759 N N . LEU A 1 100 ? -13.987 -4.178 16.595 1.00 90.64 100 A 1 ATOM 760 C CA . LEU A 1 100 ? -14.648 -2.926 16.211 1.00 90.63 100 A 1 ATOM 761 C C . LEU A 1 100 ? -14.557 -1.858 17.322 1.00 91.88 100 A 1 ATOM 762 O O . LEU A 1 100 ? -14.489 -0.655 17.050 1.00 91.11 100 A 1 ATOM 763 C CB . LEU A 1 100 ? -16.111 -3.254 15.858 1.00 89.12 100 A 1 ATOM 764 C CG . LEU A 1 100 ? -16.937 -2.036 15.414 1.00 84.98 100 A 1 ATOM 765 C CD1 . LEU A 1 100 ? -16.424 -1.424 14.111 1.00 82.29 100 A 1 ATOM 766 C CD2 . LEU A 1 100 ? -18.396 -2.445 15.225 1.00 81.94 100 A 1 ATOM 767 N N . THR A 1 101 ? -14.533 -2.290 18.588 1.00 92.13 101 A 1 ATOM 768 C CA . THR A 1 101 ? -14.378 -1.421 19.762 1.00 91.85 101 A 1 ATOM 769 C C . THR A 1 101 ? -13.044 -0.673 19.782 1.00 92.77 101 A 1 ATOM 770 O O . THR A 1 101 ? -13.024 0.482 20.212 1.00 91.60 101 A 1 ATOM 771 C CB . THR A 1 101 ? -14.534 -2.228 21.061 1.00 90.02 101 A 1 ATOM 772 O OG1 . THR A 1 101 ? -13.715 -3.364 21.032 1.00 80.17 101 A 1 ATOM 773 C CG2 . THR A 1 101 ? -15.976 -2.708 21.256 1.00 77.92 101 A 1 ATOM 774 N N . ASP A 1 102 ? -11.969 -1.250 19.238 1.00 91.62 102 A 1 ATOM 775 C CA . ASP A 1 102 ? -10.669 -0.575 19.096 1.00 91.09 102 A 1 ATOM 776 C C . ASP A 1 102 ? -10.761 0.634 18.152 1.00 92.98 102 A 1 ATOM 777 O O . ASP A 1 102 ? -10.041 1.628 18.302 1.00 92.42 102 A 1 ATOM 778 C CB . ASP A 1 102 ? -9.615 -1.546 18.535 1.00 89.48 102 A 1 ATOM 779 C CG . ASP A 1 102 ? -9.331 -2.758 19.422 1.00 86.30 102 A 1 ATOM 780 O OD1 . ASP A 1 102 ? -9.300 -2.568 20.660 1.00 82.89 102 A 1 ATOM 781 O OD2 . ASP A 1 102 ? -9.062 -3.835 18.836 1.00 82.04 102 A 1 ATOM 782 N N . LEU A 1 103 ? -11.679 0.570 17.182 1.00 93.09 103 A 1 ATOM 783 C CA . LEU A 1 103 ? -11.891 1.622 16.192 1.00 94.30 103 A 1 ATOM 784 C C . LEU A 1 103 ? -12.818 2.725 16.710 1.00 95.72 103 A 1 ATOM 785 O O . LEU A 1 103 ? -12.587 3.909 16.451 1.00 95.53 103 A 1 ATOM 786 C CB . LEU A 1 103 ? -12.462 1.014 14.899 1.00 93.73 103 A 1 ATOM 787 C CG . LEU A 1 103 ? -11.716 -0.212 14.350 1.00 92.66 103 A 1 ATOM 788 C CD1 . LEU A 1 103 ? -12.283 -0.568 12.975 1.00 90.06 103 A 1 ATOM 789 C CD2 . LEU A 1 103 ? -10.219 0.042 14.224 1.00 89.59 103 A 1 ATOM 790 N N . ILE A 1 104 ? -13.874 2.335 17.440 1.00 94.90 104 A 1 ATOM 791 C CA . ILE A 1 104 ? -14.894 3.254 17.959 1.00 95.38 104 A 1 ATOM 792 C C . ILE A 1 104 ? -14.401 3.967 19.219 1.00 95.99 104 A 1 ATOM 793 O O . ILE A 1 104 ? -14.551 5.187 19.352 1.00 95.31 104 A 1 ATOM 794 C CB . ILE A 1 104 ? -16.213 2.486 18.207 1.00 94.53 104 A 1 ATOM 795 C CG1 . ILE A 1 104 ? -16.793 1.985 16.861 1.00 91.35 104 A 1 ATOM 796 C CG2 . ILE A 1 104 ? -17.238 3.375 18.933 1.00 91.43 104 A 1 ATOM 797 C CD1 . ILE A 1 104 ? -18.025 1.083 17.014 1.00 86.37 104 A 1 ATOM 798 N N . GLY A 1 105 ? -13.810 3.217 20.150 1.00 95.34 105 A 1 ATOM 799 C CA . GLY A 1 105 ? -13.369 3.684 21.456 1.00 94.97 105 A 1 ATOM 800 C C . GLY A 1 105 ? -13.919 2.851 22.610 1.00 94.81 105 A 1 ATOM 801 O O . GLY A 1 105 ? -14.744 1.962 22.434 1.00 92.82 105 A 1 ATOM 802 N N . HIS A 1 106 ? -13.441 3.165 23.806 1.00 94.68 106 A 1 ATOM 803 C CA . HIS A 1 106 ? -13.756 2.425 25.026 1.00 93.89 106 A 1 ATOM 804 C C . HIS A 1 106 ? -13.767 3.347 26.247 1.00 94.41 106 A 1 ATOM 805 O O . HIS A 1 106 ? -13.223 4.455 26.221 1.00 93.36 106 A 1 ATOM 806 C CB . HIS A 1 106 ? -12.744 1.278 25.204 1.00 91.83 106 A 1 ATOM 807 C CG . HIS A 1 106 ? -11.308 1.736 25.310 1.00 89.78 106 A 1 ATOM 808 N ND1 . HIS A 1 106 ? -10.456 1.983 24.260 1.00 81.57 106 A 1 ATOM 809 C CD2 . HIS A 1 106 ? -10.609 1.999 26.459 1.00 80.53 106 A 1 ATOM 810 C CE1 . HIS A 1 106 ? -9.279 2.386 24.762 1.00 80.56 106 A 1 ATOM 811 N NE2 . HIS A 1 106 ? -9.321 2.411 26.098 1.00 82.46 106 A 1 ATOM 812 N N . HIS A 1 107 ? -14.380 2.885 27.333 1.00 93.28 107 A 1 ATOM 813 C CA . HIS A 1 107 ? -14.283 3.566 28.620 1.00 92.95 107 A 1 ATOM 814 C C . HIS A 1 107 ? -12.935 3.281 29.290 1.00 92.85 107 A 1 ATOM 815 O O . HIS A 1 107 ? -12.529 2.131 29.434 1.00 90.46 107 A 1 ATOM 816 C CB . HIS A 1 107 ? -15.442 3.163 29.521 1.00 92.00 107 A 1 ATOM 817 C CG . HIS A 1 107 ? -16.711 3.897 29.187 1.00 90.85 107 A 1 ATOM 818 N ND1 . HIS A 1 107 ? -16.968 5.224 29.454 1.00 79.43 107 A 1 ATOM 819 C CD2 . HIS A 1 107 ? -17.822 3.373 28.592 1.00 81.06 107 A 1 ATOM 820 C CE1 . HIS A 1 107 ? -18.211 5.490 29.032 1.00 82.58 107 A 1 ATOM 821 N NE2 . HIS A 1 107 ? -18.767 4.393 28.500 1.00 84.29 107 A 1 ATOM 822 N N . ALA A 1 108 ? -12.283 4.335 29.766 1.00 92.21 108 A 1 ATOM 823 C CA . ALA A 1 108 ? -11.047 4.240 30.529 1.00 91.71 108 A 1 ATOM 824 C C . ALA A 1 108 ? -11.160 5.025 31.843 1.00 92.61 108 A 1 ATOM 825 O O . ALA A 1 108 ? -11.839 6.050 31.925 1.00 90.60 108 A 1 ATOM 826 C CB . ALA A 1 108 ? -9.883 4.722 29.659 1.00 89.92 108 A 1 ATOM 827 N N . LEU A 1 109 ? -10.465 4.542 32.878 1.00 91.74 109 A 1 ATOM 828 C CA . LEU A 1 109 ? -10.245 5.296 34.108 1.00 91.52 109 A 1 ATOM 829 C C . LEU A 1 109 ? -9.117 6.299 33.865 1.00 91.59 109 A 1 ATOM 830 O O . LEU A 1 109 ? -7.965 5.909 33.659 1.00 89.42 109 A 1 ATOM 831 C CB . LEU A 1 109 ? -9.909 4.334 35.261 1.00 90.26 109 A 1 ATOM 832 C CG . LEU A 1 109 ? -11.121 3.557 35.805 1.00 85.25 109 A 1 ATOM 833 C CD1 . LEU A 1 109 ? -10.643 2.452 36.746 1.00 80.05 109 A 1 ATOM 834 C CD2 . LEU A 1 109 ? -12.076 4.460 36.593 1.00 81.93 109 A 1 ATOM 835 N N . VAL A 1 110 ? -9.440 7.591 33.889 1.00 90.75 110 A 1 ATOM 836 C CA . VAL A 1 110 ? -8.470 8.666 33.655 1.00 90.37 110 A 1 ATOM 837 C C . VAL A 1 110 ? -8.415 9.592 34.865 1.00 91.61 110 A 1 ATOM 838 O O . VAL A 1 110 ? -9.444 10.025 35.381 1.00 89.62 110 A 1 ATOM 839 C CB . VAL A 1 110 ? -8.747 9.436 32.348 1.00 87.51 110 A 1 ATOM 840 C CG1 . VAL A 1 110 ? -8.594 8.512 31.128 1.00 79.61 110 A 1 ATOM 841 C CG2 . VAL A 1 110 ? -10.131 10.087 32.285 1.00 80.87 110 A 1 ATOM 842 N N . ALA A 1 111 ? -7.209 9.915 35.329 1.00 90.04 111 A 1 ATOM 843 C CA . ALA A 1 111 ? -6.970 10.960 36.316 1.00 88.90 111 A 1 ATOM 844 C C . ALA A 1 111 ? -6.410 12.191 35.591 1.00 88.61 111 A 1 ATOM 845 O O . ALA A 1 111 ? -5.433 12.078 34.854 1.00 85.85 111 A 1 ATOM 846 C CB . ALA A 1 111 ? -6.029 10.428 37.403 1.00 87.31 111 A 1 ATOM 847 N N . GLU A 1 112 ? -7.019 13.363 35.787 1.00 88.36 112 A 1 ATOM 848 C CA . GLU A 1 112 ? -6.566 14.593 35.113 1.00 86.74 112 A 1 ATOM 849 C C . GLU A 1 112 ? -5.159 15.028 35.555 1.00 88.20 112 A 1 ATOM 850 O O . GLU A 1 112 ? -4.418 15.641 34.785 1.00 83.80 112 A 1 ATOM 851 C CB . GLU A 1 112 ? -7.535 15.748 35.384 1.00 82.36 112 A 1 ATOM 852 C CG . GLU A 1 112 ? -8.917 15.555 34.752 1.00 74.76 112 A 1 ATOM 853 C CD . GLU A 1 112 ? -9.771 16.834 34.835 1.00 68.99 112 A 1 ATOM 854 O OE1 . GLU A 1 112 ? -10.760 16.897 34.071 1.00 64.13 112 A 1 ATOM 855 O OE2 . GLU A 1 112 ? -9.413 17.740 35.622 1.00 63.98 112 A 1 ATOM 856 N N . LYS A 1 113 ? -4.802 14.716 36.802 1.00 88.50 113 A 1 ATOM 857 C CA . LYS A 1 113 ? -3.485 14.992 37.381 1.00 89.29 113 A 1 ATOM 858 C C . LYS A 1 113 ? -3.030 13.810 38.242 1.00 90.90 113 A 1 ATOM 859 O O . LYS A 1 113 ? -3.870 13.142 38.847 1.00 89.55 113 A 1 ATOM 860 C CB . LYS A 1 113 ? -3.526 16.282 38.218 1.00 86.95 113 A 1 ATOM 861 C CG . LYS A 1 113 ? -3.860 17.517 37.373 1.00 82.64 113 A 1 ATOM 862 C CD . LYS A 1 113 ? -3.910 18.784 38.229 1.00 78.65 113 A 1 ATOM 863 C CE . LYS A 1 113 ? -4.375 19.948 37.350 1.00 74.67 113 A 1 ATOM 864 N NZ . LYS A 1 113 ? -4.602 21.180 38.143 1.00 66.12 113 A 1 ATOM 865 N N . PRO A 1 114 ? -1.715 13.591 38.375 1.00 90.17 114 A 1 ATOM 866 C CA . PRO A 1 114 ? -1.174 12.598 39.298 1.00 89.40 114 A 1 ATOM 867 C C . PRO A 1 114 ? -1.718 12.793 40.721 1.00 89.94 114 A 1 ATOM 868 O O . PRO A 1 114 ? -1.677 13.900 41.259 1.00 87.30 114 A 1 ATOM 869 C CB . PRO A 1 114 ? 0.349 12.773 39.243 1.00 88.01 114 A 1 ATOM 870 C CG . PRO A 1 114 ? 0.591 13.375 37.858 1.00 85.58 114 A 1 ATOM 871 C CD . PRO A 1 114 ? -0.638 14.256 37.650 1.00 87.57 114 A 1 ATOM 872 N N . GLY A 1 115 ? -2.242 11.713 41.323 1.00 90.45 115 A 1 ATOM 873 C CA . GLY A 1 115 ? -2.797 11.714 42.680 1.00 90.27 115 A 1 ATOM 874 C C . GLY A 1 115 ? -4.274 12.114 42.802 1.00 91.65 115 A 1 ATOM 875 O O . GLY A 1 115 ? -4.816 12.041 43.900 1.00 88.86 115 A 1 ATOM 876 N N . GLN A 1 116 ? -4.949 12.500 41.715 1.00 92.44 116 A 1 ATOM 877 C CA . GLN A 1 116 ? -6.403 12.684 41.713 1.00 92.42 116 A 1 ATOM 878 C C . GLN A 1 116 ? -7.133 11.335 41.553 1.00 93.31 116 A 1 ATOM 879 O O . GLN A 1 116 ? -6.610 10.442 40.884 1.00 91.86 116 A 1 ATOM 880 C CB . GLN A 1 116 ? -6.838 13.680 40.630 1.00 90.44 116 A 1 ATOM 881 C CG . GLN A 1 116 ? -6.398 15.108 40.982 1.00 85.66 116 A 1 ATOM 882 C CD . GLN A 1 116 ? -6.932 16.160 40.018 1.00 81.43 116 A 1 ATOM 883 O OE1 . GLN A 1 116 ? -7.295 15.915 38.885 1.00 75.87 116 A 1 ATOM 884 N NE2 . GLN A 1 116 ? -6.984 17.410 40.424 1.00 73.98 116 A 1 ATOM 885 N N . PRO A 1 117 ? -8.342 11.179 42.149 1.00 93.09 117 A 1 ATOM 886 C CA . PRO A 1 117 ? -9.140 9.981 41.939 1.00 92.80 117 A 1 ATOM 887 C C . PRO A 1 117 ? -9.497 9.851 40.449 1.00 92.98 117 A 1 ATOM 888 O O . PRO A 1 117 ? -9.905 10.840 39.829 1.00 90.49 117 A 1 ATOM 889 C CB . PRO A 1 117 ? -10.379 10.137 42.829 1.00 91.55 117 A 1 ATOM 890 C CG . PRO A 1 117 ? -10.518 11.648 42.990 1.00 90.01 117 A 1 ATOM 891 C CD . PRO A 1 117 ? -9.076 12.148 42.954 1.00 92.23 117 A 1 ATOM 892 N N . PRO A 1 118 ? -9.331 8.664 39.852 1.00 93.20 118 A 1 ATOM 893 C CA . PRO A 1 118 ? -9.665 8.461 38.457 1.00 92.37 118 A 1 ATOM 894 C C . PRO A 1 118 ? -11.183 8.501 38.247 1.00 93.12 118 A 1 ATOM 895 O O . PRO A 1 118 ? -11.957 8.009 39.067 1.00 91.67 118 A 1 ATOM 896 C CB . PRO A 1 118 ? -9.046 7.118 38.080 1.00 90.10 118 A 1 ATOM 897 C CG . PRO A 1 118 ? -9.067 6.347 39.402 1.00 86.74 118 A 1 ATOM 898 C CD . PRO A 1 118 ? -8.836 7.432 40.449 1.00 90.11 118 A 1 ATOM 899 N N . VAL A 1 119 ? -11.604 9.059 37.120 1.00 92.19 119 A 1 ATOM 900 C CA . VAL A 1 119 ? -12.991 9.087 36.655 1.00 91.81 119 A 1 ATOM 901 C C . VAL A 1 119 ? -13.125 8.254 35.382 1.00 92.25 119 A 1 ATOM 902 O O . VAL A 1 119 ? -12.199 8.196 34.567 1.00 90.30 119 A 1 ATOM 903 C CB . VAL A 1 119 ? -13.515 10.524 36.464 1.00 90.00 119 A 1 ATOM 904 C CG1 . VAL A 1 119 ? -13.550 11.272 37.806 1.00 81.28 119 A 1 ATOM 905 C CG2 . VAL A 1 119 ? -12.703 11.350 35.462 1.00 82.14 119 A 1 ATOM 906 N N . MET A 1 120 ? -14.279 7.602 35.220 1.00 92.69 120 A 1 ATOM 907 C CA . MET A 1 120 ? -14.596 6.900 33.976 1.00 92.41 120 A 1 ATOM 908 C C . MET A 1 120 ? -14.856 7.919 32.869 1.00 93.02 120 A 1 ATOM 909 O O . MET A 1 120 ? -15.749 8.756 32.986 1.00 91.22 120 A 1 ATOM 910 C CB . MET A 1 120 ? -15.817 5.987 34.159 1.00 90.40 120 A 1 ATOM 911 C CG . MET A 1 120 ? -15.478 4.710 34.934 1.00 81.54 120 A 1 ATOM 912 S SD . MET A 1 120 ? -14.278 3.608 34.131 1.00 76.98 120 A 1 ATOM 913 C CE . MET A 1 120 ? -15.307 2.871 32.836 1.00 66.85 120 A 1 ATOM 914 N N . LYS A 1 121 ? -14.101 7.835 31.778 1.00 93.54 121 A 1 ATOM 915 C CA . LYS A 1 121 ? -14.264 8.682 30.597 1.00 93.19 121 A 1 ATOM 916 C C . LYS A 1 121 ? -14.249 7.821 29.341 1.00 94.17 121 A 1 ATOM 917 O O . LYS A 1 121 ? -13.452 6.895 29.228 1.00 92.63 121 A 1 ATOM 918 C CB . LYS A 1 121 ? -13.167 9.757 30.599 1.00 90.84 121 A 1 ATOM 919 C CG . LYS A 1 121 ? -13.367 10.800 29.491 1.00 79.86 121 A 1 ATOM 920 C CD . LYS A 1 121 ? -12.332 11.920 29.604 1.00 78.75 121 A 1 ATOM 921 C CE . LYS A 1 121 ? -12.546 12.950 28.495 1.00 70.87 121 A 1 ATOM 922 N NZ . LYS A 1 121 ? -11.567 14.058 28.587 1.00 63.18 121 A 1 ATOM 923 N N . PHE A 1 122 ? -15.120 8.152 28.390 1.00 93.60 122 A 1 ATOM 924 C CA . PHE A 1 122 ? -15.066 7.522 27.079 1.00 94.17 122 A 1 ATOM 925 C C . PHE A 1 122 ? -13.903 8.102 26.265 1.00 94.65 122 A 1 ATOM 926 O O . PHE A 1 122 ? -13.820 9.315 26.048 1.00 93.78 122 A 1 ATOM 927 C CB . PHE A 1 122 ? -16.407 7.665 26.358 1.00 93.92 122 A 1 ATOM 928 C CG . PHE A 1 122 ? -16.493 6.754 25.151 1.00 94.92 122 A 1 ATOM 929 C CD1 . PHE A 1 122 ? -16.177 7.236 23.868 1.00 93.71 122 A 1 ATOM 930 C CD2 . PHE A 1 122 ? -16.845 5.404 25.322 1.00 94.27 122 A 1 ATOM 931 C CE1 . PHE A 1 122 ? -16.217 6.371 22.764 1.00 93.70 122 A 1 ATOM 932 C CE2 . PHE A 1 122 ? -16.885 4.540 24.217 1.00 93.89 122 A 1 ATOM 933 C CZ . PHE A 1 122 ? -16.573 5.022 22.938 1.00 94.67 122 A 1 ATOM 934 N N . MET A 1 123 ? -13.000 7.225 25.838 1.00 95.46 123 A 1 ATOM 935 C CA . MET A 1 123 ? -11.863 7.543 24.983 1.00 95.44 123 A 1 ATOM 936 C C . MET A 1 123 ? -12.226 7.166 23.547 1.00 96.33 123 A 1 ATOM 937 O O . MET A 1 123 ? -12.363 5.982 23.240 1.00 95.69 123 A 1 ATOM 938 C CB . MET A 1 123 ? -10.621 6.782 25.471 1.00 94.22 123 A 1 ATOM 939 C CG . MET A 1 123 ? -10.216 7.169 26.903 1.00 88.19 123 A 1 ATOM 940 S SD . MET A 1 123 ? -9.824 8.922 27.192 1.00 84.46 123 A 1 ATOM 941 C CE . MET A 1 123 ? -8.321 9.070 26.191 1.00 70.05 123 A 1 ATOM 942 N N . TYR A 1 124 ? -12.421 8.167 22.692 1.00 96.72 124 A 1 ATOM 943 C CA . TYR A 1 124 ? -12.770 7.929 21.291 1.00 97.15 124 A 1 ATOM 944 C C . TYR A 1 124 ? -11.623 7.249 20.547 1.00 97.38 124 A 1 ATOM 945 O O . TYR A 1 124 ? -10.472 7.681 20.644 1.00 96.51 124 A 1 ATOM 946 C CB . TYR A 1 124 ? -13.159 9.237 20.590 1.00 96.82 124 A 1 ATOM 947 C CG . TYR A 1 124 ? -14.402 9.881 21.166 1.00 96.83 124 A 1 ATOM 948 C CD1 . TYR A 1 124 ? -15.674 9.390 20.813 1.00 95.21 124 A 1 ATOM 949 C CD2 . TYR A 1 124 ? -14.284 10.941 22.085 1.00 95.22 124 A 1 ATOM 950 C CE1 . TYR A 1 124 ? -16.832 9.959 21.384 1.00 94.57 124 A 1 ATOM 951 C CE2 . TYR A 1 124 ? -15.438 11.508 22.660 1.00 94.56 124 A 1 ATOM 952 C CZ . TYR A 1 124 ? -16.712 11.016 22.309 1.00 94.96 124 A 1 ATOM 953 O OH . TYR A 1 124 ? -17.817 11.565 22.873 1.00 93.13 124 A 1 ATOM 954 N N . GLY A 1 125 ? -11.961 6.214 19.793 1.00 96.70 125 A 1 ATOM 955 C CA . GLY A 1 125 ? -11.050 5.531 18.894 1.00 96.70 125 A 1 ATOM 956 C C . GLY A 1 125 ? -10.846 6.286 17.575 1.00 97.47 125 A 1 ATOM 957 O O . GLY A 1 125 ? -11.533 7.276 17.291 1.00 97.42 125 A 1 ATOM 958 N N . PRO A 1 126 ? -9.919 5.819 16.739 1.00 97.48 126 A 1 ATOM 959 C CA . PRO A 1 126 ? -9.515 6.499 15.507 1.00 97.56 126 A 1 ATOM 960 C C . PRO A 1 126 ? -10.660 6.685 14.504 1.00 98.01 126 A 1 ATOM 961 O O . PRO A 1 126 ? -10.713 7.716 13.838 1.00 97.78 126 A 1 ATOM 962 C CB . PRO A 1 126 ? -8.385 5.633 14.933 1.00 96.79 126 A 1 ATOM 963 C CG . PRO A 1 126 ? -8.621 4.254 15.542 1.00 95.11 126 A 1 ATOM 964 C CD . PRO A 1 126 ? -9.165 4.589 16.920 1.00 96.83 126 A 1 ATOM 965 N N . LEU A 1 127 ? -11.606 5.746 14.411 1.00 97.38 127 A 1 ATOM 966 C CA . LEU A 1 127 ? -12.781 5.883 13.546 1.00 97.32 127 A 1 ATOM 967 C C . LEU A 1 127 ? -13.695 7.027 14.005 1.00 97.62 127 A 1 ATOM 968 O O . LEU A 1 127 ? -14.076 7.879 13.201 1.00 97.34 127 A 1 ATOM 969 C CB . LEU A 1 127 ? -13.540 4.546 13.515 1.00 96.73 127 A 1 ATOM 970 C CG . LEU A 1 127 ? -14.876 4.597 12.753 1.00 95.81 127 A 1 ATOM 971 C CD1 . LEU A 1 127 ? -14.683 4.949 11.281 1.00 94.21 127 A 1 ATOM 972 C CD2 . LEU A 1 127 ? -15.583 3.255 12.864 1.00 93.98 127 A 1 ATOM 973 N N . ALA A 1 128 ? -14.033 7.068 15.295 1.00 97.63 128 A 1 ATOM 974 C CA . ALA A 1 128 ? -14.917 8.085 15.856 1.00 97.60 128 A 1 ATOM 975 C C . ALA A 1 128 ? -14.321 9.496 15.726 1.00 97.70 128 A 1 ATOM 976 O O . ALA A 1 128 ? -15.023 10.437 15.349 1.00 97.36 128 A 1 ATOM 977 C CB . ALA A 1 128 ? -15.204 7.717 17.316 1.00 97.18 128 A 1 ATOM 978 N N . VAL A 1 129 ? -13.008 9.635 15.969 1.00 97.92 129 A 1 ATOM 979 C CA . VAL A 1 129 ? -12.268 10.890 15.753 1.00 97.97 129 A 1 ATOM 980 C C . VAL A 1 129 ? -12.298 11.280 14.277 1.00 98.08 129 A 1 ATOM 981 O O . VAL A 1 129 ? -12.679 12.404 13.950 1.00 97.71 129 A 1 ATOM 982 C CB . VAL A 1 129 ? -10.820 10.780 16.268 1.00 97.70 129 A 1 ATOM 983 C CG1 . VAL A 1 129 ? -9.999 12.044 15.966 1.00 95.99 129 A 1 ATOM 984 C CG2 . VAL A 1 129 ? -10.791 10.575 17.787 1.00 96.05 129 A 1 ATOM 985 N N . ALA A 1 130 ? -11.974 10.354 13.373 1.00 97.91 130 A 1 ATOM 986 C CA . ALA A 1 130 ? -11.952 10.624 11.938 1.00 97.91 130 A 1 ATOM 987 C C . ALA A 1 130 ? -13.317 11.092 11.415 1.00 97.80 130 A 1 ATOM 988 O O . ALA A 1 130 ? -13.389 12.092 10.696 1.00 97.43 130 A 1 ATOM 989 C CB . ALA A 1 130 ? -11.471 9.371 11.201 1.00 97.87 130 A 1 ATOM 990 N N . MET A 1 131 ? -14.400 10.425 11.810 1.00 97.86 131 A 1 ATOM 991 C CA . MET A 1 131 ? -15.760 10.798 11.405 1.00 97.41 131 A 1 ATOM 992 C C . MET A 1 131 ? -16.172 12.178 11.914 1.00 97.21 131 A 1 ATOM 993 O O . MET A 1 131 ? -16.806 12.931 11.180 1.00 96.11 131 A 1 ATOM 994 C CB . MET A 1 131 ? -16.772 9.765 11.908 1.00 96.39 131 A 1 ATOM 995 C CG . MET A 1 131 ? -16.730 8.480 11.089 1.00 89.96 131 A 1 ATOM 996 S SD . MET A 1 131 ? -18.053 7.310 11.484 1.00 90.15 131 A 1 ATOM 997 C CE . MET A 1 131 ? -19.473 8.098 10.691 1.00 82.14 131 A 1 ATOM 998 N N . ARG A 1 132 ? -15.822 12.511 13.157 1.00 97.76 132 A 1 ATOM 999 C CA . ARG A 1 132 ? -16.184 13.784 13.793 1.00 97.41 132 A 1 ATOM 1000 C C . ARG A 1 132 ? -15.407 14.966 13.219 1.00 97.40 132 A 1 ATOM 1001 O O . ARG A 1 132 ? -15.983 16.029 13.004 1.00 96.45 132 A 1 ATOM 1002 C CB . ARG A 1 132 ? -15.963 13.640 15.303 1.00 96.03 132 A 1 ATOM 1003 C CG . ARG A 1 132 ? -16.382 14.889 16.091 1.00 87.45 132 A 1 ATOM 1004 C CD . ARG A 1 132 ? -16.145 14.702 17.588 1.00 89.01 132 A 1 ATOM 1005 N NE . ARG A 1 132 ? -16.990 13.615 18.125 1.00 79.98 132 A 1 ATOM 1006 C CZ . ARG A 1 132 ? -16.993 13.134 19.344 1.00 75.35 132 A 1 ATOM 1007 N NH1 . ARG A 1 132 ? -16.192 13.552 20.277 1.00 67.42 132 A 1 ATOM 1008 N NH2 . ARG A 1 132 ? -17.833 12.196 19.651 1.00 63.01 132 A 1 ATOM 1009 N N . GLU A 1 133 ? -14.107 14.781 12.992 1.00 97.38 133 A 1 ATOM 1010 C CA . GLU A 1 133 ? -13.172 15.867 12.662 1.00 97.20 133 A 1 ATOM 1011 C C . GLU A 1 133 ? -12.858 15.966 11.160 1.00 97.51 133 A 1 ATOM 1012 O O . GLU A 1 133 ? -12.191 16.901 10.722 1.00 96.50 133 A 1 ATOM 1013 C CB . GLU A 1 133 ? -11.900 15.721 13.508 1.00 96.68 133 A 1 ATOM 1014 C CG . GLU A 1 133 ? -12.188 15.827 15.020 1.00 94.78 133 A 1 ATOM 1015 C CD . GLU A 1 133 ? -10.928 15.815 15.903 1.00 91.68 133 A 1 ATOM 1016 O OE1 . GLU A 1 133 ? -11.110 15.725 17.141 1.00 82.28 133 A 1 ATOM 1017 O OE2 . GLU A 1 133 ? -9.806 15.923 15.365 1.00 83.24 133 A 1 ATOM 1018 N N . GLY A 1 134 ? -13.365 15.039 10.341 1.00 97.26 134 A 1 ATOM 1019 C CA . GLY A 1 134 ? -13.161 15.042 8.890 1.00 97.35 134 A 1 ATOM 1020 C C . GLY A 1 134 ? -11.789 14.527 8.464 1.00 97.77 134 A 1 ATOM 1021 O O . GLY A 1 134 ? -11.274 14.927 7.418 1.00 97.11 134 A 1 ATOM 1022 N N . HIS A 1 135 ? -11.180 13.661 9.269 1.00 98.06 135 A 1 ATOM 1023 C CA . HIS A 1 135 ? -9.908 13.038 8.922 1.00 98.22 135 A 1 ATOM 1024 C C . HIS A 1 135 ? -10.106 11.923 7.884 1.00 98.15 135 A 1 ATOM 1025 O O . HIS A 1 135 ? -11.204 11.400 7.680 1.00 97.77 135 A 1 ATOM 1026 C CB . HIS A 1 135 ? -9.196 12.519 10.186 1.00 98.15 135 A 1 ATOM 1027 C CG . HIS A 1 135 ? -8.876 13.550 11.245 1.00 98.17 135 A 1 ATOM 1028 N ND1 . HIS A 1 135 ? -8.232 13.288 12.444 1.00 94.29 135 A 1 ATOM 1029 C CD2 . HIS A 1 135 ? -9.131 14.891 11.220 1.00 94.54 135 A 1 ATOM 1030 C CE1 . HIS A 1 135 ? -8.119 14.450 13.110 1.00 94.67 135 A 1 ATOM 1031 N NE2 . HIS A 1 135 ? -8.642 15.448 12.398 1.00 95.26 135 A 1 ATOM 1032 N N . LEU A 1 136 ? -9.021 11.543 7.223 1.00 98.48 136 A 1 ATOM 1033 C CA . LEU A 1 136 ? -8.962 10.316 6.442 1.00 98.52 136 A 1 ATOM 1034 C C . LEU A 1 136 ? -8.727 9.147 7.403 1.00 98.58 136 A 1 ATOM 1035 O O . LEU A 1 136 ? -7.715 9.108 8.099 1.00 98.21 136 A 1 ATOM 1036 C CB . LEU A 1 136 ? -7.892 10.483 5.352 1.00 98.03 136 A 1 ATOM 1037 C CG . LEU A 1 136 ? -7.822 9.330 4.336 1.00 95.27 136 A 1 ATOM 1038 C CD1 . LEU A 1 136 ? -7.146 9.831 3.056 1.00 89.54 136 A 1 ATOM 1039 C CD2 . LEU A 1 136 ? -6.994 8.142 4.835 1.00 89.00 136 A 1 ATOM 1040 N N . PHE A 1 137 ? -9.644 8.188 7.427 1.00 98.05 137 A 1 ATOM 1041 C CA . PHE A 1 137 ? -9.484 6.949 8.182 1.00 97.86 137 A 1 ATOM 1042 C C . PHE A 1 137 ? -8.809 5.898 7.305 1.00 97.82 137 A 1 ATOM 1043 O O . PHE A 1 137 ? -9.365 5.487 6.287 1.00 97.39 137 A 1 ATOM 1044 C CB . PHE A 1 137 ? -10.846 6.491 8.711 1.00 97.50 137 A 1 ATOM 1045 C CG . PHE A 1 137 ? -10.764 5.280 9.615 1.00 97.36 137 A 1 ATOM 1046 C CD1 . PHE A 1 137 ? -11.540 4.137 9.342 1.00 96.17 137 A 1 ATOM 1047 C CD2 . PHE A 1 137 ? -9.915 5.294 10.735 1.00 96.38 137 A 1 ATOM 1048 C CE1 . PHE A 1 137 ? -11.475 3.023 10.194 1.00 95.64 137 A 1 ATOM 1049 C CE2 . PHE A 1 137 ? -9.840 4.175 11.578 1.00 95.62 137 A 1 ATOM 1050 C CZ . PHE A 1 137 ? -10.622 3.044 11.309 1.00 95.86 137 A 1 ATOM 1051 N N . LEU A 1 138 ? -7.578 5.499 7.652 1.00 98.17 138 A 1 ATOM 1052 C CA . LEU A 1 138 ? -6.739 4.592 6.873 1.00 98.17 138 A 1 ATOM 1053 C C . LEU A 1 138 ? -6.529 3.273 7.620 1.00 97.86 138 A 1 ATOM 1054 O O . LEU A 1 138 ? -5.811 3.231 8.619 1.00 97.28 138 A 1 ATOM 1055 C CB . LEU A 1 138 ? -5.410 5.302 6.538 1.00 98.17 138 A 1 ATOM 1056 C CG . LEU A 1 138 ? -4.388 4.445 5.770 1.00 97.77 138 A 1 ATOM 1057 C CD1 . LEU A 1 138 ? -4.920 3.942 4.427 1.00 96.89 138 A 1 ATOM 1058 C CD2 . LEU A 1 138 ? -3.135 5.279 5.489 1.00 96.91 138 A 1 ATOM 1059 N N . ILE A 1 139 ? -7.092 2.190 7.084 1.00 96.93 139 A 1 ATOM 1060 C CA . ILE A 1 139 ? -6.894 0.826 7.583 1.00 96.24 139 A 1 ATOM 1061 C C . ILE A 1 139 ? -5.891 0.115 6.673 1.00 96.04 139 A 1 ATOM 1062 O O . ILE A 1 139 ? -6.188 -0.197 5.516 1.00 95.28 139 A 1 ATOM 1063 C CB . ILE A 1 139 ? -8.220 0.042 7.678 1.00 95.29 139 A 1 ATOM 1064 C CG1 . ILE A 1 139 ? -9.342 0.865 8.353 1.00 93.88 139 A 1 ATOM 1065 C CG2 . ILE A 1 139 ? -7.968 -1.288 8.412 1.00 93.62 139 A 1 ATOM 1066 C CD1 . ILE A 1 139 ? -10.680 0.133 8.469 1.00 90.61 139 A 1 ATOM 1067 N N . ASN A 1 140 ? -4.679 -0.146 7.181 1.00 96.54 140 A 1 ATOM 1068 C CA . ASN A 1 140 ? -3.692 -0.944 6.462 1.00 95.87 140 A 1 ATOM 1069 C C . ASN A 1 140 ? -3.927 -2.437 6.686 1.00 94.64 140 A 1 ATOM 1070 O O . ASN A 1 140 ? -4.328 -2.838 7.770 1.00 93.33 140 A 1 ATOM 1071 C CB . ASN A 1 140 ? -2.279 -0.556 6.893 1.00 95.95 140 A 1 ATOM 1072 C CG . ASN A 1 140 ? -1.934 0.862 6.522 1.00 95.07 140 A 1 ATOM 1073 O OD1 . ASN A 1 140 ? -1.999 1.273 5.365 1.00 88.22 140 A 1 ATOM 1074 N ND2 . ASN A 1 140 ? -1.507 1.641 7.479 1.00 88.19 140 A 1 ATOM 1075 N N . GLU A 1 141 ? -3.586 -3.243 5.671 1.00 93.92 141 A 1 ATOM 1076 C CA . GLU A 1 141 ? -3.635 -4.709 5.743 1.00 92.45 141 A 1 ATOM 1077 C C . GLU A 1 141 ? -5.019 -5.223 6.166 1.00 91.92 141 A 1 ATOM 1078 O O . GLU A 1 141 ? -5.153 -6.149 6.952 1.00 89.65 141 A 1 ATOM 1079 C CB . GLU A 1 141 ? -2.461 -5.253 6.589 1.00 91.27 141 A 1 ATOM 1080 C CG . GLU A 1 141 ? -1.101 -4.795 6.031 1.00 88.23 141 A 1 ATOM 1081 C CD . GLU A 1 141 ? 0.128 -5.353 6.772 1.00 85.43 141 A 1 ATOM 1082 O OE1 . GLU A 1 141 ? 1.244 -5.164 6.210 1.00 77.65 141 A 1 ATOM 1083 O OE2 . GLU A 1 141 ? 0.000 -5.903 7.879 1.00 77.73 141 A 1 ATOM 1084 N N . VAL A 1 142 ? -6.077 -4.597 5.613 1.00 90.35 142 A 1 ATOM 1085 C CA . VAL A 1 142 ? -7.477 -4.901 5.966 1.00 89.22 142 A 1 ATOM 1086 C C . VAL A 1 142 ? -7.840 -6.369 5.733 1.00 87.48 142 A 1 ATOM 1087 O O . VAL A 1 142 ? -8.709 -6.907 6.402 1.00 85.12 142 A 1 ATOM 1088 C CB . VAL A 1 142 ? -8.430 -3.963 5.203 1.00 88.72 142 A 1 ATOM 1089 C CG1 . VAL A 1 142 ? -8.552 -4.307 3.708 1.00 83.37 142 A 1 ATOM 1090 C CG2 . VAL A 1 142 ? -9.823 -3.932 5.829 1.00 84.03 142 A 1 ATOM 1091 N N . ASP A 1 143 ? -7.148 -7.019 4.809 1.00 88.41 143 A 1 ATOM 1092 C CA . ASP A 1 143 ? -7.295 -8.435 4.485 1.00 86.20 143 A 1 ATOM 1093 C C . ASP A 1 143 ? -6.748 -9.385 5.570 1.00 85.56 143 A 1 ATOM 1094 O O . ASP A 1 143 ? -6.974 -10.588 5.482 1.00 82.23 143 A 1 ATOM 1095 C CB . ASP A 1 143 ? -6.712 -8.701 3.080 1.00 82.79 143 A 1 ATOM 1096 C CG . ASP A 1 143 ? -5.300 -8.163 2.773 1.00 81.56 143 A 1 ATOM 1097 O OD1 . ASP A 1 143 ? -4.694 -7.443 3.595 1.00 75.92 143 A 1 ATOM 1098 O OD2 . ASP A 1 143 ? -4.852 -8.358 1.612 1.00 77.31 143 A 1 ATOM 1099 N N . LEU A 1 144 ? -6.101 -8.861 6.623 1.00 86.84 144 A 1 ATOM 1100 C CA . LEU A 1 144 ? -5.723 -9.625 7.819 1.00 85.79 144 A 1 ATOM 1101 C C . LEU A 1 144 ? -6.781 -9.593 8.935 1.00 85.59 144 A 1 ATOM 1102 O O . LEU A 1 144 ? -6.667 -10.351 9.899 1.00 83.78 144 A 1 ATOM 1103 C CB . LEU A 1 144 ? -4.381 -9.104 8.369 1.00 84.72 144 A 1 ATOM 1104 C CG . LEU A 1 144 ? -3.192 -9.165 7.397 1.00 82.14 144 A 1 ATOM 1105 C CD1 . LEU A 1 144 ? -1.935 -8.663 8.112 1.00 79.90 144 A 1 ATOM 1106 C CD2 . LEU A 1 144 ? -2.920 -10.581 6.897 1.00 79.39 144 A 1 ATOM 1107 N N . ALA A 1 145 ? -7.772 -8.702 8.855 1.00 87.16 145 A 1 ATOM 1108 C CA . ALA A 1 145 ? -8.815 -8.580 9.870 1.00 86.51 145 A 1 ATOM 1109 C C . ALA A 1 145 ? -9.904 -9.645 9.695 1.00 86.05 145 A 1 ATOM 1110 O O . ALA A 1 145 ? -10.185 -10.092 8.579 1.00 84.43 145 A 1 ATOM 1111 C CB . ALA A 1 145 ? -9.408 -7.174 9.833 1.00 86.27 145 A 1 ATOM 1112 N N . ASP A 1 146 ? -10.565 -9.993 10.803 1.00 85.91 146 A 1 ATOM 1113 C CA . ASP A 1 146 ? -11.751 -10.844 10.774 1.00 85.58 146 A 1 ATOM 1114 C C . ASP A 1 146 ? -12.879 -10.156 9.978 1.00 85.82 146 A 1 ATOM 1115 O O . ASP A 1 146 ? -13.284 -9.040 10.327 1.00 85.22 146 A 1 ATOM 1116 C CB . ASP A 1 146 ? -12.191 -11.192 12.211 1.00 84.38 146 A 1 ATOM 1117 C CG . ASP A 1 146 ? -13.248 -12.303 12.249 1.00 82.15 146 A 1 ATOM 1118 O OD1 . ASP A 1 146 ? -14.086 -12.364 11.317 1.00 78.55 146 A 1 ATOM 1119 O OD2 . ASP A 1 146 ? -13.203 -13.121 13.190 1.00 77.71 146 A 1 ATOM 1120 N N . PRO A 1 147 ? -13.425 -10.799 8.932 1.00 84.44 147 A 1 ATOM 1121 C CA . PRO A 1 147 ? -14.554 -10.261 8.175 1.00 83.45 147 A 1 ATOM 1122 C C . PRO A 1 147 ? -15.787 -9.936 9.028 1.00 84.43 147 A 1 ATOM 1123 O O . PRO A 1 147 ? -16.549 -9.039 8.668 1.00 83.28 147 A 1 ATOM 1124 C CB . PRO A 1 147 ? -14.887 -11.333 7.134 1.00 81.48 147 A 1 ATOM 1125 C CG . PRO A 1 147 ? -13.567 -12.066 6.941 1.00 78.37 147 A 1 ATOM 1126 C CD . PRO A 1 147 ? -12.951 -12.033 8.333 1.00 81.10 147 A 1 ATOM 1127 N N . ALA A 1 148 ? -15.997 -10.643 10.149 1.00 85.40 148 A 1 ATOM 1128 C CA . ALA A 1 148 ? -17.107 -10.379 11.062 1.00 84.78 148 A 1 ATOM 1129 C C . ALA A 1 148 ? -16.957 -9.024 11.778 1.00 85.36 148 A 1 ATOM 1130 O O . ALA A 1 148 ? -17.931 -8.277 11.879 1.00 84.13 148 A 1 ATOM 1131 C CB . ALA A 1 148 ? -17.212 -11.537 12.064 1.00 83.20 148 A 1 ATOM 1132 N N . GLU A 1 149 ? -15.740 -8.666 12.194 1.00 85.46 149 A 1 ATOM 1133 C CA . GLU A 1 149 ? -15.443 -7.362 12.803 1.00 86.14 149 A 1 ATOM 1134 C C . GLU A 1 149 ? -15.546 -6.230 11.771 1.00 86.50 149 A 1 ATOM 1135 O O . GLU A 1 149 ? -16.139 -5.178 12.030 1.00 84.27 149 A 1 ATOM 1136 C CB . GLU A 1 149 ? -14.043 -7.395 13.429 1.00 85.36 149 A 1 ATOM 1137 C CG . GLU A 1 149 ? -13.956 -8.314 14.662 1.00 82.42 149 A 1 ATOM 1138 C CD . GLU A 1 149 ? -14.895 -7.873 15.801 1.00 83.23 149 A 1 ATOM 1139 O OE1 . GLU A 1 149 ? -15.408 -8.749 16.520 1.00 75.53 149 A 1 ATOM 1140 O OE2 . GLU A 1 149 ? -15.111 -6.641 15.948 1.00 77.30 149 A 1 ATOM 1141 N N . LEU A 1 150 ? -15.050 -6.462 10.550 1.00 85.67 150 A 1 ATOM 1142 C CA . LEU A 1 150 ? -15.165 -5.494 9.456 1.00 85.51 150 A 1 ATOM 1143 C C . LEU A 1 150 ? -16.614 -5.247 9.018 1.00 86.41 150 A 1 ATOM 1144 O O . LEU A 1 150 ? -16.929 -4.143 8.569 1.00 85.09 150 A 1 ATOM 1145 C CB . LEU A 1 150 ? -14.328 -5.957 8.255 1.00 84.13 150 A 1 ATOM 1146 C CG . LEU A 1 150 ? -12.809 -5.969 8.488 1.00 81.23 150 A 1 ATOM 1147 C CD1 . LEU A 1 150 ? -12.131 -6.443 7.202 1.00 78.88 150 A 1 ATOM 1148 C CD2 . LEU A 1 150 ? -12.246 -4.588 8.841 1.00 77.96 150 A 1 ATOM 1149 N N . ALA A 1 151 ? -17.514 -6.221 9.177 1.00 86.27 151 A 1 ATOM 1150 C CA . ALA A 1 151 ? -18.934 -6.036 8.879 1.00 85.59 151 A 1 ATOM 1151 C C . ALA A 1 151 ? -19.572 -4.926 9.734 1.00 86.57 151 A 1 ATOM 1152 O O . ALA A 1 151 ? -20.487 -4.243 9.270 1.00 85.32 151 A 1 ATOM 1153 C CB . ALA A 1 151 ? -19.661 -7.374 9.048 1.00 83.81 151 A 1 ATOM 1154 N N . GLY A 1 152 ? -19.051 -4.677 10.938 1.00 86.00 152 A 1 ATOM 1155 C CA . GLY A 1 152 ? -19.465 -3.550 11.779 1.00 85.46 152 A 1 ATOM 1156 C C . GLY A 1 152 ? -19.174 -2.169 11.177 1.00 87.42 152 A 1 ATOM 1157 O O . GLY A 1 152 ? -19.778 -1.181 11.592 1.00 85.97 152 A 1 ATOM 1158 N N . LEU A 1 153 ? -18.307 -2.085 10.165 1.00 87.83 153 A 1 ATOM 1159 C CA . LEU A 1 153 ? -18.021 -0.844 9.439 1.00 88.38 153 A 1 ATOM 1160 C C . LEU A 1 153 ? -19.009 -0.561 8.301 1.00 89.07 153 A 1 ATOM 1161 O O . LEU A 1 153 ? -18.998 0.548 7.774 1.00 87.61 153 A 1 ATOM 1162 C CB . LEU A 1 153 ? -16.579 -0.863 8.901 1.00 87.70 153 A 1 ATOM 1163 C CG . LEU A 1 153 ? -15.486 -0.965 9.980 1.00 85.71 153 A 1 ATOM 1164 C CD1 . LEU A 1 153 ? -14.114 -1.048 9.305 1.00 82.55 153 A 1 ATOM 1165 C CD2 . LEU A 1 153 ? -15.498 0.258 10.904 1.00 82.50 153 A 1 ATOM 1166 N N . ASN A 1 154 ? -19.868 -1.508 7.918 1.00 89.25 154 A 1 ATOM 1167 C CA . ASN A 1 154 ? -20.713 -1.391 6.725 1.00 88.62 154 A 1 ATOM 1168 C C . ASN A 1 154 ? -21.551 -0.101 6.702 1.00 89.49 154 A 1 ATOM 1169 O O . ASN A 1 154 ? -21.573 0.592 5.688 1.00 88.53 154 A 1 ATOM 1170 C CB . ASN A 1 154 ? -21.618 -2.630 6.616 1.00 86.70 154 A 1 ATOM 1171 C CG . ASN A 1 154 ? -20.888 -3.868 6.129 1.00 84.36 154 A 1 ATOM 1172 O OD1 . ASN A 1 154 ? -19.863 -3.820 5.471 1.00 78.41 154 A 1 ATOM 1173 N ND2 . ASN A 1 154 ? -21.435 -5.033 6.384 1.00 78.11 154 A 1 ATOM 1174 N N . ASP A 1 155 ? -22.181 0.262 7.826 1.00 90.06 155 A 1 ATOM 1175 C CA . ASP A 1 155 ? -22.969 1.494 7.921 1.00 90.20 155 A 1 ATOM 1176 C C . ASP A 1 155 ? -22.108 2.751 7.704 1.00 91.19 155 A 1 ATOM 1177 O O . ASP A 1 155 ? -22.513 3.684 7.010 1.00 90.11 155 A 1 ATOM 1178 C CB . ASP A 1 155 ? -23.665 1.556 9.289 1.00 89.26 155 A 1 ATOM 1179 C CG . ASP A 1 155 ? -24.929 0.691 9.380 1.00 86.42 155 A 1 ATOM 1180 O OD1 . ASP A 1 155 ? -25.619 0.526 8.341 1.00 82.32 155 A 1 ATOM 1181 O OD2 . ASP A 1 155 ? -25.260 0.273 10.507 1.00 82.00 155 A 1 ATOM 1182 N N . VAL A 1 156 ? -20.888 2.755 8.248 1.00 91.15 156 A 1 ATOM 1183 C CA . VAL A 1 156 ? -19.931 3.858 8.077 1.00 91.40 156 A 1 ATOM 1184 C C . VAL A 1 156 ? -19.467 3.963 6.625 1.00 91.55 156 A 1 ATOM 1185 O O . VAL A 1 156 ? -19.378 5.070 6.093 1.00 90.01 156 A 1 ATOM 1186 C CB . VAL A 1 156 ? -18.730 3.677 9.019 1.00 90.88 156 A 1 ATOM 1187 C CG1 . VAL A 1 156 ? -17.635 4.724 8.777 1.00 87.41 156 A 1 ATOM 1188 C CG2 . VAL A 1 156 ? -19.170 3.765 10.485 1.00 87.95 156 A 1 ATOM 1189 N N . LEU A 1 157 ? -19.209 2.827 5.968 1.00 90.54 157 A 1 ATOM 1190 C CA . LEU A 1 157 ? -18.816 2.780 4.555 1.00 89.13 157 A 1 ATOM 1191 C C . LEU A 1 157 ? -19.926 3.294 3.626 1.00 88.91 157 A 1 ATOM 1192 O O . LEU A 1 157 ? -19.629 3.887 2.599 1.00 86.82 157 A 1 ATOM 1193 C CB . LEU A 1 157 ? -18.409 1.345 4.168 1.00 88.01 157 A 1 ATOM 1194 C CG . LEU A 1 157 ? -17.211 0.757 4.935 1.00 86.34 157 A 1 ATOM 1195 C CD1 . LEU A 1 157 ? -16.957 -0.681 4.473 1.00 83.70 157 A 1 ATOM 1196 C CD2 . LEU A 1 157 ? -15.930 1.561 4.760 1.00 83.82 157 A 1 ATOM 1197 N N . GLU A 1 158 ? -21.191 3.139 4.022 1.00 89.07 158 A 1 ATOM 1198 C CA . GLU A 1 158 ? -22.366 3.691 3.325 1.00 88.51 158 A 1 ATOM 1199 C C . GLU A 1 158 ? -22.657 5.168 3.673 1.00 89.23 158 A 1 ATOM 1200 O O . GLU A 1 158 ? -23.662 5.733 3.234 1.00 87.20 158 A 1 ATOM 1201 C CB . GLU A 1 158 ? -23.587 2.807 3.621 1.00 86.10 158 A 1 ATOM 1202 C CG . GLU A 1 158 ? -23.493 1.422 2.955 1.00 81.29 158 A 1 ATOM 1203 C CD . GLU A 1 158 ? -24.661 0.489 3.319 1.00 80.73 158 A 1 ATOM 1204 O OE1 . GLU A 1 158 ? -24.547 -0.733 3.050 1.00 74.09 158 A 1 ATOM 1205 O OE2 . GLU A 1 158 ? -25.695 0.955 3.861 1.00 74.89 158 A 1 ATOM 1206 N N . GLY A 1 159 ? -21.806 5.803 4.488 1.00 89.21 159 A 1 ATOM 1207 C CA . GLY A 1 159 ? -21.982 7.203 4.892 1.00 89.42 159 A 1 ATOM 1208 C C . GLY A 1 159 ? -23.048 7.427 5.967 1.00 91.64 159 A 1 ATOM 1209 O O . GLY A 1 159 ? -23.468 8.567 6.187 1.00 90.50 159 A 1 ATOM 1210 N N . ARG A 1 160 ? -23.504 6.374 6.655 1.00 92.50 160 A 1 ATOM 1211 C CA . ARG A 1 160 ? -24.451 6.490 7.769 1.00 93.26 160 A 1 ATOM 1212 C C . ARG A 1 160 ? -23.747 6.978 9.043 1.00 94.85 160 A 1 ATOM 1213 O O . ARG A 1 160 ? -22.537 6.819 9.189 1.00 94.71 160 A 1 ATOM 1214 C CB . ARG A 1 160 ? -25.182 5.165 8.010 1.00 92.06 160 A 1 ATOM 1215 C CG . ARG A 1 160 ? -25.964 4.684 6.781 1.00 88.62 160 A 1 ATOM 1216 C CD . ARG A 1 160 ? -26.728 3.409 7.142 1.00 83.51 160 A 1 ATOM 1217 N NE . ARG A 1 160 ? -27.326 2.766 5.960 1.00 77.23 160 A 1 ATOM 1218 C CZ . ARG A 1 160 ? -27.752 1.520 5.914 1.00 69.71 160 A 1 ATOM 1219 N NH1 . ARG A 1 160 ? -27.836 0.780 6.977 1.00 63.68 160 A 1 ATOM 1220 N NH2 . ARG A 1 160 ? -28.067 0.973 4.775 1.00 62.92 160 A 1 ATOM 1221 N N . PRO A 1 161 ? -24.496 7.589 9.989 1.00 94.64 161 A 1 ATOM 1222 C CA . PRO A 1 161 ? -23.945 7.970 11.283 1.00 94.92 161 A 1 ATOM 1223 C C . PRO A 1 161 ? -23.433 6.766 12.082 1.00 95.22 161 A 1 ATOM 1224 O O . PRO A 1 161 ? -24.061 5.711 12.091 1.00 94.38 161 A 1 ATOM 1225 C CB . PRO A 1 161 ? -25.071 8.688 12.027 1.00 94.13 161 A 1 ATOM 1226 C CG . PRO A 1 161 ? -25.995 9.167 10.908 1.00 92.24 161 A 1 ATOM 1227 C CD . PRO A 1 161 ? -25.868 8.057 9.869 1.00 94.18 161 A 1 ATOM 1228 N N . LEU A 1 162 ? -22.348 6.963 12.827 1.00 94.71 162 A 1 ATOM 1229 C CA . LEU A 1 162 ? -21.845 6.001 13.803 1.00 94.88 162 A 1 ATOM 1230 C C . LEU A 1 162 ? -22.632 6.146 15.107 1.00 95.45 162 A 1 ATOM 1231 O O . LEU A 1 162 ? -22.672 7.231 15.686 1.00 94.80 162 A 1 ATOM 1232 C CB . LEU A 1 162 ? -20.339 6.249 14.004 1.00 94.48 162 A 1 ATOM 1233 C CG . LEU A 1 162 ? -19.671 5.377 15.080 1.00 93.74 162 A 1 ATOM 1234 C CD1 . LEU A 1 162 ? -19.652 3.906 14.680 1.00 91.48 162 A 1 ATOM 1235 C CD2 . LEU A 1 162 ? -18.232 5.854 15.290 1.00 91.50 162 A 1 ATOM 1236 N N . VAL A 1 163 ? -23.221 5.049 15.590 1.00 94.76 163 A 1 ATOM 1237 C CA . VAL A 1 163 ? -23.911 4.995 16.887 1.00 94.05 163 A 1 ATOM 1238 C C . VAL A 1 163 ? -23.005 4.311 17.907 1.00 94.05 163 A 1 ATOM 1239 O O . VAL A 1 163 ? -22.658 3.144 17.756 1.00 93.17 163 A 1 ATOM 1240 C CB . VAL A 1 163 ? -25.270 4.285 16.779 1.00 93.32 163 A 1 ATOM 1241 C CG1 . VAL A 1 163 ? -26.009 4.321 18.127 1.00 91.00 163 A 1 ATOM 1242 C CG2 . VAL A 1 163 ? -26.169 4.949 15.725 1.00 91.62 163 A 1 ATOM 1243 N N . ILE A 1 164 ? -22.634 5.038 18.971 1.00 93.88 164 A 1 ATOM 1244 C CA . ILE A 1 164 ? -21.758 4.529 20.029 1.00 93.78 164 A 1 ATOM 1245 C C . ILE A 1 164 ? -22.614 4.061 21.208 1.00 93.48 164 A 1 ATOM 1246 O O . ILE A 1 164 ? -22.862 4.807 22.157 1.00 92.05 164 A 1 ATOM 1247 C CB . ILE A 1 164 ? -20.682 5.565 20.428 1.00 93.74 164 A 1 ATOM 1248 C CG1 . ILE A 1 164 ? -19.945 6.123 19.184 1.00 92.50 164 A 1 ATOM 1249 C CG2 . ILE A 1 164 ? -19.696 4.890 21.397 1.00 92.26 164 A 1 ATOM 1250 C CD1 . ILE A 1 164 ? -18.789 7.074 19.505 1.00 90.80 164 A 1 ATOM 1251 N N . ALA A 1 165 ? -23.063 2.808 21.152 1.00 92.96 165 A 1 ATOM 1252 C CA . ALA A 1 165 ? -23.898 2.212 22.200 1.00 91.59 165 A 1 ATOM 1253 C C . ALA A 1 165 ? -23.223 2.257 23.582 1.00 91.95 165 A 1 ATOM 1254 O O . ALA A 1 165 ? -23.871 2.559 24.583 1.00 89.63 165 A 1 ATOM 1255 C CB . ALA A 1 165 ? -24.233 0.775 21.782 1.00 89.78 165 A 1 ATOM 1256 N N . GLN A 1 166 ? -21.905 2.043 23.634 1.00 92.90 166 A 1 ATOM 1257 C CA . GLN A 1 166 ? -21.087 2.079 24.845 1.00 91.58 166 A 1 ATOM 1258 C C . GLN A 1 166 ? -21.056 3.470 25.499 1.00 93.03 166 A 1 ATOM 1259 O O . GLN A 1 166 ? -20.839 3.565 26.702 1.00 91.54 166 A 1 ATOM 1260 C CB . GLN A 1 166 ? -19.649 1.634 24.528 1.00 88.72 166 A 1 ATOM 1261 C CG . GLN A 1 166 ? -19.490 0.235 23.904 1.00 80.46 166 A 1 ATOM 1262 C CD . GLN A 1 166 ? -19.604 0.195 22.384 1.00 75.95 166 A 1 ATOM 1263 O OE1 . GLN A 1 166 ? -20.132 1.081 21.724 1.00 69.04 166 A 1 ATOM 1264 N NE2 . GLN A 1 166 ? -19.128 -0.856 21.746 1.00 64.82 166 A 1 ATOM 1265 N N . ASN A 1 167 ? -21.289 4.545 24.750 1.00 92.52 167 A 1 ATOM 1266 C CA . ASN A 1 167 ? -21.312 5.924 25.244 1.00 93.90 167 A 1 ATOM 1267 C C . ASN A 1 167 ? -22.734 6.507 25.284 1.00 94.91 167 A 1 ATOM 1268 O O . ASN A 1 167 ? -22.984 7.619 24.820 1.00 92.78 167 A 1 ATOM 1269 C CB . ASN A 1 167 ? -20.315 6.782 24.443 1.00 93.25 167 A 1 ATOM 1270 C CG . ASN A 1 167 ? -19.920 8.036 25.204 1.00 92.37 167 A 1 ATOM 1271 O OD1 . ASN A 1 167 ? -19.823 8.029 26.423 1.00 86.31 167 A 1 ATOM 1272 N ND2 . ASN A 1 167 ? -19.606 9.112 24.524 1.00 87.47 167 A 1 ATOM 1273 N N . GLY A 1 168 ? -23.698 5.750 25.813 1.00 93.63 168 A 1 ATOM 1274 C CA . GLY A 1 168 ? -25.078 6.227 25.996 1.00 93.56 168 A 1 ATOM 1275 C C . GLY A 1 168 ? -25.867 6.425 24.697 1.00 94.90 168 A 1 ATOM 1276 O O . GLY A 1 168 ? -26.831 7.183 24.684 1.00 92.10 168 A 1 ATOM 1277 N N . GLY A 1 169 ? -25.466 5.759 23.611 1.00 94.73 169 A 1 ATOM 1278 C CA . GLY A 1 169 ? -26.113 5.898 22.304 1.00 95.33 169 A 1 ATOM 1279 C C . GLY A 1 169 ? -25.734 7.184 21.560 1.00 96.36 169 A 1 ATOM 1280 O O . GLY A 1 169 ? -26.518 7.674 20.750 1.00 94.86 169 A 1 ATOM 1281 N N . GLU A 1 170 ? -24.556 7.746 21.838 1.00 95.51 170 A 1 ATOM 1282 C CA . GLU A 1 170 ? -24.043 8.918 21.113 1.00 95.67 170 A 1 ATOM 1283 C C . GLU A 1 170 ? -24.030 8.666 19.598 1.00 96.02 170 A 1 ATOM 1284 O O . GLU A 1 170 ? -23.594 7.619 19.129 1.00 94.66 170 A 1 ATOM 1285 C CB . GLU A 1 170 ? -22.640 9.286 21.617 1.00 94.83 170 A 1 ATOM 1286 C CG . GLU A 1 170 ? -22.072 10.530 20.910 1.00 93.64 170 A 1 ATOM 1287 C CD . GLU A 1 170 ? -20.647 10.896 21.344 1.00 94.71 170 A 1 ATOM 1288 O OE1 . GLU A 1 170 ? -20.170 11.981 20.931 1.00 88.18 170 A 1 ATOM 1289 O OE2 . GLU A 1 170 ? -19.971 10.108 22.039 1.00 90.92 170 A 1 ATOM 1290 N N . ILE A 1 171 ? -24.480 9.661 18.828 1.00 97.01 171 A 1 ATOM 1291 C CA . ILE A 1 171 ? -24.537 9.606 17.367 1.00 97.16 171 A 1 ATOM 1292 C C . ILE A 1 171 ? -23.515 10.582 16.782 1.00 97.26 171 A 1 ATOM 1293 O O . ILE A 1 171 ? -23.642 11.800 16.931 1.00 96.64 171 A 1 ATOM 1294 C CB . ILE A 1 171 ? -25.965 9.885 16.850 1.00 96.62 171 A 1 ATOM 1295 C CG1 . ILE A 1 171 ? -26.974 8.874 17.448 1.00 94.60 171 A 1 ATOM 1296 C CG2 . ILE A 1 171 ? -25.987 9.827 15.311 1.00 94.93 171 A 1 ATOM 1297 C CD1 . ILE A 1 171 ? -28.434 9.120 17.054 1.00 89.98 171 A 1 ATOM 1298 N N . ILE A 1 172 ? -22.540 10.055 16.049 1.00 97.21 172 A 1 ATOM 1299 C CA . ILE A 1 172 ? -21.560 10.839 15.297 1.00 97.06 172 A 1 ATOM 1300 C C . ILE A 1 172 ? -21.957 10.829 13.819 1.00 97.05 172 A 1 ATOM 1301 O O . ILE A 1 172 ? -21.941 9.792 13.161 1.00 96.53 172 A 1 ATOM 1302 C CB . ILE A 1 172 ? -20.123 10.320 15.529 1.00 96.79 172 A 1 ATOM 1303 C CG1 . ILE A 1 172 ? -19.759 10.407 17.030 1.00 95.09 172 A 1 ATOM 1304 C CG2 . ILE A 1 172 ? -19.127 11.128 14.674 1.00 95.41 172 A 1 ATOM 1305 C CD1 . ILE A 1 172 ? -18.368 9.868 17.371 1.00 91.66 172 A 1 ATOM 1306 N N . LYS A 1 173 ? -22.309 12.003 13.280 1.00 96.79 173 A 1 ATOM 1307 C CA . LYS A 1 173 ? -22.542 12.172 11.838 1.00 96.66 173 A 1 ATOM 1308 C C . LYS A 1 173 ? -21.202 12.316 11.109 1.00 96.83 173 A 1 ATOM 1309 O O . LYS A 1 173 ? -20.330 13.013 11.624 1.00 96.39 173 A 1 ATOM 1310 C CB . LYS A 1 173 ? -23.445 13.383 11.569 1.00 96.20 173 A 1 ATOM 1311 C CG . LYS A 1 173 ? -24.857 13.166 12.127 1.00 93.20 173 A 1 ATOM 1312 C CD . LYS A 1 173 ? -25.764 14.353 11.796 1.00 88.91 173 A 1 ATOM 1313 C CE . LYS A 1 173 ? -27.156 14.106 12.382 1.00 83.91 173 A 1 ATOM 1314 N NZ . LYS A 1 173 ? -28.074 15.237 12.114 1.00 74.71 173 A 1 ATOM 1315 N N . PRO A 1 174 ? -21.034 11.718 9.920 1.00 96.72 174 A 1 ATOM 1316 C CA . PRO A 1 174 ? -19.797 11.857 9.164 1.00 96.47 174 A 1 ATOM 1317 C C . PRO A 1 174 ? -19.584 13.311 8.741 1.00 96.73 174 A 1 ATOM 1318 O O . PRO A 1 174 ? -20.460 13.945 8.142 1.00 95.95 174 A 1 ATOM 1319 C CB . PRO A 1 174 ? -19.928 10.912 7.967 1.00 95.01 174 A 1 ATOM 1320 C CG . PRO A 1 174 ? -21.439 10.786 7.772 1.00 92.07 174 A 1 ATOM 1321 C CD . PRO A 1 174 ? -21.984 10.896 9.193 1.00 95.08 174 A 1 ATOM 1322 N N . HIS A 1 175 ? -18.404 13.839 9.035 1.00 97.14 175 A 1 ATOM 1323 C CA . HIS A 1 175 ? -17.975 15.148 8.567 1.00 97.09 175 A 1 ATOM 1324 C C . HIS A 1 175 ? -17.888 15.155 7.023 1.00 97.02 175 A 1 ATOM 1325 O O . HIS A 1 175 ? -17.453 14.154 6.448 1.00 96.64 175 A 1 ATOM 1326 C CB . HIS A 1 175 ? -16.630 15.470 9.228 1.00 97.05 175 A 1 ATOM 1327 C CG . HIS A 1 175 ? -16.133 16.858 8.929 1.00 97.02 175 A 1 ATOM 1328 N ND1 . HIS A 1 175 ? -15.327 17.223 7.877 1.00 92.14 175 A 1 ATOM 1329 C CD2 . HIS A 1 175 ? -16.415 17.993 9.640 1.00 92.57 175 A 1 ATOM 1330 C CE1 . HIS A 1 175 ? -15.134 18.553 7.948 1.00 92.78 175 A 1 ATOM 1331 N NE2 . HIS A 1 175 ? -15.778 19.059 9.003 1.00 93.74 175 A 1 ATOM 1332 N N . PRO A 1 176 ? -18.206 16.257 6.310 1.00 96.83 176 A 1 ATOM 1333 C CA . PRO A 1 176 ? -18.157 16.299 4.839 1.00 96.57 176 A 1 ATOM 1334 C C . PRO A 1 176 ? -16.802 15.914 4.219 1.00 96.95 176 A 1 ATOM 1335 O O . PRO A 1 176 ? -16.744 15.417 3.093 1.00 96.45 176 A 1 ATOM 1336 C CB . PRO A 1 176 ? -18.526 17.740 4.478 1.00 95.61 176 A 1 ATOM 1337 C CG . PRO A 1 176 ? -19.424 18.178 5.635 1.00 93.25 176 A 1 ATOM 1338 C CD . PRO A 1 176 ? -18.801 17.476 6.837 1.00 95.84 176 A 1 ATOM 1339 N N . MET A 1 177 ? -15.705 16.130 4.956 1.00 96.78 177 A 1 ATOM 1340 C CA . MET A 1 177 ? -14.346 15.756 4.548 1.00 97.32 177 A 1 ATOM 1341 C C . MET A 1 177 ? -13.911 14.373 5.055 1.00 97.75 177 A 1 ATOM 1342 O O . MET A 1 177 ? -12.793 13.963 4.757 1.00 97.37 177 A 1 ATOM 1343 C CB . MET A 1 177 ? -13.347 16.838 4.996 1.00 96.91 177 A 1 ATOM 1344 C CG . MET A 1 177 ? -13.593 18.188 4.314 1.00 95.31 177 A 1 ATOM 1345 S SD . MET A 1 177 ? -13.203 18.259 2.542 1.00 94.18 177 A 1 ATOM 1346 C CE . MET A 1 177 ? -11.389 18.229 2.623 1.00 86.69 177 A 1 ATOM 1347 N N . PHE A 1 178 ? -14.746 13.647 5.790 1.00 97.38 178 A 1 ATOM 1348 C CA . PHE A 1 178 ? -14.421 12.287 6.226 1.00 97.48 178 A 1 ATOM 1349 C C . PHE A 1 178 ? -14.258 11.358 5.020 1.00 97.50 178 A 1 ATOM 1350 O O . PHE A 1 178 ? -15.073 11.379 4.091 1.00 97.02 178 A 1 ATOM 1351 C CB . PHE A 1 178 ? -15.500 11.771 7.186 1.00 97.37 178 A 1 ATOM 1352 C CG . PHE A 1 178 ? -15.330 10.315 7.572 1.00 97.55 178 A 1 ATOM 1353 C CD1 . PHE A 1 178 ? -16.322 9.370 7.237 1.00 96.96 178 A 1 ATOM 1354 C CD2 . PHE A 1 178 ? -14.179 9.897 8.263 1.00 97.12 178 A 1 ATOM 1355 C CE1 . PHE A 1 178 ? -16.168 8.025 7.609 1.00 96.96 178 A 1 ATOM 1356 C CE2 . PHE A 1 178 ? -14.024 8.551 8.628 1.00 96.94 178 A 1 ATOM 1357 C CZ . PHE A 1 178 ? -15.022 7.615 8.310 1.00 97.18 178 A 1 ATOM 1358 N N . ARG A 1 179 ? -13.200 10.566 5.018 1.00 97.99 179 A 1 ATOM 1359 C CA . ARG A 1 179 ? -12.908 9.576 3.973 1.00 97.94 179 A 1 ATOM 1360 C C . ARG A 1 179 ? -12.420 8.281 4.603 1.00 98.11 179 A 1 ATOM 1361 O O . ARG A 1 179 ? -11.668 8.327 5.569 1.00 97.74 179 A 1 ATOM 1362 C CB . ARG A 1 179 ? -11.832 10.109 3.004 1.00 97.36 179 A 1 ATOM 1363 C CG . ARG A 1 179 ? -12.246 11.347 2.195 1.00 95.16 179 A 1 ATOM 1364 C CD . ARG A 1 179 ? -13.423 11.078 1.253 1.00 95.45 179 A 1 ATOM 1365 N NE . ARG A 1 179 ? -13.798 12.299 0.522 1.00 95.17 179 A 1 ATOM 1366 C CZ . ARG A 1 179 ? -14.660 13.223 0.912 1.00 95.96 179 A 1 ATOM 1367 N NH1 . ARG A 1 179 ? -15.309 13.157 2.037 1.00 91.00 179 A 1 ATOM 1368 N NH2 . ARG A 1 179 ? -14.875 14.252 0.155 1.00 91.91 179 A 1 ATOM 1369 N N . VAL A 1 180 ? -12.778 7.153 4.007 1.00 97.45 180 A 1 ATOM 1370 C CA . VAL A 1 180 ? -12.268 5.834 4.404 1.00 97.26 180 A 1 ATOM 1371 C C . VAL A 1 180 ? -11.407 5.269 3.285 1.00 97.37 180 A 1 ATOM 1372 O O . VAL A 1 180 ? -11.863 5.119 2.153 1.00 96.97 180 A 1 ATOM 1373 C CB . VAL A 1 180 ? -13.387 4.856 4.788 1.00 96.49 180 A 1 ATOM 1374 C CG1 . VAL A 1 180 ? -12.793 3.535 5.302 1.00 95.33 180 A 1 ATOM 1375 C CG2 . VAL A 1 180 ? -14.280 5.431 5.894 1.00 95.36 180 A 1 ATOM 1376 N N . VAL A 1 181 ? -10.163 4.942 3.607 1.00 97.32 181 A 1 ATOM 1377 C CA . VAL A 1 181 ? -9.248 4.252 2.697 1.00 97.49 181 A 1 ATOM 1378 C C . VAL A 1 181 ? -8.762 2.981 3.372 1.00 97.16 181 A 1 ATOM 1379 O O . VAL A 1 181 ? -8.325 3.006 4.517 1.00 96.72 181 A 1 ATOM 1380 C CB . VAL A 1 181 ? -8.068 5.142 2.268 1.00 97.70 181 A 1 ATOM 1381 C CG1 . VAL A 1 181 ? -7.168 4.416 1.258 1.00 97.18 181 A 1 ATOM 1382 C CG2 . VAL A 1 181 ? -8.550 6.441 1.611 1.00 97.23 181 A 1 ATOM 1383 N N . VAL A 1 182 ? -8.790 1.875 2.649 1.00 95.54 182 A 1 ATOM 1384 C CA . VAL A 1 182 ? -8.214 0.614 3.112 1.00 94.93 182 A 1 ATOM 1385 C C . VAL A 1 182 ? -7.102 0.168 2.171 1.00 95.16 182 A 1 ATOM 1386 O O . VAL A 1 182 ? -7.137 0.447 0.971 1.00 94.96 182 A 1 ATOM 1387 C CB . VAL A 1 182 ? -9.283 -0.470 3.345 1.00 93.61 182 A 1 ATOM 1388 C CG1 . VAL A 1 182 ? -10.412 0.039 4.251 1.00 91.02 182 A 1 ATOM 1389 C CG2 . VAL A 1 182 ? -9.902 -0.992 2.051 1.00 90.98 182 A 1 ATOM 1390 N N . THR A 1 183 ? -6.094 -0.518 2.691 1.00 95.03 183 A 1 ATOM 1391 C CA . THR A 1 183 ? -5.052 -1.142 1.867 1.00 94.69 183 A 1 ATOM 1392 C C . THR A 1 183 ? -5.008 -2.642 2.113 1.00 93.25 183 A 1 ATOM 1393 O O . THR A 1 183 ? -5.066 -3.076 3.258 1.00 91.88 183 A 1 ATOM 1394 C CB . THR A 1 183 ? -3.656 -0.517 2.038 1.00 94.95 183 A 1 ATOM 1395 O OG1 . THR A 1 183 ? -3.040 -0.876 3.248 1.00 93.50 183 A 1 ATOM 1396 C CG2 . THR A 1 183 ? -3.651 1.007 1.967 1.00 93.63 183 A 1 ATOM 1397 N N . GLY A 1 184 ? -4.838 -3.429 1.048 1.00 91.84 184 A 1 ATOM 1398 C CA . GLY A 1 184 ? -4.710 -4.883 1.132 1.00 90.51 184 A 1 ATOM 1399 C C . GLY A 1 184 ? -3.771 -5.432 0.062 1.00 89.48 184 A 1 ATOM 1400 O O . GLY A 1 184 ? -3.470 -4.757 -0.933 1.00 87.01 184 A 1 ATOM 1401 N N . ASN A 1 185 ? -3.264 -6.647 0.276 1.00 86.87 185 A 1 ATOM 1402 C CA . ASN A 1 185 ? -2.415 -7.335 -0.700 1.00 82.75 185 A 1 ATOM 1403 C C . ASN A 1 185 ? -3.241 -8.158 -1.696 1.00 79.88 185 A 1 ATOM 1404 O O . ASN A 1 185 ? -2.823 -8.304 -2.846 1.00 73.31 185 A 1 ATOM 1405 C CB . ASN A 1 185 ? -1.368 -8.173 0.039 1.00 79.32 185 A 1 ATOM 1406 C CG . ASN A 1 185 ? -0.383 -7.326 0.824 1.00 74.51 185 A 1 ATOM 1407 O OD1 . ASN A 1 185 ? 0.113 -6.294 0.374 1.00 68.13 185 A 1 ATOM 1408 N ND2 . ASN A 1 185 ? -0.056 -7.739 2.024 1.00 67.43 185 A 1 ATOM 1409 N N . SER A 1 186 ? -4.423 -8.619 -1.285 1.00 71.60 186 A 1 ATOM 1410 C CA . SER A 1 186 ? -5.421 -9.246 -2.151 1.00 67.88 186 A 1 ATOM 1411 C C . SER A 1 186 ? -6.518 -8.248 -2.556 1.00 67.28 186 A 1 ATOM 1412 O O . SER A 1 186 ? -6.604 -7.134 -2.047 1.00 60.33 186 A 1 ATOM 1413 C CB . SER A 1 186 ? -5.999 -10.481 -1.447 1.00 61.64 186 A 1 ATOM 1414 O OG . SER A 1 186 ? -6.949 -10.095 -0.479 1.00 55.08 186 A 1 ATOM 1415 N N . THR A 1 187 ? -7.393 -8.655 -3.482 1.00 55.71 187 A 1 ATOM 1416 C CA . THR A 1 187 ? -8.632 -7.926 -3.814 1.00 52.87 187 A 1 ATOM 1417 C C . THR A 1 187 ? -9.806 -8.334 -2.915 1.00 54.04 187 A 1 ATOM 1418 O O . THR A 1 187 ? -10.955 -8.241 -3.329 1.00 48.80 187 A 1 ATOM 1419 C CB . THR A 1 187 ? -8.992 -8.098 -5.299 1.00 47.18 187 A 1 ATOM 1420 O OG1 . THR A 1 187 ? -9.012 -9.467 -5.637 1.00 44.03 187 A 1 ATOM 1421 C CG2 . THR A 1 187 ? -7.974 -7.418 -6.215 1.00 44.11 187 A 1 ATOM 1422 N N . GLY A 1 188 ? -9.530 -8.850 -1.711 1.00 44.62 188 A 1 ATOM 1423 C CA . GLY A 1 188 ? -10.541 -9.397 -0.803 1.00 42.62 188 A 1 ATOM 1424 C C . GLY A 1 188 ? -10.968 -10.840 -1.109 1.00 44.80 188 A 1 ATOM 1425 O O . GLY A 1 188 ? -11.750 -11.415 -0.363 1.00 41.58 188 A 1 ATOM 1426 N N . SER A 1 189 ? -10.431 -11.459 -2.168 1.00 42.66 189 A 1 ATOM 1427 C CA . SER A 1 189 ? -10.763 -12.837 -2.581 1.00 41.29 189 A 1 ATOM 1428 C C . SER A 1 189 ? -9.973 -13.923 -1.829 1.00 42.34 189 A 1 ATOM 1429 O O . SER A 1 189 ? -10.032 -15.092 -2.209 1.00 39.57 189 A 1 ATOM 1430 C CB . SER A 1 189 ? -10.568 -12.999 -4.093 1.00 37.48 189 A 1 ATOM 1431 O OG . SER A 1 189 ? -11.280 -11.998 -4.801 1.00 35.35 189 A 1 ATOM 1432 N N . GLY A 1 190 ? -9.236 -13.554 -0.771 1.00 41.49 190 A 1 ATOM 1433 C CA . GLY A 1 190 ? -8.273 -14.434 -0.104 1.00 41.42 190 A 1 ATOM 1434 C C . GLY A 1 190 ? -6.960 -14.554 -0.886 1.00 44.20 190 A 1 ATOM 1435 O O . GLY A 1 190 ? -6.718 -13.832 -1.858 1.00 42.05 190 A 1 ATOM 1436 N N . ASP A 1 191 ? -6.094 -15.455 -0.442 1.00 46.81 191 A 1 ATOM 1437 C CA . ASP A 1 191 ? -4.800 -15.703 -1.086 1.00 46.24 191 A 1 ATOM 1438 C C . ASP A 1 191 ? -4.825 -16.992 -1.917 1.00 48.07 191 A 1 ATOM 1439 O O . ASP A 1 191 ? -4.392 -18.056 -1.474 1.00 45.22 191 A 1 ATOM 1440 C CB . ASP A 1 191 ? -3.681 -15.704 -0.045 1.00 40.74 191 A 1 ATOM 1441 C CG . ASP A 1 191 ? -2.308 -15.857 -0.706 1.00 36.98 191 A 1 ATOM 1442 O OD1 . ASP A 1 191 ? -2.184 -15.621 -1.935 1.00 35.39 191 A 1 ATOM 1443 O OD2 . ASP A 1 191 ? -1.358 -16.202 0.023 1.00 34.30 191 A 1 ATOM 1444 N N . ALA A 1 192 ? -5.331 -16.894 -3.147 1.00 43.71 192 A 1 ATOM 1445 C CA . ALA A 1 192 ? -5.295 -18.014 -4.093 1.00 43.83 192 A 1 ATOM 1446 C C . ALA A 1 192 ? -3.866 -18.384 -4.542 1.00 46.01 192 A 1 ATOM 1447 O O . ALA A 1 192 ? -3.664 -19.459 -5.097 1.00 43.05 192 A 1 ATOM 1448 C CB . ALA A 1 192 ? -6.180 -17.655 -5.291 1.00 39.21 192 A 1 ATOM 1449 N N . SER A 1 193 ? -2.897 -17.495 -4.327 1.00 44.01 193 A 1 ATOM 1450 C CA . SER A 1 193 ? -1.501 -17.684 -4.737 1.00 44.50 193 A 1 ATOM 1451 C C . SER A 1 193 ? -0.624 -18.337 -3.661 1.00 45.84 193 A 1 ATOM 1452 O O . SER A 1 193 ? 0.483 -18.762 -3.974 1.00 42.97 193 A 1 ATOM 1453 C CB . SER A 1 193 ? -0.910 -16.337 -5.171 1.00 41.99 193 A 1 ATOM 1454 O OG . SER A 1 193 ? -0.748 -15.438 -4.092 1.00 39.87 193 A 1 ATOM 1455 N N . GLY A 1 194 ? -1.082 -18.391 -2.392 1.00 38.43 194 A 1 ATOM 1456 C CA . GLY A 1 194 ? -0.287 -18.891 -1.262 1.00 38.29 194 A 1 ATOM 1457 C C . GLY A 1 194 ? 0.867 -17.971 -0.832 1.00 40.21 194 A 1 ATOM 1458 O O . GLY A 1 194 ? 1.677 -18.348 0.017 1.00 37.83 194 A 1 ATOM 1459 N N . LEU A 1 195 ? 0.959 -16.767 -1.407 1.00 39.34 195 A 1 ATOM 1460 C CA . LEU A 1 195 ? 2.065 -15.824 -1.177 1.00 39.29 195 A 1 ATOM 1461 C C . LEU A 1 195 ? 1.854 -14.922 0.050 1.00 40.60 195 A 1 ATOM 1462 O O . LEU A 1 195 ? 2.811 -14.312 0.542 1.00 38.04 195 A 1 ATOM 1463 C CB . LEU A 1 195 ? 2.257 -14.965 -2.440 1.00 35.95 195 A 1 ATOM 1464 C CG . LEU A 1 195 ? 2.659 -15.735 -3.712 1.00 33.48 195 A 1 ATOM 1465 C CD1 . LEU A 1 195 ? 2.642 -14.791 -4.917 1.00 31.37 195 A 1 ATOM 1466 C CD2 . LEU A 1 195 ? 4.056 -16.346 -3.592 1.00 32.26 195 A 1 ATOM 1467 N N . TYR A 1 196 ? 0.615 -14.807 0.545 1.00 44.25 196 A 1 ATOM 1468 C CA . TYR A 1 196 ? 0.240 -13.912 1.640 1.00 46.36 196 A 1 ATOM 1469 C C . TYR A 1 196 ? -0.440 -14.673 2.784 1.00 47.28 196 A 1 ATOM 1470 O O . TYR A 1 196 ? -1.662 -14.793 2.853 1.00 42.78 196 A 1 ATOM 1471 C CB . TYR A 1 196 ? -0.629 -12.768 1.104 1.00 42.80 196 A 1 ATOM 1472 C CG . TYR A 1 196 ? 0.003 -11.952 -0.009 1.00 40.61 196 A 1 ATOM 1473 C CD1 . TYR A 1 196 ? 1.091 -11.101 0.267 1.00 38.46 196 A 1 ATOM 1474 C CD2 . TYR A 1 196 ? -0.488 -12.061 -1.325 1.00 36.65 196 A 1 ATOM 1475 C CE1 . TYR A 1 196 ? 1.689 -10.360 -0.773 1.00 34.03 196 A 1 ATOM 1476 C CE2 . TYR A 1 196 ? 0.105 -11.321 -2.365 1.00 34.07 196 A 1 ATOM 1477 C CZ . TYR A 1 196 ? 1.196 -10.470 -2.092 1.00 34.88 196 A 1 ATOM 1478 O OH . TYR A 1 196 ? 1.772 -9.762 -3.101 1.00 36.83 196 A 1 ATOM 1479 N N . GLN A 1 197 ? 0.356 -15.162 3.721 1.00 40.81 197 A 1 ATOM 1480 C CA . GLN A 1 197 ? -0.152 -15.866 4.898 1.00 41.78 197 A 1 ATOM 1481 C C . GLN A 1 197 ? -1.098 -14.987 5.729 1.00 42.96 197 A 1 ATOM 1482 O O . GLN A 1 197 ? -0.797 -13.830 6.020 1.00 40.80 197 A 1 ATOM 1483 C CB . GLN A 1 197 ? 1.005 -16.360 5.778 1.00 38.36 197 A 1 ATOM 1484 C CG . GLN A 1 197 ? 1.830 -17.457 5.088 1.00 34.88 197 A 1 ATOM 1485 C CD . GLN A 1 197 ? 2.901 -18.057 5.996 1.00 30.79 197 A 1 ATOM 1486 O OE1 . GLN A 1 197 ? 3.158 -17.627 7.111 1.00 29.40 197 A 1 ATOM 1487 N NE2 . GLN A 1 197 ? 3.578 -19.090 5.547 1.00 28.99 197 A 1 ATOM 1488 N N . GLY A 1 198 ? -2.221 -15.568 6.149 1.00 41.43 198 A 1 ATOM 1489 C CA . GLY A 1 198 ? -3.195 -14.906 7.023 1.00 40.94 198 A 1 ATOM 1490 C C . GLY A 1 198 ? -4.200 -13.997 6.313 1.00 43.31 198 A 1 ATOM 1491 O O . GLY A 1 198 ? -5.052 -13.423 6.986 1.00 40.24 198 A 1 ATOM 1492 N N . VAL A 1 199 ? -4.142 -13.888 4.989 1.00 46.44 199 A 1 ATOM 1493 C CA . VAL A 1 199 ? -5.143 -13.148 4.212 1.00 45.90 199 A 1 ATOM 1494 C C . VAL A 1 199 ? -6.484 -13.881 4.249 1.00 49.16 199 A 1 ATOM 1495 O O . VAL A 1 199 ? -6.605 -15.029 3.810 1.00 45.60 199 A 1 ATOM 1496 C CB . VAL A 1 199 ? -4.669 -12.913 2.769 1.00 39.48 199 A 1 ATOM 1497 C CG1 . VAL A 1 199 ? -5.766 -12.306 1.896 1.00 35.26 199 A 1 ATOM 1498 C CG2 . VAL A 1 199 ? -3.482 -11.946 2.752 1.00 36.34 199 A 1 ATOM 1499 N N . MET A 1 200 ? -7.511 -13.196 4.746 1.00 44.62 200 A 1 ATOM 1500 C CA . MET A 1 200 ? -8.867 -13.720 4.862 1.00 46.44 200 A 1 ATOM 1501 C C . MET A 1 200 ? -9.716 -13.303 3.659 1.00 49.21 200 A 1 ATOM 1502 O O . MET A 1 200 ? -9.628 -12.176 3.162 1.00 46.18 200 A 1 ATOM 1503 C CB . MET A 1 200 ? -9.501 -13.278 6.189 1.00 41.82 200 A 1 ATOM 1504 C CG . MET A 1 200 ? -8.670 -13.716 7.401 1.00 38.81 200 A 1 ATOM 1505 S SD . MET A 1 200 ? -9.448 -13.412 9.004 1.00 36.11 200 A 1 ATOM 1506 C CE . MET A 1 200 ? -10.555 -14.836 9.109 1.00 34.35 200 A 1 ATOM 1507 N N . MET A 1 201 ? -10.571 -14.221 3.199 1.00 46.33 201 A 1 ATOM 1508 C CA . MET A 1 201 ? -11.568 -13.895 2.184 1.00 46.50 201 A 1 ATOM 1509 C C . MET A 1 201 ? -12.609 -12.951 2.783 1.00 50.25 201 A 1 ATOM 1510 O O . MET A 1 201 ? -13.254 -13.274 3.782 1.00 47.03 201 A 1 ATOM 1511 C CB . MET A 1 201 ? -12.200 -15.180 1.631 1.00 40.55 201 A 1 ATOM 1512 C CG . MET A 1 201 ? -13.070 -14.896 0.402 1.00 34.22 201 A 1 ATOM 1513 S SD . MET A 1 201 ? -13.753 -16.383 -0.389 1.00 30.38 201 A 1 ATOM 1514 C CE . MET A 1 201 ? -15.044 -16.818 0.809 1.00 27.67 201 A 1 ATOM 1515 N N . GLN A 1 202 ? -12.779 -11.790 2.179 1.00 53.77 202 A 1 ATOM 1516 C CA . GLN A 1 202 ? -13.717 -10.775 2.641 1.00 54.50 202 A 1 ATOM 1517 C C . GLN A 1 202 ? -15.128 -11.034 2.091 1.00 58.01 202 A 1 ATOM 1518 O O . GLN A 1 202 ? -15.313 -11.679 1.058 1.00 53.34 202 A 1 ATOM 1519 C CB . GLN A 1 202 ? -13.189 -9.379 2.279 1.00 49.41 202 A 1 ATOM 1520 C CG . GLN A 1 202 ? -11.822 -9.073 2.925 1.00 46.01 202 A 1 ATOM 1521 C CD . GLN A 1 202 ? -11.868 -9.104 4.448 1.00 43.33 202 A 1 ATOM 1522 O OE1 . GLN A 1 202 ? -12.814 -8.633 5.064 1.00 42.81 202 A 1 ATOM 1523 N NE2 . GLN A 1 202 ? -10.879 -9.659 5.112 1.00 39.47 202 A 1 ATOM 1524 N N . ASN A 1 203 ? -16.135 -10.507 2.790 1.00 63.39 203 A 1 ATOM 1525 C CA . ASN A 1 203 ? -17.525 -10.634 2.362 1.00 64.12 203 A 1 ATOM 1526 C C . ASN A 1 203 ? -17.757 -9.857 1.052 1.00 67.27 203 A 1 ATOM 1527 O O . ASN A 1 203 ? -17.485 -8.659 0.984 1.00 65.23 203 A 1 ATOM 1528 C CB . ASN A 1 203 ? -18.428 -10.171 3.520 1.00 58.09 203 A 1 ATOM 1529 C CG . ASN A 1 203 ? -19.909 -10.368 3.263 1.00 50.69 203 A 1 ATOM 1530 O OD1 . ASN A 1 203 ? -20.400 -10.338 2.149 1.00 47.77 203 A 1 ATOM 1531 N ND2 . ASN A 1 203 ? -20.688 -10.557 4.299 1.00 44.90 203 A 1 ATOM 1532 N N . LEU A 1 204 ? -18.316 -10.517 0.034 1.00 59.80 204 A 1 ATOM 1533 C CA . LEU A 1 204 ? -18.612 -9.914 -1.270 1.00 61.95 204 A 1 ATOM 1534 C C . LEU A 1 204 ? -19.495 -8.660 -1.143 1.00 66.73 204 A 1 ATOM 1535 O O . LEU A 1 204 ? -19.201 -7.637 -1.754 1.00 64.27 204 A 1 ATOM 1536 C CB . LEU A 1 204 ? -19.270 -10.982 -2.162 1.00 55.80 204 A 1 ATOM 1537 C CG . LEU A 1 204 ? -19.529 -10.527 -3.609 1.00 48.33 204 A 1 ATOM 1538 C CD1 . LEU A 1 204 ? -18.225 -10.236 -4.358 1.00 44.35 204 A 1 ATOM 1539 C CD2 . LEU A 1 204 ? -20.278 -11.631 -4.356 1.00 43.44 204 A 1 ATOM 1540 N N . ALA A 1 205 ? -20.513 -8.695 -0.271 1.00 69.72 205 A 1 ATOM 1541 C CA . ALA A 1 205 ? -21.385 -7.544 -0.034 1.00 71.14 205 A 1 ATOM 1542 C C . ALA A 1 205 ? -20.649 -6.351 0.602 1.00 74.25 205 A 1 ATOM 1543 O O . ALA A 1 205 ? -21.057 -5.206 0.415 1.00 72.59 205 A 1 ATOM 1544 C CB . ALA A 1 205 ? -22.550 -7.998 0.856 1.00 67.49 205 A 1 ATOM 1545 N N . ALA A 1 206 ? -19.585 -6.593 1.364 1.00 75.83 206 A 1 ATOM 1546 C CA . ALA A 1 206 ? -18.719 -5.530 1.866 1.00 76.56 206 A 1 ATOM 1547 C C . ALA A 1 206 ? -17.821 -4.985 0.744 1.00 79.61 206 A 1 ATOM 1548 O O . ALA A 1 206 ? -17.616 -3.778 0.675 1.00 78.64 206 A 1 ATOM 1549 C CB . ALA A 1 206 ? -17.909 -6.045 3.062 1.00 73.22 206 A 1 ATOM 1550 N N . MET A 1 207 ? -17.341 -5.849 -0.167 1.00 78.98 207 A 1 ATOM 1551 C CA . MET A 1 207 ? -16.496 -5.434 -1.294 1.00 80.06 207 A 1 ATOM 1552 C C . MET A 1 207 ? -17.222 -4.507 -2.277 1.00 82.56 207 A 1 ATOM 1553 O O . MET A 1 207 ? -16.597 -3.587 -2.801 1.00 81.38 207 A 1 ATOM 1554 C CB . MET A 1 207 ? -15.930 -6.661 -2.027 1.00 76.80 207 A 1 ATOM 1555 C CG . MET A 1 207 ? -14.990 -7.519 -1.164 1.00 71.15 207 A 1 ATOM 1556 S SD . MET A 1 207 ? -13.467 -6.703 -0.595 1.00 66.54 207 A 1 ATOM 1557 C CE . MET A 1 207 ? -13.961 -6.134 1.047 1.00 59.45 207 A 1 ATOM 1558 N N . ASP A 1 208 ? -18.539 -4.653 -2.450 1.00 84.15 208 A 1 ATOM 1559 C CA . ASP A 1 208 ? -19.365 -3.767 -3.289 1.00 85.11 208 A 1 ATOM 1560 C C . ASP A 1 208 ? -19.431 -2.310 -2.779 1.00 86.76 208 A 1 ATOM 1561 O O . ASP A 1 208 ? -19.857 -1.417 -3.508 1.00 85.70 208 A 1 ATOM 1562 C CB . ASP A 1 208 ? -20.788 -4.350 -3.400 1.00 82.63 208 A 1 ATOM 1563 C CG . ASP A 1 208 ? -20.900 -5.587 -4.302 1.00 75.42 208 A 1 ATOM 1564 O OD1 . ASP A 1 208 ? -19.975 -5.837 -5.108 1.00 70.31 208 A 1 ATOM 1565 O OD2 . ASP A 1 208 ? -21.951 -6.267 -4.202 1.00 68.33 208 A 1 ATOM 1566 N N . ARG A 1 209 ? -18.993 -2.042 -1.541 1.00 87.24 209 A 1 ATOM 1567 C CA . ARG A 1 209 ? -18.916 -0.692 -0.943 1.00 88.02 209 A 1 ATOM 1568 C C . ARG A 1 209 ? -17.589 0.015 -1.212 1.00 89.92 209 A 1 ATOM 1569 O O . ARG A 1 209 ? -17.376 1.135 -0.732 1.00 89.24 209 A 1 ATOM 1570 C CB . ARG A 1 209 ? -19.170 -0.786 0.565 1.00 86.00 209 A 1 ATOM 1571 C CG . ARG A 1 209 ? -20.591 -1.260 0.877 1.00 81.02 209 A 1 ATOM 1572 C CD . ARG A 1 209 ? -20.707 -1.604 2.364 1.00 79.45 209 A 1 ATOM 1573 N NE . ARG A 1 209 ? -22.091 -1.918 2.732 1.00 76.54 209 A 1 ATOM 1574 C CZ . ARG A 1 209 ? -22.774 -3.010 2.474 1.00 72.42 209 A 1 ATOM 1575 N NH1 . ARG A 1 209 ? -22.250 -4.046 1.882 1.00 63.68 209 A 1 ATOM 1576 N NH2 . ARG A 1 209 ? -24.027 -3.052 2.807 1.00 65.67 209 A 1 ATOM 1577 N N . TYR A 1 210 ? -16.675 -0.634 -1.945 1.00 89.72 210 A 1 ATOM 1578 C CA . TYR A 1 210 ? -15.361 -0.073 -2.233 1.00 89.68 210 A 1 ATOM 1579 C C . TYR A 1 210 ? -15.179 0.240 -3.713 1.00 90.26 210 A 1 ATOM 1580 O O . TYR A 1 210 ? -15.421 -0.585 -4.591 1.00 89.59 210 A 1 ATOM 1581 C CB . TYR A 1 210 ? -14.249 -1.001 -1.755 1.00 89.15 210 A 1 ATOM 1582 C CG . TYR A 1 210 ? -14.183 -1.195 -0.255 1.00 88.66 210 A 1 ATOM 1583 C CD1 . TYR A 1 210 ? -13.522 -0.255 0.556 1.00 86.61 210 A 1 ATOM 1584 C CD2 . TYR A 1 210 ? -14.771 -2.333 0.332 1.00 87.09 210 A 1 ATOM 1585 C CE1 . TYR A 1 210 ? -13.443 -0.451 1.950 1.00 86.15 210 A 1 ATOM 1586 C CE2 . TYR A 1 210 ? -14.697 -2.530 1.725 1.00 86.39 210 A 1 ATOM 1587 C CZ . TYR A 1 210 ? -14.031 -1.591 2.535 1.00 86.37 210 A 1 ATOM 1588 O OH . TYR A 1 210 ? -13.959 -1.785 3.880 1.00 84.71 210 A 1 ATOM 1589 N N . ARG A 1 211 ? -14.607 1.406 -3.971 1.00 92.22 211 A 1 ATOM 1590 C CA . ARG A 1 211 ? -13.945 1.709 -5.237 1.00 92.59 211 A 1 ATOM 1591 C C . ARG A 1 211 ? -12.525 1.148 -5.191 1.00 93.21 211 A 1 ATOM 1592 O O . ARG A 1 211 ? -11.763 1.486 -4.288 1.00 92.56 211 A 1 ATOM 1593 C CB . ARG A 1 211 ? -13.960 3.223 -5.445 1.00 90.90 211 A 1 ATOM 1594 C CG . ARG A 1 211 ? -13.397 3.614 -6.817 1.00 83.12 211 A 1 ATOM 1595 C CD . ARG A 1 211 ? -13.428 5.136 -7.007 1.00 85.37 211 A 1 ATOM 1596 N NE . ARG A 1 211 ? -14.785 5.661 -6.806 1.00 81.79 211 A 1 ATOM 1597 C CZ . ARG A 1 211 ? -15.167 6.914 -6.759 1.00 83.53 211 A 1 ATOM 1598 N NH1 . ARG A 1 211 ? -14.364 7.904 -7.035 1.00 76.35 211 A 1 ATOM 1599 N NH2 . ARG A 1 211 ? -16.396 7.187 -6.408 1.00 71.10 211 A 1 ATOM 1600 N N . PHE A 1 212 ? -12.161 0.341 -6.169 1.00 92.79 212 A 1 ATOM 1601 C CA . PHE A 1 212 ? -10.842 -0.300 -6.209 1.00 92.02 212 A 1 ATOM 1602 C C . PHE A 1 212 ? -9.824 0.504 -7.018 1.00 92.81 212 A 1 ATOM 1603 O O . PHE A 1 212 ? -10.089 0.931 -8.137 1.00 92.07 212 A 1 ATOM 1604 C CB . PHE A 1 212 ? -10.960 -1.738 -6.723 1.00 89.95 212 A 1 ATOM 1605 C CG . PHE A 1 212 ? -11.551 -2.683 -5.696 1.00 88.20 212 A 1 ATOM 1606 C CD1 . PHE A 1 212 ? -10.703 -3.450 -4.874 1.00 85.71 212 A 1 ATOM 1607 C CD2 . PHE A 1 212 ? -12.944 -2.767 -5.527 1.00 85.64 212 A 1 ATOM 1608 C CE1 . PHE A 1 212 ? -11.243 -4.294 -3.893 1.00 84.08 212 A 1 ATOM 1609 C CE2 . PHE A 1 212 ? -13.488 -3.607 -4.540 1.00 83.89 212 A 1 ATOM 1610 C CZ . PHE A 1 212 ? -12.635 -4.370 -3.726 1.00 83.96 212 A 1 ATOM 1611 N N . THR A 1 213 ? -8.613 0.629 -6.463 1.00 94.11 213 A 1 ATOM 1612 C CA . THR A 1 213 ? -7.435 1.146 -7.157 1.00 94.42 213 A 1 ATOM 1613 C C . THR A 1 213 ? -6.305 0.129 -7.033 1.00 94.34 213 A 1 ATOM 1614 O O . THR A 1 213 ? -5.908 -0.253 -5.931 1.00 93.00 213 A 1 ATOM 1615 C CB . THR A 1 213 ? -7.026 2.515 -6.594 1.00 93.57 213 A 1 ATOM 1616 O OG1 . THR A 1 213 ? -7.896 3.498 -7.098 1.00 79.48 213 A 1 ATOM 1617 C CG2 . THR A 1 213 ? -5.626 2.940 -6.987 1.00 78.32 213 A 1 ATOM 1618 N N . LYS A 1 214 ? -5.752 -0.305 -8.164 1.00 93.37 214 A 1 ATOM 1619 C CA . LYS A 1 214 ? -4.645 -1.270 -8.195 1.00 92.72 214 A 1 ATOM 1620 C C . LYS A 1 214 ? -3.293 -0.564 -8.262 1.00 93.26 214 A 1 ATOM 1621 O O . LYS A 1 214 ? -3.025 0.228 -9.160 1.00 92.04 214 A 1 ATOM 1622 C CB . LYS A 1 214 ? -4.859 -2.278 -9.336 1.00 90.29 214 A 1 ATOM 1623 C CG . LYS A 1 214 ? -3.855 -3.445 -9.268 1.00 81.36 214 A 1 ATOM 1624 C CD . LYS A 1 214 ? -4.184 -4.511 -10.319 1.00 79.77 214 A 1 ATOM 1625 C CE . LYS A 1 214 ? -3.211 -5.692 -10.215 1.00 71.23 214 A 1 ATOM 1626 N NZ . LYS A 1 214 ? -3.556 -6.784 -11.166 1.00 64.69 214 A 1 ATOM 1627 N N . VAL A 1 215 ? -2.405 -0.917 -7.341 1.00 92.71 215 A 1 ATOM 1628 C CA . VAL A 1 215 ? -1.061 -0.351 -7.220 1.00 92.56 215 A 1 ATOM 1629 C C . VAL A 1 215 ? -0.029 -1.464 -7.369 1.00 91.35 215 A 1 ATOM 1630 O O . VAL A 1 215 ? 0.335 -2.135 -6.404 1.00 89.26 215 A 1 ATOM 1631 C CB . VAL A 1 215 ? -0.942 0.420 -5.889 1.00 92.59 215 A 1 ATOM 1632 C CG1 . VAL A 1 215 ? 0.452 0.979 -5.663 1.00 89.08 215 A 1 ATOM 1633 C CG2 . VAL A 1 215 ? -1.905 1.614 -5.879 1.00 89.20 215 A 1 ATOM 1634 N N . GLY A 1 216 ? 0.469 -1.654 -8.597 1.00 89.83 216 A 1 ATOM 1635 C CA . GLY A 1 216 ? 1.606 -2.537 -8.869 1.00 88.75 216 A 1 ATOM 1636 C C . GLY A 1 216 ? 2.935 -1.975 -8.352 1.00 89.73 216 A 1 ATOM 1637 O O . GLY A 1 216 ? 2.980 -0.909 -7.727 1.00 88.83 216 A 1 ATOM 1638 N N . TYR A 1 217 ? 4.033 -2.682 -8.627 1.00 88.77 217 A 1 ATOM 1639 C CA . TYR A 1 217 ? 5.358 -2.077 -8.495 1.00 88.80 217 A 1 ATOM 1640 C C . TYR A 1 217 ? 5.485 -0.889 -9.456 1.00 89.92 217 A 1 ATOM 1641 O O . TYR A 1 217 ? 4.788 -0.817 -10.468 1.00 89.36 217 A 1 ATOM 1642 C CB . TYR A 1 217 ? 6.457 -3.127 -8.699 1.00 87.77 217 A 1 ATOM 1643 C CG . TYR A 1 217 ? 6.454 -4.217 -7.636 1.00 86.68 217 A 1 ATOM 1644 C CD1 . TYR A 1 217 ? 6.565 -3.871 -6.272 1.00 83.75 217 A 1 ATOM 1645 C CD2 . TYR A 1 217 ? 6.324 -5.572 -8.004 1.00 83.67 217 A 1 ATOM 1646 C CE1 . TYR A 1 217 ? 6.534 -4.873 -5.280 1.00 82.29 217 A 1 ATOM 1647 C CE2 . TYR A 1 217 ? 6.298 -6.576 -7.015 1.00 82.07 217 A 1 ATOM 1648 C CZ . TYR A 1 217 ? 6.398 -6.227 -5.650 1.00 82.74 217 A 1 ATOM 1649 O OH . TYR A 1 217 ? 6.362 -7.192 -4.692 1.00 80.56 217 A 1 ATOM 1650 N N . ALA A 1 218 ? 6.333 0.074 -9.105 1.00 91.14 218 A 1 ATOM 1651 C CA . ALA A 1 218 ? 6.636 1.192 -9.987 1.00 91.48 218 A 1 ATOM 1652 C C . ALA A 1 218 ? 7.286 0.671 -11.285 1.00 92.31 218 A 1 ATOM 1653 O O . ALA A 1 218 ? 7.998 -0.331 -11.254 1.00 91.76 218 A 1 ATOM 1654 C CB . ALA A 1 218 ? 7.515 2.185 -9.223 1.00 90.84 218 A 1 ATOM 1655 N N . ASP A 1 219 ? 7.019 1.339 -12.411 1.00 92.91 219 A 1 ATOM 1656 C CA . ASP A 1 219 ? 7.707 1.044 -13.666 1.00 92.92 219 A 1 ATOM 1657 C C . ASP A 1 219 ? 9.190 1.442 -13.595 1.00 94.20 219 A 1 ATOM 1658 O O . ASP A 1 219 ? 9.650 2.070 -12.633 1.00 94.01 219 A 1 ATOM 1659 C CB . ASP A 1 219 ? 6.961 1.692 -14.852 1.00 91.24 219 A 1 ATOM 1660 C CG . ASP A 1 219 ? 6.780 3.210 -14.717 1.00 89.92 219 A 1 ATOM 1661 O OD1 . ASP A 1 219 ? 7.687 3.871 -14.176 1.00 85.69 219 A 1 ATOM 1662 O OD2 . ASP A 1 219 ? 5.686 3.691 -15.078 1.00 85.45 219 A 1 ATOM 1663 N N . GLU A 1 220 ? 9.952 1.042 -14.612 1.00 94.55 220 A 1 ATOM 1664 C CA . GLU A 1 220 ? 11.396 1.292 -14.675 1.00 95.14 220 A 1 ATOM 1665 C C . GLU A 1 220 ? 11.731 2.787 -14.582 1.00 95.79 220 A 1 ATOM 1666 O O . GLU A 1 220 ? 12.642 3.167 -13.843 1.00 95.19 220 A 1 ATOM 1667 C CB . GLU A 1 220 ? 11.946 0.630 -15.956 1.00 94.06 220 A 1 ATOM 1668 C CG . GLU A 1 220 ? 13.442 0.902 -16.181 1.00 86.79 220 A 1 ATOM 1669 C CD . GLU A 1 220 ? 14.128 -0.019 -17.205 1.00 86.91 220 A 1 ATOM 1670 O OE1 . GLU A 1 220 ? 15.365 0.141 -17.374 1.00 78.45 220 A 1 ATOM 1671 O OE2 . GLU A 1 220 ? 13.470 -0.924 -17.757 1.00 79.95 220 A 1 ATOM 1672 N N . GLU A 1 221 ? 10.975 3.652 -15.264 1.00 95.30 221 A 1 ATOM 1673 C CA . GLU A 1 221 ? 11.203 5.101 -15.256 1.00 94.77 221 A 1 ATOM 1674 C C . GLU A 1 221 ? 10.971 5.699 -13.860 1.00 95.40 221 A 1 ATOM 1675 O O . GLU A 1 221 ? 11.809 6.443 -13.336 1.00 94.57 221 A 1 ATOM 1676 C CB . GLU A 1 221 ? 10.284 5.762 -16.304 1.00 93.48 221 A 1 ATOM 1677 C CG . GLU A 1 221 ? 10.585 7.260 -16.470 1.00 82.54 221 A 1 ATOM 1678 C CD . GLU A 1 221 ? 9.660 7.988 -17.461 1.00 76.88 221 A 1 ATOM 1679 O OE1 . GLU A 1 221 ? 9.735 9.243 -17.483 1.00 67.40 221 A 1 ATOM 1680 O OE2 . GLU A 1 221 ? 8.888 7.324 -18.181 1.00 67.74 221 A 1 ATOM 1681 N N . ALA A 1 222 ? 9.869 5.319 -13.220 1.00 94.82 222 A 1 ATOM 1682 C CA . ALA A 1 222 ? 9.551 5.748 -11.867 1.00 94.61 222 A 1 ATOM 1683 C C . ALA A 1 222 ? 10.580 5.227 -10.852 1.00 95.50 222 A 1 ATOM 1684 O O . ALA A 1 222 ? 11.015 5.989 -9.987 1.00 94.99 222 A 1 ATOM 1685 C CB . ALA A 1 222 ? 8.126 5.306 -11.525 1.00 93.84 222 A 1 ATOM 1686 N N . GLU A 1 223 ? 11.023 3.967 -10.950 1.00 95.10 223 A 1 ATOM 1687 C CA . GLU A 1 223 ? 12.052 3.429 -10.048 1.00 95.72 223 A 1 ATOM 1688 C C . GLU A 1 223 ? 13.414 4.101 -10.248 1.00 96.50 223 A 1 ATOM 1689 O O . GLU A 1 223 ? 14.072 4.436 -9.260 1.00 96.45 223 A 1 ATOM 1690 C CB . GLU A 1 223 ? 12.177 1.900 -10.172 1.00 95.18 223 A 1 ATOM 1691 C CG . GLU A 1 223 ? 10.941 1.216 -9.574 1.00 93.13 223 A 1 ATOM 1692 C CD . GLU A 1 223 ? 11.147 -0.258 -9.231 1.00 94.21 223 A 1 ATOM 1693 O OE1 . GLU A 1 223 ? 10.698 -0.657 -8.123 1.00 88.43 223 A 1 ATOM 1694 O OE2 . GLU A 1 223 ? 11.687 -1.050 -10.018 1.00 89.86 223 A 1 ATOM 1695 N N . LEU A 1 224 ? 13.814 4.385 -11.485 1.00 96.82 224 A 1 ATOM 1696 C CA . LEU A 1 224 ? 15.026 5.158 -11.772 1.00 97.03 224 A 1 ATOM 1697 C C . LEU A 1 224 ? 14.940 6.579 -11.208 1.00 97.03 224 A 1 ATOM 1698 O O . LEU A 1 224 ? 15.917 7.065 -10.632 1.00 96.41 224 A 1 ATOM 1699 C CB . LEU A 1 224 ? 15.274 5.194 -13.290 1.00 96.76 224 A 1 ATOM 1700 C CG . LEU A 1 224 ? 15.796 3.866 -13.863 1.00 92.49 224 A 1 ATOM 1701 C CD1 . LEU A 1 224 ? 15.847 3.961 -15.389 1.00 88.42 224 A 1 ATOM 1702 C CD2 . LEU A 1 224 ? 17.206 3.536 -13.357 1.00 89.43 224 A 1 ATOM 1703 N N . SER A 1 225 ? 13.777 7.230 -11.317 1.00 96.46 225 A 1 ATOM 1704 C CA . SER A 1 225 ? 13.530 8.542 -10.706 1.00 95.52 225 A 1 ATOM 1705 C C . SER A 1 225 ? 13.630 8.483 -9.177 1.00 95.93 225 A 1 ATOM 1706 O O . SER A 1 225 ? 14.321 9.305 -8.570 1.00 94.91 225 A 1 ATOM 1707 C CB . SER A 1 225 ? 12.163 9.067 -11.150 1.00 94.33 225 A 1 ATOM 1708 O OG . SER A 1 225 ? 11.984 10.401 -10.705 1.00 83.41 225 A 1 ATOM 1709 N N . ILE A 1 226 ? 13.024 7.471 -8.551 1.00 95.66 226 A 1 ATOM 1710 C CA . ILE A 1 226 ? 13.117 7.235 -7.099 1.00 95.64 226 A 1 ATOM 1711 C C . ILE A 1 226 ? 14.582 7.056 -6.682 1.00 96.31 226 A 1 ATOM 1712 O O . ILE A 1 226 ? 15.055 7.760 -5.790 1.00 96.16 226 A 1 ATOM 1713 C CB . ILE A 1 226 ? 12.252 6.019 -6.676 1.00 95.29 226 A 1 ATOM 1714 C CG1 . ILE A 1 226 ? 10.746 6.336 -6.812 1.00 94.07 226 A 1 ATOM 1715 C CG2 . ILE A 1 226 ? 12.551 5.597 -5.221 1.00 94.02 226 A 1 ATOM 1716 C CD1 . ILE A 1 226 ? 9.846 5.091 -6.823 1.00 92.04 226 A 1 ATOM 1717 N N . LEU A 1 227 ? 15.324 6.159 -7.336 1.00 96.60 227 A 1 ATOM 1718 C CA . LEU A 1 227 ? 16.734 5.926 -7.017 1.00 97.30 227 A 1 ATOM 1719 C C . LEU A 1 227 ? 17.592 7.172 -7.263 1.00 97.47 227 A 1 ATOM 1720 O O . LEU A 1 227 ? 18.474 7.473 -6.462 1.00 96.97 227 A 1 ATOM 1721 C CB . LEU A 1 227 ? 17.278 4.735 -7.818 1.00 97.43 227 A 1 ATOM 1722 C CG . LEU A 1 227 ? 16.699 3.352 -7.467 1.00 96.63 227 A 1 ATOM 1723 C CD1 . LEU A 1 227 ? 17.506 2.293 -8.223 1.00 94.95 227 A 1 ATOM 1724 C CD2 . LEU A 1 227 ? 16.770 3.032 -5.973 1.00 94.63 227 A 1 ATOM 1725 N N . GLY A 1 228 ? 17.319 7.933 -8.328 1.00 97.12 228 A 1 ATOM 1726 C CA . GLY A 1 228 ? 18.001 9.192 -8.632 1.00 96.80 228 A 1 ATOM 1727 C C . GLY A 1 228 ? 17.835 10.252 -7.542 1.00 96.82 228 A 1 ATOM 1728 O O . GLY A 1 228 ? 18.801 10.944 -7.213 1.00 95.63 228 A 1 ATOM 1729 N N . ARG A 1 229 ? 16.641 10.350 -6.940 1.00 96.71 229 A 1 ATOM 1730 C CA . ARG A 1 229 ? 16.370 11.286 -5.834 1.00 96.09 229 A 1 ATOM 1731 C C . ARG A 1 229 ? 16.949 10.806 -4.504 1.00 96.58 229 A 1 ATOM 1732 O O . ARG A 1 229 ? 17.532 11.591 -3.767 1.00 95.16 229 A 1 ATOM 1733 C CB . ARG A 1 229 ? 14.860 11.515 -5.700 1.00 95.04 229 A 1 ATOM 1734 C CG . ARG A 1 229 ? 14.273 12.287 -6.887 1.00 91.77 229 A 1 ATOM 1735 C CD . ARG A 1 229 ? 12.773 12.498 -6.646 1.00 88.66 229 A 1 ATOM 1736 N NE . ARG A 1 229 ? 12.101 13.073 -7.821 1.00 84.21 229 A 1 ATOM 1737 C CZ . ARG A 1 229 ? 10.906 13.645 -7.817 1.00 78.47 229 A 1 ATOM 1738 N NH1 . ARG A 1 229 ? 10.215 13.810 -6.721 1.00 72.85 229 A 1 ATOM 1739 N NH2 . ARG A 1 229 ? 10.372 14.059 -8.934 1.00 72.50 229 A 1 ATOM 1740 N N . VAL A 1 230 ? 16.799 9.521 -4.203 1.00 96.13 230 A 1 ATOM 1741 C CA . VAL A 1 230 ? 17.173 8.949 -2.895 1.00 95.81 230 A 1 ATOM 1742 C C . VAL A 1 230 ? 18.673 8.649 -2.794 1.00 96.66 230 A 1 ATOM 1743 O O . VAL A 1 230 ? 19.259 8.747 -1.714 1.00 95.99 230 A 1 ATOM 1744 C CB . VAL A 1 230 ? 16.318 7.695 -2.627 1.00 94.56 230 A 1 ATOM 1745 C CG1 . VAL A 1 230 ? 16.697 7.011 -1.317 1.00 87.36 230 A 1 ATOM 1746 C CG2 . VAL A 1 230 ? 14.825 8.050 -2.513 1.00 87.72 230 A 1 ATOM 1747 N N . THR A 1 231 ? 19.313 8.301 -3.910 1.00 96.67 231 A 1 ATOM 1748 C CA . THR A 1 231 ? 20.742 7.954 -3.982 1.00 97.08 231 A 1 ATOM 1749 C C . THR A 1 231 ? 21.450 8.651 -5.152 1.00 97.28 231 A 1 ATOM 1750 O O . THR A 1 231 ? 22.014 7.991 -6.033 1.00 96.72 231 A 1 ATOM 1751 C CB . THR A 1 231 ? 20.966 6.428 -4.001 1.00 96.89 231 A 1 ATOM 1752 O OG1 . THR A 1 231 ? 20.273 5.804 -5.053 1.00 94.62 231 A 1 ATOM 1753 C CG2 . THR A 1 231 ? 20.524 5.762 -2.701 1.00 93.04 231 A 1 ATOM 1754 N N . PRO A 1 232 ? 21.473 10.003 -5.203 1.00 97.44 232 A 1 ATOM 1755 C CA . PRO A 1 232 ? 22.036 10.750 -6.336 1.00 97.00 232 A 1 ATOM 1756 C C . PRO A 1 232 ? 23.533 10.482 -6.566 1.00 97.04 232 A 1 ATOM 1757 O O . PRO A 1 232 ? 24.018 10.586 -7.690 1.00 95.97 232 A 1 ATOM 1758 C CB . PRO A 1 232 ? 21.772 12.225 -6.009 1.00 96.51 232 A 1 ATOM 1759 C CG . PRO A 1 232 ? 21.665 12.258 -4.483 1.00 95.35 232 A 1 ATOM 1760 C CD . PRO A 1 232 ? 20.997 10.920 -4.173 1.00 97.03 232 A 1 ATOM 1761 N N . LYS A 1 233 ? 24.263 10.080 -5.519 1.00 97.16 233 A 1 ATOM 1762 C CA . LYS A 1 233 ? 25.696 9.734 -5.588 1.00 96.82 233 A 1 ATOM 1763 C C . LYS A 1 233 ? 25.973 8.367 -6.225 1.00 97.01 233 A 1 ATOM 1764 O O . LYS A 1 233 ? 27.130 8.065 -6.510 1.00 95.74 233 A 1 ATOM 1765 C CB . LYS A 1 233 ? 26.318 9.791 -4.182 1.00 96.61 233 A 1 ATOM 1766 C CG . LYS A 1 233 ? 26.286 11.197 -3.565 1.00 94.04 233 A 1 ATOM 1767 C CD . LYS A 1 233 ? 26.987 11.210 -2.196 1.00 89.24 233 A 1 ATOM 1768 C CE . LYS A 1 233 ? 26.939 12.625 -1.609 1.00 85.07 233 A 1 ATOM 1769 N NZ . LYS A 1 233 ? 27.586 12.709 -0.275 1.00 73.62 233 A 1 ATOM 1770 N N . LEU A 1 234 ? 24.962 7.528 -6.405 1.00 96.88 234 A 1 ATOM 1771 C CA . LEU A 1 234 ? 25.114 6.228 -7.057 1.00 96.85 234 A 1 ATOM 1772 C C . LEU A 1 234 ? 25.120 6.430 -8.583 1.00 97.01 234 A 1 ATOM 1773 O O . LEU A 1 234 ? 24.206 7.082 -9.100 1.00 96.25 234 A 1 ATOM 1774 C CB . LEU A 1 234 ? 23.987 5.298 -6.572 1.00 96.19 234 A 1 ATOM 1775 C CG . LEU A 1 234 ? 24.200 3.815 -6.918 1.00 93.03 234 A 1 ATOM 1776 C CD1 . LEU A 1 234 ? 25.364 3.205 -6.132 1.00 90.31 234 A 1 ATOM 1777 C CD2 . LEU A 1 234 ? 22.938 3.029 -6.561 1.00 90.86 234 A 1 ATOM 1778 N N . PRO A 1 235 ? 26.110 5.905 -9.333 1.00 96.69 235 A 1 ATOM 1779 C CA . PRO A 1 235 ? 26.170 6.070 -10.786 1.00 96.49 235 A 1 ATOM 1780 C C . PRO A 1 235 ? 24.888 5.602 -11.490 1.00 97.20 235 A 1 ATOM 1781 O O . PRO A 1 235 ? 24.255 4.629 -11.083 1.00 97.10 235 A 1 ATOM 1782 C CB . PRO A 1 235 ? 27.399 5.280 -11.242 1.00 95.49 235 A 1 ATOM 1783 C CG . PRO A 1 235 ? 28.309 5.298 -10.017 1.00 93.96 235 A 1 ATOM 1784 C CD . PRO A 1 235 ? 27.321 5.242 -8.859 1.00 95.43 235 A 1 ATOM 1785 N N . GLU A 1 236 ? 24.495 6.290 -12.567 1.00 96.67 236 A 1 ATOM 1786 C CA . GLU A 1 236 ? 23.231 6.001 -13.261 1.00 96.90 236 A 1 ATOM 1787 C C . GLU A 1 236 ? 23.186 4.582 -13.853 1.00 97.25 236 A 1 ATOM 1788 O O . GLU A 1 236 ? 22.162 3.907 -13.766 1.00 96.75 236 A 1 ATOM 1789 C CB . GLU A 1 236 ? 23.014 7.047 -14.359 1.00 96.30 236 A 1 ATOM 1790 C CG . GLU A 1 236 ? 21.585 6.977 -14.923 1.00 91.51 236 A 1 ATOM 1791 C CD . GLU A 1 236 ? 21.393 7.889 -16.139 1.00 89.94 236 A 1 ATOM 1792 O OE1 . GLU A 1 236 ? 20.619 7.472 -17.033 1.00 82.07 236 A 1 ATOM 1793 O OE2 . GLU A 1 236 ? 22.054 8.944 -16.189 1.00 83.70 236 A 1 ATOM 1794 N N . ASN A 1 237 ? 24.304 4.102 -14.408 1.00 96.72 237 A 1 ATOM 1795 C CA . ASN A 1 237 ? 24.427 2.737 -14.919 1.00 96.41 237 A 1 ATOM 1796 C C . ASN A 1 237 ? 24.191 1.689 -13.817 1.00 97.19 237 A 1 ATOM 1797 O O . ASN A 1 237 ? 23.510 0.694 -14.064 1.00 96.70 237 A 1 ATOM 1798 C CB . ASN A 1 237 ? 25.806 2.553 -15.591 1.00 95.36 237 A 1 ATOM 1799 C CG . ASN A 1 237 ? 26.975 2.729 -14.635 1.00 88.59 237 A 1 ATOM 1800 O OD1 . ASN A 1 237 ? 26.985 3.623 -13.815 1.00 75.72 237 A 1 ATOM 1801 N ND2 . ASN A 1 237 ? 27.976 1.889 -14.685 1.00 80.28 237 A 1 ATOM 1802 N N . VAL A 1 238 ? 24.666 1.945 -12.589 1.00 96.54 238 A 1 ATOM 1803 C CA . VAL A 1 238 ? 24.431 1.070 -11.433 1.00 96.99 238 A 1 ATOM 1804 C C . VAL A 1 238 ? 22.952 1.085 -11.047 1.00 97.73 238 A 1 ATOM 1805 O O . VAL A 1 238 ? 22.360 0.022 -10.873 1.00 97.67 238 A 1 ATOM 1806 C CB . VAL A 1 238 ? 25.329 1.458 -10.242 1.00 96.45 238 A 1 ATOM 1807 C CG1 . VAL A 1 238 ? 25.068 0.566 -9.023 1.00 94.99 238 A 1 ATOM 1808 C CG2 . VAL A 1 238 ? 26.815 1.323 -10.599 1.00 94.80 238 A 1 ATOM 1809 N N . ARG A 1 239 ? 22.311 2.258 -11.003 1.00 97.64 239 A 1 ATOM 1810 C CA . ARG A 1 239 ? 20.865 2.355 -10.738 1.00 98.00 239 A 1 ATOM 1811 C C . ARG A 1 239 ? 20.044 1.592 -11.780 1.00 98.24 239 A 1 ATOM 1812 O O . ARG A 1 239 ? 19.148 0.841 -11.407 1.00 98.14 239 A 1 ATOM 1813 C CB . ARG A 1 239 ? 20.408 3.821 -10.669 1.00 97.70 239 A 1 ATOM 1814 C CG . ARG A 1 239 ? 21.026 4.596 -9.492 1.00 96.28 239 A 1 ATOM 1815 C CD . ARG A 1 239 ? 20.348 5.952 -9.282 1.00 95.47 239 A 1 ATOM 1816 N NE . ARG A 1 239 ? 20.506 6.856 -10.441 1.00 91.17 239 A 1 ATOM 1817 C CZ . ARG A 1 239 ? 21.331 7.877 -10.553 1.00 92.60 239 A 1 ATOM 1818 N NH1 . ARG A 1 239 ? 22.166 8.210 -9.613 1.00 82.51 239 A 1 ATOM 1819 N NH2 . ARG A 1 239 ? 21.333 8.604 -11.629 1.00 84.24 239 A 1 ATOM 1820 N N . LYS A 1 240 ? 20.387 1.723 -13.072 1.00 97.48 240 A 1 ATOM 1821 C CA . LYS A 1 240 ? 19.755 0.966 -14.165 1.00 97.43 240 A 1 ATOM 1822 C C . LYS A 1 240 ? 19.932 -0.544 -13.987 1.00 97.73 240 A 1 ATOM 1823 O O . LYS A 1 240 ? 18.965 -1.287 -14.126 1.00 97.45 240 A 1 ATOM 1824 C CB . LYS A 1 240 ? 20.316 1.429 -15.526 1.00 97.08 240 A 1 ATOM 1825 C CG . LYS A 1 240 ? 19.746 2.794 -15.940 1.00 94.36 240 A 1 ATOM 1826 C CD . LYS A 1 240 ? 20.359 3.333 -17.244 1.00 92.05 240 A 1 ATOM 1827 C CE . LYS A 1 240 ? 19.617 4.619 -17.620 1.00 88.16 240 A 1 ATOM 1828 N NZ . LYS A 1 240 ? 20.282 5.416 -18.675 1.00 80.26 240 A 1 ATOM 1829 N N . GLY A 1 241 ? 21.135 -0.995 -13.636 1.00 97.51 241 A 1 ATOM 1830 C CA . GLY A 1 241 ? 21.405 -2.402 -13.328 1.00 97.58 241 A 1 ATOM 1831 C C . GLY A 1 241 ? 20.556 -2.919 -12.165 1.00 98.03 241 A 1 ATOM 1832 O O . GLY A 1 241 ? 19.908 -3.954 -12.291 1.00 97.75 241 A 1 ATOM 1833 N N . MET A 1 242 ? 20.465 -2.163 -11.077 1.00 98.04 242 A 1 ATOM 1834 C CA . MET A 1 242 ? 19.631 -2.516 -9.919 1.00 98.09 242 A 1 ATOM 1835 C C . MET A 1 242 ? 18.150 -2.666 -10.283 1.00 98.09 242 A 1 ATOM 1836 O O . MET A 1 242 ? 17.514 -3.632 -9.867 1.00 97.60 242 A 1 ATOM 1837 C CB . MET A 1 242 ? 19.774 -1.449 -8.826 1.00 97.94 242 A 1 ATOM 1838 C CG . MET A 1 242 ? 21.128 -1.489 -8.120 1.00 97.51 242 A 1 ATOM 1839 S SD . MET A 1 242 ? 21.284 -0.217 -6.835 1.00 97.40 242 A 1 ATOM 1840 C CE . MET A 1 242 ? 22.779 -0.832 -6.019 1.00 92.99 242 A 1 ATOM 1841 N N . VAL A 1 243 ? 17.593 -1.750 -11.085 1.00 98.11 243 A 1 ATOM 1842 C CA . VAL A 1 243 ? 16.192 -1.825 -11.531 1.00 97.95 243 A 1 ATOM 1843 C C . VAL A 1 243 ? 15.963 -3.041 -12.435 1.00 97.67 243 A 1 ATOM 1844 O O . VAL A 1 243 ? 14.976 -3.755 -12.261 1.00 96.88 243 A 1 ATOM 1845 C CB . VAL A 1 243 ? 15.761 -0.515 -12.214 1.00 97.65 243 A 1 ATOM 1846 C CG1 . VAL A 1 243 ? 14.349 -0.616 -12.808 1.00 96.07 243 A 1 ATOM 1847 C CG2 . VAL A 1 243 ? 15.741 0.644 -11.210 1.00 95.92 243 A 1 ATOM 1848 N N . ARG A 1 244 ? 16.899 -3.347 -13.348 1.00 97.89 244 A 1 ATOM 1849 C CA . ARG A 1 244 ? 16.823 -4.557 -14.187 1.00 97.57 244 A 1 ATOM 1850 C C . ARG A 1 244 ? 16.817 -5.834 -13.353 1.00 97.35 244 A 1 ATOM 1851 O O . ARG A 1 244 ? 15.974 -6.695 -13.584 1.00 96.20 244 A 1 ATOM 1852 C CB . ARG A 1 244 ? 17.988 -4.595 -15.181 1.00 97.11 244 A 1 ATOM 1853 C CG . ARG A 1 244 ? 17.820 -3.567 -16.305 1.00 88.46 244 A 1 ATOM 1854 C CD . ARG A 1 244 ? 19.082 -3.567 -17.164 1.00 87.63 244 A 1 ATOM 1855 N NE . ARG A 1 244 ? 19.041 -2.504 -18.180 1.00 77.25 244 A 1 ATOM 1856 C CZ . ARG A 1 244 ? 20.033 -2.164 -18.974 1.00 70.63 244 A 1 ATOM 1857 N NH1 . ARG A 1 244 ? 21.185 -2.785 -18.945 1.00 62.88 244 A 1 ATOM 1858 N NH2 . ARG A 1 244 ? 19.883 -1.181 -19.817 1.00 60.12 244 A 1 ATOM 1859 N N . ILE A 1 245 ? 17.696 -5.936 -12.364 1.00 97.65 245 A 1 ATOM 1860 C CA . ILE A 1 245 ? 17.741 -7.076 -11.439 1.00 97.49 245 A 1 ATOM 1861 C C . ILE A 1 245 ? 16.424 -7.184 -10.672 1.00 96.95 245 A 1 ATOM 1862 O O . ILE A 1 245 ? 15.848 -8.265 -10.612 1.00 96.08 245 A 1 ATOM 1863 C CB . ILE A 1 245 ? 18.951 -6.961 -10.486 1.00 97.57 245 A 1 ATOM 1864 C CG1 . ILE A 1 245 ? 20.254 -7.140 -11.293 1.00 96.25 245 A 1 ATOM 1865 C CG2 . ILE A 1 245 ? 18.889 -8.014 -9.359 1.00 96.43 245 A 1 ATOM 1866 C CD1 . ILE A 1 245 ? 21.487 -6.610 -10.569 1.00 91.74 245 A 1 ATOM 1867 N N . ALA A 1 246 ? 15.899 -6.070 -10.149 1.00 97.07 246 A 1 ATOM 1868 C CA . ALA A 1 246 ? 14.621 -6.070 -9.446 1.00 96.20 246 A 1 ATOM 1869 C C . ALA A 1 246 ? 13.481 -6.606 -10.326 1.00 95.01 246 A 1 ATOM 1870 O O . ALA A 1 246 ? 12.686 -7.425 -9.867 1.00 93.88 246 A 1 ATOM 1871 C CB . ALA A 1 246 ? 14.325 -4.652 -8.945 1.00 96.19 246 A 1 ATOM 1872 N N . ASN A 1 247 ? 13.429 -6.201 -11.598 1.00 95.84 247 A 1 ATOM 1873 C CA . ASN A 1 247 ? 12.431 -6.676 -12.552 1.00 94.18 247 A 1 ATOM 1874 C C . ASN A 1 247 ? 12.595 -8.168 -12.883 1.00 92.66 247 A 1 ATOM 1875 O O . ASN A 1 247 ? 11.595 -8.880 -12.951 1.00 90.96 247 A 1 ATOM 1876 C CB . ASN A 1 247 ? 12.478 -5.785 -13.804 1.00 93.98 247 A 1 ATOM 1877 C CG . ASN A 1 247 ? 11.893 -4.401 -13.553 1.00 92.37 247 A 1 ATOM 1878 O OD1 . ASN A 1 247 ? 11.081 -4.206 -12.662 1.00 84.84 247 A 1 ATOM 1879 N ND2 . ASN A 1 247 ? 12.253 -3.419 -14.340 1.00 84.39 247 A 1 ATOM 1880 N N . GLN A 1 248 ? 13.823 -8.668 -13.028 1.00 95.34 248 A 1 ATOM 1881 C CA . GLN A 1 248 ? 14.072 -10.098 -13.248 1.00 94.40 248 A 1 ATOM 1882 C C . GLN A 1 248 ? 13.696 -10.942 -12.022 1.00 93.55 248 A 1 ATOM 1883 O O . GLN A 1 248 ? 13.006 -11.944 -12.169 1.00 91.76 248 A 1 ATOM 1884 C CB . GLN A 1 248 ? 15.531 -10.330 -13.650 1.00 94.55 248 A 1 ATOM 1885 C CG . GLN A 1 248 ? 15.841 -9.785 -15.056 1.00 90.57 248 A 1 ATOM 1886 C CD . GLN A 1 248 ? 17.263 -10.098 -15.514 1.00 85.71 248 A 1 ATOM 1887 O OE1 . GLN A 1 248 ? 17.942 -10.961 -14.994 1.00 77.06 248 A 1 ATOM 1888 N NE2 . GLN A 1 248 ? 17.777 -9.439 -16.523 1.00 73.24 248 A 1 ATOM 1889 N N . VAL A 1 249 ? 14.039 -10.501 -10.816 1.00 93.86 249 A 1 ATOM 1890 C CA . VAL A 1 249 ? 13.631 -11.164 -9.563 1.00 93.15 249 A 1 ATOM 1891 C C . VAL A 1 249 ? 12.105 -11.213 -9.438 1.00 91.75 249 A 1 ATOM 1892 O O . VAL A 1 249 ? 11.552 -12.240 -9.068 1.00 89.99 249 A 1 ATOM 1893 C CB . VAL A 1 249 ? 14.275 -10.466 -8.347 1.00 93.80 249 A 1 ATOM 1894 C CG1 . VAL A 1 249 ? 13.748 -10.987 -7.007 1.00 93.07 249 A 1 ATOM 1895 C CG2 . VAL A 1 249 ? 15.796 -10.667 -8.342 1.00 92.62 249 A 1 ATOM 1896 N N . ARG A 1 250 ? 11.399 -10.135 -9.800 1.00 90.90 250 A 1 ATOM 1897 C CA . ARG A 1 250 ? 9.923 -10.121 -9.803 1.00 88.53 250 A 1 ATOM 1898 C C . ARG A 1 250 ? 9.330 -11.113 -10.801 1.00 86.83 250 A 1 ATOM 1899 O O . ARG A 1 250 ? 8.334 -11.743 -10.474 1.00 85.05 250 A 1 ATOM 1900 C CB . ARG A 1 250 ? 9.407 -8.715 -10.123 1.00 88.15 250 A 1 ATOM 1901 C CG . ARG A 1 250 ? 9.632 -7.727 -8.976 1.00 86.83 250 A 1 ATOM 1902 C CD . ARG A 1 250 ? 9.490 -6.302 -9.519 1.00 86.77 250 A 1 ATOM 1903 N NE . ARG A 1 250 ? 9.928 -5.323 -8.520 1.00 86.41 250 A 1 ATOM 1904 C CZ . ARG A 1 250 ? 10.289 -4.071 -8.738 1.00 87.23 250 A 1 ATOM 1905 N NH1 . ARG A 1 250 ? 10.257 -3.497 -9.904 1.00 81.28 250 A 1 ATOM 1906 N NH2 . ARG A 1 250 ? 10.700 -3.352 -7.750 1.00 82.32 250 A 1 ATOM 1907 N N . LYS A 1 251 ? 9.929 -11.265 -11.990 1.00 88.64 251 A 1 ATOM 1908 C CA . LYS A 1 251 ? 9.504 -12.273 -12.974 1.00 86.72 251 A 1 ATOM 1909 C C . LYS A 1 251 ? 9.675 -13.692 -12.437 1.00 86.00 251 A 1 ATOM 1910 O O . LYS A 1 251 ? 8.730 -14.465 -12.500 1.00 83.48 251 A 1 ATOM 1911 C CB . LYS A 1 251 ? 10.278 -12.113 -14.284 1.00 86.20 251 A 1 ATOM 1912 C CG . LYS A 1 251 ? 9.854 -10.873 -15.075 1.00 80.60 251 A 1 ATOM 1913 C CD . LYS A 1 251 ? 10.686 -10.812 -16.354 1.00 78.46 251 A 1 ATOM 1914 C CE . LYS A 1 251 ? 10.267 -9.631 -17.227 1.00 71.57 251 A 1 ATOM 1915 N NZ . LYS A 1 251 ? 10.863 -9.780 -18.575 1.00 64.87 251 A 1 ATOM 1916 N N . LEU A 1 252 ? 10.831 -13.998 -11.847 1.00 85.46 252 A 1 ATOM 1917 C CA . LEU A 1 252 ? 11.083 -15.300 -11.217 1.00 83.49 252 A 1 ATOM 1918 C C . LEU A 1 252 ? 10.120 -15.588 -10.057 1.00 82.03 252 A 1 ATOM 1919 O O . LEU A 1 252 ? 9.745 -16.733 -9.847 1.00 78.83 252 A 1 ATOM 1920 C CB . LEU A 1 252 ? 12.532 -15.348 -10.701 1.00 85.38 252 A 1 ATOM 1921 C CG . LEU A 1 252 ? 13.623 -15.339 -11.788 1.00 83.86 252 A 1 ATOM 1922 C CD1 . LEU A 1 252 ? 14.994 -15.243 -11.112 1.00 80.95 252 A 1 ATOM 1923 C CD2 . LEU A 1 252 ? 13.594 -16.598 -12.651 1.00 81.00 252 A 1 ATOM 1924 N N . PHE A 1 253 ? 9.711 -14.561 -9.317 1.00 82.87 253 A 1 ATOM 1925 C CA . PHE A 1 253 ? 8.749 -14.679 -8.224 1.00 79.84 253 A 1 ATOM 1926 C C . PHE A 1 253 ? 7.314 -14.924 -8.711 1.00 79.89 253 A 1 ATOM 1927 O O . PHE A 1 253 ? 6.583 -15.685 -8.095 1.00 77.80 253 A 1 ATOM 1928 C CB . PHE A 1 253 ? 8.819 -13.408 -7.375 1.00 79.23 253 A 1 ATOM 1929 C CG . PHE A 1 253 ? 7.797 -13.348 -6.258 1.00 76.95 253 A 1 ATOM 1930 C CD1 . PHE A 1 253 ? 6.646 -12.542 -6.387 1.00 74.02 253 A 1 ATOM 1931 C CD2 . PHE A 1 253 ? 7.987 -14.113 -5.097 1.00 72.42 253 A 1 ATOM 1932 C CE1 . PHE A 1 253 ? 5.704 -12.493 -5.346 1.00 70.54 253 A 1 ATOM 1933 C CE2 . PHE A 1 253 ? 7.044 -14.060 -4.056 1.00 70.47 253 A 1 ATOM 1934 C CZ . PHE A 1 253 ? 5.907 -13.246 -4.179 1.00 72.72 253 A 1 ATOM 1935 N N . LEU A 1 254 ? 6.893 -14.263 -9.796 1.00 75.49 254 A 1 ATOM 1936 C CA . LEU A 1 254 ? 5.526 -14.381 -10.320 1.00 72.42 254 A 1 ATOM 1937 C C . LEU A 1 254 ? 5.317 -15.634 -11.178 1.00 71.70 254 A 1 ATOM 1938 O O . LEU A 1 254 ? 4.176 -16.046 -11.358 1.00 66.40 254 A 1 ATOM 1939 C CB . LEU A 1 254 ? 5.182 -13.107 -11.117 1.00 69.58 254 A 1 ATOM 1940 C CG . LEU A 1 254 ? 5.002 -11.840 -10.261 1.00 65.06 254 A 1 ATOM 1941 C CD1 . LEU A 1 254 ? 4.868 -10.618 -11.176 1.00 63.76 254 A 1 ATOM 1942 C CD2 . LEU A 1 254 ? 3.760 -11.905 -9.371 1.00 61.23 254 A 1 ATOM 1943 N N . GLY A 1 255 ? 6.393 -16.220 -11.703 1.00 74.03 255 A 1 ATOM 1944 C CA . GLY A 1 255 ? 6.320 -17.251 -12.734 1.00 72.68 255 A 1 ATOM 1945 C C . GLY A 1 255 ? 6.020 -16.672 -14.123 1.00 73.39 255 A 1 ATOM 1946 O O . GLY A 1 255 ? 5.620 -15.514 -14.275 1.00 67.09 255 A 1 ATOM 1947 N N . GLU A 1 256 ? 6.220 -17.482 -15.169 1.00 67.74 256 A 1 ATOM 1948 C CA . GLU A 1 256 ? 5.840 -17.151 -16.549 1.00 68.69 256 A 1 ATOM 1949 C C . GLU A 1 256 ? 4.794 -18.151 -17.062 1.00 67.82 256 A 1 ATOM 1950 O O . GLU A 1 256 ? 4.801 -19.326 -16.703 1.00 60.63 256 A 1 ATOM 1951 C CB . GLU A 1 256 ? 7.072 -17.058 -17.479 1.00 62.94 256 A 1 ATOM 1952 C CG . GLU A 1 256 ? 7.983 -15.845 -17.163 1.00 57.61 256 A 1 ATOM 1953 C CD . GLU A 1 256 ? 9.055 -15.533 -18.230 1.00 53.92 256 A 1 ATOM 1954 O OE1 . GLU A 1 256 ? 9.622 -14.408 -18.168 1.00 50.72 256 A 1 ATOM 1955 O OE2 . GLU A 1 256 ? 9.293 -16.363 -19.132 1.00 53.25 256 A 1 ATOM 1956 N N . ASN A 1 257 ? 3.875 -17.695 -17.912 1.00 66.03 257 A 1 ATOM 1957 C CA . ASN A 1 257 ? 2.895 -18.536 -18.616 1.00 65.59 257 A 1 ATOM 1958 C C . ASN A 1 257 ? 1.980 -19.407 -17.728 1.00 65.92 257 A 1 ATOM 1959 O O . ASN A 1 257 ? 1.474 -20.431 -18.187 1.00 60.71 257 A 1 ATOM 1960 C CB . ASN A 1 257 ? 3.622 -19.335 -19.713 1.00 60.40 257 A 1 ATOM 1961 C CG . ASN A 1 257 ? 4.394 -18.454 -20.673 1.00 57.29 257 A 1 ATOM 1962 O OD1 . ASN A 1 257 ? 3.966 -17.376 -21.062 1.00 52.27 257 A 1 ATOM 1963 N ND2 . ASN A 1 257 ? 5.569 -18.867 -21.080 1.00 51.14 257 A 1 ATOM 1964 N N . GLY A 1 258 ? 1.714 -18.992 -16.493 1.00 64.11 258 A 1 ATOM 1965 C CA . GLY A 1 258 ? 0.840 -19.722 -15.566 1.00 63.86 258 A 1 ATOM 1966 C C . GLY A 1 258 ? 1.537 -20.833 -14.777 1.00 66.57 258 A 1 ATOM 1967 O O . GLY A 1 258 ? 0.846 -21.585 -14.090 1.00 62.05 258 A 1 ATOM 1968 N N . GLU A 1 259 ? 2.862 -20.935 -14.855 1.00 65.46 259 A 1 ATOM 1969 C CA . GLU A 1 259 ? 3.667 -21.753 -13.946 1.00 68.01 259 A 1 ATOM 1970 C C . GLU A 1 259 ? 3.898 -21.013 -12.623 1.00 68.92 259 A 1 ATOM 1971 O O . GLU A 1 259 ? 3.997 -19.782 -12.596 1.00 62.57 259 A 1 ATOM 1972 C CB . GLU A 1 259 ? 5.005 -22.149 -14.591 1.00 63.54 259 A 1 ATOM 1973 C CG . GLU A 1 259 ? 4.820 -23.034 -15.839 1.00 57.33 259 A 1 ATOM 1974 C CD . GLU A 1 259 ? 6.142 -23.564 -16.429 1.00 51.28 259 A 1 ATOM 1975 O OE1 . GLU A 1 259 ? 6.056 -24.472 -17.292 1.00 46.45 259 A 1 ATOM 1976 O OE2 . GLU A 1 259 ? 7.228 -23.076 -16.036 1.00 49.52 259 A 1 ATOM 1977 N N . ASP A 1 260 ? 3.990 -21.774 -11.523 1.00 69.72 260 A 1 ATOM 1978 C CA . ASP A 1 260 ? 4.300 -21.215 -10.209 1.00 72.80 260 A 1 ATOM 1979 C C . ASP A 1 260 ? 5.676 -20.526 -10.206 1.00 75.23 260 A 1 ATOM 1980 O O . ASP A 1 260 ? 6.603 -20.908 -10.925 1.00 68.47 260 A 1 ATOM 1981 C CB . ASP A 1 260 ? 4.229 -22.304 -9.122 1.00 67.12 260 A 1 ATOM 1982 C CG . ASP A 1 260 ? 2.801 -22.758 -8.784 1.00 61.70 260 A 1 ATOM 1983 O OD1 . ASP A 1 260 ? 1.880 -21.917 -8.873 1.00 58.55 260 A 1 ATOM 1984 O OD2 . ASP A 1 260 ? 2.651 -23.938 -8.399 1.00 57.21 260 A 1 ATOM 1985 N N . GLY A 1 261 ? 5.810 -19.486 -9.382 1.00 75.06 261 A 1 ATOM 1986 C CA . GLY A 1 261 ? 7.063 -18.756 -9.229 1.00 76.78 261 A 1 ATOM 1987 C C . GLY A 1 261 ? 8.214 -19.672 -8.799 1.00 80.03 261 A 1 ATOM 1988 O O . GLY A 1 261 ? 8.058 -20.545 -7.952 1.00 75.42 261 A 1 ATOM 1989 N N . GLN A 1 262 ? 9.400 -19.449 -9.362 1.00 76.20 262 A 1 ATOM 1990 C CA . GLN A 1 262 ? 10.600 -20.258 -9.099 1.00 78.97 262 A 1 ATOM 1991 C C . GLN A 1 262 ? 11.303 -19.887 -7.787 1.00 82.34 262 A 1 ATOM 1992 O O . GLN A 1 262 ? 12.199 -20.604 -7.346 1.00 78.78 262 A 1 ATOM 1993 C CB . GLN A 1 262 ? 11.583 -20.112 -10.270 1.00 75.11 262 A 1 ATOM 1994 C CG . GLN A 1 262 ? 11.007 -20.612 -11.601 1.00 69.82 262 A 1 ATOM 1995 C CD . GLN A 1 262 ? 11.981 -20.460 -12.767 1.00 64.64 262 A 1 ATOM 1996 O OE1 . GLN A 1 262 ? 13.122 -20.025 -12.649 1.00 59.67 262 A 1 ATOM 1997 N NE2 . GLN A 1 262 ? 11.556 -20.811 -13.960 1.00 57.02 262 A 1 ATOM 1998 N N . ILE A 1 263 ? 10.945 -18.742 -7.199 1.00 84.30 263 A 1 ATOM 1999 C CA . ILE A 1 263 ? 11.521 -18.227 -5.951 1.00 85.03 263 A 1 ATOM 2000 C C . ILE A 1 263 ? 10.420 -17.711 -5.020 1.00 84.22 263 A 1 ATOM 2001 O O . ILE A 1 263 ? 9.412 -17.169 -5.471 1.00 80.66 263 A 1 ATOM 2002 C CB . ILE A 1 263 ? 12.604 -17.151 -6.216 1.00 84.66 263 A 1 ATOM 2003 C CG1 . ILE A 1 263 ? 12.047 -15.891 -6.910 1.00 80.63 263 A 1 ATOM 2004 C CG2 . ILE A 1 263 ? 13.786 -17.744 -7.012 1.00 77.13 263 A 1 ATOM 2005 C CD1 . ILE A 1 263 ? 13.077 -14.761 -7.070 1.00 77.76 263 A 1 ATOM 2006 N N . SER A 1 264 ? 10.645 -17.819 -3.714 1.00 87.85 264 A 1 ATOM 2007 C CA . SER A 1 264 ? 9.714 -17.387 -2.660 1.00 87.13 264 A 1 ATOM 2008 C C . SER A 1 264 ? 9.895 -15.925 -2.236 1.00 87.66 264 A 1 ATOM 2009 O O . SER A 1 264 ? 9.040 -15.342 -1.568 1.00 85.73 264 A 1 ATOM 2010 C CB . SER A 1 264 ? 9.862 -18.317 -1.455 1.00 86.10 264 A 1 ATOM 2011 O OG . SER A 1 264 ? 11.122 -18.122 -0.837 1.00 82.74 264 A 1 ATOM 2012 N N . VAL A 1 265 ? 11.004 -15.293 -2.634 1.00 89.29 265 A 1 ATOM 2013 C CA . VAL A 1 265 ? 11.327 -13.903 -2.285 1.00 89.79 265 A 1 ATOM 2014 C C . VAL A 1 265 ? 11.194 -12.969 -3.486 1.00 89.72 265 A 1 ATOM 2015 O O . VAL A 1 265 ? 11.615 -13.275 -4.595 1.00 88.20 265 A 1 ATOM 2016 C CB . VAL A 1 265 ? 12.710 -13.760 -1.623 1.00 89.79 265 A 1 ATOM 2017 C CG1 . VAL A 1 265 ? 12.765 -14.502 -0.283 1.00 86.05 265 A 1 ATOM 2018 C CG2 . VAL A 1 265 ? 13.873 -14.216 -2.500 1.00 85.83 265 A 1 ATOM 2019 N N . THR A 1 266 ? 10.664 -11.767 -3.255 1.00 89.09 266 A 1 ATOM 2020 C CA . THR A 1 266 ? 10.542 -10.739 -4.297 1.00 89.33 266 A 1 ATOM 2021 C C . THR A 1 266 ? 11.317 -9.466 -3.956 1.00 90.91 266 A 1 ATOM 2022 O O . THR A 1 266 ? 11.548 -9.122 -2.790 1.00 90.56 266 A 1 ATOM 2023 C CB . THR A 1 266 ? 9.065 -10.453 -4.636 1.00 87.04 266 A 1 ATOM 2024 O OG1 . THR A 1 266 ? 8.990 -9.677 -5.816 1.00 82.66 266 A 1 ATOM 2025 C CG2 . THR A 1 266 ? 8.314 -9.705 -3.541 1.00 82.63 266 A 1 ATOM 2026 N N . MET A 1 267 ? 11.704 -8.719 -4.990 1.00 92.83 267 A 1 ATOM 2027 C CA . MET A 1 267 ? 12.338 -7.409 -4.872 1.00 93.54 267 A 1 ATOM 2028 C C . MET A 1 267 ? 11.274 -6.311 -4.970 1.00 93.24 267 A 1 ATOM 2029 O O . MET A 1 267 ? 10.958 -5.807 -6.050 1.00 91.27 267 A 1 ATOM 2030 C CB . MET A 1 267 ? 13.441 -7.280 -5.935 1.00 93.11 267 A 1 ATOM 2031 C CG . MET A 1 267 ? 14.265 -5.999 -5.764 1.00 89.67 267 A 1 ATOM 2032 S SD . MET A 1 267 ? 15.442 -5.991 -4.388 1.00 89.06 267 A 1 ATOM 2033 C CE . MET A 1 267 ? 16.747 -7.031 -5.097 1.00 82.35 267 A 1 ATOM 2034 N N . SER A 1 268 ? 10.712 -5.910 -3.829 1.00 91.89 268 A 1 ATOM 2035 C CA . SER A 1 268 ? 9.837 -4.730 -3.779 1.00 91.78 268 A 1 ATOM 2036 C C . SER A 1 268 ? 10.622 -3.437 -4.032 1.00 93.09 268 A 1 ATOM 2037 O O . SER A 1 268 ? 11.821 -3.376 -3.756 1.00 93.36 268 A 1 ATOM 2038 C CB . SER A 1 268 ? 9.088 -4.666 -2.443 1.00 90.52 268 A 1 ATOM 2039 O OG . SER A 1 268 ? 9.942 -4.313 -1.372 1.00 88.45 268 A 1 ATOM 2040 N N . THR A 1 269 ? 9.942 -2.355 -4.439 1.00 92.40 269 A 1 ATOM 2041 C CA . THR A 1 269 ? 10.564 -1.018 -4.564 1.00 93.16 269 A 1 ATOM 2042 C C . THR A 1 269 ? 11.208 -0.566 -3.246 1.00 94.38 269 A 1 ATOM 2043 O O . THR A 1 269 ? 12.287 0.023 -3.247 1.00 94.13 269 A 1 ATOM 2044 C CB . THR A 1 269 ? 9.528 0.019 -5.034 1.00 92.39 269 A 1 ATOM 2045 O OG1 . THR A 1 269 ? 8.919 -0.430 -6.223 1.00 90.20 269 A 1 ATOM 2046 C CG2 . THR A 1 269 ? 10.123 1.395 -5.302 1.00 89.82 269 A 1 ATOM 2047 N N . ARG A 1 270 ? 10.627 -0.921 -2.090 1.00 93.48 270 A 1 ATOM 2048 C CA . ARG A 1 270 ? 11.236 -0.691 -0.766 1.00 93.66 270 A 1 ATOM 2049 C C . ARG A 1 270 ? 12.578 -1.421 -0.617 1.00 95.01 270 A 1 ATOM 2050 O O . ARG A 1 270 ? 13.539 -0.845 -0.120 1.00 94.72 270 A 1 ATOM 2051 C CB . ARG A 1 270 ? 10.246 -1.122 0.332 1.00 91.95 270 A 1 ATOM 2052 C CG . ARG A 1 270 ? 10.771 -0.842 1.753 1.00 86.51 270 A 1 ATOM 2053 C CD . ARG A 1 270 ? 9.856 -1.449 2.830 1.00 83.72 270 A 1 ATOM 2054 N NE . ARG A 1 270 ? 8.515 -0.831 2.862 1.00 78.05 270 A 1 ATOM 2055 C CZ . ARG A 1 270 ? 7.421 -1.356 3.404 1.00 74.92 270 A 1 ATOM 2056 N NH1 . ARG A 1 270 ? 7.415 -2.533 3.970 1.00 65.12 270 A 1 ATOM 2057 N NH2 . ARG A 1 270 ? 6.295 -0.695 3.394 1.00 65.42 270 A 1 ATOM 2058 N N . THR A 1 271 ? 12.640 -2.690 -1.032 1.00 95.17 271 A 1 ATOM 2059 C CA . THR A 1 271 ? 13.868 -3.500 -0.982 1.00 95.86 271 A 1 ATOM 2060 C C . THR A 1 271 ? 14.920 -2.958 -1.951 1.00 96.94 271 A 1 ATOM 2061 O O . THR A 1 271 ? 16.079 -2.839 -1.565 1.00 97.11 271 A 1 ATOM 2062 C CB . THR A 1 271 ? 13.563 -4.976 -1.273 1.00 95.21 271 A 1 ATOM 2063 O OG1 . THR A 1 271 ? 12.620 -5.470 -0.344 1.00 93.11 271 A 1 ATOM 2064 C CG2 . THR A 1 271 ? 14.798 -5.860 -1.127 1.00 93.24 271 A 1 ATOM 2065 N N . LEU A 1 272 ? 14.519 -2.540 -3.152 1.00 96.31 272 A 1 ATOM 2066 C CA . LEU A 1 272 ? 15.387 -1.898 -4.144 1.00 96.80 272 A 1 ATOM 2067 C C . LEU A 1 272 ? 16.020 -0.603 -3.602 1.00 97.22 272 A 1 ATOM 2068 O O . LEU A 1 272 ? 17.235 -0.426 -3.664 1.00 97.26 272 A 1 ATOM 2069 C CB . LEU A 1 272 ? 14.546 -1.647 -5.412 1.00 96.87 272 A 1 ATOM 2070 C CG . LEU A 1 272 ? 15.280 -0.875 -6.523 1.00 96.32 272 A 1 ATOM 2071 C CD1 . LEU A 1 272 ? 16.510 -1.618 -7.021 1.00 95.31 272 A 1 ATOM 2072 C CD2 . LEU A 1 272 ? 14.323 -0.644 -7.692 1.00 95.19 272 A 1 ATOM 2073 N N . VAL A 1 273 ? 15.219 0.280 -3.003 1.00 96.64 273 A 1 ATOM 2074 C CA . VAL A 1 273 ? 15.714 1.513 -2.358 1.00 96.29 273 A 1 ATOM 2075 C C . VAL A 1 273 ? 16.662 1.195 -1.200 1.00 96.84 273 A 1 ATOM 2076 O O . VAL A 1 273 ? 17.697 1.849 -1.053 1.00 96.82 273 A 1 ATOM 2077 C CB . VAL A 1 273 ? 14.533 2.382 -1.877 1.00 95.40 273 A 1 ATOM 2078 C CG1 . VAL A 1 273 ? 14.964 3.529 -0.953 1.00 94.05 273 A 1 ATOM 2079 C CG2 . VAL A 1 273 ? 13.808 3.009 -3.077 1.00 94.00 273 A 1 ATOM 2080 N N . ARG A 1 274 ? 16.340 0.183 -0.383 1.00 97.43 274 A 1 ATOM 2081 C CA . ARG A 1 274 ? 17.225 -0.276 0.696 1.00 97.55 274 A 1 ATOM 2082 C C . ARG A 1 274 ? 18.569 -0.743 0.143 1.00 98.04 274 A 1 ATOM 2083 O O . ARG A 1 274 ? 19.593 -0.307 0.648 1.00 98.02 274 A 1 ATOM 2084 C CB . ARG A 1 274 ? 16.532 -1.377 1.510 1.00 97.02 274 A 1 ATOM 2085 C CG . ARG A 1 274 ? 17.395 -1.839 2.699 1.00 95.20 274 A 1 ATOM 2086 C CD . ARG A 1 274 ? 16.757 -3.032 3.424 1.00 93.41 274 A 1 ATOM 2087 N NE . ARG A 1 274 ? 15.463 -2.686 4.040 1.00 88.99 274 A 1 ATOM 2088 C CZ . ARG A 1 274 ? 14.408 -3.478 4.158 1.00 89.17 274 A 1 ATOM 2089 N NH1 . ARG A 1 274 ? 14.397 -4.699 3.697 1.00 79.24 274 A 1 ATOM 2090 N NH2 . ARG A 1 274 ? 13.335 -3.048 4.757 1.00 80.95 274 A 1 ATOM 2091 N N . TRP A 1 275 ? 18.562 -1.564 -0.898 1.00 97.92 275 A 1 ATOM 2092 C CA . TRP A 1 275 ? 19.781 -2.049 -1.544 1.00 98.32 275 A 1 ATOM 2093 C C . TRP A 1 275 ? 20.655 -0.896 -2.052 1.00 98.46 275 A 1 ATOM 2094 O O . TRP A 1 275 ? 21.842 -0.839 -1.739 1.00 98.24 275 A 1 ATOM 2095 C CB . TRP A 1 275 ? 19.400 -3.004 -2.679 1.00 98.24 275 A 1 ATOM 2096 C CG . TRP A 1 275 ? 20.563 -3.584 -3.431 1.00 98.33 275 A 1 ATOM 2097 C CD1 . TRP A 1 275 ? 21.809 -3.792 -2.947 1.00 97.82 275 A 1 ATOM 2098 C CD2 . TRP A 1 275 ? 20.600 -4.037 -4.814 1.00 98.26 275 A 1 ATOM 2099 N NE1 . TRP A 1 275 ? 22.612 -4.338 -3.926 1.00 97.71 275 A 1 ATOM 2100 C CE2 . TRP A 1 275 ? 21.912 -4.523 -5.100 1.00 97.97 275 A 1 ATOM 2101 C CE3 . TRP A 1 275 ? 19.648 -4.107 -5.856 1.00 97.80 275 A 1 ATOM 2102 C CZ2 . TRP A 1 275 ? 22.264 -5.058 -6.344 1.00 97.45 275 A 1 ATOM 2103 C CZ3 . TRP A 1 275 ? 19.992 -4.647 -7.101 1.00 97.17 275 A 1 ATOM 2104 C CH2 . TRP A 1 275 ? 21.293 -5.124 -7.347 1.00 96.84 275 A 1 ATOM 2105 N N . ALA A 1 276 ? 20.065 0.087 -2.742 1.00 98.16 276 A 1 ATOM 2106 C CA . ALA A 1 276 ? 20.794 1.254 -3.237 1.00 97.95 276 A 1 ATOM 2107 C C . ALA A 1 276 ? 21.419 2.099 -2.106 1.00 97.93 276 A 1 ATOM 2108 O O . ALA A 1 276 ? 22.579 2.506 -2.199 1.00 97.65 276 A 1 ATOM 2109 C CB . ALA A 1 276 ? 19.833 2.071 -4.106 1.00 97.89 276 A 1 ATOM 2110 N N . LYS A 1 277 ? 20.685 2.328 -1.005 1.00 97.93 277 A 1 ATOM 2111 C CA . LYS A 1 277 ? 21.210 3.036 0.180 1.00 97.69 277 A 1 ATOM 2112 C C . LYS A 1 277 ? 22.362 2.274 0.837 1.00 97.85 277 A 1 ATOM 2113 O O . LYS A 1 277 ? 23.390 2.876 1.141 1.00 97.34 277 A 1 ATOM 2114 C CB . LYS A 1 277 ? 20.085 3.287 1.201 1.00 97.34 277 A 1 ATOM 2115 C CG . LYS A 1 277 ? 19.129 4.410 0.770 1.00 96.42 277 A 1 ATOM 2116 C CD . LYS A 1 277 ? 18.027 4.633 1.823 1.00 94.51 277 A 1 ATOM 2117 C CE . LYS A 1 277 ? 17.152 5.822 1.413 1.00 91.17 277 A 1 ATOM 2118 N NZ . LYS A 1 277 ? 16.114 6.174 2.417 1.00 84.98 277 A 1 ATOM 2119 N N . LEU A 1 278 ? 22.210 0.965 1.022 1.00 97.84 278 A 1 ATOM 2120 C CA . LEU A 1 278 ? 23.240 0.115 1.620 1.00 97.73 278 A 1 ATOM 2121 C C . LEU A 1 278 ? 24.494 0.031 0.742 1.00 97.77 278 A 1 ATOM 2122 O O . LEU A 1 278 ? 25.597 0.087 1.273 1.00 97.37 278 A 1 ATOM 2123 C CB . LEU A 1 278 ? 22.663 -1.283 1.895 1.00 97.63 278 A 1 ATOM 2124 C CG . LEU A 1 278 ? 21.632 -1.352 3.037 1.00 96.95 278 A 1 ATOM 2125 C CD1 . LEU A 1 278 ? 21.079 -2.775 3.127 1.00 95.77 278 A 1 ATOM 2126 C CD2 . LEU A 1 278 ? 22.220 -0.985 4.398 1.00 95.71 278 A 1 ATOM 2127 N N . SER A 1 279 ? 24.350 0.010 -0.584 1.00 97.85 279 A 1 ATOM 2128 C CA . SER A 1 279 ? 25.495 0.019 -1.510 1.00 97.46 279 A 1 ATOM 2129 C C . SER A 1 279 ? 26.359 1.275 -1.363 1.00 97.08 279 A 1 ATOM 2130 O O . SER A 1 279 ? 27.582 1.203 -1.453 1.00 96.11 279 A 1 ATOM 2131 C CB . SER A 1 279 ? 25.019 -0.101 -2.958 1.00 97.38 279 A 1 ATOM 2132 O OG . SER A 1 279 ? 24.293 -1.297 -3.144 1.00 94.19 279 A 1 ATOM 2133 N N . LEU A 1 280 ? 25.749 2.435 -1.085 1.00 97.57 280 A 1 ATOM 2134 C CA . LEU A 1 280 ? 26.498 3.655 -0.762 1.00 97.14 280 A 1 ATOM 2135 C C . LEU A 1 280 ? 27.125 3.606 0.638 1.00 96.83 280 A 1 ATOM 2136 O O . LEU A 1 280 ? 28.258 4.055 0.807 1.00 95.24 280 A 1 ATOM 2137 C CB . LEU A 1 280 ? 25.586 4.887 -0.882 1.00 96.79 280 A 1 ATOM 2138 C CG . LEU A 1 280 ? 25.203 5.266 -2.319 1.00 95.40 280 A 1 ATOM 2139 C CD1 . LEU A 1 280 ? 24.233 6.450 -2.266 1.00 93.04 280 A 1 ATOM 2140 C CD2 . LEU A 1 280 ? 26.415 5.687 -3.154 1.00 93.44 280 A 1 ATOM 2141 N N . ALA A 1 281 ? 26.399 3.073 1.623 1.00 97.02 281 A 1 ATOM 2142 C CA . ALA A 1 281 ? 26.887 2.963 2.999 1.00 96.54 281 A 1 ATOM 2143 C C . ALA A 1 281 ? 28.097 2.019 3.110 1.00 96.38 281 A 1 ATOM 2144 O O . ALA A 1 281 ? 29.055 2.327 3.814 1.00 94.62 281 A 1 ATOM 2145 C CB . ALA A 1 281 ? 25.727 2.504 3.891 1.00 96.36 281 A 1 ATOM 2146 N N . PHE A 1 282 ? 28.085 0.916 2.358 1.00 96.61 282 A 1 ATOM 2147 C CA . PHE A 1 282 ? 29.123 -0.115 2.362 1.00 95.58 282 A 1 ATOM 2148 C C . PHE A 1 282 ? 30.097 -0.028 1.180 1.00 94.83 282 A 1 ATOM 2149 O O . PHE A 1 282 ? 30.755 -1.008 0.852 1.00 92.27 282 A 1 ATOM 2150 C CB . PHE A 1 282 ? 28.463 -1.494 2.483 1.00 94.81 282 A 1 ATOM 2151 C CG . PHE A 1 282 ? 27.648 -1.670 3.747 1.00 93.84 282 A 1 ATOM 2152 C CD1 . PHE A 1 282 ? 28.245 -1.483 5.009 1.00 90.51 282 A 1 ATOM 2153 C CD2 . PHE A 1 282 ? 26.290 -2.019 3.664 1.00 91.41 282 A 1 ATOM 2154 C CE1 . PHE A 1 282 ? 27.485 -1.638 6.183 1.00 89.44 282 A 1 ATOM 2155 C CE2 . PHE A 1 282 ? 25.533 -2.176 4.839 1.00 89.71 282 A 1 ATOM 2156 C CZ . PHE A 1 282 ? 26.129 -1.985 6.097 1.00 89.49 282 A 1 ATOM 2157 N N . ARG A 1 283 ? 30.250 1.140 0.559 1.00 94.38 283 A 1 ATOM 2158 C CA . ARG A 1 283 ? 31.141 1.343 -0.605 1.00 91.82 283 A 1 ATOM 2159 C C . ARG A 1 283 ? 32.607 0.918 -0.409 1.00 91.27 283 A 1 ATOM 2160 O O . ARG A 1 283 ? 33.337 0.830 -1.386 1.00 84.24 283 A 1 ATOM 2161 C CB . ARG A 1 283 ? 31.073 2.816 -1.045 1.00 89.40 283 A 1 ATOM 2162 C CG . ARG A 1 283 ? 31.724 3.768 -0.027 1.00 79.67 283 A 1 ATOM 2163 C CD . ARG A 1 283 ? 31.604 5.223 -0.471 1.00 78.04 283 A 1 ATOM 2164 N NE . ARG A 1 283 ? 32.303 6.107 0.482 1.00 69.43 283 A 1 ATOM 2165 C CZ . ARG A 1 283 ? 32.451 7.415 0.372 1.00 62.45 283 A 1 ATOM 2166 N NH1 . ARG A 1 283 ? 31.943 8.078 -0.627 1.00 58.14 283 A 1 ATOM 2167 N NH2 . ARG A 1 283 ? 33.123 8.077 1.273 1.00 53.86 283 A 1 ATOM 2168 N N . GLY A 1 284 ? 33.053 0.741 0.833 1.00 89.64 284 A 1 ATOM 2169 C CA . GLY A 1 284 ? 34.391 0.255 1.178 1.00 89.47 284 A 1 ATOM 2170 C C . GLY A 1 284 ? 34.478 -1.259 1.408 1.00 90.72 284 A 1 ATOM 2171 O O . GLY A 1 284 ? 35.572 -1.756 1.655 1.00 86.85 284 A 1 ATOM 2172 N N . ALA A 1 285 ? 33.366 -1.986 1.355 1.00 90.28 285 A 1 ATOM 2173 C CA . ALA A 1 285 ? 33.361 -3.441 1.480 1.00 89.57 285 A 1 ATOM 2174 C C . ALA A 1 285 ? 33.841 -4.106 0.173 1.00 90.51 285 A 1 ATOM 2175 O O . ALA A 1 285 ? 33.587 -3.570 -0.910 1.00 89.31 285 A 1 ATOM 2176 C CB . ALA A 1 285 ? 31.957 -3.916 1.874 1.00 88.50 285 A 1 ATOM 2177 N N . PRO A 1 286 ? 34.495 -5.285 0.238 1.00 89.90 286 A 1 ATOM 2178 C CA . PRO A 1 286 ? 34.688 -6.124 -0.937 1.00 88.64 286 A 1 ATOM 2179 C C . PRO A 1 286 ? 33.326 -6.436 -1.564 1.00 88.87 286 A 1 ATOM 2180 O O . PRO A 1 286 ? 32.401 -6.801 -0.844 1.00 83.98 286 A 1 ATOM 2181 C CB . PRO A 1 286 ? 35.384 -7.399 -0.436 1.00 86.81 286 A 1 ATOM 2182 C CG . PRO A 1 286 ? 35.979 -6.991 0.913 1.00 85.13 286 A 1 ATOM 2183 C CD . PRO A 1 286 ? 34.993 -5.947 1.431 1.00 88.06 286 A 1 ATOM 2184 N N . ASN A 1 287 ? 33.195 -6.248 -2.871 1.00 91.43 287 A 1 ATOM 2185 C CA . ASN A 1 287 ? 31.923 -6.347 -3.592 1.00 92.63 287 A 1 ATOM 2186 C C . ASN A 1 287 ? 30.742 -5.662 -2.861 1.00 94.58 287 A 1 ATOM 2187 O O . ASN A 1 287 ? 29.804 -6.301 -2.376 1.00 93.74 287 A 1 ATOM 2188 C CB . ASN A 1 287 ? 31.657 -7.800 -4.009 1.00 89.30 287 A 1 ATOM 2189 C CG . ASN A 1 287 ? 30.571 -7.890 -5.071 1.00 84.89 287 A 1 ATOM 2190 O OD1 . ASN A 1 287 ? 29.898 -6.914 -5.393 1.00 79.40 287 A 1 ATOM 2191 N ND2 . ASN A 1 287 ? 30.388 -9.047 -5.655 1.00 78.38 287 A 1 ATOM 2192 N N . ALA A 1 288 ? 30.800 -4.332 -2.769 1.00 95.21 288 A 1 ATOM 2193 C CA . ALA A 1 288 ? 29.809 -3.538 -2.039 1.00 95.48 288 A 1 ATOM 2194 C C . ALA A 1 288 ? 28.362 -3.758 -2.517 1.00 96.45 288 A 1 ATOM 2195 O O . ALA A 1 288 ? 27.428 -3.658 -1.719 1.00 95.75 288 A 1 ATOM 2196 C CB . ALA A 1 288 ? 30.201 -2.061 -2.172 1.00 93.95 288 A 1 ATOM 2197 N N . LEU A 1 289 ? 28.161 -4.051 -3.809 1.00 96.30 289 A 1 ATOM 2198 C CA . LEU A 1 289 ? 26.842 -4.324 -4.384 1.00 96.69 289 A 1 ATOM 2199 C C . LEU A 1 289 ? 26.273 -5.649 -3.874 1.00 97.23 289 A 1 ATOM 2200 O O . LEU A 1 289 ? 25.117 -5.683 -3.453 1.00 96.99 289 A 1 ATOM 2201 C CB . LEU A 1 289 ? 26.922 -4.323 -5.923 1.00 96.42 289 A 1 ATOM 2202 C CG . LEU A 1 289 ? 27.266 -2.972 -6.571 1.00 95.35 289 A 1 ATOM 2203 C CD1 . LEU A 1 289 ? 27.346 -3.142 -8.091 1.00 93.32 289 A 1 ATOM 2204 C CD2 . LEU A 1 289 ? 26.217 -1.899 -6.278 1.00 93.17 289 A 1 ATOM 2205 N N . GLU A 1 290 ? 27.078 -6.710 -3.873 1.00 96.70 290 A 1 ATOM 2206 C CA . GLU A 1 290 ? 26.688 -8.025 -3.356 1.00 96.64 290 A 1 ATOM 2207 C C . GLU A 1 290 ? 26.446 -7.975 -1.848 1.00 96.87 290 A 1 ATOM 2208 O O . GLU A 1 290 ? 25.390 -8.397 -1.383 1.00 96.31 290 A 1 ATOM 2209 C CB . GLU A 1 290 ? 27.762 -9.063 -3.690 1.00 95.80 290 A 1 ATOM 2210 C CG . GLU A 1 290 ? 27.332 -10.481 -3.277 1.00 93.79 290 A 1 ATOM 2211 C CD . GLU A 1 290 ? 28.322 -11.571 -3.698 1.00 92.67 290 A 1 ATOM 2212 O OE1 . GLU A 1 290 ? 28.216 -12.679 -3.132 1.00 84.73 290 A 1 ATOM 2213 O OE2 . GLU A 1 290 ? 29.142 -11.310 -4.605 1.00 86.70 290 A 1 ATOM 2214 N N . TYR A 1 291 ? 27.374 -7.391 -1.097 1.00 96.86 291 A 1 ATOM 2215 C CA . TYR A 1 291 ? 27.251 -7.262 0.353 1.00 96.62 291 A 1 ATOM 2216 C C . TYR A 1 291 ? 25.988 -6.489 0.767 1.00 97.13 291 A 1 ATOM 2217 O O . TYR A 1 291 ? 25.293 -6.847 1.717 1.00 96.95 291 A 1 ATOM 2218 C CB . TYR A 1 291 ? 28.515 -6.579 0.885 1.00 96.02 291 A 1 ATOM 2219 C CG . TYR A 1 291 ? 28.568 -6.533 2.395 1.00 94.66 291 A 1 ATOM 2220 C CD1 . TYR A 1 291 ? 28.273 -5.340 3.085 1.00 91.26 291 A 1 ATOM 2221 C CD2 . TYR A 1 291 ? 28.890 -7.699 3.115 1.00 91.42 291 A 1 ATOM 2222 C CE1 . TYR A 1 291 ? 28.301 -5.317 4.493 1.00 89.47 291 A 1 ATOM 2223 C CE2 . TYR A 1 291 ? 28.913 -7.680 4.522 1.00 89.58 291 A 1 ATOM 2224 C CZ . TYR A 1 291 ? 28.615 -6.489 5.211 1.00 89.70 291 A 1 ATOM 2225 O OH . TYR A 1 291 ? 28.624 -6.476 6.571 1.00 87.70 291 A 1 ATOM 2226 N N . ALA A 1 292 ? 25.654 -5.437 0.028 1.00 96.60 292 A 1 ATOM 2227 C CA . ALA A 1 292 ? 24.428 -4.678 0.249 1.00 97.16 292 A 1 ATOM 2228 C C . ALA A 1 292 ? 23.165 -5.447 -0.182 1.00 97.57 292 A 1 ATOM 2229 O O . ALA A 1 292 ? 22.136 -5.355 0.492 1.00 97.42 292 A 1 ATOM 2230 C CB . ALA A 1 292 ? 24.561 -3.350 -0.493 1.00 97.14 292 A 1 ATOM 2231 N N . LEU A 1 293 ? 23.220 -6.200 -1.291 1.00 97.51 293 A 1 ATOM 2232 C CA . LEU A 1 293 ? 22.115 -7.051 -1.743 1.00 97.49 293 A 1 ATOM 2233 C C . LEU A 1 293 ? 21.830 -8.166 -0.738 1.00 97.45 293 A 1 ATOM 2234 O O . LEU A 1 293 ? 20.668 -8.457 -0.461 1.00 97.05 293 A 1 ATOM 2235 C CB . LEU A 1 293 ? 22.443 -7.624 -3.132 1.00 97.40 293 A 1 ATOM 2236 C CG . LEU A 1 293 ? 21.318 -8.487 -3.738 1.00 96.79 293 A 1 ATOM 2237 C CD1 . LEU A 1 293 ? 20.011 -7.710 -3.909 1.00 95.22 293 A 1 ATOM 2238 C CD2 . LEU A 1 293 ? 21.741 -9.002 -5.112 1.00 95.22 293 A 1 ATOM 2239 N N . ASP A 1 294 ? 22.887 -8.733 -0.161 1.00 97.53 294 A 1 ATOM 2240 C CA . ASP A 1 294 ? 22.799 -9.734 0.897 1.00 97.03 294 A 1 ATOM 2241 C C . ASP A 1 294 ? 21.934 -9.232 2.059 1.00 97.14 294 A 1 ATOM 2242 O O . ASP A 1 294 ? 20.867 -9.784 2.331 1.00 96.10 294 A 1 ATOM 2243 C CB . ASP A 1 294 ? 24.218 -10.097 1.358 1.00 95.80 294 A 1 ATOM 2244 C CG . ASP A 1 294 ? 24.187 -11.337 2.237 1.00 89.23 294 A 1 ATOM 2245 O OD1 . ASP A 1 294 ? 23.709 -12.364 1.719 1.00 82.52 294 A 1 ATOM 2246 O OD2 . ASP A 1 294 ? 24.644 -11.286 3.386 1.00 81.61 294 A 1 ATOM 2247 N N . GLN A 1 295 ? 22.297 -8.098 2.634 1.00 97.29 295 A 1 ATOM 2248 C CA . GLN A 1 295 ? 21.544 -7.491 3.736 1.00 96.80 295 A 1 ATOM 2249 C C . GLN A 1 295 ? 20.147 -6.988 3.336 1.00 97.03 295 A 1 ATOM 2250 O O . GLN A 1 295 ? 19.238 -6.908 4.165 1.00 95.99 295 A 1 ATOM 2251 C CB . GLN A 1 295 ? 22.344 -6.327 4.323 1.00 95.75 295 A 1 ATOM 2252 C CG . GLN A 1 295 ? 23.659 -6.777 4.965 1.00 90.41 295 A 1 ATOM 2253 C CD . GLN A 1 295 ? 24.339 -5.647 5.723 1.00 84.21 295 A 1 ATOM 2254 O OE1 . GLN A 1 295 ? 23.718 -4.718 6.227 1.00 75.91 295 A 1 ATOM 2255 N NE2 . GLN A 1 295 ? 25.635 -5.683 5.858 1.00 70.94 295 A 1 ATOM 2256 N N . ALA A 1 296 ? 19.957 -6.610 2.077 1.00 95.87 296 A 1 ATOM 2257 C CA . ALA A 1 296 ? 18.672 -6.106 1.607 1.00 95.35 296 A 1 ATOM 2258 C C . ALA A 1 296 ? 17.654 -7.227 1.338 1.00 95.33 296 A 1 ATOM 2259 O O . ALA A 1 296 ? 16.457 -7.008 1.572 1.00 93.61 296 A 1 ATOM 2260 C CB . ALA A 1 296 ? 18.899 -5.236 0.367 1.00 95.28 296 A 1 ATOM 2261 N N . LEU A 1 297 ? 18.107 -8.386 0.843 1.00 96.63 297 A 1 ATOM 2262 C CA . LEU A 1 297 ? 17.250 -9.457 0.330 1.00 96.18 297 A 1 ATOM 2263 C C . LEU A 1 297 ? 17.748 -10.879 0.619 1.00 96.24 297 A 1 ATOM 2264 O O . LEU A 1 297 ? 16.947 -11.696 1.061 1.00 95.01 297 A 1 ATOM 2265 C CB . LEU A 1 297 ? 17.067 -9.252 -1.188 1.00 95.32 297 A 1 ATOM 2266 C CG . LEU A 1 297 ? 16.067 -10.224 -1.847 1.00 94.20 297 A 1 ATOM 2267 C CD1 . LEU A 1 297 ? 14.646 -10.038 -1.305 1.00 90.83 297 A 1 ATOM 2268 C CD2 . LEU A 1 297 ? 16.018 -9.985 -3.353 1.00 90.83 297 A 1 ATOM 2269 N N . LEU A 1 298 ? 19.014 -11.200 0.349 1.00 96.56 298 A 1 ATOM 2270 C CA . LEU A 1 298 ? 19.460 -12.589 0.186 1.00 96.26 298 A 1 ATOM 2271 C C . LEU A 1 298 ? 19.522 -13.384 1.495 1.00 96.02 298 A 1 ATOM 2272 O O . LEU A 1 298 ? 19.344 -14.592 1.461 1.00 94.90 298 A 1 ATOM 2273 C CB . LEU A 1 298 ? 20.824 -12.640 -0.518 1.00 95.95 298 A 1 ATOM 2274 C CG . LEU A 1 298 ? 20.909 -11.958 -1.888 1.00 95.17 298 A 1 ATOM 2275 C CD1 . LEU A 1 298 ? 22.347 -12.050 -2.401 1.00 93.25 298 A 1 ATOM 2276 C CD2 . LEU A 1 298 ? 19.981 -12.605 -2.910 1.00 93.12 298 A 1 ATOM 2277 N N . ILE A 1 299 ? 19.721 -12.725 2.653 1.00 96.35 299 A 1 ATOM 2278 C CA . ILE A 1 299 ? 19.749 -13.391 3.973 1.00 95.56 299 A 1 ATOM 2279 C C . ILE A 1 299 ? 18.453 -14.169 4.260 1.00 95.28 299 A 1 ATOM 2280 O O . ILE A 1 299 ? 18.476 -15.166 4.972 1.00 92.94 299 A 1 ATOM 2281 C CB . ILE A 1 299 ? 20.050 -12.351 5.082 1.00 94.37 299 A 1 ATOM 2282 C CG1 . ILE A 1 299 ? 21.543 -11.956 5.019 1.00 89.07 299 A 1 ATOM 2283 C CG2 . ILE A 1 299 ? 19.706 -12.855 6.499 1.00 88.35 299 A 1 ATOM 2284 C CD1 . ILE A 1 299 ? 21.931 -10.770 5.916 1.00 81.62 299 A 1 ATOM 2285 N N . ARG A 1 300 ? 17.316 -13.716 3.726 1.00 94.40 300 A 1 ATOM 2286 C CA . ARG A 1 300 ? 16.010 -14.366 3.919 1.00 92.93 300 A 1 ATOM 2287 C C . ARG A 1 300 ? 15.609 -15.316 2.786 1.00 94.01 300 A 1 ATOM 2288 O O . ARG A 1 300 ? 14.501 -15.834 2.824 1.00 92.33 300 A 1 ATOM 2289 C CB . ARG A 1 300 ? 14.933 -13.304 4.198 1.00 90.31 300 A 1 ATOM 2290 C CG . ARG A 1 300 ? 14.732 -12.369 2.993 1.00 85.90 300 A 1 ATOM 2291 C CD . ARG A 1 300 ? 13.609 -11.365 3.229 1.00 83.68 300 A 1 ATOM 2292 N NE . ARG A 1 300 ? 13.449 -10.506 2.037 1.00 77.32 300 A 1 ATOM 2293 C CZ . ARG A 1 300 ? 12.490 -9.623 1.829 1.00 72.83 300 A 1 ATOM 2294 N NH1 . ARG A 1 300 ? 11.581 -9.380 2.727 1.00 68.18 300 A 1 ATOM 2295 N NH2 . ARG A 1 300 ? 12.430 -8.975 0.705 1.00 64.57 300 A 1 ATOM 2296 N N . ALA A 1 301 ? 16.452 -15.473 1.764 1.00 92.03 301 A 1 ATOM 2297 C CA . ALA A 1 301 ? 16.206 -16.370 0.642 1.00 92.10 301 A 1 ATOM 2298 C C . ALA A 1 301 ? 16.776 -17.766 0.933 1.00 92.74 301 A 1 ATOM 2299 O O . ALA A 1 301 ? 17.810 -17.892 1.594 1.00 91.84 301 A 1 ATOM 2300 C CB . ALA A 1 301 ? 16.812 -15.750 -0.627 1.00 91.95 301 A 1 ATOM 2301 N N . ALA A 1 302 ? 16.133 -18.811 0.405 1.00 93.05 302 A 1 ATOM 2302 C CA . ALA A 1 302 ? 16.708 -20.149 0.402 1.00 92.46 302 A 1 ATOM 2303 C C . ALA A 1 302 ? 18.034 -20.164 -0.383 1.00 93.19 302 A 1 ATOM 2304 O O . ALA A 1 302 ? 18.300 -19.288 -1.210 1.00 92.55 302 A 1 ATOM 2305 C CB . ALA A 1 302 ? 15.683 -21.136 -0.167 1.00 91.14 302 A 1 ATOM 2306 N N . LYS A 1 303 ? 18.890 -21.154 -0.115 1.00 93.57 303 A 1 ATOM 2307 C CA . LYS A 1 303 ? 20.241 -21.212 -0.699 1.00 93.53 303 A 1 ATOM 2308 C C . LYS A 1 303 ? 20.209 -21.219 -2.235 1.00 94.16 303 A 1 ATOM 2309 O O . LYS A 1 303 ? 20.960 -20.484 -2.873 1.00 93.31 303 A 1 ATOM 2310 C CB . LYS A 1 303 ? 20.967 -22.437 -0.135 1.00 92.72 303 A 1 ATOM 2311 C CG . LYS A 1 303 ? 22.414 -22.505 -0.630 1.00 84.49 303 A 1 ATOM 2312 C CD . LYS A 1 303 ? 23.090 -23.790 -0.156 1.00 80.09 303 A 1 ATOM 2313 C CE . LYS A 1 303 ? 24.459 -23.881 -0.832 1.00 73.72 303 A 1 ATOM 2314 N NZ . LYS A 1 303 ? 25.068 -25.212 -0.623 1.00 62.64 303 A 1 ATOM 2315 N N . GLU A 1 304 ? 19.311 -21.999 -2.807 1.00 91.38 304 A 1 ATOM 2316 C CA . GLU A 1 304 ? 19.130 -22.155 -4.249 1.00 90.91 304 A 1 ATOM 2317 C C . GLU A 1 304 ? 18.621 -20.853 -4.888 1.00 91.83 304 A 1 ATOM 2318 O O . GLU A 1 304 ? 19.125 -20.416 -5.925 1.00 90.55 304 A 1 ATOM 2319 C CB . GLU A 1 304 ? 18.144 -23.311 -4.513 1.00 89.66 304 A 1 ATOM 2320 C CG . GLU A 1 304 ? 18.587 -24.696 -3.982 1.00 80.63 304 A 1 ATOM 2321 C CD . GLU A 1 304 ? 18.594 -24.844 -2.443 1.00 72.87 304 A 1 ATOM 2322 O OE1 . GLU A 1 304 ? 19.401 -25.667 -1.944 1.00 65.13 304 A 1 ATOM 2323 O OE2 . GLU A 1 304 ? 17.887 -24.072 -1.749 1.00 65.46 304 A 1 ATOM 2324 N N . GLU A 1 305 ? 17.680 -20.172 -4.220 1.00 93.09 305 A 1 ATOM 2325 C CA . GLU A 1 305 ? 17.138 -18.882 -4.654 1.00 93.00 305 A 1 ATOM 2326 C C . GLU A 1 305 ? 18.200 -17.782 -4.597 1.00 93.96 305 A 1 ATOM 2327 O O . GLU A 1 305 ? 18.329 -16.975 -5.518 1.00 93.37 305 A 1 ATOM 2328 C CB . GLU A 1 305 ? 15.976 -18.461 -3.749 1.00 91.25 305 A 1 ATOM 2329 C CG . GLU A 1 305 ? 14.817 -19.456 -3.680 1.00 87.90 305 A 1 ATOM 2330 C CD . GLU A 1 305 ? 13.694 -18.944 -2.767 1.00 88.36 305 A 1 ATOM 2331 O OE1 . GLU A 1 305 ? 12.553 -19.415 -2.901 1.00 80.47 305 A 1 ATOM 2332 O OE2 . GLU A 1 305 ? 13.937 -18.028 -1.939 1.00 82.53 305 A 1 ATOM 2333 N N . ARG A 1 306 ? 19.005 -17.779 -3.529 1.00 94.72 306 A 1 ATOM 2334 C CA . ARG A 1 306 ? 20.155 -16.881 -3.391 1.00 95.10 306 A 1 ATOM 2335 C C . ARG A 1 306 ? 21.106 -17.025 -4.575 1.00 95.70 306 A 1 ATOM 2336 O O . ARG A 1 306 ? 21.485 -16.019 -5.176 1.00 95.16 306 A 1 ATOM 2337 C CB . ARG A 1 306 ? 20.856 -17.170 -2.053 1.00 94.40 306 A 1 ATOM 2338 C CG . ARG A 1 306 ? 22.129 -16.345 -1.872 1.00 89.60 306 A 1 ATOM 2339 C CD . ARG A 1 306 ? 22.963 -16.831 -0.690 1.00 88.41 306 A 1 ATOM 2340 N NE . ARG A 1 306 ? 24.164 -15.987 -0.535 1.00 82.00 306 A 1 ATOM 2341 C CZ . ARG A 1 306 ? 24.296 -14.996 0.327 1.00 76.57 306 A 1 ATOM 2342 N NH1 . ARG A 1 306 ? 23.393 -14.737 1.230 1.00 68.75 306 A 1 ATOM 2343 N NH2 . ARG A 1 306 ? 25.334 -14.217 0.298 1.00 66.88 306 A 1 ATOM 2344 N N . GLU A 1 307 ? 21.488 -18.254 -4.923 1.00 94.14 307 A 1 ATOM 2345 C CA . GLU A 1 307 ? 22.378 -18.526 -6.052 1.00 93.98 307 A 1 ATOM 2346 C C . GLU A 1 307 ? 21.769 -18.066 -7.384 1.00 94.54 307 A 1 ATOM 2347 O O . GLU A 1 307 ? 22.472 -17.470 -8.200 1.00 93.69 307 A 1 ATOM 2348 C CB . GLU A 1 307 ? 22.717 -20.021 -6.110 1.00 93.67 307 A 1 ATOM 2349 C CG . GLU A 1 307 ? 23.696 -20.453 -5.001 1.00 86.22 307 A 1 ATOM 2350 C CD . GLU A 1 307 ? 24.016 -21.957 -5.022 1.00 80.21 307 A 1 ATOM 2351 O OE1 . GLU A 1 307 ? 24.569 -22.447 -4.006 1.00 71.10 307 A 1 ATOM 2352 O OE2 . GLU A 1 307 ? 23.764 -22.603 -6.068 1.00 71.79 307 A 1 ATOM 2353 N N . ALA A 1 308 ? 20.469 -18.273 -7.595 1.00 93.93 308 A 1 ATOM 2354 C CA . ALA A 1 308 ? 19.764 -17.797 -8.784 1.00 93.23 308 A 1 ATOM 2355 C C . ALA A 1 308 ? 19.789 -16.261 -8.895 1.00 94.34 308 A 1 ATOM 2356 O O . ALA A 1 308 ? 20.150 -15.719 -9.942 1.00 94.14 308 A 1 ATOM 2357 C CB . ALA A 1 308 ? 18.334 -18.348 -8.761 1.00 92.33 308 A 1 ATOM 2358 N N . ILE A 1 309 ? 19.490 -15.547 -7.808 1.00 94.69 309 A 1 ATOM 2359 C CA . ILE A 1 309 ? 19.512 -14.075 -7.783 1.00 95.41 309 A 1 ATOM 2360 C C . ILE A 1 309 ? 20.937 -13.537 -7.995 1.00 96.00 309 A 1 ATOM 2361 O O . ILE A 1 309 ? 21.124 -12.555 -8.717 1.00 95.81 309 A 1 ATOM 2362 C CB . ILE A 1 309 ? 18.882 -13.546 -6.473 1.00 95.43 309 A 1 ATOM 2363 C CG1 . ILE A 1 309 ? 17.380 -13.923 -6.381 1.00 94.49 309 A 1 ATOM 2364 C CG2 . ILE A 1 309 ? 19.022 -12.009 -6.378 1.00 94.50 309 A 1 ATOM 2365 C CD1 . ILE A 1 309 ? 16.779 -13.738 -4.980 1.00 92.31 309 A 1 ATOM 2366 N N . LEU A 1 310 ? 21.957 -14.178 -7.420 1.00 96.49 310 A 1 ATOM 2367 C CA . LEU A 1 310 ? 23.359 -13.794 -7.626 1.00 96.24 310 A 1 ATOM 2368 C C . LEU A 1 310 ? 23.813 -13.995 -9.078 1.00 96.40 310 A 1 ATOM 2369 O O . LEU A 1 310 ? 24.546 -13.152 -9.597 1.00 95.87 310 A 1 ATOM 2370 C CB . LEU A 1 310 ? 24.265 -14.580 -6.665 1.00 95.85 310 A 1 ATOM 2371 C CG . LEU A 1 310 ? 24.214 -14.107 -5.200 1.00 94.53 310 A 1 ATOM 2372 C CD1 . LEU A 1 310 ? 25.049 -15.056 -4.336 1.00 92.04 310 A 1 ATOM 2373 C CD2 . LEU A 1 310 ? 24.773 -12.695 -5.027 1.00 92.85 310 A 1 ATOM 2374 N N . ARG A 1 311 ? 23.354 -15.056 -9.761 1.00 95.85 311 A 1 ATOM 2375 C CA . ARG A 1 311 ? 23.612 -15.244 -11.200 1.00 95.46 311 A 1 ATOM 2376 C C . ARG A 1 311 ? 23.006 -14.105 -12.013 1.00 96.06 311 A 1 ATOM 2377 O O . ARG A 1 311 ? 23.728 -13.473 -12.770 1.00 95.31 311 A 1 ATOM 2378 C CB . ARG A 1 311 ? 23.080 -16.594 -11.698 1.00 94.84 311 A 1 ATOM 2379 C CG . ARG A 1 311 ? 23.909 -17.784 -11.190 1.00 83.61 311 A 1 ATOM 2380 C CD . ARG A 1 311 ? 23.269 -19.098 -11.651 1.00 80.67 311 A 1 ATOM 2381 N NE . ARG A 1 311 ? 23.571 -20.207 -10.730 1.00 70.16 311 A 1 ATOM 2382 C CZ . ARG A 1 311 ? 23.059 -21.424 -10.781 1.00 63.13 311 A 1 ATOM 2383 N NH1 . ARG A 1 311 ? 22.308 -21.811 -11.778 1.00 56.36 311 A 1 ATOM 2384 N NH2 . ARG A 1 311 ? 23.279 -22.274 -9.814 1.00 54.09 311 A 1 ATOM 2385 N N . VAL A 1 312 ? 21.734 -13.771 -11.767 1.00 94.54 312 A 1 ATOM 2386 C CA . VAL A 1 312 ? 21.067 -12.623 -12.403 1.00 94.40 312 A 1 ATOM 2387 C C . VAL A 1 312 ? 21.858 -11.329 -12.184 1.00 95.63 312 A 1 ATOM 2388 O O . VAL A 1 312 ? 22.081 -10.567 -13.124 1.00 95.57 312 A 1 ATOM 2389 C CB . VAL A 1 312 ? 19.632 -12.478 -11.856 1.00 93.86 312 A 1 ATOM 2390 C CG1 . VAL A 1 312 ? 18.960 -11.161 -12.262 1.00 91.53 312 A 1 ATOM 2391 C CG2 . VAL A 1 312 ? 18.740 -13.632 -12.339 1.00 91.60 312 A 1 ATOM 2392 N N . ALA A 1 313 ? 22.314 -11.072 -10.959 1.00 95.57 313 A 1 ATOM 2393 C CA . ALA A 1 313 ? 23.082 -9.872 -10.642 1.00 95.51 313 A 1 ATOM 2394 C C . ALA A 1 313 ? 24.427 -9.827 -11.387 1.00 95.82 313 A 1 ATOM 2395 O O . ALA A 1 313 ? 24.793 -8.788 -11.941 1.00 95.23 313 A 1 ATOM 2396 C CB . ALA A 1 313 ? 23.258 -9.790 -9.124 1.00 95.57 313 A 1 ATOM 2397 N N . LYS A 1 314 ? 25.129 -10.962 -11.454 1.00 96.78 314 A 1 ATOM 2398 C CA . LYS A 1 314 ? 26.390 -11.095 -12.189 1.00 95.98 314 A 1 ATOM 2399 C C . LYS A 1 314 ? 26.202 -10.901 -13.694 1.00 96.25 314 A 1 ATOM 2400 O O . LYS A 1 314 ? 26.996 -10.197 -14.306 1.00 95.09 314 A 1 ATOM 2401 C CB . LYS A 1 314 ? 27.009 -12.454 -11.853 1.00 94.75 314 A 1 ATOM 2402 C CG . LYS A 1 314 ? 28.415 -12.582 -12.442 1.00 80.00 314 A 1 ATOM 2403 C CD . LYS A 1 314 ? 29.048 -13.908 -12.017 1.00 76.90 314 A 1 ATOM 2404 C CE . LYS A 1 314 ? 30.460 -13.988 -12.596 1.00 67.21 314 A 1 ATOM 2405 N NZ . LYS A 1 314 ? 31.138 -15.236 -12.179 1.00 59.01 314 A 1 ATOM 2406 N N . ASP A 1 315 ? 25.140 -11.459 -14.271 1.00 95.48 315 A 1 ATOM 2407 C CA . ASP A 1 315 ? 24.835 -11.314 -15.698 1.00 95.08 315 A 1 ATOM 2408 C C . ASP A 1 315 ? 24.502 -9.859 -16.066 1.00 95.63 315 A 1 ATOM 2409 O O . ASP A 1 315 ? 24.903 -9.368 -17.121 1.00 94.10 315 A 1 ATOM 2410 C CB . ASP A 1 315 ? 23.662 -12.237 -16.064 1.00 94.63 315 A 1 ATOM 2411 C CG . ASP A 1 315 ? 23.986 -13.736 -15.981 1.00 89.98 315 A 1 ATOM 2412 O OD1 . ASP A 1 315 ? 25.188 -14.091 -15.965 1.00 85.31 315 A 1 ATOM 2413 O OD2 . ASP A 1 315 ? 23.011 -14.522 -15.960 1.00 85.19 315 A 1 ATOM 2414 N N . VAL A 1 316 ? 23.798 -9.138 -15.194 1.00 94.91 316 A 1 ATOM 2415 C CA . VAL A 1 316 ? 23.432 -7.729 -15.418 1.00 94.55 316 A 1 ATOM 2416 C C . VAL A 1 316 ? 24.623 -6.786 -15.238 1.00 95.16 316 A 1 ATOM 2417 O O . VAL A 1 316 ? 24.780 -5.852 -16.026 1.00 93.66 316 A 1 ATOM 2418 C CB . VAL A 1 316 ? 22.258 -7.319 -14.504 1.00 94.44 316 A 1 ATOM 2419 C CG1 . VAL A 1 316 ? 21.977 -5.806 -14.539 1.00 92.08 316 A 1 ATOM 2420 C CG2 . VAL A 1 316 ? 20.961 -8.016 -14.940 1.00 92.14 316 A 1 ATOM 2421 N N . PHE A 1 317 ? 25.433 -6.974 -14.205 1.00 95.91 317 A 1 ATOM 2422 C CA . PHE A 1 317 ? 26.543 -6.064 -13.898 1.00 94.92 317 A 1 ATOM 2423 C C . PHE A 1 317 ? 27.871 -6.453 -14.561 1.00 93.99 317 A 1 ATOM 2424 O O . PHE A 1 317 ? 28.736 -5.580 -14.720 1.00 89.06 317 A 1 ATOM 2425 C CB . PHE A 1 317 ? 26.695 -5.924 -12.379 1.00 94.33 317 A 1 ATOM 2426 C CG . PHE A 1 317 ? 25.676 -5.003 -11.728 1.00 95.59 317 A 1 ATOM 2427 C CD1 . PHE A 1 317 ? 25.632 -3.643 -12.087 1.00 93.79 317 A 1 ATOM 2428 C CD2 . PHE A 1 317 ? 24.809 -5.484 -10.733 1.00 94.55 317 A 1 ATOM 2429 C CE1 . PHE A 1 317 ? 24.728 -2.771 -11.458 1.00 93.78 317 A 1 ATOM 2430 C CE2 . PHE A 1 317 ? 23.904 -4.609 -10.101 1.00 94.22 317 A 1 ATOM 2431 C CZ . PHE A 1 317 ? 23.864 -3.253 -10.463 1.00 94.94 317 A 1 ATOM 2432 N N . GLY A 1 318 ? 28.055 -7.713 -14.958 1.00 94.07 318 A 1 ATOM 2433 C CA . GLY A 1 318 ? 29.287 -8.224 -15.554 1.00 92.41 318 A 1 ATOM 2434 C C . GLY A 1 318 ? 30.513 -7.893 -14.697 1.00 92.07 318 A 1 ATOM 2435 O O . GLY A 1 318 ? 30.554 -8.180 -13.501 1.00 88.44 318 A 1 ATOM 2436 N N . ASP A 1 319 ? 31.485 -7.218 -15.305 1.00 90.51 319 A 1 ATOM 2437 C CA . ASP A 1 319 ? 32.737 -6.836 -14.641 1.00 88.44 319 A 1 ATOM 2438 C C . ASP A 1 319 ? 32.587 -5.843 -13.474 1.00 87.57 319 A 1 ATOM 2439 O O . ASP A 1 319 ? 33.533 -5.675 -12.703 1.00 82.17 319 A 1 ATOM 2440 C CB . ASP A 1 319 ? 33.695 -6.241 -15.679 1.00 86.55 319 A 1 ATOM 2441 C CG . ASP A 1 319 ? 34.315 -7.303 -16.584 1.00 82.22 319 A 1 ATOM 2442 O OD1 . ASP A 1 319 ? 34.705 -8.354 -16.024 1.00 76.70 319 A 1 ATOM 2443 O OD2 . ASP A 1 319 ? 34.474 -7.006 -17.784 1.00 78.81 319 A 1 ATOM 2444 N N . GLN A 1 320 ? 31.436 -5.174 -13.351 1.00 88.87 320 A 1 ATOM 2445 C CA . GLN A 1 320 ? 31.147 -4.266 -12.231 1.00 86.23 320 A 1 ATOM 2446 C C . GLN A 1 320 ? 30.702 -5.019 -10.966 1.00 86.23 320 A 1 ATOM 2447 O O . GLN A 1 320 ? 30.633 -4.416 -9.895 1.00 81.58 320 A 1 ATOM 2448 C CB . GLN A 1 320 ? 30.082 -3.223 -12.628 1.00 85.02 320 A 1 ATOM 2449 C CG . GLN A 1 320 ? 30.510 -2.372 -13.833 1.00 80.36 320 A 1 ATOM 2450 C CD . GLN A 1 320 ? 29.470 -1.336 -14.260 1.00 77.43 320 A 1 ATOM 2451 O OE1 . GLN A 1 320 ? 28.540 -0.956 -13.562 1.00 70.75 320 A 1 ATOM 2452 N NE2 . GLN A 1 320 ? 29.605 -0.803 -15.458 1.00 67.60 320 A 1 ATOM 2453 N N . TRP A 1 321 ? 30.402 -6.313 -11.077 1.00 90.80 321 A 1 ATOM 2454 C CA . TRP A 1 321 ? 30.044 -7.187 -9.956 1.00 88.69 321 A 1 ATOM 2455 C C . TRP A 1 321 ? 31.302 -7.770 -9.299 1.00 86.16 321 A 1 ATOM 2456 O O . TRP A 1 321 ? 31.644 -8.940 -9.490 1.00 78.08 321 A 1 ATOM 2457 C CB . TRP A 1 321 ? 29.074 -8.262 -10.438 1.00 87.52 321 A 1 ATOM 2458 C CG . TRP A 1 321 ? 28.365 -8.977 -9.330 1.00 86.93 321 A 1 ATOM 2459 C CD1 . TRP A 1 321 ? 28.636 -10.226 -8.879 1.00 83.50 321 A 1 ATOM 2460 C CD2 . TRP A 1 321 ? 27.255 -8.493 -8.519 1.00 89.48 321 A 1 ATOM 2461 N NE1 . TRP A 1 321 ? 27.766 -10.548 -7.861 1.00 84.79 321 A 1 ATOM 2462 C CE2 . TRP A 1 321 ? 26.890 -9.518 -7.595 1.00 89.47 321 A 1 ATOM 2463 C CE3 . TRP A 1 321 ? 26.522 -7.284 -8.471 1.00 88.83 321 A 1 ATOM 2464 C CZ2 . TRP A 1 321 ? 25.842 -9.357 -6.681 1.00 89.67 321 A 1 ATOM 2465 C CZ3 . TRP A 1 321 ? 25.472 -7.117 -7.554 1.00 87.26 321 A 1 ATOM 2466 C CH2 . TRP A 1 321 ? 25.129 -8.145 -6.665 1.00 87.63 321 A 1 ATOM 2467 N N . ARG A 1 322 ? 32.041 -6.911 -8.609 1.00 88.62 322 A 1 ATOM 2468 C CA . ARG A 1 322 ? 33.316 -7.230 -7.944 1.00 84.50 322 A 1 ATOM 2469 C C . ARG A 1 322 ? 33.400 -6.604 -6.549 1.00 76.75 322 A 1 ATOM 2470 O O . ARG A 1 322 ? 32.922 -5.468 -6.375 1.00 65.06 322 A 1 ATOM 2471 C CB . ARG A 1 322 ? 34.510 -6.779 -8.794 1.00 77.91 322 A 1 ATOM 2472 C CG . ARG A 1 322 ? 34.595 -7.506 -10.148 1.00 70.55 322 A 1 ATOM 2473 C CD . ARG A 1 322 ? 35.882 -7.119 -10.887 1.00 67.25 322 A 1 ATOM 2474 N NE . ARG A 1 322 ? 35.932 -7.714 -12.233 1.00 60.84 322 A 1 ATOM 2475 C CZ . ARG A 1 322 ? 36.941 -7.643 -13.082 1.00 53.10 322 A 1 ATOM 2476 N NH1 . ARG A 1 322 ? 38.057 -7.052 -12.772 1.00 56.89 322 A 1 ATOM 2477 N NH2 . ARG A 1 322 ? 36.840 -8.161 -14.270 1.00 48.90 322 A 1 ATOM 2478 O OXT . ARG A 1 322 ? 34.002 -7.302 -5.697 1.00 57.90 322 A 1 #