data_4JDT # _entry.id 4JDT # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4JDT RCSB RCSB077920 WWPDB D_1000077920 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 4JDV _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.entry_id 4JDT _pdbx_database_status.status_code REL _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2013-02-25 _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Scharf, L.' 1 'Diskin, R.' 2 'Bjorkman, P.J.' 3 # _citation.id primary _citation.title 'Structural basis for HIV-1 gp120 recognition by a germ-line version of a broadly neutralizing antibody.' _citation.journal_abbrev Proc.Natl.Acad.Sci.USA _citation.journal_volume 110 _citation.page_first 6049 _citation.page_last 6054 _citation.year 2013 _citation.journal_id_ASTM PNASA6 _citation.country US _citation.journal_id_ISSN 0027-8424 _citation.journal_id_CSD 0040 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 23524883 _citation.pdbx_database_id_DOI 10.1073/pnas.1303682110 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Scharf, L.' 1 primary 'West, A.P.' 2 primary 'Gao, H.' 3 primary 'Lee, T.' 4 primary 'Scheid, J.F.' 5 primary 'Nussenzweig, M.C.' 6 primary 'Bjorkman, P.J.' 7 primary 'Diskin, R.' 8 # _cell.entry_id 4JDT _cell.length_a 65.664 _cell.length_b 69.815 _cell.length_c 207.768 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 4JDT _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man gp120 40204.512 1 ? 'UNP RESIDUES 43-122, 201-303, 325-486' 'GP120 CORE' ? 2 polymer man 'Fab heavy chain' 25186.221 1 ? ? 'NIH45-46 Germ-line HEAVY CHAIN, IG GAMMA-1 CHAIN' ? 3 polymer man 'Fab light chain' 23000.438 1 ? ? 'NIH45-46 LIGHT CHAIN' ? 4 non-polymer syn 'SULFATE ION' 96.063 1 ? ? ? ? 5 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 1 ? ? ? ? # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;VWKDADTTLFCASDAKAHETECHNVWATHACVPTDPNPQEIHLENVTENFNMWKNNMVEQMQEDVISLWDQCLQPCVKLT GGSVIKQACPKISFDPIPIHYCTPAGYVILKCNDKNFNGTGPCKNVSSVQCTHGIKPVVSTQLLLNGSLAEEEIIIRSEN LTNNAKTIIVHLNKSVEINCTRPSNGGSGSGGDIRKAYCEINGTKWNKVLKQVTEKLKEHFNNKTIIFQPPSGGDLEITM HHFNCRGEFFYCNTTQLFNNTCIGNETMKGCNGTITLPCKIKQIINMWQGTGQAMYAPPIDGKINCVSNITGILLTRDGG ANNTSNETFRPGGGNIKDNWRSELYKYKVVQIEGSHHHHHH ; ;VWKDADTTLFCASDAKAHETECHNVWATHACVPTDPNPQEIHLENVTENFNMWKNNMVEQMQEDVISLWDQCLQPCVKLT GGSVIKQACPKISFDPIPIHYCTPAGYVILKCNDKNFNGTGPCKNVSSVQCTHGIKPVVSTQLLLNGSLAEEEIIIRSEN LTNNAKTIIVHLNKSVEINCTRPSNGGSGSGGDIRKAYCEINGTKWNKVLKQVTEKLKEHFNNKTIIFQPPSGGDLEITM HHFNCRGEFFYCNTTQLFNNTCIGNETMKGCNGTITLPCKIKQIINMWQGTGQAMYAPPIDGKINCVSNITGILLTRDGG ANNTSNETFRPGGGNIKDNWRSELYKYKVVQIEGSHHHHHH ; G ? 2 'polypeptide(L)' no no ;QVQLVQSGAEVKKPGASVKVSCKASGYTFTGYYMHWVRQAPGQGLEWMGWINPNSGGTNYAQKFQGRVTMTRDTSISTAY MELSRLRSDDTAVYYCARGKYCTARDYYNWDFQHWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPE PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKTH ; ;QVQLVQSGAEVKKPGASVKVSCKASGYTFTGYYMHWVRQAPGQGLEWMGWINPNSGGTNYAQKFQGRVTMTRDTSISTAY MELSRLRSDDTAVYYCARGKYCTARDYYNWDFQHWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPE PVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKRVEPKSCDKTH ; H ? 3 'polypeptide(L)' no no ;EIVLTQSPATLSLSPGETAIISCRTSQSGSLAWYQQRPGQAPRLVIYSGSTRAAGIPDRFSGSRWGADYNLSISNLESGD FGVYYCQQYEFFGQGTKVQVDIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVT EQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC ; ;EIVLTQSPATLSLSPGETAIISCRTSQSGSLAWYQQRPGQAPRLVIYSGSTRAAGIPDRFSGSRWGADYNLSISNLESGD FGVYYCQQYEFFGQGTKVQVDIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVT EQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC ; L ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 VAL n 1 2 TRP n 1 3 LYS n 1 4 ASP n 1 5 ALA n 1 6 ASP n 1 7 THR n 1 8 THR n 1 9 LEU n 1 10 PHE n 1 11 CYS n 1 12 ALA n 1 13 SER n 1 14 ASP n 1 15 ALA n 1 16 LYS n 1 17 ALA n 1 18 HIS n 1 19 GLU n 1 20 THR n 1 21 GLU n 1 22 CYS n 1 23 HIS n 1 24 ASN n 1 25 VAL n 1 26 TRP n 1 27 ALA n 1 28 THR n 1 29 HIS n 1 30 ALA n 1 31 CYS n 1 32 VAL n 1 33 PRO n 1 34 THR n 1 35 ASP n 1 36 PRO n 1 37 ASN n 1 38 PRO n 1 39 GLN n 1 40 GLU n 1 41 ILE n 1 42 HIS n 1 43 LEU n 1 44 GLU n 1 45 ASN n 1 46 VAL n 1 47 THR n 1 48 GLU n 1 49 ASN n 1 50 PHE n 1 51 ASN n 1 52 MET n 1 53 TRP n 1 54 LYS n 1 55 ASN n 1 56 ASN n 1 57 MET n 1 58 VAL n 1 59 GLU n 1 60 GLN n 1 61 MET n 1 62 GLN n 1 63 GLU n 1 64 ASP n 1 65 VAL n 1 66 ILE n 1 67 SER n 1 68 LEU n 1 69 TRP n 1 70 ASP n 1 71 GLN n 1 72 CYS n 1 73 LEU n 1 74 GLN n 1 75 PRO n 1 76 CYS n 1 77 VAL n 1 78 LYS n 1 79 LEU n 1 80 THR n 1 81 GLY n 1 82 GLY n 1 83 SER n 1 84 VAL n 1 85 ILE n 1 86 LYS n 1 87 GLN n 1 88 ALA n 1 89 CYS n 1 90 PRO n 1 91 LYS n 1 92 ILE n 1 93 SER n 1 94 PHE n 1 95 ASP n 1 96 PRO n 1 97 ILE n 1 98 PRO n 1 99 ILE n 1 100 HIS n 1 101 TYR n 1 102 CYS n 1 103 THR n 1 104 PRO n 1 105 ALA n 1 106 GLY n 1 107 TYR n 1 108 VAL n 1 109 ILE n 1 110 LEU n 1 111 LYS n 1 112 CYS n 1 113 ASN n 1 114 ASP n 1 115 LYS n 1 116 ASN n 1 117 PHE n 1 118 ASN n 1 119 GLY n 1 120 THR n 1 121 GLY n 1 122 PRO n 1 123 CYS n 1 124 LYS n 1 125 ASN n 1 126 VAL n 1 127 SER n 1 128 SER n 1 129 VAL n 1 130 GLN n 1 131 CYS n 1 132 THR n 1 133 HIS n 1 134 GLY n 1 135 ILE n 1 136 LYS n 1 137 PRO n 1 138 VAL n 1 139 VAL n 1 140 SER n 1 141 THR n 1 142 GLN n 1 143 LEU n 1 144 LEU n 1 145 LEU n 1 146 ASN n 1 147 GLY n 1 148 SER n 1 149 LEU n 1 150 ALA n 1 151 GLU n 1 152 GLU n 1 153 GLU n 1 154 ILE n 1 155 ILE n 1 156 ILE n 1 157 ARG n 1 158 SER n 1 159 GLU n 1 160 ASN n 1 161 LEU n 1 162 THR n 1 163 ASN n 1 164 ASN n 1 165 ALA n 1 166 LYS n 1 167 THR n 1 168 ILE n 1 169 ILE n 1 170 VAL n 1 171 HIS n 1 172 LEU n 1 173 ASN n 1 174 LYS n 1 175 SER n 1 176 VAL n 1 177 GLU n 1 178 ILE n 1 179 ASN n 1 180 CYS n 1 181 THR n 1 182 ARG n 1 183 PRO n 1 184 SER n 1 185 ASN n 1 186 GLY n 1 187 GLY n 1 188 SER n 1 189 GLY n 1 190 SER n 1 191 GLY n 1 192 GLY n 1 193 ASP n 1 194 ILE n 1 195 ARG n 1 196 LYS n 1 197 ALA n 1 198 TYR n 1 199 CYS n 1 200 GLU n 1 201 ILE n 1 202 ASN n 1 203 GLY n 1 204 THR n 1 205 LYS n 1 206 TRP n 1 207 ASN n 1 208 LYS n 1 209 VAL n 1 210 LEU n 1 211 LYS n 1 212 GLN n 1 213 VAL n 1 214 THR n 1 215 GLU n 1 216 LYS n 1 217 LEU n 1 218 LYS n 1 219 GLU n 1 220 HIS n 1 221 PHE n 1 222 ASN n 1 223 ASN n 1 224 LYS n 1 225 THR n 1 226 ILE n 1 227 ILE n 1 228 PHE n 1 229 GLN n 1 230 PRO n 1 231 PRO n 1 232 SER n 1 233 GLY n 1 234 GLY n 1 235 ASP n 1 236 LEU n 1 237 GLU n 1 238 ILE n 1 239 THR n 1 240 MET n 1 241 HIS n 1 242 HIS n 1 243 PHE n 1 244 ASN n 1 245 CYS n 1 246 ARG n 1 247 GLY n 1 248 GLU n 1 249 PHE n 1 250 PHE n 1 251 TYR n 1 252 CYS n 1 253 ASN n 1 254 THR n 1 255 THR n 1 256 GLN n 1 257 LEU n 1 258 PHE n 1 259 ASN n 1 260 ASN n 1 261 THR n 1 262 CYS n 1 263 ILE n 1 264 GLY n 1 265 ASN n 1 266 GLU n 1 267 THR n 1 268 MET n 1 269 LYS n 1 270 GLY n 1 271 CYS n 1 272 ASN n 1 273 GLY n 1 274 THR n 1 275 ILE n 1 276 THR n 1 277 LEU n 1 278 PRO n 1 279 CYS n 1 280 LYS n 1 281 ILE n 1 282 LYS n 1 283 GLN n 1 284 ILE n 1 285 ILE n 1 286 ASN n 1 287 MET n 1 288 TRP n 1 289 GLN n 1 290 GLY n 1 291 THR n 1 292 GLY n 1 293 GLN n 1 294 ALA n 1 295 MET n 1 296 TYR n 1 297 ALA n 1 298 PRO n 1 299 PRO n 1 300 ILE n 1 301 ASP n 1 302 GLY n 1 303 LYS n 1 304 ILE n 1 305 ASN n 1 306 CYS n 1 307 VAL n 1 308 SER n 1 309 ASN n 1 310 ILE n 1 311 THR n 1 312 GLY n 1 313 ILE n 1 314 LEU n 1 315 LEU n 1 316 THR n 1 317 ARG n 1 318 ASP n 1 319 GLY n 1 320 GLY n 1 321 ALA n 1 322 ASN n 1 323 ASN n 1 324 THR n 1 325 SER n 1 326 ASN n 1 327 GLU n 1 328 THR n 1 329 PHE n 1 330 ARG n 1 331 PRO n 1 332 GLY n 1 333 GLY n 1 334 GLY n 1 335 ASN n 1 336 ILE n 1 337 LYS n 1 338 ASP n 1 339 ASN n 1 340 TRP n 1 341 ARG n 1 342 SER n 1 343 GLU n 1 344 LEU n 1 345 TYR n 1 346 LYS n 1 347 TYR n 1 348 LYS n 1 349 VAL n 1 350 VAL n 1 351 GLN n 1 352 ILE n 1 353 GLU n 1 354 GLY n 1 355 SER n 1 356 HIS n 1 357 HIS n 1 358 HIS n 1 359 HIS n 1 360 HIS n 1 361 HIS n 2 1 GLN n 2 2 VAL n 2 3 GLN n 2 4 LEU n 2 5 VAL n 2 6 GLN n 2 7 SER n 2 8 GLY n 2 9 ALA n 2 10 GLU n 2 11 VAL n 2 12 LYS n 2 13 LYS n 2 14 PRO n 2 15 GLY n 2 16 ALA n 2 17 SER n 2 18 VAL n 2 19 LYS n 2 20 VAL n 2 21 SER n 2 22 CYS n 2 23 LYS n 2 24 ALA n 2 25 SER n 2 26 GLY n 2 27 TYR n 2 28 THR n 2 29 PHE n 2 30 THR n 2 31 GLY n 2 32 TYR n 2 33 TYR n 2 34 MET n 2 35 HIS n 2 36 TRP n 2 37 VAL n 2 38 ARG n 2 39 GLN n 2 40 ALA n 2 41 PRO n 2 42 GLY n 2 43 GLN n 2 44 GLY n 2 45 LEU n 2 46 GLU n 2 47 TRP n 2 48 MET n 2 49 GLY n 2 50 TRP n 2 51 ILE n 2 52 ASN n 2 53 PRO n 2 54 ASN n 2 55 SER n 2 56 GLY n 2 57 GLY n 2 58 THR n 2 59 ASN n 2 60 TYR n 2 61 ALA n 2 62 GLN n 2 63 LYS n 2 64 PHE n 2 65 GLN n 2 66 GLY n 2 67 ARG n 2 68 VAL n 2 69 THR n 2 70 MET n 2 71 THR n 2 72 ARG n 2 73 ASP n 2 74 THR n 2 75 SER n 2 76 ILE n 2 77 SER n 2 78 THR n 2 79 ALA n 2 80 TYR n 2 81 MET n 2 82 GLU n 2 83 LEU n 2 84 SER n 2 85 ARG n 2 86 LEU n 2 87 ARG n 2 88 SER n 2 89 ASP n 2 90 ASP n 2 91 THR n 2 92 ALA n 2 93 VAL n 2 94 TYR n 2 95 TYR n 2 96 CYS n 2 97 ALA n 2 98 ARG n 2 99 GLY n 2 100 LYS n 2 101 TYR n 2 102 CYS n 2 103 THR n 2 104 ALA n 2 105 ARG n 2 106 ASP n 2 107 TYR n 2 108 TYR n 2 109 ASN n 2 110 TRP n 2 111 ASP n 2 112 PHE n 2 113 GLN n 2 114 HIS n 2 115 TRP n 2 116 GLY n 2 117 GLN n 2 118 GLY n 2 119 THR n 2 120 LEU n 2 121 VAL n 2 122 THR n 2 123 VAL n 2 124 SER n 2 125 SER n 2 126 ALA n 2 127 SER n 2 128 THR n 2 129 LYS n 2 130 GLY n 2 131 PRO n 2 132 SER n 2 133 VAL n 2 134 PHE n 2 135 PRO n 2 136 LEU n 2 137 ALA n 2 138 PRO n 2 139 SER n 2 140 SER n 2 141 LYS n 2 142 SER n 2 143 THR n 2 144 SER n 2 145 GLY n 2 146 GLY n 2 147 THR n 2 148 ALA n 2 149 ALA n 2 150 LEU n 2 151 GLY n 2 152 CYS n 2 153 LEU n 2 154 VAL n 2 155 LYS n 2 156 ASP n 2 157 TYR n 2 158 PHE n 2 159 PRO n 2 160 GLU n 2 161 PRO n 2 162 VAL n 2 163 THR n 2 164 VAL n 2 165 SER n 2 166 TRP n 2 167 ASN n 2 168 SER n 2 169 GLY n 2 170 ALA n 2 171 LEU n 2 172 THR n 2 173 SER n 2 174 GLY n 2 175 VAL n 2 176 HIS n 2 177 THR n 2 178 PHE n 2 179 PRO n 2 180 ALA n 2 181 VAL n 2 182 LEU n 2 183 GLN n 2 184 SER n 2 185 SER n 2 186 GLY n 2 187 LEU n 2 188 TYR n 2 189 SER n 2 190 LEU n 2 191 SER n 2 192 SER n 2 193 VAL n 2 194 VAL n 2 195 THR n 2 196 VAL n 2 197 PRO n 2 198 SER n 2 199 SER n 2 200 SER n 2 201 LEU n 2 202 GLY n 2 203 THR n 2 204 GLN n 2 205 THR n 2 206 TYR n 2 207 ILE n 2 208 CYS n 2 209 ASN n 2 210 VAL n 2 211 ASN n 2 212 HIS n 2 213 LYS n 2 214 PRO n 2 215 SER n 2 216 ASN n 2 217 THR n 2 218 LYS n 2 219 VAL n 2 220 ASP n 2 221 LYS n 2 222 ARG n 2 223 VAL n 2 224 GLU n 2 225 PRO n 2 226 LYS n 2 227 SER n 2 228 CYS n 2 229 ASP n 2 230 LYS n 2 231 THR n 2 232 HIS n 3 1 GLU n 3 2 ILE n 3 3 VAL n 3 4 LEU n 3 5 THR n 3 6 GLN n 3 7 SER n 3 8 PRO n 3 9 ALA n 3 10 THR n 3 11 LEU n 3 12 SER n 3 13 LEU n 3 14 SER n 3 15 PRO n 3 16 GLY n 3 17 GLU n 3 18 THR n 3 19 ALA n 3 20 ILE n 3 21 ILE n 3 22 SER n 3 23 CYS n 3 24 ARG n 3 25 THR n 3 26 SER n 3 27 GLN n 3 28 SER n 3 29 GLY n 3 30 SER n 3 31 LEU n 3 32 ALA n 3 33 TRP n 3 34 TYR n 3 35 GLN n 3 36 GLN n 3 37 ARG n 3 38 PRO n 3 39 GLY n 3 40 GLN n 3 41 ALA n 3 42 PRO n 3 43 ARG n 3 44 LEU n 3 45 VAL n 3 46 ILE n 3 47 TYR n 3 48 SER n 3 49 GLY n 3 50 SER n 3 51 THR n 3 52 ARG n 3 53 ALA n 3 54 ALA n 3 55 GLY n 3 56 ILE n 3 57 PRO n 3 58 ASP n 3 59 ARG n 3 60 PHE n 3 61 SER n 3 62 GLY n 3 63 SER n 3 64 ARG n 3 65 TRP n 3 66 GLY n 3 67 ALA n 3 68 ASP n 3 69 TYR n 3 70 ASN n 3 71 LEU n 3 72 SER n 3 73 ILE n 3 74 SER n 3 75 ASN n 3 76 LEU n 3 77 GLU n 3 78 SER n 3 79 GLY n 3 80 ASP n 3 81 PHE n 3 82 GLY n 3 83 VAL n 3 84 TYR n 3 85 TYR n 3 86 CYS n 3 87 GLN n 3 88 GLN n 3 89 TYR n 3 90 GLU n 3 91 PHE n 3 92 PHE n 3 93 GLY n 3 94 GLN n 3 95 GLY n 3 96 THR n 3 97 LYS n 3 98 VAL n 3 99 GLN n 3 100 VAL n 3 101 ASP n 3 102 ILE n 3 103 LYS n 3 104 ARG n 3 105 THR n 3 106 VAL n 3 107 ALA n 3 108 ALA n 3 109 PRO n 3 110 SER n 3 111 VAL n 3 112 PHE n 3 113 ILE n 3 114 PHE n 3 115 PRO n 3 116 PRO n 3 117 SER n 3 118 ASP n 3 119 GLU n 3 120 GLN n 3 121 LEU n 3 122 LYS n 3 123 SER n 3 124 GLY n 3 125 THR n 3 126 ALA n 3 127 SER n 3 128 VAL n 3 129 VAL n 3 130 CYS n 3 131 LEU n 3 132 LEU n 3 133 ASN n 3 134 ASN n 3 135 PHE n 3 136 TYR n 3 137 PRO n 3 138 ARG n 3 139 GLU n 3 140 ALA n 3 141 LYS n 3 142 VAL n 3 143 GLN n 3 144 TRP n 3 145 LYS n 3 146 VAL n 3 147 ASP n 3 148 ASN n 3 149 ALA n 3 150 LEU n 3 151 GLN n 3 152 SER n 3 153 GLY n 3 154 ASN n 3 155 SER n 3 156 GLN n 3 157 GLU n 3 158 SER n 3 159 VAL n 3 160 THR n 3 161 GLU n 3 162 GLN n 3 163 ASP n 3 164 SER n 3 165 LYS n 3 166 ASP n 3 167 SER n 3 168 THR n 3 169 TYR n 3 170 SER n 3 171 LEU n 3 172 SER n 3 173 SER n 3 174 THR n 3 175 LEU n 3 176 THR n 3 177 LEU n 3 178 SER n 3 179 LYS n 3 180 ALA n 3 181 ASP n 3 182 TYR n 3 183 GLU n 3 184 LYS n 3 185 HIS n 3 186 LYS n 3 187 VAL n 3 188 TYR n 3 189 ALA n 3 190 CYS n 3 191 GLU n 3 192 VAL n 3 193 THR n 3 194 HIS n 3 195 GLN n 3 196 GLY n 3 197 LEU n 3 198 SER n 3 199 SER n 3 200 PRO n 3 201 VAL n 3 202 THR n 3 203 LYS n 3 204 SER n 3 205 PHE n 3 206 ASN n 3 207 ARG n 3 208 GLY n 3 209 GLU n 3 210 CYS n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _entity_src_gen.pdbx_seq_type _entity_src_gen.pdbx_beg_seq_num _entity_src_gen.pdbx_end_seq_num _entity_src_gen.gene_src_common_name _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _entity_src_gen.gene_src_species _entity_src_gen.gene_src_strain _entity_src_gen.gene_src_tissue _entity_src_gen.gene_src_tissue_fraction _entity_src_gen.gene_src_details _entity_src_gen.pdbx_gene_src_fragment _entity_src_gen.pdbx_gene_src_scientific_name _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _entity_src_gen.pdbx_gene_src_variant _entity_src_gen.pdbx_gene_src_cell_line _entity_src_gen.pdbx_gene_src_atcc _entity_src_gen.pdbx_gene_src_organ _entity_src_gen.pdbx_gene_src_organelle _entity_src_gen.pdbx_gene_src_cell _entity_src_gen.pdbx_gene_src_cellular_location _entity_src_gen.host_org_common_name _entity_src_gen.pdbx_host_org_scientific_name _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample ? ? ? ? ? ? ? 93TH057 ? ? ? ? 'Human Immunodeficiency Virus 1' 11676 ? ? ? ? ? ? ? ? 'SPODOPTERA FRUGIPERDA' 7108 ? ? ? ? ? ? Hi5 ? ? ? ? ? ? ? plasmid ? ? ? ? ? ? 2 1 sample ? ? ? ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? HEK293-6E ? ? ? ? ? ? ? plasmid ? ? ? ? ? ? 3 1 sample ? ? ? ? ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? HEK293-6E ? ? ? ? ? ? ? plasmid ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_align_begin _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_db_isoform 1 PDB 4JDT 4JDT 1 ? ? ? 2 PDB 4JDT 4JDT 2 ? ? ? 3 PDB 4JDT 4JDT 3 ? ? ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 4JDT G 1 ? 361 ? 4JDT 44 ? 500 ? 44 500 2 2 4JDT H 1 ? 232 ? 4JDT 1 ? 224 ? 1 224 3 3 4JDT L 1 ? 210 ? 4JDT 1 ? 210 ? 1 210 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 4JDT _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.69 _exptl_crystal.density_percent_sol 54.34 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details 'PEG 10000, ammonium sulfate, Bis-Tris, isopropanol , pH 6.5, VAPOR DIFFUSION, temperature 298K' # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector PIXEL _diffrn_detector.type 'DECTRIS PILATUS 6M' _diffrn_detector.pdbx_collection_date 2012-10-17 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'LIQUID NITROGEN-COOLED DOUBLE CRYSTAL' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.033 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'SSRL BEAMLINE BL12-2' _diffrn_source.pdbx_synchrotron_site SSRL _diffrn_source.pdbx_synchrotron_beamline BL12-2 _diffrn_source.pdbx_wavelength 1.033 _diffrn_source.pdbx_wavelength_list ? # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 4JDT _reflns.observed_criterion_sigma_I -3.000 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 29.711 _reflns.d_resolution_high 3.256 _reflns.number_obs 15409 _reflns.number_all ? _reflns.percent_possible_obs 98.4 _reflns.pdbx_Rmerge_I_obs 0.075 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy ? _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? # _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_ordinal 1 _reflns_shell.d_res_high 3.26 _reflns_shell.d_res_low 3.43 _reflns_shell.percent_possible_all 91.4 _reflns_shell.Rmerge_I_obs 0.789 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 4JDT _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 15346 _refine.ls_number_reflns_all 15613 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.330 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 29.71 _refine.ls_d_res_high 3.26 _refine.ls_percent_reflns_obs 98.3 _refine.ls_R_factor_obs 0.229 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.227 _refine.ls_R_factor_R_free 0.267 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 4.990 _refine.ls_number_reflns_R_free 765 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min 0.000 _refine.occupancy_max 1.000 _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 147.10 _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model '3U7Y, 3U7W' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.400 _refine.pdbx_overall_phase_error ? _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 5830 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 19 _refine_hist.number_atoms_solvent 0 _refine_hist.number_atoms_total 5849 _refine_hist.d_res_high 3.26 _refine_hist.d_res_low 29.71 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.010 ? ? 6000 'X-RAY DIFFRACTION' ? f_angle_d 1.642 ? ? 8134 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 13.261 ? ? 2162 'X-RAY DIFFRACTION' ? f_chiral_restr 0.077 ? ? 907 'X-RAY DIFFRACTION' ? f_plane_restr 0.010 ? ? 1043 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.number_reflns_obs 'X-RAY DIFFRACTION' . 3.2557 3.5068 2717 0.2898 93.00 0.3154 . . 136 . . . . 'X-RAY DIFFRACTION' . 3.5068 3.8590 2905 0.2677 100.00 0.3551 . . 157 . . . . 'X-RAY DIFFRACTION' . 3.8590 4.4158 2919 0.2319 100.00 0.2716 . . 150 . . . . 'X-RAY DIFFRACTION' . 4.4158 5.5575 2951 0.2057 100.00 0.2430 . . 156 . . . . 'X-RAY DIFFRACTION' . 5.5575 29.7119 3089 0.2177 99.00 0.2531 . . 166 . . . . # _pdbx_refine.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine.entry_id 4JDT _pdbx_refine.R_factor_all_no_cutoff ? _pdbx_refine.R_factor_obs_no_cutoff ? _pdbx_refine.free_R_factor_no_cutoff ? _pdbx_refine.free_R_error_no_cutoff ? _pdbx_refine.free_R_val_test_set_size_perc_no_cutoff ? _pdbx_refine.free_R_val_test_set_ct_no_cutoff ? _pdbx_refine.R_factor_all_4sig_cutoff ? _pdbx_refine.R_factor_obs_4sig_cutoff ? _pdbx_refine.free_R_factor_4sig_cutoff ? _pdbx_refine.free_R_val_test_set_size_perc_4sig_cutoff ? _pdbx_refine.free_R_val_test_set_ct_4sig_cutoff ? _pdbx_refine.number_reflns_obs_4sig_cutoff ? # _struct.entry_id 4JDT _struct.title 'Crystal structure of chimeric germ-line precursor of NIH45-46 Fab in complex with gp120 of 93TH057 HIV-1' _struct.pdbx_descriptor 'gp120, Fab heavy chain, Fab light chain' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4JDT _struct_keywords.text 'IG FOLD, ANTI HIV, ANTIBODY, IMMUNE SYSTEM COMPLEX, viral protein-immune system complex' _struct_keywords.pdbx_keywords 'viral protein/immune system' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? E N N 5 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLU A 21 ? CYS A 31 ? GLU G 64 CYS G 74 1 ? 11 HELX_P HELX_P2 2 ASN A 55 ? LEU A 73 ? ASN G 98 LEU G 116 1 ? 19 HELX_P HELX_P3 3 GLY A 203 ? HIS A 220 ? GLY G 335 HIS G 352 1 ? 18 HELX_P HELX_P4 4 ASP A 235 ? MET A 240 ? ASP G 368 MET G 373 1 ? 6 HELX_P HELX_P5 5 ASN A 259 ? ILE A 263 ? ASN G 392 ILE G 396 5 ? 5 HELX_P HELX_P6 6 ILE A 336 ? TYR A 345 ? ILE G 475 TYR G 484 1 ? 10 HELX_P HELX_P7 7 THR B 28 ? TYR B 32 ? THR H 28 TYR H 32 5 ? 5 HELX_P HELX_P8 8 GLN B 62 ? GLN B 65 ? GLN H 61 GLN H 64 5 ? 4 HELX_P HELX_P9 9 THR B 74 ? ILE B 76 ? THR H 73 ILE H 75 5 ? 3 HELX_P HELX_P10 10 ARG B 87 ? THR B 91 ? ARG H 83 THR H 87 5 ? 5 HELX_P HELX_P11 11 SER B 168 ? ALA B 170 ? SER H 160 ALA H 162 5 ? 3 HELX_P HELX_P12 12 PRO B 197 ? LEU B 201 ? PRO H 189 LEU H 193 5 ? 5 HELX_P HELX_P13 13 PRO B 214 ? ASN B 216 ? PRO H 206 ASN H 208 5 ? 3 HELX_P HELX_P14 14 GLU C 77 ? PHE C 81 ? GLU L 77 PHE L 81 5 ? 5 HELX_P HELX_P15 15 SER C 117 ? SER C 123 ? SER L 117 SER L 123 1 ? 7 HELX_P HELX_P16 16 LYS C 179 ? GLU C 183 ? LYS L 179 GLU L 183 1 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 11 SG ? ? ? 1_555 A CYS 31 SG ? ? G CYS 54 G CYS 74 1_555 ? ? ? ? ? ? ? 2.049 ? disulf2 disulf ? ? A CYS 22 SG ? ? ? 1_555 A CYS 72 SG ? ? G CYS 65 G CYS 115 1_555 ? ? ? ? ? ? ? 2.031 ? disulf3 disulf ? ? A CYS 76 SG ? ? ? 1_555 A CYS 89 SG ? ? G CYS 119 G CYS 205 1_555 ? ? ? ? ? ? ? 2.040 ? disulf4 disulf ? ? A CYS 102 SG ? ? ? 1_555 A CYS 131 SG ? ? G CYS 218 G CYS 247 1_555 ? ? ? ? ? ? ? 2.051 ? disulf5 disulf ? ? A CYS 112 SG ? ? ? 1_555 A CYS 123 SG ? ? G CYS 228 G CYS 239 1_555 ? ? ? ? ? ? ? 2.054 ? disulf6 disulf ? ? A CYS 180 SG ? ? ? 1_555 A CYS 199 SG ? ? G CYS 296 G CYS 331 1_555 ? ? ? ? ? ? ? 2.041 ? disulf7 disulf ? ? A CYS 245 SG ? ? ? 1_555 A CYS 306 SG ? ? G CYS 378 G CYS 445 1_555 ? ? ? ? ? ? ? 2.022 ? disulf8 disulf ? ? A CYS 252 SG ? ? ? 1_555 A CYS 279 SG ? ? G CYS 385 G CYS 418 1_555 ? ? ? ? ? ? ? 2.039 ? disulf9 disulf ? ? B CYS 22 SG ? ? ? 1_555 B CYS 96 SG ? ? H CYS 22 H CYS 92 1_555 ? ? ? ? ? ? ? 1.993 ? disulf10 disulf ? ? B CYS 152 SG ? ? ? 1_555 B CYS 208 SG ? ? H CYS 144 H CYS 200 1_555 ? ? ? ? ? ? ? 2.041 ? disulf11 disulf ? ? C CYS 23 SG ? ? ? 1_555 C CYS 86 SG ? ? L CYS 23 L CYS 86 1_555 ? ? ? ? ? ? ? 2.035 ? disulf12 disulf ? ? C CYS 130 SG ? ? ? 1_555 C CYS 190 SG ? ? L CYS 130 L CYS 190 1_555 ? ? ? ? ? ? ? 2.032 ? covale1 covale ? ? A ASN 146 ND2 ? ? ? 1_555 E NAG . C1 ? ? G ASN 262 G NAG 602 1_555 ? ? ? ? ? ? ? 1.449 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 PHE 158 B . ? PHE 150 H PRO 159 B ? PRO 151 H 1 -5.77 2 GLU 160 B . ? GLU 152 H PRO 161 B ? PRO 153 H 1 10.29 3 SER 7 C . ? SER 7 L PRO 8 C ? PRO 8 L 1 -1.82 4 TYR 136 C . ? TYR 136 L PRO 137 C ? PRO 137 L 1 0.33 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 5 ? B ? 3 ? C ? 2 ? D ? 4 ? E ? 5 ? F ? 7 ? G ? 4 ? H ? 6 ? I ? 4 ? J ? 4 ? K ? 4 ? L ? 3 ? M ? 4 ? N ? 6 ? O ? 4 ? P ? 4 ? Q ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel B 1 2 ? parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 4 5 ? parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 4 5 ? anti-parallel F 5 6 ? anti-parallel F 6 7 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel H 1 2 ? parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel H 4 5 ? anti-parallel H 5 6 ? anti-parallel I 1 2 ? parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel N 5 6 ? anti-parallel O 1 2 ? parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel P 3 4 ? anti-parallel Q 1 2 ? anti-parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 LYS A 3 ? ASP A 4 ? LYS G 46 ASP G 47 A 2 TYR A 347 ? GLN A 351 ? TYR G 486 GLN G 490 A 3 TYR A 107 ? CYS A 112 ? TYR G 223 CYS G 228 A 4 VAL A 126 ? VAL A 129 ? VAL G 242 VAL G 245 A 5 ILE A 41 ? HIS A 42 ? ILE G 84 HIS G 85 B 1 VAL A 32 ? PRO A 33 ? VAL G 75 PRO G 76 B 2 PHE A 10 ? SER A 13 ? PHE G 53 SER G 56 B 3 HIS A 100 ? CYS A 102 ? HIS G 216 CYS G 218 C 1 GLU A 48 ? ASN A 51 ? GLU G 91 ASN G 94 C 2 THR A 120 ? CYS A 123 ? THR G 236 CYS G 239 D 1 VAL A 84 ? LYS A 86 ? VAL G 200 LYS G 202 D 2 VAL A 77 ? LEU A 79 ? VAL G 120 LEU G 122 D 3 GLN A 293 ? MET A 295 ? GLN G 432 MET G 434 D 4 ILE A 284 ? ASN A 286 ? ILE G 423 ASN G 425 E 1 LEU A 143 ? LEU A 145 ? LEU G 259 LEU G 261 E 2 ILE A 304 ? ARG A 317 ? ILE G 443 ARG G 456 E 3 ILE A 168 ? ARG A 182 ? ILE G 284 ARG G 298 E 4 GLU A 327 ? PRO A 331 ? GLU G 466 PRO G 470 E 5 ILE A 226 ? PHE A 228 ? ILE G 359 PHE G 361 F 1 ILE A 155 ? ARG A 157 ? ILE G 271 ARG G 273 F 2 ILE A 168 ? ARG A 182 ? ILE G 284 ARG G 298 F 3 ILE A 304 ? ARG A 317 ? ILE G 443 ARG G 456 F 4 LYS A 196 ? ASN A 202 ? LYS G 328 ASN G 334 F 5 THR A 274 ? LYS A 282 ? THR G 413 LYS G 421 F 6 GLU A 248 ? CYS A 252 ? GLU G 381 CYS G 385 F 7 HIS A 241 ? CYS A 245 ? HIS G 374 CYS G 378 G 1 GLN B 3 ? GLN B 6 ? GLN H 3 GLN H 6 G 2 VAL B 18 ? SER B 25 ? VAL H 18 SER H 25 G 3 THR B 78 ? LEU B 83 ? THR H 77 LEU H 82 G 4 VAL B 68 ? ASP B 73 ? VAL H 67 ASP H 72 H 1 GLU B 10 ? LYS B 12 ? GLU H 10 LYS H 12 H 2 THR B 119 ? VAL B 123 ? THR H 111 VAL H 115 H 3 ALA B 92 ? GLY B 99 ? ALA H 88 GLY H 95 H 4 MET B 34 ? GLN B 39 ? MET H 34 GLN H 39 H 5 LEU B 45 ? ASN B 52 ? LEU H 45 ASN H 52 H 6 GLY B 57 ? TYR B 60 ? GLY H 56 TYR H 59 I 1 GLU B 10 ? LYS B 12 ? GLU H 10 LYS H 12 I 2 THR B 119 ? VAL B 123 ? THR H 111 VAL H 115 I 3 ALA B 92 ? GLY B 99 ? ALA H 88 GLY H 95 I 4 PHE B 112 ? TRP B 115 ? PHE H 104 TRP H 107 J 1 SER B 132 ? LEU B 136 ? SER H 124 LEU H 128 J 2 ALA B 148 ? TYR B 157 ? ALA H 140 TYR H 149 J 3 TYR B 188 ? VAL B 196 ? TYR H 180 VAL H 188 J 4 VAL B 175 ? THR B 177 ? VAL H 167 THR H 169 K 1 SER B 132 ? LEU B 136 ? SER H 124 LEU H 128 K 2 ALA B 148 ? TYR B 157 ? ALA H 140 TYR H 149 K 3 TYR B 188 ? VAL B 196 ? TYR H 180 VAL H 188 K 4 VAL B 181 ? LEU B 182 ? VAL H 173 LEU H 174 L 1 VAL B 162 ? TRP B 166 ? VAL H 154 TRP H 158 L 2 ILE B 207 ? HIS B 212 ? ILE H 199 HIS H 204 L 3 THR B 217 ? ARG B 222 ? THR H 209 ARG H 214 M 1 THR C 5 ? SER C 7 ? THR L 5 SER L 7 M 2 ALA C 19 ? ARG C 24 ? ALA L 19 ARG L 24 M 3 ASP C 68 ? ILE C 73 ? ASP L 68 ILE L 73 M 4 PHE C 60 ? TRP C 65 ? PHE L 60 TRP L 65 N 1 THR C 10 ? LEU C 13 ? THR L 10 LEU L 13 N 2 THR C 96 ? VAL C 100 ? THR L 96 VAL L 100 N 3 GLY C 82 ? GLN C 88 ? GLY L 82 GLN L 88 N 4 ALA C 32 ? GLN C 36 ? ALA L 32 GLN L 36 N 5 ARG C 43 ? TYR C 47 ? ARG L 43 TYR L 47 N 6 THR C 51 ? ARG C 52 ? THR L 51 ARG L 52 O 1 THR C 10 ? LEU C 13 ? THR L 10 LEU L 13 O 2 THR C 96 ? VAL C 100 ? THR L 96 VAL L 100 O 3 GLY C 82 ? GLN C 88 ? GLY L 82 GLN L 88 O 4 PHE C 91 ? PHE C 92 ? PHE L 91 PHE L 92 P 1 SER C 110 ? PHE C 114 ? SER L 110 PHE L 114 P 2 THR C 125 ? PHE C 135 ? THR L 125 PHE L 135 P 3 TYR C 169 ? SER C 178 ? TYR L 169 SER L 178 P 4 SER C 155 ? VAL C 159 ? SER L 155 VAL L 159 Q 1 ALA C 149 ? GLN C 151 ? ALA L 149 GLN L 151 Q 2 LYS C 141 ? VAL C 146 ? LYS L 141 VAL L 146 Q 3 VAL C 187 ? THR C 193 ? VAL L 187 THR L 193 Q 4 VAL C 201 ? ASN C 206 ? VAL L 201 ASN L 206 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N LYS A 3 ? N LYS G 46 O GLN A 351 ? O GLN G 490 A 2 3 O VAL A 350 ? O VAL G 489 N VAL A 108 ? N VAL G 224 A 3 4 N LYS A 111 ? N LYS G 227 O SER A 127 ? O SER G 243 A 4 5 O SER A 128 ? O SER G 244 N ILE A 41 ? N ILE G 84 B 1 2 O VAL A 32 ? O VAL G 75 N SER A 13 ? N SER G 56 B 2 3 N ALA A 12 ? N ALA G 55 O HIS A 100 ? O HIS G 216 C 1 2 N PHE A 50 ? N PHE G 93 O GLY A 121 ? O GLY G 237 D 1 2 O ILE A 85 ? O ILE G 201 N LYS A 78 ? N LYS G 121 D 2 3 N LEU A 79 ? N LEU G 122 O GLN A 293 ? O GLN G 432 D 3 4 O ALA A 294 ? O ALA G 433 N ILE A 285 ? N ILE G 424 E 1 2 N LEU A 144 ? N LEU G 260 O GLY A 312 ? O GLY G 451 E 2 3 O ILE A 313 ? O ILE G 452 N VAL A 170 ? N VAL G 286 E 4 5 O PHE A 329 ? O PHE G 468 N ILE A 227 ? N ILE G 360 F 1 2 N ARG A 157 ? N ARG G 273 O ILE A 169 ? O ILE G 285 F 2 3 N VAL A 170 ? N VAL G 286 O ILE A 313 ? O ILE G 452 F 4 5 N CYS A 199 ? N CYS G 331 O LEU A 277 ? O LEU G 416 F 5 6 O LYS A 282 ? O LYS G 421 N PHE A 249 ? N PHE G 382 F 6 7 O GLU A 248 ? O GLU G 381 N CYS A 245 ? N CYS G 378 G 1 2 N VAL B 5 ? N VAL H 5 O LYS B 23 ? O LYS H 23 G 2 3 N VAL B 20 ? N VAL H 20 O MET B 81 ? O MET H 80 G 3 4 O TYR B 80 ? O TYR H 79 N THR B 71 ? N THR H 70 H 1 2 N GLU B 10 ? N GLU H 10 O LEU B 120 ? O LEU H 112 H 2 3 O THR B 119 ? O THR H 111 N TYR B 94 ? N TYR H 90 H 3 4 O TYR B 95 ? O TYR H 91 N VAL B 37 ? N VAL H 37 H 4 5 N ARG B 38 ? N ARG H 38 O GLU B 46 ? O GLU H 46 H 5 6 N ASN B 52 ? N ASN H 52 O GLY B 57 ? O GLY H 56 I 1 2 N GLU B 10 ? N GLU H 10 O LEU B 120 ? O LEU H 112 I 2 3 O THR B 119 ? O THR H 111 N TYR B 94 ? N TYR H 90 I 3 4 N ARG B 98 ? N ARG H 94 O HIS B 114 ? O HIS H 106 J 1 2 N PHE B 134 ? N PHE H 126 O LEU B 153 ? O LEU H 145 J 2 3 N LEU B 150 ? N LEU H 142 O VAL B 194 ? O VAL H 186 J 3 4 O VAL B 193 ? O VAL H 185 N HIS B 176 ? N HIS H 168 K 1 2 N PHE B 134 ? N PHE H 126 O LEU B 153 ? O LEU H 145 K 2 3 N LEU B 150 ? N LEU H 142 O VAL B 194 ? O VAL H 186 K 3 4 O SER B 189 ? O SER H 181 N VAL B 181 ? N VAL H 173 L 1 2 N THR B 163 ? N THR H 155 O ASN B 211 ? O ASN H 203 L 2 3 N HIS B 212 ? N HIS H 204 O THR B 217 ? O THR H 209 M 1 2 N SER C 7 ? N SER L 7 O SER C 22 ? O SER L 22 M 2 3 N ILE C 21 ? N ILE L 21 O LEU C 71 ? O LEU L 71 M 3 4 O SER C 72 ? O SER L 72 N SER C 61 ? N SER L 61 N 1 2 N LEU C 13 ? N LEU L 13 O GLN C 99 ? O GLN L 99 N 2 3 O VAL C 98 ? O VAL L 98 N GLY C 82 ? N GLY L 82 N 3 4 O VAL C 83 ? O VAL L 83 N GLN C 36 ? N GLN L 36 N 4 5 N TRP C 33 ? N TRP L 33 O VAL C 45 ? O VAL L 45 N 5 6 N TYR C 47 ? N TYR L 47 O THR C 51 ? O THR L 51 O 1 2 N LEU C 13 ? N LEU L 13 O GLN C 99 ? O GLN L 99 O 2 3 O VAL C 98 ? O VAL L 98 N GLY C 82 ? N GLY L 82 O 3 4 N GLN C 88 ? N GLN L 88 O PHE C 91 ? O PHE L 91 P 1 2 N SER C 110 ? N SER L 110 O ASN C 133 ? O ASN L 133 P 2 3 N CYS C 130 ? N CYS L 130 O SER C 173 ? O SER L 173 P 3 4 O SER C 172 ? O SER L 172 N SER C 158 ? N SER L 158 Q 1 2 O GLN C 151 ? O GLN L 151 N TRP C 144 ? N TRP L 144 Q 2 3 N LYS C 145 ? N LYS L 145 O ALA C 189 ? O ALA L 189 Q 3 4 N VAL C 192 ? N VAL L 192 O VAL C 201 ? O VAL L 201 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE SO4 G 601' AC2 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE NAG G 602' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 3 ASN A 335 ? ASN G 474 . ? 1_555 ? 2 AC1 3 LYS A 337 ? LYS G 476 . ? 1_555 ? 3 AC1 3 ARG A 341 ? ARG G 480 . ? 1_555 ? 4 AC2 7 PRO A 96 ? PRO G 212 . ? 1_555 ? 5 AC2 7 LYS A 136 ? LYS G 252 . ? 1_555 ? 6 AC2 7 ASN A 146 ? ASN G 262 . ? 1_555 ? 7 AC2 7 ASN A 244 ? ASN G 377 . ? 1_555 ? 8 AC2 7 CYS A 306 ? CYS G 445 . ? 1_555 ? 9 AC2 7 VAL A 307 ? VAL G 446 . ? 1_555 ? 10 AC2 7 SER A 308 ? SER G 447 . ? 1_555 ? # _atom_sites.entry_id 4JDT _atom_sites.fract_transf_matrix[1][1] 0.015229 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.014324 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.004813 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # 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.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . VAL A 1 1 ? 21.024 19.214 -25.789 1.00 172.47 ? 44 VAL G N 1 ATOM 2 C CA . VAL A 1 1 ? 20.934 19.930 -27.062 1.00 165.79 ? 44 VAL G CA 1 ATOM 3 C C . VAL A 1 1 ? 19.826 19.340 -27.943 1.00 160.27 ? 44 VAL G C 1 ATOM 4 O O . VAL A 1 1 ? 19.201 20.056 -28.722 1.00 159.09 ? 44 VAL G O 1 ATOM 5 C CB . VAL A 1 1 ? 22.283 19.917 -27.816 1.00 162.16 ? 44 VAL G CB 1 ATOM 6 C CG1 . VAL A 1 1 ? 22.254 20.891 -28.970 1.00 157.86 ? 44 VAL G CG1 1 ATOM 7 C CG2 . VAL A 1 1 ? 23.417 20.267 -26.867 1.00 167.99 ? 44 VAL G CG2 1 ATOM 8 N N . TRP A 1 2 ? 19.595 18.033 -27.826 1.00 155.33 ? 45 TRP G N 1 ATOM 9 C CA . TRP A 1 2 ? 18.508 17.380 -28.559 1.00 145.30 ? 45 TRP G CA 1 ATOM 10 C C . TRP A 1 2 ? 17.825 16.332 -27.681 1.00 136.98 ? 45 TRP G C 1 ATOM 11 O O . TRP A 1 2 ? 18.341 15.981 -26.624 1.00 147.92 ? 45 TRP G O 1 ATOM 12 C CB . TRP A 1 2 ? 19.021 16.692 -29.823 1.00 145.34 ? 45 TRP G CB 1 ATOM 13 C CG . TRP A 1 2 ? 19.986 15.575 -29.551 1.00 140.66 ? 45 TRP G CG 1 ATOM 14 C CD1 . TRP A 1 2 ? 19.676 14.295 -29.187 1.00 136.88 ? 45 TRP G CD1 1 ATOM 15 C CD2 . TRP A 1 2 ? 21.409 15.627 -29.651 1.00 142.26 ? 45 TRP G CD2 1 ATOM 16 N NE1 . TRP A 1 2 ? 20.819 13.553 -29.037 1.00 143.43 ? 45 TRP G NE1 1 ATOM 17 C CE2 . TRP A 1 2 ? 21.900 14.347 -29.317 1.00 148.52 ? 45 TRP G CE2 1 ATOM 18 C CE3 . TRP A 1 2 ? 22.319 16.634 -29.974 1.00 142.38 ? 45 TRP G CE3 1 ATOM 19 C CZ2 . TRP A 1 2 ? 23.259 14.049 -29.302 1.00 155.27 ? 45 TRP G CZ2 1 ATOM 20 C CZ3 . TRP A 1 2 ? 23.666 16.337 -29.958 1.00 151.42 ? 45 TRP G CZ3 1 ATOM 21 C CH2 . TRP A 1 2 ? 24.125 15.055 -29.626 1.00 156.58 ? 45 TRP G CH2 1 ATOM 22 N N . LYS A 1 3 ? 16.681 15.814 -28.105 1.00 120.18 ? 46 LYS G N 1 ATOM 23 C CA . LYS A 1 3 ? 16.020 14.818 -27.276 1.00 126.11 ? 46 LYS G CA 1 ATOM 24 C C . LYS A 1 3 ? 15.405 13.765 -28.188 1.00 144.23 ? 46 LYS G C 1 ATOM 25 O O . LYS A 1 3 ? 15.079 14.066 -29.329 1.00 147.54 ? 46 LYS G O 1 ATOM 26 C CB . LYS A 1 3 ? 14.959 15.450 -26.369 0.00 124.94 ? 46 LYS G CB 1 ATOM 27 C CG . LYS A 1 3 ? 14.134 14.418 -25.576 0.00 125.62 ? 46 LYS G CG 1 ATOM 28 C CD . LYS A 1 3 ? 15.050 13.630 -24.592 0.00 127.73 ? 46 LYS G CD 1 ATOM 29 C CE . LYS A 1 3 ? 14.401 12.368 -24.009 0.00 127.90 ? 46 LYS G CE 1 ATOM 30 N NZ . LYS A 1 3 ? 13.177 12.637 -23.207 0.00 127.68 ? 46 LYS G NZ 1 ATOM 31 N N . ASP A 1 4 ? 15.238 12.536 -27.712 1.00 151.43 ? 47 ASP G N 1 ATOM 32 C CA . ASP A 1 4 ? 14.581 11.544 -28.541 1.00 146.83 ? 47 ASP G CA 1 ATOM 33 C C . ASP A 1 4 ? 13.152 11.993 -28.774 1.00 140.99 ? 47 ASP G C 1 ATOM 34 O O . ASP A 1 4 ? 12.503 12.549 -27.886 1.00 138.58 ? 47 ASP G O 1 ATOM 35 C CB . ASP A 1 4 ? 14.624 10.177 -27.875 1.00 150.08 ? 47 ASP G CB 1 ATOM 36 C CG . ASP A 1 4 ? 16.008 9.577 -27.885 1.00 157.74 ? 47 ASP G CG 1 ATOM 37 O OD1 . ASP A 1 4 ? 16.990 10.340 -27.732 1.00 162.66 ? 47 ASP G OD1 1 ATOM 38 O OD2 . ASP A 1 4 ? 16.110 8.338 -28.027 1.00 158.29 ? 47 ASP G OD2 1 ATOM 39 N N . ALA A 1 5 ? 12.661 11.717 -29.973 1.00 142.02 ? 48 ALA G N 1 ATOM 40 C CA . ALA A 1 5 ? 11.346 12.176 -30.383 1.00 145.64 ? 48 ALA G CA 1 ATOM 41 C C . ALA A 1 5 ? 10.852 11.421 -31.604 1.00 149.36 ? 48 ALA G C 1 ATOM 42 O O . ALA A 1 5 ? 11.651 10.925 -32.403 1.00 150.27 ? 48 ALA G O 1 ATOM 43 C CB . ALA A 1 5 ? 11.372 13.672 -30.668 1.00 145.22 ? 48 ALA G CB 1 ATOM 44 N N . ASP A 1 6 ? 9.532 11.330 -31.732 1.00 149.03 ? 49 ASP G N 1 ATOM 45 C CA . ASP A 1 6 ? 8.904 10.844 -32.961 1.00 145.66 ? 49 ASP G CA 1 ATOM 46 C C . ASP A 1 6 ? 8.400 12.027 -33.783 1.00 144.86 ? 49 ASP G C 1 ATOM 47 O O . ASP A 1 6 ? 8.198 13.118 -33.240 1.00 150.38 ? 49 ASP G O 1 ATOM 48 C CB . ASP A 1 6 ? 7.708 9.927 -32.669 1.00 141.71 ? 49 ASP G CB 1 ATOM 49 C CG . ASP A 1 6 ? 8.094 8.655 -31.940 1.00 135.80 ? 49 ASP G CG 1 ATOM 50 O OD1 . ASP A 1 6 ? 9.304 8.422 -31.724 1.00 137.72 ? 49 ASP G OD1 1 ATOM 51 O OD2 . ASP A 1 6 ? 7.170 7.892 -31.585 1.00 130.64 ? 49 ASP G OD2 1 ATOM 52 N N . THR A 1 7 ? 8.169 11.791 -35.078 1.00 140.74 ? 50 THR G N 1 ATOM 53 C CA . THR A 1 7 ? 7.671 12.815 -36.000 1.00 139.45 ? 50 THR G CA 1 ATOM 54 C C . THR A 1 7 ? 7.264 12.240 -37.359 1.00 136.43 ? 50 THR G C 1 ATOM 55 O O . THR A 1 7 ? 7.392 11.045 -37.610 1.00 140.97 ? 50 THR G O 1 ATOM 56 C CB . THR A 1 7 ? 8.747 13.927 -36.222 1.00 122.63 ? 50 THR G CB 1 ATOM 57 O OG1 . THR A 1 7 ? 8.147 15.059 -36.872 1.00 121.72 ? 50 THR G OG1 1 ATOM 58 C CG2 . THR A 1 7 ? 9.878 13.420 -37.092 1.00 117.87 ? 50 THR G CG2 1 ATOM 59 N N . THR A 1 8 ? 6.765 13.110 -38.231 1.00 135.20 ? 51 THR G N 1 ATOM 60 C CA . THR A 1 8 ? 6.397 12.700 -39.571 1.00 132.51 ? 51 THR G CA 1 ATOM 61 C C . THR A 1 8 ? 7.535 12.891 -40.562 1.00 130.17 ? 51 THR G C 1 ATOM 62 O O . THR A 1 8 ? 7.962 14.019 -40.820 1.00 130.57 ? 51 THR G O 1 ATOM 63 C CB . THR A 1 8 ? 5.164 13.497 -40.051 1.00 130.45 ? 51 THR G CB 1 ATOM 64 O OG1 . THR A 1 8 ? 4.054 13.212 -39.191 1.00 130.69 ? 51 THR G OG1 1 ATOM 65 C CG2 . THR A 1 8 ? 4.792 13.123 -41.471 1.00 130.54 ? 51 THR G CG2 1 ATOM 66 N N . LEU A 1 9 ? 8.022 11.771 -41.103 1.00 124.57 ? 52 LEU G N 1 ATOM 67 C CA . LEU A 1 9 ? 9.112 11.784 -42.076 1.00 118.45 ? 52 LEU G CA 1 ATOM 68 C C . LEU A 1 9 ? 8.592 11.802 -43.496 1.00 109.24 ? 52 LEU G C 1 ATOM 69 O O . LEU A 1 9 ? 7.448 11.420 -43.743 1.00 94.50 ? 52 LEU G O 1 ATOM 70 C CB . LEU A 1 9 ? 9.987 10.550 -41.898 1.00 120.24 ? 52 LEU G CB 1 ATOM 71 C CG . LEU A 1 9 ? 10.374 10.270 -40.460 1.00 114.76 ? 52 LEU G CG 1 ATOM 72 C CD1 . LEU A 1 9 ? 10.798 8.832 -40.308 1.00 110.34 ? 52 LEU G CD1 1 ATOM 73 C CD2 . LEU A 1 9 ? 11.511 11.200 -40.125 1.00 117.78 ? 52 LEU G CD2 1 ATOM 74 N N . PHE A 1 10 ? 9.433 12.247 -44.426 1.00 112.81 ? 53 PHE G N 1 ATOM 75 C CA . PHE A 1 10 ? 9.107 12.160 -45.855 1.00 115.04 ? 53 PHE G CA 1 ATOM 76 C C . PHE A 1 10 ? 10.112 11.282 -46.636 1.00 119.47 ? 53 PHE G C 1 ATOM 77 O O . PHE A 1 10 ? 11.270 11.127 -46.231 1.00 123.27 ? 53 PHE G O 1 ATOM 78 C CB . PHE A 1 10 ? 8.974 13.562 -46.444 1.00 110.72 ? 53 PHE G CB 1 ATOM 79 C CG . PHE A 1 10 ? 10.237 14.322 -46.429 1.00 116.64 ? 53 PHE G CG 1 ATOM 80 C CD1 . PHE A 1 10 ? 10.607 15.014 -45.304 1.00 116.92 ? 53 PHE G CD1 1 ATOM 81 C CD2 . PHE A 1 10 ? 11.093 14.292 -47.509 1.00 128.29 ? 53 PHE G CD2 1 ATOM 82 C CE1 . PHE A 1 10 ? 11.795 15.704 -45.278 1.00 124.96 ? 53 PHE G CE1 1 ATOM 83 C CE2 . PHE A 1 10 ? 12.279 14.973 -47.492 1.00 103.55 ? 53 PHE G CE2 1 ATOM 84 C CZ . PHE A 1 10 ? 12.632 15.685 -46.382 1.00 126.89 ? 53 PHE G CZ 1 ATOM 85 N N . CYS A 1 11 ? 9.672 10.728 -47.759 1.00 114.95 ? 54 CYS G N 1 ATOM 86 C CA . CYS A 1 11 ? 10.508 9.823 -48.543 1.00 118.31 ? 54 CYS G CA 1 ATOM 87 C C . CYS A 1 11 ? 11.176 10.512 -49.722 1.00 120.29 ? 54 CYS G C 1 ATOM 88 O O . CYS A 1 11 ? 10.692 11.528 -50.197 1.00 118.20 ? 54 CYS G O 1 ATOM 89 C CB . CYS A 1 11 ? 9.712 8.629 -49.049 1.00 117.02 ? 54 CYS G CB 1 ATOM 90 S SG . CYS A 1 11 ? 8.296 9.089 -50.031 1.00 224.64 ? 54 CYS G SG 1 ATOM 91 N N . ALA A 1 12 ? 12.321 9.989 -50.145 1.00 125.65 ? 55 ALA G N 1 ATOM 92 C CA . ALA A 1 12 ? 13.029 10.503 -51.309 1.00 129.05 ? 55 ALA G CA 1 ATOM 93 C C . ALA A 1 12 ? 13.539 9.364 -52.222 1.00 131.40 ? 55 ALA G C 1 ATOM 94 O O . ALA A 1 12 ? 13.934 8.317 -51.717 1.00 135.06 ? 55 ALA G O 1 ATOM 95 C CB . ALA A 1 12 ? 14.187 11.371 -50.857 1.00 111.08 ? 55 ALA G CB 1 ATOM 96 N N . SER A 1 13 ? 13.488 9.536 -53.552 1.00 132.15 ? 56 SER G N 1 ATOM 97 C CA . SER A 1 13 ? 13.935 8.469 -54.470 1.00 136.60 ? 56 SER G CA 1 ATOM 98 C C . SER A 1 13 ? 14.437 8.984 -55.823 1.00 136.66 ? 56 SER G C 1 ATOM 99 O O . SER A 1 13 ? 14.488 10.188 -56.040 1.00 139.61 ? 56 SER G O 1 ATOM 100 C CB . SER A 1 13 ? 12.798 7.483 -54.737 1.00 136.32 ? 56 SER G CB 1 ATOM 101 O OG . SER A 1 13 ? 11.864 8.033 -55.655 1.00 131.16 ? 56 SER G OG 1 ATOM 102 N N . ASP A 1 14 ? 14.814 8.061 -56.718 1.00 132.81 ? 57 ASP G N 1 ATOM 103 C CA . ASP A 1 14 ? 15.268 8.410 -58.069 1.00 134.45 ? 57 ASP G CA 1 ATOM 104 C C . ASP A 1 14 ? 14.263 7.931 -59.082 1.00 133.29 ? 57 ASP G C 1 ATOM 105 O O . ASP A 1 14 ? 14.618 7.608 -60.215 1.00 140.16 ? 57 ASP G O 1 ATOM 106 C CB . ASP A 1 14 ? 16.624 7.813 -58.440 1.00 144.39 ? 57 ASP G CB 1 ATOM 107 C CG . ASP A 1 14 ? 17.727 8.242 -57.521 1.00 153.16 ? 57 ASP G CG 1 ATOM 108 O OD1 . ASP A 1 14 ? 17.439 8.667 -56.383 1.00 152.43 ? 57 ASP G OD1 1 ATOM 109 O OD2 . ASP A 1 14 ? 18.893 8.183 -57.969 1.00 159.04 ? 57 ASP G OD2 1 ATOM 110 N N . ALA A 1 15 ? 13.010 7.881 -58.664 1.00 128.85 ? 58 ALA G N 1 ATOM 111 C CA . ALA A 1 15 ? 11.910 7.455 -59.518 1.00 130.92 ? 58 ALA G CA 1 ATOM 112 C C . ALA A 1 15 ? 11.687 8.410 -60.706 1.00 139.38 ? 58 ALA G C 1 ATOM 113 O O . ALA A 1 15 ? 11.753 9.633 -60.555 1.00 129.14 ? 58 ALA G O 1 ATOM 114 C CB . ALA A 1 15 ? 10.653 7.330 -58.717 1.00 129.91 ? 58 ALA G CB 1 ATOM 115 N N . LYS A 1 16 ? 11.454 7.867 -61.895 1.00 143.21 ? 59 LYS G N 1 ATOM 116 C CA . LYS A 1 16 ? 11.302 8.732 -63.043 1.00 145.45 ? 59 LYS G CA 1 ATOM 117 C C . LYS A 1 16 ? 9.866 8.719 -63.533 1.00 138.99 ? 59 LYS G C 1 ATOM 118 O O . LYS A 1 16 ? 9.192 7.700 -63.504 1.00 134.81 ? 59 LYS G O 1 ATOM 119 C CB . LYS A 1 16 ? 12.239 8.285 -64.159 1.00 159.62 ? 59 LYS G CB 1 ATOM 120 C CG . LYS A 1 16 ? 13.723 8.295 -63.796 1.00 168.70 ? 59 LYS G CG 1 ATOM 121 C CD . LYS A 1 16 ? 14.176 9.711 -63.415 1.00 173.08 ? 59 LYS G CD 1 ATOM 122 C CE . LYS A 1 16 ? 15.651 9.766 -63.031 1.00 177.27 ? 59 LYS G CE 1 ATOM 123 N NZ . LYS A 1 16 ? 15.930 10.904 -62.115 1.00 174.11 ? 59 LYS G NZ 1 ATOM 124 N N . ALA A 1 17 ? 9.394 9.898 -63.921 1.00 136.90 ? 60 ALA G N 1 ATOM 125 C CA . ALA A 1 17 ? 8.049 10.069 -64.441 1.00 137.51 ? 60 ALA G CA 1 ATOM 126 C C . ALA A 1 17 ? 7.752 9.141 -65.607 1.00 140.47 ? 60 ALA G C 1 ATOM 127 O O . ALA A 1 17 ? 6.643 8.625 -65.745 1.00 138.75 ? 60 ALA G O 1 ATOM 128 C CB . ALA A 1 17 ? 7.826 11.522 -64.856 1.00 136.74 ? 60 ALA G CB 1 ATOM 129 N N . HIS A 1 18 ? 8.761 8.892 -66.431 1.00 143.27 ? 61 HIS G N 1 ATOM 130 C CA . HIS A 1 18 ? 8.533 8.075 -67.606 1.00 153.80 ? 61 HIS G CA 1 ATOM 131 C C . HIS A 1 18 ? 8.378 6.652 -67.241 1.00 148.96 ? 61 HIS G C 1 ATOM 132 O O . HIS A 1 18 ? 7.644 5.925 -67.890 1.00 149.62 ? 61 HIS G O 1 ATOM 133 C CB . HIS A 1 18 ? 9.696 8.178 -68.602 1.00 160.75 ? 61 HIS G CB 1 ATOM 134 C CG . HIS A 1 18 ? 10.941 7.464 -68.174 1.00 161.18 ? 61 HIS G CG 1 ATOM 135 N ND1 . HIS A 1 18 ? 11.903 8.050 -67.379 1.00 161.24 ? 61 HIS G ND1 1 ATOM 136 C CD2 . HIS A 1 18 ? 11.393 6.220 -68.456 1.00 159.94 ? 61 HIS G CD2 1 ATOM 137 C CE1 . HIS A 1 18 ? 12.887 7.193 -67.177 1.00 153.64 ? 61 HIS G CE1 1 ATOM 138 N NE2 . HIS A 1 18 ? 12.600 6.073 -67.816 1.00 163.16 ? 61 HIS G NE2 1 ATOM 139 N N . GLU A 1 19 ? 8.993 6.280 -66.133 1.00 143.98 ? 62 GLU G N 1 ATOM 140 C CA . GLU A 1 19 ? 8.928 4.910 -65.717 1.00 143.74 ? 62 GLU G CA 1 ATOM 141 C C . GLU A 1 19 ? 7.555 4.601 -65.123 1.00 140.46 ? 62 GLU G C 1 ATOM 142 O O . GLU A 1 19 ? 7.066 5.301 -64.251 1.00 136.51 ? 62 GLU G O 1 ATOM 143 C CB . GLU A 1 19 ? 10.028 4.610 -64.720 1.00 142.39 ? 62 GLU G CB 1 ATOM 144 C CG . GLU A 1 19 ? 9.947 3.202 -64.296 1.00 172.62 ? 62 GLU G CG 1 ATOM 145 C CD . GLU A 1 19 ? 9.920 2.315 -65.543 1.00 172.95 ? 62 GLU G CD 1 ATOM 146 O OE1 . GLU A 1 19 ? 11.002 2.136 -66.145 1.00 176.75 ? 62 GLU G OE1 1 ATOM 147 O OE2 . GLU A 1 19 ? 8.835 1.834 -65.959 1.00 171.08 ? 62 GLU G OE2 1 ATOM 148 N N . THR A 1 20 ? 6.971 3.502 -65.571 1.00 158.66 ? 63 THR G N 1 ATOM 149 C CA . THR A 1 20 ? 5.602 3.126 -65.226 1.00 155.03 ? 63 THR G CA 1 ATOM 150 C C . THR A 1 20 ? 5.495 1.891 -64.334 1.00 157.51 ? 63 THR G C 1 ATOM 151 O O . THR A 1 20 ? 4.387 1.446 -64.018 1.00 156.29 ? 63 THR G O 1 ATOM 152 C CB . THR A 1 20 ? 4.779 2.894 -66.490 1.00 155.77 ? 63 THR G CB 1 ATOM 153 O OG1 . THR A 1 20 ? 5.232 1.692 -67.135 1.00 157.18 ? 63 THR G OG1 1 ATOM 154 C CG2 . THR A 1 20 ? 4.965 4.079 -67.431 1.00 162.88 ? 63 THR G CG2 1 ATOM 155 N N . GLU A 1 21 ? 6.644 1.331 -63.954 1.00 159.59 ? 64 GLU G N 1 ATOM 156 C CA . GLU A 1 21 ? 6.694 0.268 -62.962 1.00 139.43 ? 64 GLU G CA 1 ATOM 157 C C . GLU A 1 21 ? 6.031 0.842 -61.725 1.00 143.64 ? 64 GLU G C 1 ATOM 158 O O . GLU A 1 21 ? 6.214 2.019 -61.408 1.00 144.72 ? 64 GLU G O 1 ATOM 159 C CB . GLU A 1 21 ? 8.140 -0.165 -62.691 1.00 141.02 ? 64 GLU G CB 1 ATOM 160 C CG . GLU A 1 21 ? 8.321 -1.225 -61.607 1.00 150.22 ? 64 GLU G CG 1 ATOM 161 C CD . GLU A 1 21 ? 8.340 -0.632 -60.213 1.00 149.66 ? 64 GLU G CD 1 ATOM 162 O OE1 . GLU A 1 21 ? 9.006 0.413 -60.040 1.00 148.81 ? 64 GLU G OE1 1 ATOM 163 O OE2 . GLU A 1 21 ? 7.694 -1.202 -59.298 1.00 154.62 ? 64 GLU G OE2 1 ATOM 164 N N . CYS A 1 22 ? 5.293 0.009 -61.005 1.00 133.48 ? 65 CYS G N 1 ATOM 165 C CA . CYS A 1 22 ? 4.393 0.505 -59.974 1.00 139.89 ? 65 CYS G CA 1 ATOM 166 C C . CYS A 1 22 ? 5.054 1.254 -58.799 1.00 136.74 ? 65 CYS G C 1 ATOM 167 O O . CYS A 1 22 ? 4.562 2.308 -58.370 1.00 132.79 ? 65 CYS G O 1 ATOM 168 C CB . CYS A 1 22 ? 3.579 -0.664 -59.444 1.00 136.93 ? 65 CYS G CB 1 ATOM 169 S SG . CYS A 1 22 ? 2.207 -0.139 -58.437 1.00 220.38 ? 65 CYS G SG 1 ATOM 170 N N . HIS A 1 23 ? 6.144 0.723 -58.258 1.00 141.41 ? 66 HIS G N 1 ATOM 171 C CA . HIS A 1 23 ? 6.800 1.421 -57.162 1.00 147.14 ? 66 HIS G CA 1 ATOM 172 C C . HIS A 1 23 ? 7.306 2.770 -57.575 1.00 140.00 ? 66 HIS G C 1 ATOM 173 O O . HIS A 1 23 ? 7.147 3.751 -56.872 1.00 122.00 ? 66 HIS G O 1 ATOM 174 C CB . HIS A 1 23 ? 7.993 0.650 -56.626 1.00 155.86 ? 66 HIS G CB 1 ATOM 175 C CG . HIS A 1 23 ? 7.623 -0.580 -55.886 1.00 167.56 ? 66 HIS G CG 1 ATOM 176 N ND1 . HIS A 1 23 ? 8.549 -1.344 -55.219 1.00 174.31 ? 66 HIS G ND1 1 ATOM 177 C CD2 . HIS A 1 23 ? 6.435 -1.206 -55.736 1.00 175.08 ? 66 HIS G CD2 1 ATOM 178 C CE1 . HIS A 1 23 ? 7.945 -2.373 -54.658 1.00 178.40 ? 66 HIS G CE1 1 ATOM 179 N NE2 . HIS A 1 23 ? 6.660 -2.317 -54.962 1.00 179.76 ? 66 HIS G NE2 1 ATOM 180 N N . ASN A 1 24 ? 7.987 2.774 -58.709 1.00 146.60 ? 67 ASN G N 1 ATOM 181 C CA . ASN A 1 24 ? 8.521 3.986 -59.289 1.00 151.02 ? 67 ASN G CA 1 ATOM 182 C C . ASN A 1 24 ? 7.430 5.070 -59.411 1.00 150.55 ? 67 ASN G C 1 ATOM 183 O O . ASN A 1 24 ? 7.671 6.252 -59.125 1.00 149.25 ? 67 ASN G O 1 ATOM 184 C CB . ASN A 1 24 ? 9.162 3.638 -60.635 1.00 154.51 ? 67 ASN G CB 1 ATOM 185 C CG . ASN A 1 24 ? 10.112 4.686 -61.097 1.00 156.07 ? 67 ASN G CG 1 ATOM 186 O OD1 . ASN A 1 24 ? 9.719 5.653 -61.728 1.00 159.94 ? 67 ASN G OD1 1 ATOM 187 N ND2 . ASN A 1 24 ? 11.394 4.502 -60.777 1.00 132.93 ? 67 ASN G ND2 1 ATOM 188 N N . VAL A 1 25 ? 6.229 4.672 -59.830 1.00 124.03 ? 68 VAL G N 1 ATOM 189 C CA . VAL A 1 25 ? 5.176 5.659 -60.036 1.00 123.77 ? 68 VAL G CA 1 ATOM 190 C C . VAL A 1 25 ? 4.728 6.155 -58.653 1.00 118.87 ? 68 VAL G C 1 ATOM 191 O O . VAL A 1 25 ? 4.604 7.381 -58.397 1.00 117.32 ? 68 VAL G O 1 ATOM 192 C CB . VAL A 1 25 ? 4.007 5.105 -60.897 1.00 125.16 ? 68 VAL G CB 1 ATOM 193 C CG1 . VAL A 1 25 ? 3.286 3.943 -60.245 1.00 124.58 ? 68 VAL G CG1 1 ATOM 194 C CG2 . VAL A 1 25 ? 3.019 6.223 -61.147 1.00 158.28 ? 68 VAL G CG2 1 ATOM 195 N N . TRP A 1 26 ? 4.551 5.198 -57.738 1.00 117.58 ? 69 TRP G N 1 ATOM 196 C CA . TRP A 1 26 ? 4.184 5.552 -56.369 1.00 130.90 ? 69 TRP G CA 1 ATOM 197 C C . TRP A 1 26 ? 5.154 6.554 -55.755 1.00 127.18 ? 69 TRP G C 1 ATOM 198 O O . TRP A 1 26 ? 4.735 7.451 -55.050 1.00 110.10 ? 69 TRP G O 1 ATOM 199 C CB . TRP A 1 26 ? 4.073 4.310 -55.489 1.00 129.11 ? 69 TRP G CB 1 ATOM 200 C CG . TRP A 1 26 ? 3.831 4.639 -54.040 1.00 128.43 ? 69 TRP G CG 1 ATOM 201 C CD1 . TRP A 1 26 ? 2.631 4.682 -53.384 1.00 126.98 ? 69 TRP G CD1 1 ATOM 202 C CD2 . TRP A 1 26 ? 4.839 4.882 -53.042 1.00 121.80 ? 69 TRP G CD2 1 ATOM 203 N NE1 . TRP A 1 26 ? 2.830 4.982 -52.048 1.00 124.00 ? 69 TRP G NE1 1 ATOM 204 C CE2 . TRP A 1 26 ? 4.174 5.112 -51.817 1.00 120.83 ? 69 TRP G CE2 1 ATOM 205 C CE3 . TRP A 1 26 ? 6.237 4.953 -53.074 1.00 120.88 ? 69 TRP G CE3 1 ATOM 206 C CZ2 . TRP A 1 26 ? 4.852 5.415 -50.651 1.00 104.48 ? 69 TRP G CZ2 1 ATOM 207 C CZ3 . TRP A 1 26 ? 6.912 5.245 -51.910 1.00 113.29 ? 69 TRP G CZ3 1 ATOM 208 C CH2 . TRP A 1 26 ? 6.221 5.472 -50.716 1.00 109.47 ? 69 TRP G CH2 1 ATOM 209 N N . ALA A 1 27 ? 6.443 6.373 -56.027 1.00 125.38 ? 70 ALA G N 1 ATOM 210 C CA . ALA A 1 27 ? 7.469 7.264 -55.530 1.00 112.70 ? 70 ALA G CA 1 ATOM 211 C C . ALA A 1 27 ? 7.371 8.635 -56.198 1.00 113.24 ? 70 ALA G C 1 ATOM 212 O O . ALA A 1 27 ? 7.526 9.640 -55.511 1.00 115.35 ? 70 ALA G O 1 ATOM 213 C CB . ALA A 1 27 ? 8.853 6.660 -55.734 1.00 114.90 ? 70 ALA G CB 1 ATOM 214 N N . THR A 1 28 ? 7.171 8.711 -57.520 1.00 116.03 ? 71 THR G N 1 ATOM 215 C CA . THR A 1 28 ? 7.019 10.050 -58.123 1.00 136.84 ? 71 THR G CA 1 ATOM 216 C C . THR A 1 28 ? 5.864 10.834 -57.486 1.00 131.53 ? 71 THR G C 1 ATOM 217 O O . THR A 1 28 ? 5.888 12.072 -57.432 1.00 114.61 ? 71 THR G O 1 ATOM 218 C CB . THR A 1 28 ? 6.737 10.057 -59.668 1.00 120.59 ? 71 THR G CB 1 ATOM 219 O OG1 . THR A 1 28 ? 5.418 9.576 -59.950 1.00 120.59 ? 71 THR G OG1 1 ATOM 220 C CG2 . THR A 1 28 ? 7.813 9.315 -60.473 1.00 175.18 ? 71 THR G CG2 1 ATOM 221 N N . HIS A 1 29 ? 4.895 10.106 -56.932 1.00 128.16 ? 72 HIS G N 1 ATOM 222 C CA . HIS A 1 29 ? 3.758 10.773 -56.297 1.00 124.46 ? 72 HIS G CA 1 ATOM 223 C C . HIS A 1 29 ? 3.959 11.066 -54.819 1.00 122.72 ? 72 HIS G C 1 ATOM 224 O O . HIS A 1 29 ? 3.645 12.149 -54.351 1.00 127.90 ? 72 HIS G O 1 ATOM 225 C CB . HIS A 1 29 ? 2.504 9.928 -56.493 1.00 134.51 ? 72 HIS G CB 1 ATOM 226 C CG . HIS A 1 29 ? 1.981 9.955 -57.899 1.00 147.75 ? 72 HIS G CG 1 ATOM 227 N ND1 . HIS A 1 29 ? 1.552 8.823 -58.559 1.00 151.33 ? 72 HIS G ND1 1 ATOM 228 C CD2 . HIS A 1 29 ? 1.819 10.983 -58.771 1.00 154.88 ? 72 HIS G CD2 1 ATOM 229 C CE1 . HIS A 1 29 ? 1.149 9.153 -59.775 1.00 158.43 ? 72 HIS G CE1 1 ATOM 230 N NE2 . HIS A 1 29 ? 1.298 10.458 -59.928 1.00 158.78 ? 72 HIS G NE2 1 ATOM 231 N N . ALA A 1 30 ? 4.464 10.088 -54.085 1.00 127.95 ? 73 ALA G N 1 ATOM 232 C CA . ALA A 1 30 ? 4.596 10.169 -52.644 1.00 104.53 ? 73 ALA G CA 1 ATOM 233 C C . ALA A 1 30 ? 5.887 10.894 -52.307 1.00 131.08 ? 73 ALA G C 1 ATOM 234 O O . ALA A 1 30 ? 5.923 11.634 -51.339 1.00 133.23 ? 73 ALA G O 1 ATOM 235 C CB . ALA A 1 30 ? 4.562 8.809 -52.018 1.00 103.92 ? 73 ALA G CB 1 ATOM 236 N N . CYS A 1 31 ? 6.964 10.651 -53.057 1.00 131.13 ? 74 CYS G N 1 ATOM 237 C CA . CYS A 1 31 ? 8.292 11.129 -52.638 1.00 131.96 ? 74 CYS G CA 1 ATOM 238 C C . CYS A 1 31 ? 8.849 12.342 -53.365 1.00 108.17 ? 74 CYS G C 1 ATOM 239 O O . CYS A 1 31 ? 8.228 12.887 -54.259 1.00 140.58 ? 74 CYS G O 1 ATOM 240 C CB . CYS A 1 31 ? 9.320 10.004 -52.743 1.00 131.04 ? 74 CYS G CB 1 ATOM 241 S SG . CYS A 1 31 ? 8.779 8.497 -51.932 1.00 147.39 ? 74 CYS G SG 1 ATOM 242 N N . VAL A 1 32 ? 10.025 12.772 -52.923 1.00 117.27 ? 75 VAL G N 1 ATOM 243 C CA . VAL A 1 32 ? 10.803 13.812 -53.583 1.00 128.85 ? 75 VAL G CA 1 ATOM 244 C C . VAL A 1 32 ? 12.144 13.303 -54.102 1.00 125.74 ? 75 VAL G C 1 ATOM 245 O O . VAL A 1 32 ? 12.556 12.193 -53.769 1.00 127.18 ? 75 VAL G O 1 ATOM 246 C CB . VAL A 1 32 ? 11.065 14.991 -52.626 1.00 135.30 ? 75 VAL G CB 1 ATOM 247 C CG1 . VAL A 1 32 ? 9.767 15.653 -52.217 1.00 139.88 ? 75 VAL G CG1 1 ATOM 248 C CG2 . VAL A 1 32 ? 11.881 14.522 -51.435 1.00 129.43 ? 75 VAL G CG2 1 ATOM 249 N N . PRO A 1 33 ? 12.807 14.089 -54.968 1.00 127.52 ? 76 PRO G N 1 ATOM 250 C CA . PRO A 1 33 ? 14.118 13.648 -55.459 1.00 129.52 ? 76 PRO G CA 1 ATOM 251 C C . PRO A 1 33 ? 15.156 13.421 -54.362 1.00 135.92 ? 76 PRO G C 1 ATOM 252 O O . PRO A 1 33 ? 15.194 14.166 -53.384 1.00 139.92 ? 76 PRO G O 1 ATOM 253 C CB . PRO A 1 33 ? 14.559 14.799 -56.361 1.00 129.41 ? 76 PRO G CB 1 ATOM 254 C CG . PRO A 1 33 ? 13.288 15.440 -56.779 1.00 133.68 ? 76 PRO G CG 1 ATOM 255 C CD . PRO A 1 33 ? 12.370 15.334 -55.623 1.00 126.92 ? 76 PRO G CD 1 ATOM 256 N N . THR A 1 34 ? 15.954 12.372 -54.514 1.00 134.24 ? 77 THR G N 1 ATOM 257 C CA . THR A 1 34 ? 17.025 12.051 -53.583 1.00 129.71 ? 77 THR G CA 1 ATOM 258 C C . THR A 1 34 ? 17.995 13.238 -53.518 1.00 138.00 ? 77 THR G C 1 ATOM 259 O O . THR A 1 34 ? 18.188 13.922 -54.531 1.00 143.37 ? 77 THR G O 1 ATOM 260 C CB . THR A 1 34 ? 17.754 10.787 -54.022 1.00 136.00 ? 77 THR G CB 1 ATOM 261 O OG1 . THR A 1 34 ? 16.807 9.721 -54.149 1.00 135.06 ? 77 THR G OG1 1 ATOM 262 C CG2 . THR A 1 34 ? 18.854 10.407 -53.028 1.00 144.45 ? 77 THR G CG2 1 ATOM 263 N N . ASP A 1 35 ? 18.602 13.489 -52.356 1.00 146.02 ? 78 ASP G N 1 ATOM 264 C CA . ASP A 1 35 ? 19.543 14.606 -52.235 1.00 155.31 ? 78 ASP G CA 1 ATOM 265 C C . ASP A 1 35 ? 20.667 14.478 -53.244 1.00 162.44 ? 78 ASP G C 1 ATOM 266 O O . ASP A 1 35 ? 21.379 13.474 -53.243 1.00 165.32 ? 78 ASP G O 1 ATOM 267 C CB . ASP A 1 35 ? 20.172 14.651 -50.833 1.00 158.66 ? 78 ASP G CB 1 ATOM 268 C CG . ASP A 1 35 ? 19.342 15.419 -49.830 1.00 156.97 ? 78 ASP G CG 1 ATOM 269 O OD1 . ASP A 1 35 ? 18.556 16.292 -50.253 1.00 153.25 ? 78 ASP G OD1 1 ATOM 270 O OD2 . ASP A 1 35 ? 19.493 15.160 -48.613 1.00 157.85 ? 78 ASP G OD2 1 ATOM 271 N N . PRO A 1 36 ? 20.848 15.500 -54.095 1.00 166.37 ? 79 PRO G N 1 ATOM 272 C CA . PRO A 1 36 ? 21.939 15.404 -55.068 1.00 173.07 ? 79 PRO G CA 1 ATOM 273 C C . PRO A 1 36 ? 23.287 15.321 -54.352 1.00 180.76 ? 79 PRO G C 1 ATOM 274 O O . PRO A 1 36 ? 24.177 14.606 -54.809 1.00 188.73 ? 79 PRO G O 1 ATOM 275 C CB . PRO A 1 36 ? 21.800 16.692 -55.890 1.00 172.60 ? 79 PRO G CB 1 ATOM 276 C CG . PRO A 1 36 ? 21.003 17.620 -55.023 1.00 166.89 ? 79 PRO G CG 1 ATOM 277 C CD . PRO A 1 36 ? 20.061 16.733 -54.263 1.00 161.28 ? 79 PRO G CD 1 ATOM 278 N N . ASN A 1 37 ? 23.416 16.031 -53.230 1.00 177.40 ? 80 ASN G N 1 ATOM 279 C CA . ASN A 1 37 ? 24.654 16.041 -52.459 1.00 177.46 ? 80 ASN G CA 1 ATOM 280 C C . ASN A 1 37 ? 24.364 15.900 -50.961 1.00 171.54 ? 80 ASN G C 1 ATOM 281 O O . ASN A 1 37 ? 24.168 16.902 -50.273 1.00 167.46 ? 80 ASN G O 1 ATOM 282 C CB . ASN A 1 37 ? 25.416 17.353 -52.734 1.00 179.63 ? 80 ASN G CB 1 ATOM 283 C CG . ASN A 1 37 ? 26.910 17.149 -52.983 1.00 182.80 ? 80 ASN G CG 1 ATOM 284 O OD1 . ASN A 1 37 ? 27.320 16.224 -53.681 1.00 185.48 ? 80 ASN G OD1 1 ATOM 285 N ND2 . ASN A 1 37 ? 27.723 18.057 -52.450 1.00 183.15 ? 80 ASN G ND2 1 ATOM 286 N N . PRO A 1 38 ? 24.352 14.656 -50.451 1.00 170.25 ? 81 PRO G N 1 ATOM 287 C CA . PRO A 1 38 ? 24.119 14.327 -49.038 1.00 165.57 ? 81 PRO G CA 1 ATOM 288 C C . PRO A 1 38 ? 25.217 14.905 -48.152 1.00 174.70 ? 81 PRO G C 1 ATOM 289 O O . PRO A 1 38 ? 26.337 15.064 -48.636 1.00 180.51 ? 81 PRO G O 1 ATOM 290 C CB . PRO A 1 38 ? 24.126 12.797 -49.022 1.00 162.42 ? 81 PRO G CB 1 ATOM 291 C CG . PRO A 1 38 ? 23.819 12.402 -50.415 1.00 162.33 ? 81 PRO G CG 1 ATOM 292 C CD . PRO A 1 38 ? 24.461 13.443 -51.276 1.00 171.12 ? 81 PRO G CD 1 ATOM 293 N N . GLN A 1 39 ? 24.907 15.237 -46.902 1.00 180.63 ? 82 GLN G N 1 ATOM 294 C CA . GLN A 1 39 ? 25.918 15.717 -45.955 1.00 197.92 ? 82 GLN G CA 1 ATOM 295 C C . GLN A 1 39 ? 25.878 14.964 -44.615 1.00 224.23 ? 82 GLN G C 1 ATOM 296 O O . GLN A 1 39 ? 24.897 15.064 -43.877 1.00 220.18 ? 82 GLN G O 1 ATOM 297 C CB . GLN A 1 39 ? 25.761 17.225 -45.728 0.00 186.46 ? 82 GLN G CB 1 ATOM 298 C CG . GLN A 1 39 ? 26.241 18.092 -46.899 0.00 179.45 ? 82 GLN G CG 1 ATOM 299 C CD . GLN A 1 39 ? 27.749 18.055 -47.113 0.00 172.85 ? 82 GLN G CD 1 ATOM 300 O OE1 . GLN A 1 39 ? 28.488 17.443 -46.339 0.00 168.56 ? 82 GLN G OE1 1 ATOM 301 N NE2 . GLN A 1 39 ? 28.210 18.707 -48.178 0.00 171.63 ? 82 GLN G NE2 1 ATOM 302 N N . GLU A 1 40 ? 26.914 14.177 -44.321 1.00 253.33 ? 83 GLU G N 1 ATOM 303 C CA . GLU A 1 40 ? 26.998 13.455 -43.040 1.00 140.06 ? 83 GLU G CA 1 ATOM 304 C C . GLU A 1 40 ? 28.037 13.979 -42.029 1.00 162.39 ? 83 GLU G C 1 ATOM 305 O O . GLU A 1 40 ? 29.240 13.811 -42.233 1.00 162.97 ? 83 GLU G O 1 ATOM 306 C CB . GLU A 1 40 ? 27.314 11.980 -43.324 0.00 147.04 ? 83 GLU G CB 1 ATOM 307 C CG . GLU A 1 40 ? 27.232 11.067 -42.110 0.00 155.39 ? 83 GLU G CG 1 ATOM 308 C CD . GLU A 1 40 ? 27.749 9.660 -42.383 0.00 164.15 ? 83 GLU G CD 1 ATOM 309 O OE1 . GLU A 1 40 ? 27.879 9.281 -43.569 0.00 167.45 ? 83 GLU G OE1 1 ATOM 310 O OE2 . GLU A 1 40 ? 28.032 8.934 -41.404 0.00 167.44 ? 83 GLU G OE2 1 ATOM 311 N N . ILE A 1 41 ? 27.576 14.611 -40.946 1.00 328.11 ? 84 ILE G N 1 ATOM 312 C CA . ILE A 1 41 ? 28.481 15.106 -39.893 1.00 354.44 ? 84 ILE G CA 1 ATOM 313 C C . ILE A 1 41 ? 28.676 14.136 -38.693 1.00 241.90 ? 84 ILE G C 1 ATOM 314 O O . ILE A 1 41 ? 27.723 13.784 -37.993 1.00 234.41 ? 84 ILE G O 1 ATOM 315 C CB . ILE A 1 41 ? 28.030 16.508 -39.363 1.00 187.01 ? 84 ILE G CB 1 ATOM 316 C CG1 . ILE A 1 41 ? 26.724 16.450 -38.568 1.00 181.95 ? 84 ILE G CG1 1 ATOM 317 C CG2 . ILE A 1 41 ? 27.893 17.493 -40.519 1.00 188.01 ? 84 ILE G CG2 1 ATOM 318 C CD1 . ILE A 1 41 ? 26.352 17.760 -37.902 1.00 183.20 ? 84 ILE G CD1 1 ATOM 319 N N . HIS A 1 42 ? 29.912 13.692 -38.476 1.00 244.67 ? 85 HIS G N 1 ATOM 320 C CA . HIS A 1 42 ? 30.272 12.879 -37.306 1.00 242.46 ? 85 HIS G CA 1 ATOM 321 C C . HIS A 1 42 ? 31.022 13.730 -36.285 1.00 241.74 ? 85 HIS G C 1 ATOM 322 O O . HIS A 1 42 ? 31.973 14.409 -36.653 1.00 246.56 ? 85 HIS G O 1 ATOM 323 C CB . HIS A 1 42 ? 31.118 11.672 -37.725 1.00 252.49 ? 85 HIS G CB 1 ATOM 324 C CG . HIS A 1 42 ? 31.617 10.860 -36.571 1.00 264.05 ? 85 HIS G CG 1 ATOM 325 N ND1 . HIS A 1 42 ? 30.777 10.304 -35.630 1.00 265.01 ? 85 HIS G ND1 1 ATOM 326 C CD2 . HIS A 1 42 ? 32.874 10.508 -36.208 1.00 274.59 ? 85 HIS G CD2 1 ATOM 327 C CE1 . HIS A 1 42 ? 31.497 9.664 -34.725 1.00 271.17 ? 85 HIS G CE1 1 ATOM 328 N NE2 . HIS A 1 42 ? 32.771 9.760 -35.061 1.00 277.11 ? 85 HIS G NE2 1 ATOM 329 N N . LEU A 1 43 ? 30.602 13.672 -35.029 1.00 237.75 ? 86 LEU G N 1 ATOM 330 C CA . LEU A 1 43 ? 31.272 14.426 -33.982 1.00 243.01 ? 86 LEU G CA 1 ATOM 331 C C . LEU A 1 43 ? 31.737 13.558 -32.819 1.00 239.80 ? 86 LEU G C 1 ATOM 332 O O . LEU A 1 43 ? 30.964 12.793 -32.252 1.00 236.68 ? 86 LEU G O 1 ATOM 333 C CB . LEU A 1 43 ? 30.357 15.534 -33.472 1.00 245.04 ? 86 LEU G CB 1 ATOM 334 C CG . LEU A 1 43 ? 30.041 16.601 -34.516 1.00 246.71 ? 86 LEU G CG 1 ATOM 335 C CD1 . LEU A 1 43 ? 29.012 17.581 -33.973 1.00 245.30 ? 86 LEU G CD1 1 ATOM 336 C CD2 . LEU A 1 43 ? 31.312 17.312 -34.951 1.00 253.91 ? 86 LEU G CD2 1 ATOM 337 N N . GLU A 1 44 ? 33.003 13.707 -32.456 1.00 240.46 ? 87 GLU G N 1 ATOM 338 C CA . GLU A 1 44 ? 33.566 13.019 -31.305 1.00 238.50 ? 87 GLU G CA 1 ATOM 339 C C . GLU A 1 44 ? 32.937 13.600 -30.045 1.00 231.67 ? 87 GLU G C 1 ATOM 340 O O . GLU A 1 44 ? 32.154 14.546 -30.125 1.00 231.64 ? 87 GLU G O 1 ATOM 341 C CB . GLU A 1 44 ? 35.096 13.048 -31.349 0.00 249.23 ? 87 GLU G CB 1 ATOM 342 C CG . GLU A 1 44 ? 35.768 12.366 -30.166 0.00 255.23 ? 87 GLU G CG 1 ATOM 343 C CD . GLU A 1 44 ? 36.601 11.166 -30.573 0.00 259.82 ? 87 GLU G CD 1 ATOM 344 O OE1 . GLU A 1 44 ? 36.239 10.499 -31.565 0.00 256.23 ? 87 GLU G OE1 1 ATOM 345 O OE2 . GLU A 1 44 ? 37.617 10.890 -29.900 0.00 268.02 ? 87 GLU G OE2 1 ATOM 346 N N . ASN A 1 45 ? 33.265 13.018 -28.893 1.00 225.33 ? 88 ASN G N 1 ATOM 347 C CA . ASN A 1 45 ? 32.751 13.483 -27.605 1.00 216.73 ? 88 ASN G CA 1 ATOM 348 C C . ASN A 1 45 ? 31.269 13.291 -27.300 1.00 205.58 ? 88 ASN G C 1 ATOM 349 O O . ASN A 1 45 ? 30.747 13.882 -26.362 1.00 209.37 ? 88 ASN G O 1 ATOM 350 C CB . ASN A 1 45 ? 33.124 14.961 -27.443 1.00 217.29 ? 88 ASN G CB 1 ATOM 351 C CG . ASN A 1 45 ? 34.559 15.158 -26.995 1.00 221.92 ? 88 ASN G CG 1 ATOM 352 O OD1 . ASN A 1 45 ? 34.889 14.962 -25.826 1.00 227.58 ? 88 ASN G OD1 1 ATOM 353 N ND2 . ASN A 1 45 ? 35.420 15.553 -27.925 1.00 221.61 ? 88 ASN G ND2 1 ATOM 354 N N . VAL A 1 46 ? 30.586 12.476 -28.093 1.00 192.33 ? 89 VAL G N 1 ATOM 355 C CA . VAL A 1 46 ? 29.168 12.244 -27.854 1.00 181.44 ? 89 VAL G CA 1 ATOM 356 C C . VAL A 1 46 ? 28.796 10.765 -27.824 1.00 173.83 ? 89 VAL G C 1 ATOM 357 O O . VAL A 1 46 ? 29.417 9.942 -28.487 1.00 176.08 ? 89 VAL G O 1 ATOM 358 C CB . VAL A 1 46 ? 28.291 12.978 -28.881 1.00 174.39 ? 89 VAL G CB 1 ATOM 359 C CG1 . VAL A 1 46 ? 26.913 13.235 -28.298 1.00 168.76 ? 89 VAL G CG1 1 ATOM 360 C CG2 . VAL A 1 46 ? 28.941 14.289 -29.296 1.00 177.67 ? 89 VAL G CG2 1 ATOM 361 N N . THR A 1 47 ? 27.776 10.444 -27.037 1.00 165.43 ? 90 THR G N 1 ATOM 362 C CA . THR A 1 47 ? 27.320 9.070 -26.855 1.00 146.33 ? 90 THR G CA 1 ATOM 363 C C . THR A 1 47 ? 25.810 9.040 -26.935 1.00 178.27 ? 90 THR G C 1 ATOM 364 O O . THR A 1 47 ? 25.159 9.963 -26.437 1.00 175.79 ? 90 THR G O 1 ATOM 365 C CB . THR A 1 47 ? 27.755 8.473 -25.482 1.00 168.93 ? 90 THR G CB 1 ATOM 366 O OG1 . THR A 1 47 ? 29.180 8.319 -25.431 1.00 175.48 ? 90 THR G OG1 1 ATOM 367 C CG2 . THR A 1 47 ? 27.088 7.116 -25.233 1.00 163.01 ? 90 THR G CG2 1 ATOM 368 N N . GLU A 1 48 ? 25.233 8.039 -27.600 1.00 173.63 ? 91 GLU G N 1 ATOM 369 C CA . GLU A 1 48 ? 23.764 8.037 -27.703 1.00 165.01 ? 91 GLU G CA 1 ATOM 370 C C . GLU A 1 48 ? 23.241 6.611 -27.542 1.00 161.89 ? 91 GLU G C 1 ATOM 371 O O . GLU A 1 48 ? 23.864 5.679 -28.006 1.00 165.80 ? 91 GLU G O 1 ATOM 372 C CB . GLU A 1 48 ? 23.296 8.644 -29.029 1.00 160.63 ? 91 GLU G CB 1 ATOM 373 C CG . GLU A 1 48 ? 21.778 8.820 -29.126 1.00 157.78 ? 91 GLU G CG 1 ATOM 374 C CD . GLU A 1 48 ? 21.297 10.193 -28.682 1.00 161.27 ? 91 GLU G CD 1 ATOM 375 O OE1 . GLU A 1 48 ? 22.100 10.950 -28.091 1.00 166.57 ? 91 GLU G OE1 1 ATOM 376 O OE2 . GLU A 1 48 ? 20.107 10.505 -28.917 1.00 158.48 ? 91 GLU G OE2 1 ATOM 377 N N . ASN A 1 49 ? 22.077 6.430 -26.927 1.00 156.17 ? 92 ASN G N 1 ATOM 378 C CA . ASN A 1 49 ? 21.493 5.089 -26.879 1.00 151.22 ? 92 ASN G CA 1 ATOM 379 C C . ASN A 1 49 ? 20.556 4.769 -28.049 1.00 138.04 ? 92 ASN G C 1 ATOM 380 O O . ASN A 1 49 ? 19.684 5.564 -28.404 1.00 123.68 ? 92 ASN G O 1 ATOM 381 C CB . ASN A 1 49 ? 20.729 4.900 -25.558 1.00 155.72 ? 92 ASN G CB 1 ATOM 382 C CG . ASN A 1 49 ? 21.650 4.763 -24.360 1.00 169.69 ? 92 ASN G CG 1 ATOM 383 O OD1 . ASN A 1 49 ? 22.781 5.244 -24.375 1.00 177.97 ? 92 ASN G OD1 1 ATOM 384 N ND2 . ASN A 1 49 ? 21.162 4.116 -23.308 1.00 175.12 ? 92 ASN G ND2 1 ATOM 385 N N . PHE A 1 50 ? 20.748 3.600 -28.651 1.00 138.98 ? 93 PHE G N 1 ATOM 386 C CA . PHE A 1 50 ? 19.860 3.149 -29.704 1.00 135.91 ? 93 PHE G CA 1 ATOM 387 C C . PHE A 1 50 ? 19.092 1.886 -29.346 1.00 137.01 ? 93 PHE G C 1 ATOM 388 O O . PHE A 1 50 ? 19.625 0.996 -28.665 1.00 146.14 ? 93 PHE G O 1 ATOM 389 C CB . PHE A 1 50 ? 20.670 2.814 -30.951 1.00 139.32 ? 93 PHE G CB 1 ATOM 390 C CG . PHE A 1 50 ? 21.232 4.012 -31.638 1.00 143.34 ? 93 PHE G CG 1 ATOM 391 C CD1 . PHE A 1 50 ? 22.357 4.646 -31.136 1.00 148.01 ? 93 PHE G CD1 1 ATOM 392 C CD2 . PHE A 1 50 ? 20.636 4.510 -32.779 1.00 141.01 ? 93 PHE G CD2 1 ATOM 393 C CE1 . PHE A 1 50 ? 22.872 5.752 -31.763 1.00 149.42 ? 93 PHE G CE1 1 ATOM 394 C CE2 . PHE A 1 50 ? 21.153 5.608 -33.410 1.00 142.09 ? 93 PHE G CE2 1 ATOM 395 C CZ . PHE A 1 50 ? 22.268 6.233 -32.899 1.00 146.44 ? 93 PHE G CZ 1 ATOM 396 N N . ASN A 1 51 ? 17.854 1.792 -29.826 1.00 130.86 ? 94 ASN G N 1 ATOM 397 C CA . ASN A 1 51 ? 17.092 0.552 -29.726 1.00 127.26 ? 94 ASN G CA 1 ATOM 398 C C . ASN A 1 51 ? 16.297 0.223 -31.012 1.00 119.63 ? 94 ASN G C 1 ATOM 399 O O . ASN A 1 51 ? 15.176 0.707 -31.179 1.00 112.41 ? 94 ASN G O 1 ATOM 400 C CB . ASN A 1 51 ? 16.173 0.694 -28.520 1.00 132.18 ? 94 ASN G CB 1 ATOM 401 C CG . ASN A 1 51 ? 15.378 -0.548 -28.241 1.00 134.60 ? 94 ASN G CG 1 ATOM 402 O OD1 . ASN A 1 51 ? 15.467 -1.545 -28.961 1.00 132.24 ? 94 ASN G OD1 1 ATOM 403 N ND2 . ASN A 1 51 ? 14.578 -0.495 -27.186 1.00 140.96 ? 94 ASN G ND2 1 ATOM 404 N N . MET A 1 52 ? 16.845 -0.604 -31.899 1.00 121.72 ? 95 MET G N 1 ATOM 405 C CA . MET A 1 52 ? 16.169 -0.885 -33.170 1.00 117.88 ? 95 MET G CA 1 ATOM 406 C C . MET A 1 52 ? 14.840 -1.604 -33.020 1.00 109.30 ? 95 MET G C 1 ATOM 407 O O . MET A 1 52 ? 13.997 -1.611 -33.916 1.00 105.92 ? 95 MET G O 1 ATOM 408 C CB . MET A 1 52 ? 17.064 -1.694 -34.085 1.00 126.46 ? 95 MET G CB 1 ATOM 409 C CG . MET A 1 52 ? 17.366 -3.081 -33.640 1.00 102.76 ? 95 MET G CG 1 ATOM 410 S SD . MET A 1 52 ? 18.272 -3.760 -35.032 1.00 157.29 ? 95 MET G SD 1 ATOM 411 C CE . MET A 1 52 ? 16.895 -4.082 -36.101 1.00 168.20 ? 95 MET G CE 1 ATOM 412 N N . TRP A 1 53 ? 14.668 -2.253 -31.893 1.00 114.90 ? 96 TRP G N 1 ATOM 413 C CA . TRP A 1 53 ? 13.456 -2.998 -31.653 1.00 124.50 ? 96 TRP G CA 1 ATOM 414 C C . TRP A 1 53 ? 12.357 -2.054 -31.229 1.00 131.89 ? 96 TRP G C 1 ATOM 415 O O . TRP A 1 53 ? 11.183 -2.424 -31.218 1.00 133.25 ? 96 TRP G O 1 ATOM 416 C CB . TRP A 1 53 ? 13.753 -4.105 -30.667 1.00 130.77 ? 96 TRP G CB 1 ATOM 417 C CG . TRP A 1 53 ? 14.850 -4.901 -31.229 1.00 138.96 ? 96 TRP G CG 1 ATOM 418 C CD1 . TRP A 1 53 ? 16.151 -4.935 -30.838 1.00 146.80 ? 96 TRP G CD1 1 ATOM 419 C CD2 . TRP A 1 53 ? 14.707 -5.893 -32.237 1.00 141.94 ? 96 TRP G CD2 1 ATOM 420 N NE1 . TRP A 1 53 ? 16.852 -5.836 -31.606 1.00 147.55 ? 96 TRP G NE1 1 ATOM 421 C CE2 . TRP A 1 53 ? 15.978 -6.451 -32.461 1.00 145.64 ? 96 TRP G CE2 1 ATOM 422 C CE3 . TRP A 1 53 ? 13.625 -6.348 -32.992 1.00 146.43 ? 96 TRP G CE3 1 ATOM 423 C CZ2 . TRP A 1 53 ? 16.198 -7.442 -33.406 1.00 153.32 ? 96 TRP G CZ2 1 ATOM 424 C CZ3 . TRP A 1 53 ? 13.843 -7.325 -33.936 1.00 152.92 ? 96 TRP G CZ3 1 ATOM 425 C CH2 . TRP A 1 53 ? 15.121 -7.867 -34.135 1.00 156.49 ? 96 TRP G CH2 1 ATOM 426 N N . LYS A 1 54 ? 12.734 -0.813 -30.944 1.00 135.79 ? 97 LYS G N 1 ATOM 427 C CA . LYS A 1 54 ? 11.739 0.192 -30.618 1.00 138.44 ? 97 LYS G CA 1 ATOM 428 C C . LYS A 1 54 ? 12.073 1.493 -31.362 1.00 138.57 ? 97 LYS G C 1 ATOM 429 O O . LYS A 1 54 ? 12.377 2.530 -30.770 1.00 143.36 ? 97 LYS G O 1 ATOM 430 C CB . LYS A 1 54 ? 11.706 0.399 -29.105 0.00 143.20 ? 97 LYS G CB 1 ATOM 431 C CG . LYS A 1 54 ? 11.197 -0.799 -28.334 0.00 147.36 ? 97 LYS G CG 1 ATOM 432 C CD . LYS A 1 54 ? 11.213 -0.536 -26.837 0.00 153.57 ? 97 LYS G CD 1 ATOM 433 C CE . LYS A 1 54 ? 10.677 -1.733 -26.066 0.00 158.78 ? 97 LYS G CE 1 ATOM 434 N NZ . LYS A 1 54 ? 10.709 -1.499 -24.594 0.00 164.47 ? 97 LYS G NZ 1 ATOM 435 N N . ASN A 1 55 ? 11.997 1.407 -32.686 1.00 132.59 ? 98 ASN G N 1 ATOM 436 C CA . ASN A 1 55 ? 12.258 2.523 -33.586 1.00 125.46 ? 98 ASN G CA 1 ATOM 437 C C . ASN A 1 55 ? 11.005 2.853 -34.383 1.00 126.46 ? 98 ASN G C 1 ATOM 438 O O . ASN A 1 55 ? 10.649 2.087 -35.273 1.00 127.46 ? 98 ASN G O 1 ATOM 439 C CB . ASN A 1 55 ? 13.413 2.195 -34.520 1.00 118.80 ? 98 ASN G CB 1 ATOM 440 C CG . ASN A 1 55 ? 13.901 3.383 -35.263 1.00 116.99 ? 98 ASN G CG 1 ATOM 441 O OD1 . ASN A 1 55 ? 13.211 4.393 -35.364 1.00 113.71 ? 98 ASN G OD1 1 ATOM 442 N ND2 . ASN A 1 55 ? 15.131 3.304 -35.744 1.00 122.90 ? 98 ASN G ND2 1 ATOM 443 N N . ASN A 1 56 ? 10.353 3.978 -34.081 1.00 130.26 ? 99 ASN G N 1 ATOM 444 C CA . ASN A 1 56 ? 9.128 4.399 -34.781 1.00 132.08 ? 99 ASN G CA 1 ATOM 445 C C . ASN A 1 56 ? 9.225 4.477 -36.308 1.00 121.03 ? 99 ASN G C 1 ATOM 446 O O . ASN A 1 56 ? 8.207 4.398 -37.037 1.00 125.94 ? 99 ASN G O 1 ATOM 447 C CB . ASN A 1 56 ? 8.679 5.766 -34.265 1.00 142.52 ? 99 ASN G CB 1 ATOM 448 C CG . ASN A 1 56 ? 7.312 6.163 -34.794 1.00 148.74 ? 99 ASN G CG 1 ATOM 449 O OD1 . ASN A 1 56 ? 6.285 5.701 -34.290 1.00 152.29 ? 99 ASN G OD1 1 ATOM 450 N ND2 . ASN A 1 56 ? 7.291 6.998 -35.841 1.00 146.78 ? 99 ASN G ND2 1 ATOM 451 N N . MET A 1 57 ? 10.447 4.633 -36.800 1.00 105.11 ? 100 MET G N 1 ATOM 452 C CA . MET A 1 57 ? 10.637 4.719 -38.231 1.00 100.47 ? 100 MET G CA 1 ATOM 453 C C . MET A 1 57 ? 10.149 3.429 -38.887 1.00 104.47 ? 100 MET G C 1 ATOM 454 O O . MET A 1 57 ? 9.653 3.435 -40.017 1.00 114.10 ? 100 MET G O 1 ATOM 455 C CB . MET A 1 57 ? 12.114 4.931 -38.568 1.00 94.96 ? 100 MET G CB 1 ATOM 456 C CG . MET A 1 57 ? 12.771 6.124 -37.913 1.00 92.14 ? 100 MET G CG 1 ATOM 457 S SD . MET A 1 57 ? 14.539 6.224 -38.302 1.00 129.44 ? 100 MET G SD 1 ATOM 458 C CE . MET A 1 57 ? 14.558 6.662 -40.037 1.00 159.86 ? 100 MET G CE 1 ATOM 459 N N . VAL A 1 58 ? 10.256 2.328 -38.153 1.00 102.94 ? 101 VAL G N 1 ATOM 460 C CA . VAL A 1 58 ? 9.806 1.046 -38.649 1.00 100.22 ? 101 VAL G CA 1 ATOM 461 C C . VAL A 1 58 ? 8.310 1.080 -38.885 1.00 99.47 ? 101 VAL G C 1 ATOM 462 O O . VAL A 1 58 ? 7.805 0.542 -39.877 1.00 100.42 ? 101 VAL G O 1 ATOM 463 C CB . VAL A 1 58 ? 10.173 -0.067 -37.655 1.00 103.90 ? 101 VAL G CB 1 ATOM 464 C CG1 . VAL A 1 58 ? 9.207 -1.280 -37.774 1.00 152.35 ? 101 VAL G CG1 1 ATOM 465 C CG2 . VAL A 1 58 ? 11.590 -0.511 -37.922 1.00 105.66 ? 101 VAL G CG2 1 ATOM 466 N N . GLU A 1 59 ? 7.602 1.735 -37.973 1.00 107.19 ? 102 GLU G N 1 ATOM 467 C CA . GLU A 1 59 ? 6.162 1.803 -38.075 1.00 115.67 ? 102 GLU G CA 1 ATOM 468 C C . GLU A 1 59 ? 5.799 2.627 -39.303 1.00 114.97 ? 102 GLU G C 1 ATOM 469 O O . GLU A 1 59 ? 4.916 2.257 -40.079 1.00 115.38 ? 102 GLU G O 1 ATOM 470 C CB . GLU A 1 59 ? 5.559 2.464 -36.828 1.00 119.66 ? 102 GLU G CB 1 ATOM 471 C CG . GLU A 1 59 ? 6.197 2.093 -35.473 1.00 127.88 ? 102 GLU G CG 1 ATOM 472 C CD . GLU A 1 59 ? 5.986 0.656 -35.007 1.00 141.45 ? 102 GLU G CD 1 ATOM 473 O OE1 . GLU A 1 59 ? 4.897 0.090 -35.261 1.00 145.77 ? 102 GLU G OE1 1 ATOM 474 O OE2 . GLU A 1 59 ? 6.916 0.110 -34.356 1.00 145.71 ? 102 GLU G OE2 1 ATOM 475 N N . GLN A 1 60 ? 6.526 3.727 -39.504 1.00 118.69 ? 103 GLN G N 1 ATOM 476 C CA . GLN A 1 60 ? 6.205 4.609 -40.631 1.00 127.71 ? 103 GLN G CA 1 ATOM 477 C C . GLN A 1 60 ? 6.464 3.978 -41.996 1.00 123.19 ? 103 GLN G C 1 ATOM 478 O O . GLN A 1 60 ? 5.625 4.052 -42.923 1.00 121.86 ? 103 GLN G O 1 ATOM 479 C CB . GLN A 1 60 ? 7.003 5.917 -40.511 1.00 143.75 ? 103 GLN G CB 1 ATOM 480 C CG . GLN A 1 60 ? 6.696 6.963 -41.584 1.00 151.77 ? 103 GLN G CG 1 ATOM 481 C CD . GLN A 1 60 ? 5.928 8.167 -41.056 1.00 155.61 ? 103 GLN G CD 1 ATOM 482 O OE1 . GLN A 1 60 ? 6.048 8.545 -39.886 1.00 150.21 ? 103 GLN G OE1 1 ATOM 483 N NE2 . GLN A 1 60 ? 5.129 8.775 -41.928 1.00 161.33 ? 103 GLN G NE2 1 ATOM 484 N N . MET A 1 61 ? 7.614 3.322 -42.109 1.00 116.33 ? 104 MET G N 1 ATOM 485 C CA . MET A 1 61 ? 7.931 2.626 -43.339 1.00 107.68 ? 104 MET G CA 1 ATOM 486 C C . MET A 1 61 ? 6.875 1.559 -43.553 1.00 99.53 ? 104 MET G C 1 ATOM 487 O O . MET A 1 61 ? 6.398 1.369 -44.657 1.00 108.49 ? 104 MET G O 1 ATOM 488 C CB . MET A 1 61 ? 9.337 2.054 -43.281 1.00 85.09 ? 104 MET G CB 1 ATOM 489 C CG . MET A 1 61 ? 9.776 1.404 -44.548 1.00 86.90 ? 104 MET G CG 1 ATOM 490 S SD . MET A 1 61 ? 11.493 0.866 -44.452 1.00 140.56 ? 104 MET G SD 1 ATOM 491 C CE . MET A 1 61 ? 11.757 0.238 -46.126 1.00 120.53 ? 104 MET G CE 1 ATOM 492 N N . GLN A 1 62 ? 6.503 0.880 -42.476 1.00 94.99 ? 105 GLN G N 1 ATOM 493 C CA . GLN A 1 62 ? 5.456 -0.128 -42.535 1.00 94.76 ? 105 GLN G CA 1 ATOM 494 C C . GLN A 1 62 ? 4.187 0.453 -43.181 1.00 94.11 ? 105 GLN G C 1 ATOM 495 O O . GLN A 1 62 ? 3.594 -0.189 -44.053 1.00 100.58 ? 105 GLN G O 1 ATOM 496 C CB . GLN A 1 62 ? 5.104 -0.687 -41.159 1.00 102.55 ? 105 GLN G CB 1 ATOM 497 C CG . GLN A 1 62 ? 3.954 -1.689 -41.212 1.00 102.58 ? 105 GLN G CG 1 ATOM 498 C CD . GLN A 1 62 ? 4.373 -3.019 -41.828 1.00 103.56 ? 105 GLN G CD 1 ATOM 499 O OE1 . GLN A 1 62 ? 5.439 -3.136 -42.439 1.00 103.26 ? 105 GLN G OE1 1 ATOM 500 N NE2 . GLN A 1 62 ? 3.502 -4.017 -41.712 1.00 104.63 ? 105 GLN G NE2 1 ATOM 501 N N . GLU A 1 63 ? 3.735 1.627 -42.711 1.00 96.36 ? 106 GLU G N 1 ATOM 502 C CA . GLU A 1 63 ? 2.518 2.251 -43.266 1.00 105.30 ? 106 GLU G CA 1 ATOM 503 C C . GLU A 1 63 ? 2.674 2.579 -44.725 1.00 105.00 ? 106 GLU G C 1 ATOM 504 O O . GLU A 1 63 ? 1.704 2.496 -45.493 1.00 111.85 ? 106 GLU G O 1 ATOM 505 C CB . GLU A 1 63 ? 2.113 3.543 -42.543 1.00 121.75 ? 106 GLU G CB 1 ATOM 506 C CG . GLU A 1 63 ? 1.765 3.425 -41.061 1.00 137.82 ? 106 GLU G CG 1 ATOM 507 C CD . GLU A 1 63 ? 1.664 4.796 -40.373 1.00 146.43 ? 106 GLU G CD 1 ATOM 508 O OE1 . GLU A 1 63 ? 1.634 4.837 -39.112 1.00 148.33 ? 106 GLU G OE1 1 ATOM 509 O OE2 . GLU A 1 63 ? 1.602 5.824 -41.102 1.00 147.63 ? 106 GLU G OE2 1 ATOM 510 N N . ASP A 1 64 ? 3.894 2.912 -45.132 1.00 100.60 ? 107 ASP G N 1 ATOM 511 C CA . ASP A 1 64 ? 4.085 3.224 -46.552 1.00 96.28 ? 107 ASP G CA 1 ATOM 512 C C . ASP A 1 64 ? 3.985 2.018 -47.416 1.00 96.12 ? 107 ASP G C 1 ATOM 513 O O . ASP A 1 64 ? 3.237 2.005 -48.352 1.00 95.02 ? 107 ASP G O 1 ATOM 514 C CB . ASP A 1 64 ? 5.447 3.837 -46.810 1.00 94.31 ? 107 ASP G CB 1 ATOM 515 C CG . ASP A 1 64 ? 5.523 5.231 -46.352 1.00 107.02 ? 107 ASP G CG 1 ATOM 516 O OD1 . ASP A 1 64 ? 4.459 5.744 -45.931 1.00 109.00 ? 107 ASP G OD1 1 ATOM 517 O OD2 . ASP A 1 64 ? 6.644 5.789 -46.357 1.00 113.10 ? 107 ASP G OD2 1 ATOM 518 N N . VAL A 1 65 ? 4.707 0.984 -47.055 1.00 89.09 ? 108 VAL G N 1 ATOM 519 C CA . VAL A 1 65 ? 4.663 -0.224 -47.814 1.00 91.10 ? 108 VAL G CA 1 ATOM 520 C C . VAL A 1 65 ? 3.232 -0.793 -47.860 1.00 97.59 ? 108 VAL G C 1 ATOM 521 O O . VAL A 1 65 ? 2.799 -1.351 -48.887 1.00 94.87 ? 108 VAL G O 1 ATOM 522 C CB . VAL A 1 65 ? 5.671 -1.212 -47.252 1.00 97.43 ? 108 VAL G CB 1 ATOM 523 C CG1 . VAL A 1 65 ? 5.666 -2.502 -48.063 1.00 102.98 ? 108 VAL G CG1 1 ATOM 524 C CG2 . VAL A 1 65 ? 7.054 -0.579 -47.331 1.00 90.61 ? 108 VAL G CG2 1 ATOM 525 N N . ILE A 1 66 ? 2.457 -0.578 -46.803 1.00 101.34 ? 109 ILE G N 1 ATOM 526 C CA . ILE A 1 66 ? 1.055 -1.003 -46.839 1.00 109.05 ? 109 ILE G CA 1 ATOM 527 C C . ILE A 1 66 ? 0.243 -0.166 -47.820 1.00 108.79 ? 109 ILE G C 1 ATOM 528 O O . ILE A 1 66 ? -0.594 -0.689 -48.606 1.00 103.89 ? 109 ILE G O 1 ATOM 529 C CB . ILE A 1 66 ? 0.424 -0.898 -45.447 1.00 100.23 ? 109 ILE G CB 1 ATOM 530 C CG1 . ILE A 1 66 ? 0.969 -2.008 -44.561 1.00 99.91 ? 109 ILE G CG1 1 ATOM 531 C CG2 . ILE A 1 66 ? -1.079 -0.996 -45.532 1.00 100.03 ? 109 ILE G CG2 1 ATOM 532 C CD1 . ILE A 1 66 ? 0.367 -2.024 -43.204 1.00 106.20 ? 109 ILE G CD1 1 ATOM 533 N N . SER A 1 67 ? 0.627 1.101 -47.887 1.00 113.71 ? 110 SER G N 1 ATOM 534 C CA . SER A 1 67 ? 0.011 2.034 -48.810 1.00 115.98 ? 110 SER G CA 1 ATOM 535 C C . SER A 1 67 ? 0.368 1.652 -50.244 1.00 119.55 ? 110 SER G C 1 ATOM 536 O O . SER A 1 67 ? -0.494 1.632 -51.103 1.00 111.86 ? 110 SER G O 1 ATOM 537 C CB . SER A 1 67 ? 0.466 3.452 -48.480 1.00 115.16 ? 110 SER G CB 1 ATOM 538 O OG . SER A 1 67 ? -0.019 4.385 -49.421 1.00 127.81 ? 110 SER G OG 1 ATOM 539 N N . LEU A 1 68 ? 1.627 1.309 -50.477 1.00 123.50 ? 111 LEU G N 1 ATOM 540 C CA . LEU A 1 68 ? 2.128 0.936 -51.788 1.00 122.28 ? 111 LEU G CA 1 ATOM 541 C C . LEU A 1 68 ? 1.428 -0.301 -52.296 1.00 128.75 ? 111 LEU G C 1 ATOM 542 O O . LEU A 1 68 ? 1.025 -0.377 -53.459 1.00 143.54 ? 111 LEU G O 1 ATOM 543 C CB . LEU A 1 68 ? 3.635 0.667 -51.708 1.00 115.21 ? 111 LEU G CB 1 ATOM 544 C CG . LEU A 1 68 ? 4.500 0.342 -52.931 1.00 114.04 ? 111 LEU G CG 1 ATOM 545 C CD1 . LEU A 1 68 ? 4.822 1.515 -53.778 1.00 112.79 ? 111 LEU G CD1 1 ATOM 546 C CD2 . LEU A 1 68 ? 5.791 -0.286 -52.458 1.00 110.43 ? 111 LEU G CD2 1 ATOM 547 N N . TRP A 1 69 ? 1.244 -1.264 -51.410 1.00 120.93 ? 112 TRP G N 1 ATOM 548 C CA . TRP A 1 69 ? 0.632 -2.516 -51.822 1.00 116.50 ? 112 TRP G CA 1 ATOM 549 C C . TRP A 1 69 ? -0.865 -2.361 -52.006 1.00 118.32 ? 112 TRP G C 1 ATOM 550 O O . TRP A 1 69 ? -1.512 -3.200 -52.617 1.00 112.41 ? 112 TRP G O 1 ATOM 551 C CB . TRP A 1 69 ? 0.908 -3.618 -50.809 1.00 115.36 ? 112 TRP G CB 1 ATOM 552 C CG . TRP A 1 69 ? 2.204 -4.269 -51.043 1.00 106.53 ? 112 TRP G CG 1 ATOM 553 C CD1 . TRP A 1 69 ? 3.432 -3.665 -51.064 1.00 106.72 ? 112 TRP G CD1 1 ATOM 554 C CD2 . TRP A 1 69 ? 2.423 -5.642 -51.346 1.00 107.36 ? 112 TRP G CD2 1 ATOM 555 N NE1 . TRP A 1 69 ? 4.407 -4.595 -51.330 1.00 112.17 ? 112 TRP G NE1 1 ATOM 556 C CE2 . TRP A 1 69 ? 3.812 -5.816 -51.514 1.00 114.70 ? 112 TRP G CE2 1 ATOM 557 C CE3 . TRP A 1 69 ? 1.581 -6.742 -51.490 1.00 110.46 ? 112 TRP G CE3 1 ATOM 558 C CZ2 . TRP A 1 69 ? 4.376 -7.046 -51.813 1.00 117.97 ? 112 TRP G CZ2 1 ATOM 559 C CZ3 . TRP A 1 69 ? 2.140 -7.965 -51.788 1.00 117.17 ? 112 TRP G CZ3 1 ATOM 560 C CH2 . TRP A 1 69 ? 3.526 -8.110 -51.944 1.00 118.99 ? 112 TRP G CH2 1 ATOM 561 N N . ASP A 1 70 ? -1.423 -1.273 -51.498 1.00 134.20 ? 113 ASP G N 1 ATOM 562 C CA . ASP A 1 70 ? -2.862 -1.119 -51.628 1.00 156.26 ? 113 ASP G CA 1 ATOM 563 C C . ASP A 1 70 ? -3.344 -0.589 -52.986 1.00 168.17 ? 113 ASP G C 1 ATOM 564 O O . ASP A 1 70 ? -4.497 -0.772 -53.347 1.00 174.92 ? 113 ASP G O 1 ATOM 565 C CB . ASP A 1 70 ? -3.341 -0.164 -50.542 1.00 164.28 ? 113 ASP G CB 1 ATOM 566 C CG . ASP A 1 70 ? -4.833 -0.007 -50.524 1.00 178.89 ? 113 ASP G CG 1 ATOM 567 O OD1 . ASP A 1 70 ? -5.344 0.723 -49.649 1.00 179.39 ? 113 ASP G OD1 1 ATOM 568 O OD2 . ASP A 1 70 ? -5.497 -0.666 -51.357 1.00 189.81 ? 113 ASP G OD2 1 ATOM 569 N N . GLN A 1 71 ? -2.473 0.066 -53.734 1.00 171.92 ? 114 GLN G N 1 ATOM 570 C CA . GLN A 1 71 ? -2.828 0.655 -55.025 1.00 183.83 ? 114 GLN G CA 1 ATOM 571 C C . GLN A 1 71 ? -2.066 0.028 -56.187 1.00 191.91 ? 114 GLN G C 1 ATOM 572 O O . GLN A 1 71 ? -2.318 0.361 -57.345 1.00 205.40 ? 114 GLN G O 1 ATOM 573 C CB . GLN A 1 71 ? -2.751 2.180 -54.980 1.00 189.49 ? 114 GLN G CB 1 ATOM 574 C CG . GLN A 1 71 ? -3.765 2.843 -54.103 1.00 196.07 ? 114 GLN G CG 1 ATOM 575 C CD . GLN A 1 71 ? -3.562 4.337 -54.068 1.00 201.02 ? 114 GLN G CD 1 ATOM 576 O OE1 . GLN A 1 71 ? -2.457 4.838 -54.296 1.00 202.62 ? 114 GLN G OE1 1 ATOM 577 N NE2 . GLN A 1 71 ? -4.633 5.065 -53.802 1.00 202.70 ? 114 GLN G NE2 1 ATOM 578 N N . CYS A 1 72 ? -1.162 -0.898 -55.876 1.00 193.81 ? 115 CYS G N 1 ATOM 579 C CA . CYS A 1 72 ? -0.340 -1.556 -56.891 1.00 88.98 ? 115 CYS G CA 1 ATOM 580 C C . CYS A 1 72 ? -0.551 -3.036 -57.016 1.00 91.00 ? 115 CYS G C 1 ATOM 581 O O . CYS A 1 72 ? -0.427 -3.593 -58.091 1.00 106.44 ? 115 CYS G O 1 ATOM 582 C CB . CYS A 1 72 ? 1.119 -1.283 -56.538 1.00 93.74 ? 115 CYS G CB 1 ATOM 583 S SG . CYS A 1 72 ? 1.597 0.453 -56.592 1.00 140.50 ? 115 CYS G SG 1 ATOM 584 N N . LEU A 1 73 ? -0.901 -3.663 -55.910 1.00 196.02 ? 116 LEU G N 1 ATOM 585 C CA . LEU A 1 73 ? -1.159 -5.086 -55.880 1.00 173.27 ? 116 LEU G CA 1 ATOM 586 C C . LEU A 1 73 ? -2.604 -5.306 -55.515 1.00 163.08 ? 116 LEU G C 1 ATOM 587 O O . LEU A 1 73 ? -2.967 -6.219 -54.796 1.00 155.30 ? 116 LEU G O 1 ATOM 588 C CB . LEU A 1 73 ? -0.187 -5.818 -54.953 1.00 162.87 ? 116 LEU G CB 1 ATOM 589 C CG . LEU A 1 73 ? 1.315 -5.901 -55.248 1.00 159.92 ? 116 LEU G CG 1 ATOM 590 C CD1 . LEU A 1 73 ? 1.545 -6.352 -56.657 1.00 165.59 ? 116 LEU G CD1 1 ATOM 591 C CD2 . LEU A 1 73 ? 2.044 -4.580 -55.038 1.00 162.95 ? 116 LEU G CD2 1 ATOM 592 N N . GLN A 1 74 ? -3.422 -4.396 -56.025 1.00 166.83 ? 117 GLN G N 1 ATOM 593 C CA . GLN A 1 74 ? -4.846 -4.503 -55.847 1.00 174.42 ? 117 GLN G CA 1 ATOM 594 C C . GLN A 1 74 ? -5.224 -5.885 -56.413 1.00 178.15 ? 117 GLN G C 1 ATOM 595 O O . GLN A 1 74 ? -4.955 -6.175 -57.591 1.00 183.08 ? 117 GLN G O 1 ATOM 596 C CB . GLN A 1 74 ? -5.557 -3.382 -56.605 1.00 182.65 ? 117 GLN G CB 1 ATOM 597 C CG . GLN A 1 74 ? -6.984 -3.141 -56.287 1.00 187.70 ? 117 GLN G CG 1 ATOM 598 C CD . GLN A 1 74 ? -7.176 -2.278 -55.105 1.00 189.59 ? 117 GLN G CD 1 ATOM 599 O OE1 . GLN A 1 74 ? -6.419 -2.364 -54.144 1.00 189.79 ? 117 GLN G OE1 1 ATOM 600 N NE2 . GLN A 1 74 ? -8.190 -1.440 -55.152 1.00 189.74 ? 117 GLN G NE2 1 ATOM 601 N N . PRO A 1 75 ? -5.844 -6.739 -55.587 1.00 175.64 ? 118 PRO G N 1 ATOM 602 C CA . PRO A 1 75 ? -6.243 -8.100 -55.973 1.00 179.06 ? 118 PRO G CA 1 ATOM 603 C C . PRO A 1 75 ? -7.580 -8.209 -56.712 1.00 187.00 ? 118 PRO G C 1 ATOM 604 O O . PRO A 1 75 ? -8.358 -7.273 -56.638 1.00 193.18 ? 118 PRO G O 1 ATOM 605 C CB . PRO A 1 75 ? -6.343 -8.817 -54.632 1.00 179.83 ? 118 PRO G CB 1 ATOM 606 C CG . PRO A 1 75 ? -6.729 -7.763 -53.683 1.00 178.83 ? 118 PRO G CG 1 ATOM 607 C CD . PRO A 1 75 ? -6.045 -6.500 -54.153 1.00 176.39 ? 118 PRO G CD 1 ATOM 608 N N . CYS A 1 76 ? -7.847 -9.338 -57.378 1.00 187.79 ? 119 CYS G N 1 ATOM 609 C CA . CYS A 1 76 ? -9.123 -9.520 -58.087 1.00 189.11 ? 119 CYS G CA 1 ATOM 610 C C . CYS A 1 76 ? -10.265 -9.652 -57.110 1.00 184.40 ? 119 CYS G C 1 ATOM 611 O O . CYS A 1 76 ? -11.363 -9.137 -57.342 1.00 185.59 ? 119 CYS G O 1 ATOM 612 C CB . CYS A 1 76 ? -9.080 -10.729 -59.018 1.00 189.89 ? 119 CYS G CB 1 ATOM 613 S SG . CYS A 1 76 ? -7.811 -10.589 -60.282 1.00 287.27 ? 119 CYS G SG 1 ATOM 614 N N . VAL A 1 77 ? -10.022 -10.381 -56.032 1.00 179.83 ? 120 VAL G N 1 ATOM 615 C CA . VAL A 1 77 ? -11.053 -10.459 -55.012 1.00 178.60 ? 120 VAL G CA 1 ATOM 616 C C . VAL A 1 77 ? -10.435 -10.476 -53.594 1.00 173.99 ? 120 VAL G C 1 ATOM 617 O O . VAL A 1 77 ? -9.337 -10.997 -53.373 1.00 165.33 ? 120 VAL G O 1 ATOM 618 C CB . VAL A 1 77 ? -11.936 -11.722 -55.253 1.00 152.85 ? 120 VAL G CB 1 ATOM 619 C CG1 . VAL A 1 77 ? -12.940 -11.909 -54.152 1.00 150.71 ? 120 VAL G CG1 1 ATOM 620 C CG2 . VAL A 1 77 ? -12.628 -11.661 -56.601 1.00 161.84 ? 120 VAL G CG2 1 ATOM 621 N N . LYS A 1 78 ? -11.163 -9.914 -52.635 1.00 177.74 ? 121 LYS G N 1 ATOM 622 C CA . LYS A 1 78 ? -10.706 -9.922 -51.253 1.00 179.86 ? 121 LYS G CA 1 ATOM 623 C C . LYS A 1 78 ? -11.679 -10.634 -50.347 1.00 189.55 ? 121 LYS G C 1 ATOM 624 O O . LYS A 1 78 ? -12.864 -10.293 -50.328 1.00 188.22 ? 121 LYS G O 1 ATOM 625 C CB . LYS A 1 78 ? -10.489 -8.508 -50.703 0.00 178.08 ? 121 LYS G CB 1 ATOM 626 C CG . LYS A 1 78 ? -9.389 -7.670 -51.330 0.00 175.30 ? 121 LYS G CG 1 ATOM 627 C CD . LYS A 1 78 ? -9.514 -6.215 -50.841 0.00 176.01 ? 121 LYS G CD 1 ATOM 628 C CE . LYS A 1 78 ? -8.481 -5.274 -51.470 0.00 174.76 ? 121 LYS G CE 1 ATOM 629 N NZ . LYS A 1 78 ? -8.785 -3.821 -51.265 0.00 177.09 ? 121 LYS G NZ 1 ATOM 630 N N . LEU A 1 79 ? -11.187 -11.606 -49.586 1.00 200.18 ? 122 LEU G N 1 ATOM 631 C CA . LEU A 1 79 ? -12.031 -12.271 -48.610 1.00 210.79 ? 122 LEU G CA 1 ATOM 632 C C . LEU A 1 79 ? -11.543 -11.813 -47.239 1.00 224.64 ? 122 LEU G C 1 ATOM 633 O O . LEU A 1 79 ? -10.586 -12.370 -46.707 1.00 225.15 ? 122 LEU G O 1 ATOM 634 C CB . LEU A 1 79 ? -11.950 -13.798 -48.736 1.00 206.57 ? 122 LEU G CB 1 ATOM 635 C CG . LEU A 1 79 ? -12.432 -14.512 -50.003 1.00 200.84 ? 122 LEU G CG 1 ATOM 636 C CD1 . LEU A 1 79 ? -11.310 -15.349 -50.600 1.00 196.03 ? 122 LEU G CD1 1 ATOM 637 C CD2 . LEU A 1 79 ? -13.639 -15.387 -49.705 1.00 201.30 ? 122 LEU G CD2 1 ATOM 638 N N . THR A 1 80 ? -12.201 -10.816 -46.659 1.00 237.55 ? 123 THR G N 1 ATOM 639 C CA . THR A 1 80 ? -11.773 -10.271 -45.372 1.00 245.71 ? 123 THR G CA 1 ATOM 640 C C . THR A 1 80 ? -12.554 -10.914 -44.230 1.00 250.83 ? 123 THR G C 1 ATOM 641 O O . THR A 1 80 ? -12.627 -10.366 -43.129 1.00 254.23 ? 123 THR G O 1 ATOM 642 C CB . THR A 1 80 ? -11.922 -8.738 -45.316 1.00 248.27 ? 123 THR G CB 1 ATOM 643 O OG1 . THR A 1 80 ? -13.297 -8.381 -45.489 1.00 250.58 ? 123 THR G OG1 1 ATOM 644 C CG2 . THR A 1 80 ? -11.094 -8.084 -46.412 1.00 247.04 ? 123 THR G CG2 1 ATOM 645 N N . GLY A 1 81 ? -13.131 -12.083 -44.501 1.00 250.23 ? 124 GLY G N 1 ATOM 646 C CA . GLY A 1 81 ? -13.910 -12.828 -43.523 1.00 248.29 ? 124 GLY G CA 1 ATOM 647 C C . GLY A 1 81 ? -15.265 -12.207 -43.224 1.00 245.49 ? 124 GLY G C 1 ATOM 648 O O . GLY A 1 81 ? -16.267 -12.917 -43.117 1.00 246.67 ? 124 GLY G O 1 ATOM 649 N N . GLY A 1 82 ? -15.298 -10.885 -43.080 1.00 238.90 ? 198 GLY G N 1 ATOM 650 C CA . GLY A 1 82 ? -16.534 -10.163 -42.840 1.00 229.92 ? 198 GLY G CA 1 ATOM 651 C C . GLY A 1 82 ? -17.247 -9.838 -44.141 1.00 219.11 ? 198 GLY G C 1 ATOM 652 O O . GLY A 1 82 ? -18.459 -9.633 -44.161 1.00 221.55 ? 198 GLY G O 1 ATOM 653 N N . SER A 1 83 ? -16.483 -9.780 -45.229 1.00 207.29 ? 199 SER G N 1 ATOM 654 C CA . SER A 1 83 ? -17.028 -9.478 -46.553 1.00 196.72 ? 199 SER G CA 1 ATOM 655 C C . SER A 1 83 ? -16.180 -10.096 -47.668 1.00 182.34 ? 199 SER G C 1 ATOM 656 O O . SER A 1 83 ? -15.072 -10.572 -47.426 1.00 178.00 ? 199 SER G O 1 ATOM 657 C CB . SER A 1 83 ? -17.131 -7.966 -46.760 1.00 199.83 ? 199 SER G CB 1 ATOM 658 O OG . SER A 1 83 ? -15.855 -7.353 -46.703 1.00 199.68 ? 199 SER G OG 1 ATOM 659 N N . VAL A 1 84 ? -16.720 -10.116 -48.885 1.00 176.31 ? 200 VAL G N 1 ATOM 660 C CA . VAL A 1 84 ? -15.987 -10.615 -50.051 1.00 171.14 ? 200 VAL G CA 1 ATOM 661 C C . VAL A 1 84 ? -16.152 -9.650 -51.223 1.00 167.79 ? 200 VAL G C 1 ATOM 662 O O . VAL A 1 84 ? -17.195 -9.650 -51.876 1.00 164.76 ? 200 VAL G O 1 ATOM 663 C CB . VAL A 1 84 ? -16.482 -12.022 -50.476 1.00 189.54 ? 200 VAL G CB 1 ATOM 664 C CG1 . VAL A 1 84 ? -15.734 -12.508 -51.714 1.00 187.41 ? 200 VAL G CG1 1 ATOM 665 C CG2 . VAL A 1 84 ? -16.350 -13.023 -49.329 1.00 187.13 ? 200 VAL G CG2 1 ATOM 666 N N . ILE A 1 85 ? -15.135 -8.835 -51.503 1.00 170.56 ? 201 ILE G N 1 ATOM 667 C CA . ILE A 1 85 ? -15.303 -7.795 -52.532 1.00 177.64 ? 201 ILE G CA 1 ATOM 668 C C . ILE A 1 85 ? -14.577 -8.108 -53.857 1.00 175.93 ? 201 ILE G C 1 ATOM 669 O O . ILE A 1 85 ? -13.399 -8.484 -53.881 1.00 169.50 ? 201 ILE G O 1 ATOM 670 C CB . ILE A 1 85 ? -14.851 -6.392 -51.998 1.00 167.35 ? 201 ILE G CB 1 ATOM 671 C CG1 . ILE A 1 85 ? -15.139 -5.294 -53.032 1.00 170.34 ? 201 ILE G CG1 1 ATOM 672 C CG2 . ILE A 1 85 ? -13.382 -6.390 -51.592 1.00 143.22 ? 201 ILE G CG2 1 ATOM 673 C CD1 . ILE A 1 85 ? -16.472 -4.572 -52.842 1.00 169.77 ? 201 ILE G CD1 1 ATOM 674 N N . LYS A 1 86 ? -15.271 -7.881 -54.967 1.00 180.49 ? 202 LYS G N 1 ATOM 675 C CA . LYS A 1 86 ? -14.646 -8.064 -56.262 1.00 182.74 ? 202 LYS G CA 1 ATOM 676 C C . LYS A 1 86 ? -14.139 -6.692 -56.666 1.00 185.78 ? 202 LYS G C 1 ATOM 677 O O . LYS A 1 86 ? -14.694 -5.672 -56.249 1.00 186.51 ? 202 LYS G O 1 ATOM 678 C CB . LYS A 1 86 ? -15.641 -8.621 -57.283 1.00 184.38 ? 202 LYS G CB 1 ATOM 679 C CG . LYS A 1 86 ? -15.005 -9.218 -58.513 1.00 183.50 ? 202 LYS G CG 1 ATOM 680 C CD . LYS A 1 86 ? -14.957 -10.725 -58.431 1.00 180.38 ? 202 LYS G CD 1 ATOM 681 C CE . LYS A 1 86 ? -13.972 -11.252 -59.439 1.00 181.73 ? 202 LYS G CE 1 ATOM 682 N NZ . LYS A 1 86 ? -14.301 -10.701 -60.785 1.00 187.25 ? 202 LYS G NZ 1 ATOM 683 N N . GLN A 1 87 ? -13.065 -6.669 -57.444 1.00 185.42 ? 203 GLN G N 1 ATOM 684 C CA . GLN A 1 87 ? -12.473 -5.423 -57.909 1.00 186.73 ? 203 GLN G CA 1 ATOM 685 C C . GLN A 1 87 ? -11.466 -5.697 -59.001 1.00 187.77 ? 203 GLN G C 1 ATOM 686 O O . GLN A 1 87 ? -11.036 -6.835 -59.185 1.00 180.17 ? 203 GLN G O 1 ATOM 687 C CB . GLN A 1 87 ? -11.812 -4.661 -56.758 1.00 183.98 ? 203 GLN G CB 1 ATOM 688 C CG . GLN A 1 87 ? -10.710 -5.436 -56.088 1.00 179.58 ? 203 GLN G CG 1 ATOM 689 C CD . GLN A 1 87 ? -10.016 -4.668 -54.988 1.00 177.76 ? 203 GLN G CD 1 ATOM 690 O OE1 . GLN A 1 87 ? -10.469 -3.603 -54.572 1.00 184.44 ? 203 GLN G OE1 1 ATOM 691 N NE2 . GLN A 1 87 ? -8.910 -5.215 -54.500 1.00 168.38 ? 203 GLN G NE2 1 ATOM 692 N N . ALA A 1 88 ? -11.135 -4.656 -59.755 1.00 199.40 ? 204 ALA G N 1 ATOM 693 C CA . ALA A 1 88 ? -10.202 -4.779 -60.858 1.00 208.99 ? 204 ALA G CA 1 ATOM 694 C C . ALA A 1 88 ? -8.942 -5.492 -60.385 1.00 211.58 ? 204 ALA G C 1 ATOM 695 O O . ALA A 1 88 ? -8.519 -5.345 -59.234 1.00 201.77 ? 204 ALA G O 1 ATOM 696 C CB . ALA A 1 88 ? -9.897 -3.414 -61.444 1.00 210.95 ? 204 ALA G CB 1 ATOM 697 N N . CYS A 1 89 ? -8.360 -6.278 -61.286 1.00 220.24 ? 205 CYS G N 1 ATOM 698 C CA . CYS A 1 89 ? -7.168 -7.061 -60.989 1.00 221.11 ? 205 CYS G CA 1 ATOM 699 C C . CYS A 1 89 ? -6.135 -6.624 -62.010 1.00 226.24 ? 205 CYS G C 1 ATOM 700 O O . CYS A 1 89 ? -5.874 -7.352 -62.970 1.00 230.86 ? 205 CYS G O 1 ATOM 701 C CB . CYS A 1 89 ? -7.418 -8.563 -61.107 1.00 220.20 ? 205 CYS G CB 1 ATOM 702 S SG . CYS A 1 89 ? -9.108 -9.087 -60.755 1.00 318.91 ? 205 CYS G SG 1 ATOM 703 N N . PRO A 1 90 ? -5.563 -5.422 -61.826 1.00 222.43 ? 206 PRO G N 1 ATOM 704 C CA . PRO A 1 90 ? -4.641 -4.910 -62.838 1.00 215.06 ? 206 PRO G CA 1 ATOM 705 C C . PRO A 1 90 ? -3.395 -5.777 -62.874 1.00 200.84 ? 206 PRO G C 1 ATOM 706 O O . PRO A 1 90 ? -2.953 -6.226 -61.817 1.00 208.50 ? 206 PRO G O 1 ATOM 707 C CB . PRO A 1 90 ? -4.289 -3.512 -62.322 1.00 220.44 ? 206 PRO G CB 1 ATOM 708 C CG . PRO A 1 90 ? -5.441 -3.108 -61.470 1.00 223.75 ? 206 PRO G CG 1 ATOM 709 C CD . PRO A 1 90 ? -5.894 -4.377 -60.826 1.00 222.98 ? 206 PRO G CD 1 ATOM 710 N N . LYS A 1 91 ? -2.846 -6.022 -64.056 1.00 183.13 ? 207 LYS G N 1 ATOM 711 C CA . LYS A 1 91 ? -1.578 -6.723 -64.145 1.00 172.35 ? 207 LYS G CA 1 ATOM 712 C C . LYS A 1 91 ? -0.491 -5.918 -63.447 1.00 172.77 ? 207 LYS G C 1 ATOM 713 O O . LYS A 1 91 ? -0.383 -4.710 -63.609 1.00 162.77 ? 207 LYS G O 1 ATOM 714 C CB . LYS A 1 91 ? -1.199 -6.994 -65.595 1.00 174.24 ? 207 LYS G CB 1 ATOM 715 C CG . LYS A 1 91 ? 0.087 -7.784 -65.736 1.00 175.09 ? 207 LYS G CG 1 ATOM 716 C CD . LYS A 1 91 ? 0.223 -8.900 -64.712 1.00 172.82 ? 207 LYS G CD 1 ATOM 717 C CE . LYS A 1 91 ? 1.525 -9.643 -64.943 1.00 173.26 ? 207 LYS G CE 1 ATOM 718 N NZ . LYS A 1 91 ? 2.685 -8.688 -65.019 1.00 172.72 ? 207 LYS G NZ 1 ATOM 719 N N . ILE A 1 92 ? 0.328 -6.614 -62.681 1.00 193.92 ? 208 ILE G N 1 ATOM 720 C CA . ILE A 1 92 ? 1.314 -5.982 -61.832 1.00 209.53 ? 208 ILE G CA 1 ATOM 721 C C . ILE A 1 92 ? 2.758 -6.151 -62.306 1.00 212.09 ? 208 ILE G C 1 ATOM 722 O O . ILE A 1 92 ? 3.280 -7.261 -62.427 1.00 210.25 ? 208 ILE G O 1 ATOM 723 C CB . ILE A 1 92 ? 1.120 -6.490 -60.408 1.00 211.22 ? 208 ILE G CB 1 ATOM 724 C CG1 . ILE A 1 92 ? 1.027 -8.012 -60.427 1.00 213.61 ? 208 ILE G CG1 1 ATOM 725 C CG2 . ILE A 1 92 ? -0.228 -6.050 -59.904 1.00 212.93 ? 208 ILE G CG2 1 ATOM 726 C CD1 . ILE A 1 92 ? 0.630 -8.609 -59.113 1.00 212.28 ? 208 ILE G CD1 1 ATOM 727 N N . SER A 1 93 ? 3.401 -5.031 -62.578 1.00 212.13 ? 209 SER G N 1 ATOM 728 C CA . SER A 1 93 ? 4.814 -5.067 -62.829 1.00 135.22 ? 209 SER G CA 1 ATOM 729 C C . SER A 1 93 ? 5.443 -4.252 -61.746 1.00 158.42 ? 209 SER G C 1 ATOM 730 O O . SER A 1 93 ? 5.179 -3.062 -61.654 1.00 158.61 ? 209 SER G O 1 ATOM 731 C CB . SER A 1 93 ? 5.101 -4.390 -64.151 1.00 138.42 ? 209 SER G CB 1 ATOM 732 O OG . SER A 1 93 ? 4.374 -3.182 -64.225 1.00 149.32 ? 209 SER G OG 1 ATOM 733 N N . PHE A 1 94 ? 6.288 -4.862 -60.929 1.00 158.31 ? 210 PHE G N 1 ATOM 734 C CA . PHE A 1 94 ? 7.073 -4.067 -60.006 1.00 166.61 ? 210 PHE G CA 1 ATOM 735 C C . PHE A 1 94 ? 8.435 -4.626 -59.665 1.00 168.00 ? 210 PHE G C 1 ATOM 736 O O . PHE A 1 94 ? 8.626 -5.827 -59.531 1.00 126.31 ? 210 PHE G O 1 ATOM 737 C CB . PHE A 1 94 ? 6.281 -3.708 -58.746 1.00 173.67 ? 210 PHE G CB 1 ATOM 738 C CG . PHE A 1 94 ? 6.096 -4.843 -57.786 1.00 179.92 ? 210 PHE G CG 1 ATOM 739 C CD1 . PHE A 1 94 ? 7.180 -5.523 -57.267 1.00 182.91 ? 210 PHE G CD1 1 ATOM 740 C CD2 . PHE A 1 94 ? 4.830 -5.204 -57.375 1.00 186.72 ? 210 PHE G CD2 1 ATOM 741 C CE1 . PHE A 1 94 ? 7.005 -6.559 -56.377 1.00 186.31 ? 210 PHE G CE1 1 ATOM 742 C CE2 . PHE A 1 94 ? 4.645 -6.236 -56.483 1.00 189.93 ? 210 PHE G CE2 1 ATOM 743 C CZ . PHE A 1 94 ? 5.734 -6.917 -55.985 1.00 188.78 ? 210 PHE G CZ 1 ATOM 744 N N . ASP A 1 95 ? 9.372 -3.711 -59.509 1.00 169.54 ? 211 ASP G N 1 ATOM 745 C CA . ASP A 1 95 ? 10.656 -3.996 -58.936 1.00 168.27 ? 211 ASP G CA 1 ATOM 746 C C . ASP A 1 95 ? 10.789 -2.975 -57.838 1.00 164.80 ? 211 ASP G C 1 ATOM 747 O O . ASP A 1 95 ? 10.544 -1.790 -58.077 1.00 170.25 ? 211 ASP G O 1 ATOM 748 C CB . ASP A 1 95 ? 11.751 -3.794 -59.968 1.00 176.55 ? 211 ASP G CB 1 ATOM 749 C CG . ASP A 1 95 ? 13.105 -4.171 -59.446 1.00 183.82 ? 211 ASP G CG 1 ATOM 750 O OD1 . ASP A 1 95 ? 13.180 -4.609 -58.284 1.00 180.68 ? 211 ASP G OD1 1 ATOM 751 O OD2 . ASP A 1 95 ? 14.094 -4.032 -60.192 1.00 191.00 ? 211 ASP G OD2 1 ATOM 752 N N . PRO A 1 96 ? 11.177 -3.470 -56.585 1.00 158.57 ? 212 PRO G N 1 ATOM 753 C CA . PRO A 1 96 ? 11.314 -2.414 -55.574 1.00 158.45 ? 212 PRO G CA 1 ATOM 754 C C . PRO A 1 96 ? 12.491 -1.541 -55.950 1.00 149.37 ? 212 PRO G C 1 ATOM 755 O O . PRO A 1 96 ? 13.473 -2.055 -56.469 1.00 154.27 ? 212 PRO G O 1 ATOM 756 C CB . PRO A 1 96 ? 11.619 -3.177 -54.283 1.00 162.02 ? 212 PRO G CB 1 ATOM 757 C CG . PRO A 1 96 ? 11.083 -4.539 -54.491 1.00 161.37 ? 212 PRO G CG 1 ATOM 758 C CD . PRO A 1 96 ? 11.536 -4.793 -55.878 1.00 161.04 ? 212 PRO G CD 1 ATOM 759 N N . ILE A 1 97 ? 12.391 -0.245 -55.695 1.00 133.00 ? 213 ILE G N 1 ATOM 760 C CA . ILE A 1 97 ? 13.518 0.660 -55.880 1.00 130.79 ? 213 ILE G CA 1 ATOM 761 C C . ILE A 1 97 ? 13.943 1.232 -54.518 1.00 137.82 ? 213 ILE G C 1 ATOM 762 O O . ILE A 1 97 ? 13.104 1.373 -53.627 1.00 144.02 ? 213 ILE G O 1 ATOM 763 C CB . ILE A 1 97 ? 13.134 1.821 -56.849 1.00 146.63 ? 213 ILE G CB 1 ATOM 764 C CG1 . ILE A 1 97 ? 12.120 2.738 -56.169 1.00 125.29 ? 213 ILE G CG1 1 ATOM 765 C CG2 . ILE A 1 97 ? 12.518 1.273 -58.126 1.00 125.20 ? 213 ILE G CG2 1 ATOM 766 C CD1 . ILE A 1 97 ? 11.930 4.057 -56.809 1.00 127.62 ? 213 ILE G CD1 1 ATOM 767 N N . PRO A 1 98 ? 15.225 1.619 -54.357 1.00 145.38 ? 214 PRO G N 1 ATOM 768 C CA . PRO A 1 98 ? 15.661 2.136 -53.055 1.00 146.68 ? 214 PRO G CA 1 ATOM 769 C C . PRO A 1 98 ? 14.929 3.405 -52.667 1.00 156.27 ? 214 PRO G C 1 ATOM 770 O O . PRO A 1 98 ? 14.787 4.305 -53.494 1.00 151.17 ? 214 PRO G O 1 ATOM 771 C CB . PRO A 1 98 ? 17.162 2.376 -53.243 1.00 119.65 ? 214 PRO G CB 1 ATOM 772 C CG . PRO A 1 98 ? 17.540 1.498 -54.352 1.00 129.82 ? 214 PRO G CG 1 ATOM 773 C CD . PRO A 1 98 ? 16.360 1.463 -55.276 1.00 136.39 ? 214 PRO G CD 1 ATOM 774 N N . ILE A 1 99 ? 14.422 3.454 -51.447 1.00 162.31 ? 215 ILE G N 1 ATOM 775 C CA . ILE A 1 99 ? 13.745 4.642 -50.951 1.00 76.08 ? 215 ILE G CA 1 ATOM 776 C C . ILE A 1 99 ? 14.514 5.211 -49.754 1.00 80.78 ? 215 ILE G C 1 ATOM 777 O O . ILE A 1 99 ? 14.744 4.525 -48.749 1.00 103.51 ? 215 ILE G O 1 ATOM 778 C CB . ILE A 1 99 ? 12.305 4.348 -50.540 1.00 92.51 ? 215 ILE G CB 1 ATOM 779 C CG1 . ILE A 1 99 ? 11.523 3.754 -51.710 1.00 101.26 ? 215 ILE G CG1 1 ATOM 780 C CG2 . ILE A 1 99 ? 11.646 5.628 -50.016 1.00 91.17 ? 215 ILE G CG2 1 ATOM 781 C CD1 . ILE A 1 99 ? 11.421 4.679 -52.862 1.00 106.44 ? 215 ILE G CD1 1 ATOM 782 N N . HIS A 1 100 ? 14.789 6.499 -49.798 1.00 152.29 ? 216 HIS G N 1 ATOM 783 C CA . HIS A 1 100 ? 15.467 7.173 -48.708 1.00 135.86 ? 216 HIS G CA 1 ATOM 784 C C . HIS A 1 100 ? 14.455 7.836 -47.790 1.00 128.33 ? 216 HIS G C 1 ATOM 785 O O . HIS A 1 100 ? 13.456 8.360 -48.254 1.00 126.51 ? 216 HIS G O 1 ATOM 786 C CB . HIS A 1 100 ? 16.483 8.198 -49.236 1.00 141.58 ? 216 HIS G CB 1 ATOM 787 C CG . HIS A 1 100 ? 17.570 7.602 -50.079 1.00 144.30 ? 216 HIS G CG 1 ATOM 788 N ND1 . HIS A 1 100 ? 17.394 7.275 -51.406 1.00 143.44 ? 216 HIS G ND1 1 ATOM 789 C CD2 . HIS A 1 100 ? 18.848 7.272 -49.777 1.00 147.72 ? 216 HIS G CD2 1 ATOM 790 C CE1 . HIS A 1 100 ? 18.516 6.770 -51.886 1.00 146.45 ? 216 HIS G CE1 1 ATOM 791 N NE2 . HIS A 1 100 ? 19.415 6.758 -50.918 1.00 146.42 ? 216 HIS G NE2 1 ATOM 792 N N . TYR A 1 101 ? 14.653 7.694 -46.480 1.00 128.65 ? 217 TYR G N 1 ATOM 793 C CA . TYR A 1 101 ? 13.828 8.409 -45.507 1.00 122.99 ? 217 TYR G CA 1 ATOM 794 C C . TYR A 1 101 ? 14.543 9.591 -44.878 1.00 118.41 ? 217 TYR G C 1 ATOM 795 O O . TYR A 1 101 ? 15.686 9.516 -44.426 1.00 112.24 ? 217 TYR G O 1 ATOM 796 C CB . TYR A 1 101 ? 13.310 7.492 -44.404 1.00 119.33 ? 217 TYR G CB 1 ATOM 797 C CG . TYR A 1 101 ? 12.098 6.738 -44.844 1.00 119.99 ? 217 TYR G CG 1 ATOM 798 C CD1 . TYR A 1 101 ? 10.831 7.226 -44.558 1.00 129.07 ? 217 TYR G CD1 1 ATOM 799 C CD2 . TYR A 1 101 ? 12.202 5.525 -45.509 1.00 117.73 ? 217 TYR G CD2 1 ATOM 800 C CE1 . TYR A 1 101 ? 9.691 6.549 -44.962 1.00 131.80 ? 217 TYR G CE1 1 ATOM 801 C CE2 . TYR A 1 101 ? 11.065 4.831 -45.914 1.00 120.76 ? 217 TYR G CE2 1 ATOM 802 C CZ . TYR A 1 101 ? 9.813 5.350 -45.635 1.00 125.81 ? 217 TYR G CZ 1 ATOM 803 O OH . TYR A 1 101 ? 8.678 4.682 -46.032 1.00 122.13 ? 217 TYR G OH 1 ATOM 804 N N . CYS A 1 102 ? 13.808 10.696 -44.871 1.00 119.34 ? 218 CYS G N 1 ATOM 805 C CA . CYS A 1 102 ? 14.306 12.005 -44.496 1.00 128.89 ? 218 CYS G CA 1 ATOM 806 C C . CYS A 1 102 ? 13.414 12.704 -43.443 1.00 123.81 ? 218 CYS G C 1 ATOM 807 O O . CYS A 1 102 ? 12.209 12.406 -43.346 1.00 125.67 ? 218 CYS G O 1 ATOM 808 C CB . CYS A 1 102 ? 14.423 12.868 -45.765 1.00 139.26 ? 218 CYS G CB 1 ATOM 809 S SG . CYS A 1 102 ? 15.342 12.130 -47.169 1.00 118.19 ? 218 CYS G SG 1 ATOM 810 N N . THR A 1 103 ? 14.015 13.624 -42.672 1.00 117.44 ? 219 THR G N 1 ATOM 811 C CA . THR A 1 103 ? 13.322 14.414 -41.623 1.00 120.40 ? 219 THR G CA 1 ATOM 812 C C . THR A 1 103 ? 12.864 15.835 -42.045 1.00 129.58 ? 219 THR G C 1 ATOM 813 O O . THR A 1 103 ? 13.507 16.484 -42.870 1.00 131.37 ? 219 THR G O 1 ATOM 814 C CB . THR A 1 103 ? 14.198 14.611 -40.331 1.00 132.28 ? 219 THR G CB 1 ATOM 815 O OG1 . THR A 1 103 ? 15.533 15.027 -40.666 1.00 134.38 ? 219 THR G OG1 1 ATOM 816 C CG2 . THR A 1 103 ? 14.224 13.353 -39.495 1.00 116.28 ? 219 THR G CG2 1 ATOM 817 N N . PRO A 1 104 ? 11.740 16.306 -41.460 1.00 121.33 ? 220 PRO G N 1 ATOM 818 C CA . PRO A 1 104 ? 11.267 17.669 -41.682 1.00 125.79 ? 220 PRO G CA 1 ATOM 819 C C . PRO A 1 104 ? 12.151 18.595 -40.875 1.00 149.22 ? 220 PRO G C 1 ATOM 820 O O . PRO A 1 104 ? 13.035 18.110 -40.155 1.00 130.22 ? 220 PRO G O 1 ATOM 821 C CB . PRO A 1 104 ? 9.853 17.667 -41.090 1.00 141.53 ? 220 PRO G CB 1 ATOM 822 C CG . PRO A 1 104 ? 9.927 16.624 -40.020 1.00 130.33 ? 220 PRO G CG 1 ATOM 823 C CD . PRO A 1 104 ? 10.843 15.563 -40.548 1.00 123.75 ? 220 PRO G CD 1 ATOM 824 N N . ALA A 1 105 ? 11.923 19.900 -41.018 1.00 154.19 ? 221 ALA G N 1 ATOM 825 C CA . ALA A 1 105 ? 12.667 20.920 -40.292 1.00 141.08 ? 221 ALA G CA 1 ATOM 826 C C . ALA A 1 105 ? 12.579 20.649 -38.804 1.00 151.02 ? 221 ALA G C 1 ATOM 827 O O . ALA A 1 105 ? 11.594 20.073 -38.339 1.00 148.90 ? 221 ALA G O 1 ATOM 828 C CB . ALA A 1 105 ? 12.130 22.295 -40.609 1.00 146.41 ? 221 ALA G CB 1 ATOM 829 N N . GLY A 1 106 ? 13.600 21.065 -38.060 1.00 154.87 ? 222 GLY G N 1 ATOM 830 C CA . GLY A 1 106 ? 13.583 20.938 -36.612 1.00 159.98 ? 222 GLY G CA 1 ATOM 831 C C . GLY A 1 106 ? 13.782 19.543 -36.043 1.00 153.75 ? 222 GLY G C 1 ATOM 832 O O . GLY A 1 106 ? 13.619 19.329 -34.840 1.00 156.49 ? 222 GLY G O 1 ATOM 833 N N . TYR A 1 107 ? 14.106 18.581 -36.898 1.00 142.35 ? 223 TYR G N 1 ATOM 834 C CA . TYR A 1 107 ? 14.396 17.240 -36.421 1.00 140.03 ? 223 TYR G CA 1 ATOM 835 C C . TYR A 1 107 ? 15.692 16.851 -37.132 1.00 140.65 ? 223 TYR G C 1 ATOM 836 O O . TYR A 1 107 ? 16.235 17.660 -37.870 1.00 146.73 ? 223 TYR G O 1 ATOM 837 C CB . TYR A 1 107 ? 13.274 16.248 -36.713 1.00 140.72 ? 223 TYR G CB 1 ATOM 838 C CG . TYR A 1 107 ? 12.019 16.517 -35.903 1.00 147.24 ? 223 TYR G CG 1 ATOM 839 C CD1 . TYR A 1 107 ? 11.122 17.512 -36.306 1.00 153.24 ? 223 TYR G CD1 1 ATOM 840 C CD2 . TYR A 1 107 ? 11.722 15.788 -34.750 1.00 140.68 ? 223 TYR G CD2 1 ATOM 841 C CE1 . TYR A 1 107 ? 9.971 17.778 -35.585 1.00 154.64 ? 223 TYR G CE1 1 ATOM 842 C CE2 . TYR A 1 107 ? 10.565 16.046 -34.021 1.00 142.15 ? 223 TYR G CE2 1 ATOM 843 C CZ . TYR A 1 107 ? 9.695 17.041 -34.446 1.00 152.87 ? 223 TYR G CZ 1 ATOM 844 O OH . TYR A 1 107 ? 8.546 17.309 -33.741 1.00 160.87 ? 223 TYR G OH 1 ATOM 845 N N . VAL A 1 108 ? 16.160 15.614 -36.953 1.00 132.44 ? 224 VAL G N 1 ATOM 846 C CA . VAL A 1 108 ? 17.369 15.113 -37.647 1.00 129.52 ? 224 VAL G CA 1 ATOM 847 C C . VAL A 1 108 ? 17.604 13.668 -37.328 1.00 126.07 ? 224 VAL G C 1 ATOM 848 O O . VAL A 1 108 ? 17.091 13.161 -36.333 1.00 141.14 ? 224 VAL G O 1 ATOM 849 C CB . VAL A 1 108 ? 18.689 15.836 -37.286 1.00 135.31 ? 224 VAL G CB 1 ATOM 850 C CG1 . VAL A 1 108 ? 19.026 15.647 -35.814 1.00 165.10 ? 224 VAL G CG1 1 ATOM 851 C CG2 . VAL A 1 108 ? 19.829 15.434 -38.198 1.00 135.46 ? 224 VAL G CG2 1 ATOM 852 N N . ILE A 1 109 ? 18.378 12.995 -38.175 1.00 137.64 ? 225 ILE G N 1 ATOM 853 C CA . ILE A 1 109 ? 18.639 11.577 -37.970 1.00 121.86 ? 225 ILE G CA 1 ATOM 854 C C . ILE A 1 109 ? 20.014 11.369 -37.416 1.00 134.05 ? 225 ILE G C 1 ATOM 855 O O . ILE A 1 109 ? 20.961 12.053 -37.784 1.00 129.62 ? 225 ILE G O 1 ATOM 856 C CB . ILE A 1 109 ? 18.481 10.753 -39.268 1.00 117.85 ? 225 ILE G CB 1 ATOM 857 C CG1 . ILE A 1 109 ? 17.023 10.734 -39.680 1.00 120.34 ? 225 ILE G CG1 1 ATOM 858 C CG2 . ILE A 1 109 ? 18.830 9.304 -39.056 1.00 123.34 ? 225 ILE G CG2 1 ATOM 859 C CD1 . ILE A 1 109 ? 16.773 11.530 -40.918 1.00 131.44 ? 225 ILE G CD1 1 ATOM 860 N N . LEU A 1 110 ? 20.100 10.415 -36.502 1.00 136.06 ? 226 LEU G N 1 ATOM 861 C CA . LEU A 1 110 ? 21.368 10.055 -35.949 1.00 145.19 ? 226 LEU G CA 1 ATOM 862 C C . LEU A 1 110 ? 21.629 8.683 -36.533 1.00 141.29 ? 226 LEU G C 1 ATOM 863 O O . LEU A 1 110 ? 20.717 7.841 -36.652 1.00 130.75 ? 226 LEU G O 1 ATOM 864 C CB . LEU A 1 110 ? 21.312 10.009 -34.418 1.00 147.02 ? 226 LEU G CB 1 ATOM 865 C CG . LEU A 1 110 ? 21.074 11.309 -33.640 1.00 135.32 ? 226 LEU G CG 1 ATOM 866 C CD1 . LEU A 1 110 ? 21.082 11.031 -32.155 1.00 138.15 ? 226 LEU G CD1 1 ATOM 867 C CD2 . LEU A 1 110 ? 22.083 12.383 -33.992 1.00 149.59 ? 226 LEU G CD2 1 ATOM 868 N N . LYS A 1 111 ? 22.900 8.481 -36.861 1.00 149.00 ? 227 LYS G N 1 ATOM 869 C CA . LYS A 1 111 ? 23.396 7.301 -37.546 1.00 147.15 ? 227 LYS G CA 1 ATOM 870 C C . LYS A 1 111 ? 24.503 6.693 -36.714 1.00 148.97 ? 227 LYS G C 1 ATOM 871 O O . LYS A 1 111 ? 25.405 7.391 -36.240 1.00 142.60 ? 227 LYS G O 1 ATOM 872 C CB . LYS A 1 111 ? 23.910 7.631 -38.947 1.00 142.38 ? 227 LYS G CB 1 ATOM 873 C CG . LYS A 1 111 ? 24.396 6.408 -39.698 1.00 145.01 ? 227 LYS G CG 1 ATOM 874 C CD . LYS A 1 111 ? 24.956 6.774 -41.050 1.00 152.54 ? 227 LYS G CD 1 ATOM 875 C CE . LYS A 1 111 ? 25.430 5.543 -41.808 1.00 159.71 ? 227 LYS G CE 1 ATOM 876 N NZ . LYS A 1 111 ? 26.049 5.911 -43.118 1.00 164.49 ? 227 LYS G NZ 1 ATOM 877 N N . CYS A 1 112 ? 24.418 5.394 -36.500 1.00 153.08 ? 228 CYS G N 1 ATOM 878 C CA . CYS A 1 112 ? 25.440 4.741 -35.719 1.00 161.25 ? 228 CYS G CA 1 ATOM 879 C C . CYS A 1 112 ? 26.506 4.109 -36.634 1.00 167.36 ? 228 CYS G C 1 ATOM 880 O O . CYS A 1 112 ? 26.196 3.237 -37.457 1.00 168.90 ? 228 CYS G O 1 ATOM 881 C CB . CYS A 1 112 ? 24.823 3.713 -34.782 1.00 153.81 ? 228 CYS G CB 1 ATOM 882 S SG . CYS A 1 112 ? 26.075 2.862 -33.849 1.00 154.27 ? 228 CYS G SG 1 ATOM 883 N N . ASN A 1 113 ? 27.736 4.614 -36.553 1.00 166.88 ? 229 ASN G N 1 ATOM 884 C CA . ASN A 1 113 ? 28.805 4.141 -37.423 1.00 168.17 ? 229 ASN G CA 1 ATOM 885 C C . ASN A 1 113 ? 29.775 3.178 -36.743 1.00 173.43 ? 229 ASN G C 1 ATOM 886 O O . ASN A 1 113 ? 30.910 3.025 -37.205 1.00 182.37 ? 229 ASN G O 1 ATOM 887 C CB . ASN A 1 113 ? 29.586 5.308 -38.006 1.00 175.81 ? 229 ASN G CB 1 ATOM 888 C CG . ASN A 1 113 ? 28.696 6.306 -38.690 1.00 176.37 ? 229 ASN G CG 1 ATOM 889 O OD1 . ASN A 1 113 ? 27.764 5.933 -39.413 1.00 141.68 ? 229 ASN G OD1 1 ATOM 890 N ND2 . ASN A 1 113 ? 29.005 7.587 -38.513 1.00 179.77 ? 229 ASN G ND2 1 ATOM 891 N N . ASP A 1 114 ? 29.323 2.519 -35.668 1.00 171.07 ? 230 ASP G N 1 ATOM 892 C CA . ASP A 1 114 ? 30.095 1.433 -35.041 1.00 156.14 ? 230 ASP G CA 1 ATOM 893 C C . ASP A 1 114 ? 30.042 0.206 -35.933 1.00 206.04 ? 230 ASP G C 1 ATOM 894 O O . ASP A 1 114 ? 28.966 -0.309 -36.236 1.00 147.63 ? 230 ASP G O 1 ATOM 895 C CB . ASP A 1 114 ? 29.553 1.034 -33.649 1.00 168.44 ? 230 ASP G CB 1 ATOM 896 C CG . ASP A 1 114 ? 29.851 2.050 -32.535 1.00 172.92 ? 230 ASP G CG 1 ATOM 897 O OD1 . ASP A 1 114 ? 30.068 3.247 -32.801 1.00 161.65 ? 230 ASP G OD1 1 ATOM 898 O OD2 . ASP A 1 114 ? 29.841 1.624 -31.353 1.00 174.50 ? 230 ASP G OD2 1 ATOM 899 N N . LYS A 1 115 ? 31.210 -0.241 -36.378 1.00 211.95 ? 231 LYS G N 1 ATOM 900 C CA . LYS A 1 115 ? 31.287 -1.282 -37.389 1.00 216.21 ? 231 LYS G CA 1 ATOM 901 C C . LYS A 1 115 ? 30.725 -2.623 -36.893 1.00 225.60 ? 231 LYS G C 1 ATOM 902 O O . LYS A 1 115 ? 30.361 -3.475 -37.699 1.00 219.74 ? 231 LYS G O 1 ATOM 903 C CB . LYS A 1 115 ? 32.739 -1.452 -37.843 0.00 217.85 ? 231 LYS G CB 1 ATOM 904 C CG . LYS A 1 115 ? 33.399 -0.160 -38.328 0.00 216.86 ? 231 LYS G CG 1 ATOM 905 C CD . LYS A 1 115 ? 32.605 0.523 -39.435 0.00 208.94 ? 231 LYS G CD 1 ATOM 906 C CE . LYS A 1 115 ? 33.143 1.920 -39.709 0.00 210.65 ? 231 LYS G CE 1 ATOM 907 N NZ . LYS A 1 115 ? 34.606 1.917 -39.992 0.00 218.41 ? 231 LYS G NZ 1 ATOM 908 N N . ASN A 1 116 ? 30.592 -2.771 -35.573 1.00 239.10 ? 232 ASN G N 1 ATOM 909 C CA . ASN A 1 116 ? 30.044 -3.986 -34.955 1.00 243.07 ? 232 ASN G CA 1 ATOM 910 C C . ASN A 1 116 ? 28.905 -3.733 -33.959 1.00 234.59 ? 232 ASN G C 1 ATOM 911 O O . ASN A 1 116 ? 28.732 -4.463 -32.985 1.00 240.90 ? 232 ASN G O 1 ATOM 912 C CB . ASN A 1 116 ? 31.170 -4.756 -34.254 1.00 260.76 ? 232 ASN G CB 1 ATOM 913 C CG . ASN A 1 116 ? 30.761 -6.164 -33.866 1.00 270.95 ? 232 ASN G CG 1 ATOM 914 O OD1 . ASN A 1 116 ? 29.870 -6.751 -34.480 1.00 270.34 ? 232 ASN G OD1 1 ATOM 915 N ND2 . ASN A 1 116 ? 31.392 -6.703 -32.827 1.00 278.92 ? 232 ASN G ND2 1 ATOM 916 N N . PHE A 1 117 ? 28.131 -2.687 -34.208 1.00 211.51 ? 233 PHE G N 1 ATOM 917 C CA . PHE A 1 117 ? 26.967 -2.353 -33.392 1.00 195.63 ? 233 PHE G CA 1 ATOM 918 C C . PHE A 1 117 ? 25.876 -3.412 -33.627 1.00 191.34 ? 233 PHE G C 1 ATOM 919 O O . PHE A 1 117 ? 25.422 -3.589 -34.760 1.00 187.63 ? 233 PHE G O 1 ATOM 920 C CB . PHE A 1 117 ? 26.479 -0.942 -33.747 1.00 184.93 ? 233 PHE G CB 1 ATOM 921 C CG . PHE A 1 117 ? 25.235 -0.501 -33.016 1.00 176.50 ? 233 PHE G CG 1 ATOM 922 C CD1 . PHE A 1 117 ? 25.277 -0.245 -31.648 1.00 180.10 ? 233 PHE G CD1 1 ATOM 923 C CD2 . PHE A 1 117 ? 24.038 -0.306 -33.694 1.00 167.65 ? 233 PHE G CD2 1 ATOM 924 C CE1 . PHE A 1 117 ? 24.148 0.182 -30.964 1.00 175.92 ? 233 PHE G CE1 1 ATOM 925 C CE2 . PHE A 1 117 ? 22.902 0.117 -33.018 1.00 163.49 ? 233 PHE G CE2 1 ATOM 926 C CZ . PHE A 1 117 ? 22.959 0.356 -31.647 1.00 168.28 ? 233 PHE G CZ 1 ATOM 927 N N . ASN A 1 118 ? 25.482 -4.140 -32.575 1.00 191.76 ? 234 ASN G N 1 ATOM 928 C CA . ASN A 1 118 ? 24.553 -5.267 -32.744 1.00 182.49 ? 234 ASN G CA 1 ATOM 929 C C . ASN A 1 118 ? 23.063 -4.895 -32.748 1.00 168.84 ? 234 ASN G C 1 ATOM 930 O O . ASN A 1 118 ? 22.208 -5.760 -32.943 1.00 163.78 ? 234 ASN G O 1 ATOM 931 C CB . ASN A 1 118 ? 24.817 -6.339 -31.661 1.00 183.53 ? 234 ASN G CB 1 ATOM 932 C CG . ASN A 1 118 ? 24.626 -5.828 -30.231 1.00 176.31 ? 234 ASN G CG 1 ATOM 933 O OD1 . ASN A 1 118 ? 23.981 -4.808 -29.993 1.00 172.75 ? 234 ASN G OD1 1 ATOM 934 N ND2 . ASN A 1 118 ? 25.177 -6.564 -29.269 1.00 176.91 ? 234 ASN G ND2 1 ATOM 935 N N . GLY A 1 119 ? 22.763 -3.616 -32.528 1.00 164.18 ? 235 GLY G N 1 ATOM 936 C CA . GLY A 1 119 ? 21.399 -3.115 -32.616 1.00 157.65 ? 235 GLY G CA 1 ATOM 937 C C . GLY A 1 119 ? 20.722 -2.515 -31.393 1.00 158.10 ? 235 GLY G C 1 ATOM 938 O O . GLY A 1 119 ? 19.696 -1.842 -31.515 1.00 153.00 ? 235 GLY G O 1 ATOM 939 N N . THR A 1 120 ? 21.311 -2.723 -30.220 1.00 162.31 ? 236 THR G N 1 ATOM 940 C CA . THR A 1 120 ? 20.812 -2.141 -28.971 1.00 157.10 ? 236 THR G CA 1 ATOM 941 C C . THR A 1 120 ? 21.929 -1.646 -28.054 1.00 155.63 ? 236 THR G C 1 ATOM 942 O O . THR A 1 120 ? 22.990 -2.267 -27.983 1.00 166.76 ? 236 THR G O 1 ATOM 943 C CB . THR A 1 120 ? 19.954 -3.171 -28.189 1.00 151.18 ? 236 THR G CB 1 ATOM 944 O OG1 . THR A 1 120 ? 20.705 -4.380 -28.045 1.00 151.12 ? 236 THR G OG1 1 ATOM 945 C CG2 . THR A 1 120 ? 18.688 -3.526 -28.942 1.00 147.52 ? 236 THR G CG2 1 ATOM 946 N N . GLY A 1 121 ? 21.716 -0.521 -27.372 1.00 143.23 ? 237 GLY G N 1 ATOM 947 C CA . GLY A 1 121 ? 22.757 -0.033 -26.475 1.00 141.07 ? 237 GLY G CA 1 ATOM 948 C C . GLY A 1 121 ? 23.382 1.309 -26.780 1.00 154.79 ? 237 GLY G C 1 ATOM 949 O O . GLY A 1 121 ? 22.938 2.004 -27.683 1.00 156.07 ? 237 GLY G O 1 ATOM 950 N N . PRO A 1 122 ? 24.414 1.700 -26.018 1.00 162.13 ? 238 PRO G N 1 ATOM 951 C CA . PRO A 1 122 ? 24.993 2.997 -26.376 1.00 164.08 ? 238 PRO G CA 1 ATOM 952 C C . PRO A 1 122 ? 25.909 2.888 -27.589 1.00 160.63 ? 238 PRO G C 1 ATOM 953 O O . PRO A 1 122 ? 26.520 1.850 -27.830 1.00 160.12 ? 238 PRO G O 1 ATOM 954 C CB . PRO A 1 122 ? 25.789 3.380 -25.125 1.00 177.53 ? 238 PRO G CB 1 ATOM 955 C CG . PRO A 1 122 ? 26.159 2.064 -24.500 1.00 180.88 ? 238 PRO G CG 1 ATOM 956 C CD . PRO A 1 122 ? 25.010 1.129 -24.797 1.00 171.99 ? 238 PRO G CD 1 ATOM 957 N N . CYS A 1 123 ? 25.982 3.956 -28.364 1.00 153.29 ? 239 CYS G N 1 ATOM 958 C CA . CYS A 1 123 ? 26.866 3.994 -29.494 1.00 174.96 ? 239 CYS G CA 1 ATOM 959 C C . CYS A 1 123 ? 27.867 5.116 -29.225 1.00 174.25 ? 239 CYS G C 1 ATOM 960 O O . CYS A 1 123 ? 27.501 6.195 -28.690 1.00 173.35 ? 239 CYS G O 1 ATOM 961 C CB . CYS A 1 123 ? 26.060 4.189 -30.783 1.00 174.41 ? 239 CYS G CB 1 ATOM 962 S SG . CYS A 1 123 ? 26.934 4.009 -32.377 1.00 237.63 ? 239 CYS G SG 1 ATOM 963 N N . LYS A 1 124 ? 29.112 4.821 -29.602 1.00 178.68 ? 240 LYS G N 1 ATOM 964 C CA . LYS A 1 124 ? 30.301 5.659 -29.440 1.00 173.78 ? 240 LYS G CA 1 ATOM 965 C C . LYS A 1 124 ? 30.514 6.568 -30.660 1.00 225.73 ? 240 LYS G C 1 ATOM 966 O O . LYS A 1 124 ? 30.684 7.786 -30.529 1.00 175.94 ? 240 LYS G O 1 ATOM 967 C CB . LYS A 1 124 ? 31.516 4.755 -29.216 0.00 180.02 ? 240 LYS G CB 1 ATOM 968 C CG . LYS A 1 124 ? 31.365 3.831 -28.005 0.00 181.70 ? 240 LYS G CG 1 ATOM 969 C CD . LYS A 1 124 ? 32.686 3.509 -27.317 0.00 191.20 ? 240 LYS G CD 1 ATOM 970 C CE . LYS A 1 124 ? 33.131 4.606 -26.372 0.00 197.97 ? 240 LYS G CE 1 ATOM 971 N NZ . LYS A 1 124 ? 34.360 4.253 -25.599 0.00 207.83 ? 240 LYS G NZ 1 ATOM 972 N N . ASN A 1 125 ? 30.567 5.938 -31.839 1.00 217.63 ? 241 ASN G N 1 ATOM 973 C CA . ASN A 1 125 ? 30.746 6.613 -33.133 1.00 208.48 ? 241 ASN G CA 1 ATOM 974 C C . ASN A 1 125 ? 29.388 7.041 -33.679 1.00 197.01 ? 241 ASN G C 1 ATOM 975 O O . ASN A 1 125 ? 28.743 6.300 -34.421 1.00 191.14 ? 241 ASN G O 1 ATOM 976 C CB . ASN A 1 125 ? 31.452 5.647 -34.105 1.00 203.09 ? 241 ASN G CB 1 ATOM 977 C CG . ASN A 1 125 ? 31.881 6.289 -35.409 1.00 196.88 ? 241 ASN G CG 1 ATOM 978 O OD1 . ASN A 1 125 ? 31.251 7.218 -35.896 1.00 194.13 ? 241 ASN G OD1 1 ATOM 979 N ND2 . ASN A 1 125 ? 32.939 5.757 -36.004 1.00 196.78 ? 241 ASN G ND2 1 ATOM 980 N N . VAL A 1 126 ? 29.024 8.292 -33.436 1.00 194.31 ? 242 VAL G N 1 ATOM 981 C CA . VAL A 1 126 ? 27.721 8.784 -33.854 1.00 187.37 ? 242 VAL G CA 1 ATOM 982 C C . VAL A 1 126 ? 27.816 9.864 -34.918 1.00 188.90 ? 242 VAL G C 1 ATOM 983 O O . VAL A 1 126 ? 28.728 10.684 -34.888 1.00 198.91 ? 242 VAL G O 1 ATOM 984 C CB . VAL A 1 126 ? 26.933 9.349 -32.637 1.00 212.78 ? 242 VAL G CB 1 ATOM 985 C CG1 . VAL A 1 126 ? 25.487 9.646 -33.013 1.00 206.73 ? 242 VAL G CG1 1 ATOM 986 C CG2 . VAL A 1 126 ? 26.987 8.381 -31.459 1.00 214.06 ? 242 VAL G CG2 1 ATOM 987 N N . SER A 1 127 ? 26.909 9.853 -35.887 1.00 178.05 ? 243 SER G N 1 ATOM 988 C CA . SER A 1 127 ? 26.934 10.920 -36.872 1.00 169.28 ? 243 SER G CA 1 ATOM 989 C C . SER A 1 127 ? 25.519 11.435 -37.111 1.00 162.36 ? 243 SER G C 1 ATOM 990 O O . SER A 1 127 ? 24.544 10.840 -36.646 1.00 159.79 ? 243 SER G O 1 ATOM 991 C CB . SER A 1 127 ? 27.566 10.434 -38.178 1.00 163.79 ? 243 SER G CB 1 ATOM 992 O OG . SER A 1 127 ? 26.835 9.352 -38.731 1.00 156.04 ? 243 SER G OG 1 ATOM 993 N N . SER A 1 128 ? 25.406 12.529 -37.857 1.00 163.60 ? 244 SER G N 1 ATOM 994 C CA . SER A 1 128 ? 24.104 13.130 -38.114 1.00 163.25 ? 244 SER G CA 1 ATOM 995 C C . SER A 1 128 ? 23.812 13.177 -39.612 1.00 164.10 ? 244 SER G C 1 ATOM 996 O O . SER A 1 128 ? 24.614 13.697 -40.393 1.00 170.69 ? 244 SER G O 1 ATOM 997 C CB . SER A 1 128 ? 24.027 14.527 -37.496 1.00 166.70 ? 244 SER G CB 1 ATOM 998 O OG . SER A 1 128 ? 22.689 14.989 -37.446 1.00 166.55 ? 244 SER G OG 1 ATOM 999 N N . VAL A 1 129 ? 22.651 12.674 -40.012 1.00 155.31 ? 245 VAL G N 1 ATOM 1000 C CA . VAL A 1 129 ? 22.269 12.722 -41.413 1.00 153.35 ? 245 VAL G CA 1 ATOM 1001 C C . VAL A 1 129 ? 20.850 13.229 -41.572 1.00 152.86 ? 245 VAL G C 1 ATOM 1002 O O . VAL A 1 129 ? 20.039 13.177 -40.630 1.00 146.10 ? 245 VAL G O 1 ATOM 1003 C CB . VAL A 1 129 ? 22.371 11.325 -42.084 1.00 138.29 ? 245 VAL G CB 1 ATOM 1004 C CG1 . VAL A 1 129 ? 23.751 10.734 -41.928 1.00 141.46 ? 245 VAL G CG1 1 ATOM 1005 C CG2 . VAL A 1 129 ? 21.306 10.378 -41.536 1.00 135.07 ? 245 VAL G CG2 1 ATOM 1006 N N . GLN A 1 130 ? 20.567 13.771 -42.753 1.00 156.40 ? 246 GLN G N 1 ATOM 1007 C CA . GLN A 1 130 ? 19.237 14.268 -43.010 1.00 157.65 ? 246 GLN G CA 1 ATOM 1008 C C . GLN A 1 130 ? 18.375 13.188 -43.659 1.00 153.54 ? 246 GLN G C 1 ATOM 1009 O O . GLN A 1 130 ? 17.154 13.299 -43.677 1.00 151.46 ? 246 GLN G O 1 ATOM 1010 C CB . GLN A 1 130 ? 19.327 15.502 -43.902 1.00 164.56 ? 246 GLN G CB 1 ATOM 1011 C CG . GLN A 1 130 ? 18.095 16.361 -43.927 1.00 169.56 ? 246 GLN G CG 1 ATOM 1012 C CD . GLN A 1 130 ? 18.446 17.811 -44.151 1.00 180.73 ? 246 GLN G CD 1 ATOM 1013 O OE1 . GLN A 1 130 ? 19.408 18.317 -43.576 1.00 185.83 ? 246 GLN G OE1 1 ATOM 1014 N NE2 . GLN A 1 130 ? 17.679 18.487 -44.999 1.00 185.76 ? 246 GLN G NE2 1 ATOM 1015 N N . CYS A 1 131 ? 19.013 12.109 -44.116 1.00 151.45 ? 247 CYS G N 1 ATOM 1016 C CA . CYS A 1 131 ? 18.325 11.009 -44.806 1.00 145.20 ? 247 CYS G CA 1 ATOM 1017 C C . CYS A 1 131 ? 19.073 9.689 -44.643 1.00 143.56 ? 247 CYS G C 1 ATOM 1018 O O . CYS A 1 131 ? 20.299 9.660 -44.685 1.00 148.47 ? 247 CYS G O 1 ATOM 1019 C CB . CYS A 1 131 ? 18.141 11.284 -46.312 1.00 146.54 ? 247 CYS G CB 1 ATOM 1020 S SG . CYS A 1 131 ? 17.256 12.798 -46.858 1.00 165.89 ? 247 CYS G SG 1 ATOM 1021 N N . THR A 1 132 ? 18.325 8.596 -44.521 1.00 141.73 ? 248 THR G N 1 ATOM 1022 C CA . THR A 1 132 ? 18.869 7.227 -44.555 1.00 140.97 ? 248 THR G CA 1 ATOM 1023 C C . THR A 1 132 ? 19.533 6.877 -45.891 1.00 138.67 ? 248 THR G C 1 ATOM 1024 O O . THR A 1 132 ? 19.459 7.660 -46.848 1.00 129.67 ? 248 THR G O 1 ATOM 1025 C CB . THR A 1 132 ? 17.782 6.184 -44.253 1.00 142.48 ? 248 THR G CB 1 ATOM 1026 O OG1 . THR A 1 132 ? 16.718 6.298 -45.206 1.00 101.50 ? 248 THR G OG1 1 ATOM 1027 C CG2 . THR A 1 132 ? 17.231 6.407 -42.860 1.00 146.63 ? 248 THR G CG2 1 ATOM 1028 N N . HIS A 1 133 ? 20.241 5.744 -45.938 1.00 138.09 ? 249 HIS G N 1 ATOM 1029 C CA . HIS A 1 133 ? 20.700 5.200 -47.220 1.00 138.10 ? 249 HIS G CA 1 ATOM 1030 C C . HIS A 1 133 ? 19.508 4.665 -48.026 1.00 129.27 ? 249 HIS G C 1 ATOM 1031 O O . HIS A 1 133 ? 18.414 4.516 -47.480 1.00 118.53 ? 249 HIS G O 1 ATOM 1032 C CB . HIS A 1 133 ? 21.738 4.097 -47.007 1.00 139.32 ? 249 HIS G CB 1 ATOM 1033 C CG . HIS A 1 133 ? 21.168 2.839 -46.434 1.00 138.51 ? 249 HIS G CG 1 ATOM 1034 N ND1 . HIS A 1 133 ? 21.104 2.602 -45.078 1.00 137.69 ? 249 HIS G ND1 1 ATOM 1035 C CD2 . HIS A 1 133 ? 20.625 1.753 -47.033 1.00 134.39 ? 249 HIS G CD2 1 ATOM 1036 C CE1 . HIS A 1 133 ? 20.554 1.421 -44.866 1.00 130.42 ? 249 HIS G CE1 1 ATOM 1037 N NE2 . HIS A 1 133 ? 20.254 0.885 -46.035 1.00 128.22 ? 249 HIS G NE2 1 ATOM 1038 N N . GLY A 1 134 ? 19.718 4.358 -49.307 1.00 133.59 ? 250 GLY G N 1 ATOM 1039 C CA . GLY A 1 134 ? 18.639 3.844 -50.138 1.00 128.31 ? 250 GLY G CA 1 ATOM 1040 C C . GLY A 1 134 ? 18.252 2.436 -49.739 1.00 124.13 ? 250 GLY G C 1 ATOM 1041 O O . GLY A 1 134 ? 19.058 1.512 -49.810 1.00 127.43 ? 250 GLY G O 1 ATOM 1042 N N . ILE A 1 135 ? 17.000 2.271 -49.336 1.00 119.82 ? 251 ILE G N 1 ATOM 1043 C CA . ILE A 1 135 ? 16.506 0.979 -48.889 1.00 119.52 ? 251 ILE G CA 1 ATOM 1044 C C . ILE A 1 135 ? 15.416 0.382 -49.754 1.00 114.11 ? 251 ILE G C 1 ATOM 1045 O O . ILE A 1 135 ? 14.411 1.025 -50.021 1.00 117.64 ? 251 ILE G O 1 ATOM 1046 C CB . ILE A 1 135 ? 15.977 1.086 -47.451 1.00 126.57 ? 251 ILE G CB 1 ATOM 1047 C CG1 . ILE A 1 135 ? 17.099 1.572 -46.531 1.00 131.15 ? 251 ILE G CG1 1 ATOM 1048 C CG2 . ILE A 1 135 ? 15.466 -0.260 -46.967 1.00 130.64 ? 251 ILE G CG2 1 ATOM 1049 C CD1 . ILE A 1 135 ? 16.674 1.816 -45.105 1.00 128.56 ? 251 ILE G CD1 1 ATOM 1050 N N . LYS A 1 136 ? 15.584 -0.867 -50.160 1.00 112.69 ? 252 LYS G N 1 ATOM 1051 C CA . LYS A 1 136 ? 14.587 -1.483 -51.014 1.00 111.45 ? 252 LYS G CA 1 ATOM 1052 C C . LYS A 1 136 ? 13.603 -2.184 -50.082 1.00 111.06 ? 252 LYS G C 1 ATOM 1053 O O . LYS A 1 136 ? 14.003 -2.957 -49.209 1.00 114.80 ? 252 LYS G O 1 ATOM 1054 C CB . LYS A 1 136 ? 15.221 -2.447 -52.030 1.00 112.52 ? 252 LYS G CB 1 ATOM 1055 C CG . LYS A 1 136 ? 16.123 -1.743 -53.045 1.00 121.67 ? 252 LYS G CG 1 ATOM 1056 C CD . LYS A 1 136 ? 17.283 -2.615 -53.555 1.00 129.61 ? 252 LYS G CD 1 ATOM 1057 C CE . LYS A 1 136 ? 16.835 -3.817 -54.406 1.00 127.65 ? 252 LYS G CE 1 ATOM 1058 N NZ . LYS A 1 136 ? 16.499 -3.451 -55.820 1.00 121.52 ? 252 LYS G NZ 1 ATOM 1059 N N . PRO A 1 137 ? 12.304 -1.920 -50.275 1.00 103.14 ? 253 PRO G N 1 ATOM 1060 C CA . PRO A 1 137 ? 11.220 -2.478 -49.460 1.00 91.00 ? 253 PRO G CA 1 ATOM 1061 C C . PRO A 1 137 ? 10.857 -3.902 -49.878 1.00 89.48 ? 253 PRO G C 1 ATOM 1062 O O . PRO A 1 137 ? 9.767 -4.150 -50.387 1.00 88.59 ? 253 PRO G O 1 ATOM 1063 C CB . PRO A 1 137 ? 10.056 -1.527 -49.734 1.00 86.57 ? 253 PRO G CB 1 ATOM 1064 C CG . PRO A 1 137 ? 10.310 -1.060 -51.129 1.00 93.54 ? 253 PRO G CG 1 ATOM 1065 C CD . PRO A 1 137 ? 11.802 -0.978 -51.290 1.00 97.12 ? 253 PRO G CD 1 ATOM 1066 N N . VAL A 1 138 ? 11.760 -4.844 -49.668 1.00 90.22 ? 254 VAL G N 1 ATOM 1067 C CA . VAL A 1 138 ? 11.442 -6.200 -50.066 1.00 96.93 ? 254 VAL G CA 1 ATOM 1068 C C . VAL A 1 138 ? 10.647 -6.939 -49.023 1.00 104.93 ? 254 VAL G C 1 ATOM 1069 O O . VAL A 1 138 ? 11.122 -7.231 -47.909 1.00 104.88 ? 254 VAL G O 1 ATOM 1070 C CB . VAL A 1 138 ? 12.701 -7.036 -50.345 1.00 97.53 ? 254 VAL G CB 1 ATOM 1071 C CG1 . VAL A 1 138 ? 12.341 -8.310 -51.099 1.00 96.84 ? 254 VAL G CG1 1 ATOM 1072 C CG2 . VAL A 1 138 ? 13.726 -6.214 -51.080 1.00 97.71 ? 254 VAL G CG2 1 ATOM 1073 N N . VAL A 1 139 ? 9.462 -7.343 -49.436 1.00 102.37 ? 255 VAL G N 1 ATOM 1074 C CA . VAL A 1 139 ? 8.587 -8.056 -48.538 1.00 96.64 ? 255 VAL G CA 1 ATOM 1075 C C . VAL A 1 139 ? 8.916 -9.485 -48.843 1.00 95.97 ? 255 VAL G C 1 ATOM 1076 O O . VAL A 1 139 ? 8.737 -9.953 -49.975 1.00 95.25 ? 255 VAL G O 1 ATOM 1077 C CB . VAL A 1 139 ? 7.093 -7.766 -48.771 1.00 94.03 ? 255 VAL G CB 1 ATOM 1078 C CG1 . VAL A 1 139 ? 6.228 -8.620 -47.860 1.00 82.37 ? 255 VAL G CG1 1 ATOM 1079 C CG2 . VAL A 1 139 ? 6.813 -6.288 -48.618 1.00 82.31 ? 255 VAL G CG2 1 ATOM 1080 N N . SER A 1 140 ? 9.444 -10.153 -47.831 1.00 98.63 ? 256 SER G N 1 ATOM 1081 C CA . SER A 1 140 ? 9.801 -11.542 -47.987 1.00 110.58 ? 256 SER G CA 1 ATOM 1082 C C . SER A 1 140 ? 9.852 -12.273 -46.641 1.00 112.64 ? 256 SER G C 1 ATOM 1083 O O . SER A 1 140 ? 9.938 -11.654 -45.571 1.00 115.01 ? 256 SER G O 1 ATOM 1084 C CB . SER A 1 140 ? 11.137 -11.585 -48.746 1.00 116.08 ? 256 SER G CB 1 ATOM 1085 O OG . SER A 1 140 ? 12.213 -11.079 -47.969 1.00 120.93 ? 256 SER G OG 1 ATOM 1086 N N . THR A 1 141 ? 9.869 -13.598 -46.687 1.00 109.29 ? 257 THR G N 1 ATOM 1087 C CA . THR A 1 141 ? 9.938 -14.388 -45.463 1.00 110.43 ? 257 THR G CA 1 ATOM 1088 C C . THR A 1 141 ? 11.101 -15.373 -45.413 1.00 112.18 ? 257 THR G C 1 ATOM 1089 O O . THR A 1 141 ? 11.596 -15.794 -46.461 1.00 119.02 ? 257 THR G O 1 ATOM 1090 C CB . THR A 1 141 ? 8.669 -15.246 -45.298 1.00 106.07 ? 257 THR G CB 1 ATOM 1091 O OG1 . THR A 1 141 ? 8.467 -16.079 -46.447 1.00 116.87 ? 257 THR G OG1 1 ATOM 1092 C CG2 . THR A 1 141 ? 7.453 -14.349 -45.046 1.00 94.44 ? 257 THR G CG2 1 ATOM 1093 N N . GLN A 1 142 ? 11.569 -15.685 -44.208 1.00 101.94 ? 258 GLN G N 1 ATOM 1094 C CA . GLN A 1 142 ? 12.655 -16.655 -44.022 1.00 108.30 ? 258 GLN G CA 1 ATOM 1095 C C . GLN A 1 142 ? 13.994 -16.078 -44.458 1.00 109.69 ? 258 GLN G C 1 ATOM 1096 O O . GLN A 1 142 ? 14.935 -15.939 -43.674 1.00 102.95 ? 258 GLN G O 1 ATOM 1097 C CB . GLN A 1 142 ? 12.457 -17.997 -44.767 1.00 102.00 ? 258 GLN G CB 1 ATOM 1098 C CG . GLN A 1 142 ? 11.229 -18.823 -44.364 1.00 105.59 ? 258 GLN G CG 1 ATOM 1099 C CD . GLN A 1 142 ? 11.282 -20.311 -44.818 1.00 125.66 ? 258 GLN G CD 1 ATOM 1100 O OE1 . GLN A 1 142 ? 11.354 -20.623 -46.003 1.00 128.69 ? 258 GLN G OE1 1 ATOM 1101 N NE2 . GLN A 1 142 ? 11.246 -21.214 -43.858 1.00 133.32 ? 258 GLN G NE2 1 ATOM 1102 N N . LEU A 1 143 ? 14.033 -15.679 -45.717 1.00 115.55 ? 259 LEU G N 1 ATOM 1103 C CA . LEU A 1 143 ? 15.188 -15.042 -46.296 1.00 118.25 ? 259 LEU G CA 1 ATOM 1104 C C . LEU A 1 143 ? 15.002 -13.547 -46.454 1.00 117.81 ? 259 LEU G C 1 ATOM 1105 O O . LEU A 1 143 ? 13.969 -13.095 -46.950 1.00 113.11 ? 259 LEU G O 1 ATOM 1106 C CB . LEU A 1 143 ? 15.440 -15.673 -47.659 1.00 119.13 ? 259 LEU G CB 1 ATOM 1107 C CG . LEU A 1 143 ? 15.986 -17.106 -47.661 1.00 126.34 ? 259 LEU G CG 1 ATOM 1108 C CD1 . LEU A 1 143 ? 16.100 -17.630 -49.092 1.00 128.75 ? 259 LEU G CD1 1 ATOM 1109 C CD2 . LEU A 1 143 ? 17.301 -17.219 -46.922 1.00 130.03 ? 259 LEU G CD2 1 ATOM 1110 N N . LEU A 1 144 ? 16.012 -12.777 -46.049 1.00 120.91 ? 260 LEU G N 1 ATOM 1111 C CA . LEU A 1 144 ? 15.986 -11.348 -46.303 1.00 115.52 ? 260 LEU G CA 1 ATOM 1112 C C . LEU A 1 144 ? 16.645 -11.095 -47.642 1.00 127.62 ? 260 LEU G C 1 ATOM 1113 O O . LEU A 1 144 ? 17.810 -11.456 -47.853 1.00 136.30 ? 260 LEU G O 1 ATOM 1114 C CB . LEU A 1 144 ? 16.730 -10.561 -45.228 1.00 111.06 ? 260 LEU G CB 1 ATOM 1115 C CG . LEU A 1 144 ? 16.145 -10.459 -43.832 1.00 108.72 ? 260 LEU G CG 1 ATOM 1116 C CD1 . LEU A 1 144 ? 17.091 -9.665 -42.928 1.00 98.87 ? 260 LEU G CD1 1 ATOM 1117 C CD2 . LEU A 1 144 ? 14.805 -9.777 -43.953 1.00 100.34 ? 260 LEU G CD2 1 ATOM 1118 N N . LEU A 1 145 ? 15.881 -10.479 -48.545 1.00 129.10 ? 261 LEU G N 1 ATOM 1119 C CA . LEU A 1 145 ? 16.314 -10.353 -49.926 1.00 127.24 ? 261 LEU G CA 1 ATOM 1120 C C . LEU A 1 145 ? 16.695 -8.881 -50.221 1.00 125.26 ? 261 LEU G C 1 ATOM 1121 O O . LEU A 1 145 ? 16.005 -7.959 -49.766 1.00 115.72 ? 261 LEU G O 1 ATOM 1122 C CB . LEU A 1 145 ? 15.202 -10.885 -50.832 1.00 120.24 ? 261 LEU G CB 1 ATOM 1123 C CG . LEU A 1 145 ? 15.390 -12.406 -50.983 1.00 114.92 ? 261 LEU G CG 1 ATOM 1124 C CD1 . LEU A 1 145 ? 14.425 -13.071 -51.969 1.00 116.25 ? 261 LEU G CD1 1 ATOM 1125 C CD2 . LEU A 1 145 ? 16.841 -12.772 -51.268 1.00 118.00 ? 261 LEU G CD2 1 ATOM 1126 N N . ASN A 1 146 ? 17.799 -8.670 -50.944 1.00 134.06 ? 262 ASN G N 1 ATOM 1127 C CA . ASN A 1 146 ? 18.201 -7.352 -51.478 1.00 143.48 ? 262 ASN G CA 1 ATOM 1128 C C . ASN A 1 146 ? 18.421 -6.286 -50.408 1.00 137.81 ? 262 ASN G C 1 ATOM 1129 O O . ASN A 1 146 ? 18.150 -5.111 -50.644 1.00 134.69 ? 262 ASN G O 1 ATOM 1130 C CB . ASN A 1 146 ? 17.203 -6.799 -52.512 1.00 158.10 ? 262 ASN G CB 1 ATOM 1131 C CG . ASN A 1 146 ? 17.074 -7.669 -53.756 1.00 175.22 ? 262 ASN G CG 1 ATOM 1132 O OD1 . ASN A 1 146 ? 17.960 -8.474 -54.060 1.00 176.41 ? 262 ASN G OD1 1 ATOM 1133 N ND2 . ASN A 1 146 ? 15.975 -7.475 -54.508 1.00 193.74 ? 262 ASN G ND2 1 ATOM 1134 N N . GLY A 1 147 ? 18.917 -6.681 -49.240 1.00 138.99 ? 263 GLY G N 1 ATOM 1135 C CA . GLY A 1 147 ? 19.208 -5.707 -48.199 1.00 135.94 ? 263 GLY G CA 1 ATOM 1136 C C . GLY A 1 147 ? 20.674 -5.333 -48.112 1.00 129.43 ? 263 GLY G C 1 ATOM 1137 O O . GLY A 1 147 ? 21.469 -5.772 -48.936 1.00 128.19 ? 263 GLY G O 1 ATOM 1138 N N . SER A 1 148 ? 21.025 -4.502 -47.132 1.00 127.00 ? 264 SER G N 1 ATOM 1139 C CA . SER A 1 148 ? 22.425 -4.182 -46.846 1.00 139.58 ? 264 SER G CA 1 ATOM 1140 C C . SER A 1 148 ? 23.203 -5.291 -46.135 1.00 153.32 ? 264 SER G C 1 ATOM 1141 O O . SER A 1 148 ? 22.618 -6.269 -45.673 1.00 157.17 ? 264 SER G O 1 ATOM 1142 C CB . SER A 1 148 ? 22.494 -2.916 -45.996 1.00 143.22 ? 264 SER G CB 1 ATOM 1143 O OG . SER A 1 148 ? 21.685 -3.046 -44.839 1.00 143.93 ? 264 SER G OG 1 ATOM 1144 N N . LEU A 1 149 ? 24.529 -5.152 -46.091 1.00 163.41 ? 265 LEU G N 1 ATOM 1145 C CA . LEU A 1 149 ? 25.394 -6.168 -45.480 1.00 174.83 ? 265 LEU G CA 1 ATOM 1146 C C . LEU A 1 149 ? 26.262 -5.655 -44.311 1.00 180.36 ? 265 LEU G C 1 ATOM 1147 O O . LEU A 1 149 ? 26.536 -4.459 -44.204 1.00 179.07 ? 265 LEU G O 1 ATOM 1148 C CB . LEU A 1 149 ? 26.280 -6.824 -46.543 1.00 182.00 ? 265 LEU G CB 1 ATOM 1149 C CG . LEU A 1 149 ? 25.616 -7.666 -47.644 1.00 183.54 ? 265 LEU G CG 1 ATOM 1150 C CD1 . LEU A 1 149 ? 24.841 -6.857 -48.673 1.00 181.92 ? 265 LEU G CD1 1 ATOM 1151 C CD2 . LEU A 1 149 ? 26.677 -8.485 -48.337 1.00 192.18 ? 265 LEU G CD2 1 ATOM 1152 N N . ALA A 1 150 ? 26.682 -6.574 -43.442 1.00 186.18 ? 266 ALA G N 1 ATOM 1153 C CA . ALA A 1 150 ? 27.632 -6.315 -42.351 1.00 193.57 ? 266 ALA G CA 1 ATOM 1154 C C . ALA A 1 150 ? 28.982 -5.822 -42.907 1.00 203.52 ? 266 ALA G C 1 ATOM 1155 O O . ALA A 1 150 ? 29.483 -6.406 -43.862 1.00 209.73 ? 266 ALA G O 1 ATOM 1156 C CB . ALA A 1 150 ? 27.824 -7.562 -41.499 1.00 195.09 ? 266 ALA G CB 1 ATOM 1157 N N . GLU A 1 151 ? 29.575 -4.771 -42.338 1.00 206.28 ? 267 GLU G N 1 ATOM 1158 C CA . GLU A 1 151 ? 30.816 -4.226 -42.920 1.00 212.04 ? 267 GLU G CA 1 ATOM 1159 C C . GLU A 1 151 ? 31.967 -5.201 -42.642 1.00 221.19 ? 267 GLU G C 1 ATOM 1160 O O . GLU A 1 151 ? 32.777 -5.482 -43.528 1.00 227.48 ? 267 GLU G O 1 ATOM 1161 C CB . GLU A 1 151 ? 30.982 -2.756 -42.522 0.00 210.64 ? 267 GLU G CB 1 ATOM 1162 C CG . GLU A 1 151 ? 29.951 -1.810 -43.113 0.00 202.08 ? 267 GLU G CG 1 ATOM 1163 C CD . GLU A 1 151 ? 30.130 -0.389 -42.622 0.00 199.77 ? 267 GLU G CD 1 ATOM 1164 O OE1 . GLU A 1 151 ? 30.929 -0.178 -41.684 0.00 203.15 ? 267 GLU G OE1 1 ATOM 1165 O OE2 . GLU A 1 151 ? 29.466 0.517 -43.167 0.00 194.52 ? 267 GLU G OE2 1 ATOM 1166 N N . GLU A 1 152 ? 32.042 -5.697 -41.413 1.00 221.97 ? 268 GLU G N 1 ATOM 1167 C CA . GLU A 1 152 ? 33.079 -6.635 -40.980 1.00 228.60 ? 268 GLU G CA 1 ATOM 1168 C C . GLU A 1 152 ? 32.919 -8.165 -40.952 1.00 226.01 ? 268 GLU G C 1 ATOM 1169 O O . GLU A 1 152 ? 33.673 -8.889 -41.603 1.00 232.74 ? 268 GLU G O 1 ATOM 1170 C CB . GLU A 1 152 ? 33.485 -6.248 -39.549 1.00 234.49 ? 268 GLU G CB 1 ATOM 1171 C CG . GLU A 1 152 ? 34.095 -4.884 -39.346 1.00 242.09 ? 268 GLU G CG 1 ATOM 1172 C CD . GLU A 1 152 ? 35.344 -4.662 -40.169 1.00 255.01 ? 268 GLU G CD 1 ATOM 1173 O OE1 . GLU A 1 152 ? 36.166 -5.597 -40.293 1.00 262.67 ? 268 GLU G OE1 1 ATOM 1174 O OE2 . GLU A 1 152 ? 35.500 -3.537 -40.694 1.00 257.11 ? 268 GLU G OE2 1 ATOM 1175 N N . GLU A 1 153 ? 31.923 -8.646 -40.207 1.00 217.67 ? 269 GLU G N 1 ATOM 1176 C CA . GLU A 1 153 ? 31.631 -10.081 -40.083 1.00 218.32 ? 269 GLU G CA 1 ATOM 1177 C C . GLU A 1 153 ? 30.198 -10.260 -39.595 1.00 210.93 ? 269 GLU G C 1 ATOM 1178 O O . GLU A 1 153 ? 29.600 -9.341 -39.045 1.00 210.74 ? 269 GLU G O 1 ATOM 1179 C CB . GLU A 1 153 ? 32.541 -10.893 -39.164 1.00 225.67 ? 269 GLU G CB 1 ATOM 1180 C CG . GLU A 1 153 ? 33.967 -11.036 -39.629 1.00 235.58 ? 269 GLU G CG 1 ATOM 1181 C CD . GLU A 1 153 ? 34.811 -11.788 -38.630 1.00 243.86 ? 269 GLU G CD 1 ATOM 1182 O OE1 . GLU A 1 153 ? 34.316 -12.020 -37.507 1.00 242.10 ? 269 GLU G OE1 1 ATOM 1183 O OE2 . GLU A 1 153 ? 35.959 -12.146 -38.959 1.00 252.29 ? 269 GLU G OE2 1 ATOM 1184 N N . ILE A 1 154 ? 29.653 -11.450 -39.832 1.00 203.36 ? 270 ILE G N 1 ATOM 1185 C CA . ILE A 1 154 ? 28.248 -11.783 -39.576 1.00 188.17 ? 270 ILE G CA 1 ATOM 1186 C C . ILE A 1 154 ? 27.752 -11.327 -38.202 1.00 178.63 ? 270 ILE G C 1 ATOM 1187 O O . ILE A 1 154 ? 28.463 -11.474 -37.210 1.00 184.82 ? 270 ILE G O 1 ATOM 1188 C CB . ILE A 1 154 ? 28.041 -13.326 -39.672 1.00 178.96 ? 270 ILE G CB 1 ATOM 1189 C CG1 . ILE A 1 154 ? 28.648 -13.891 -40.960 1.00 182.27 ? 270 ILE G CG1 1 ATOM 1190 C CG2 . ILE A 1 154 ? 26.578 -13.717 -39.481 1.00 171.28 ? 270 ILE G CG2 1 ATOM 1191 C CD1 . ILE A 1 154 ? 30.115 -14.333 -40.815 1.00 189.33 ? 270 ILE G CD1 1 ATOM 1192 N N . ILE A 1 155 ? 26.546 -10.750 -38.160 1.00 166.81 ? 271 ILE G N 1 ATOM 1193 C CA . ILE A 1 155 ? 26.014 -10.168 -36.913 1.00 163.49 ? 271 ILE G CA 1 ATOM 1194 C C . ILE A 1 155 ? 24.639 -10.709 -36.520 1.00 157.97 ? 271 ILE G C 1 ATOM 1195 O O . ILE A 1 155 ? 23.707 -10.768 -37.332 1.00 148.74 ? 271 ILE G O 1 ATOM 1196 C CB . ILE A 1 155 ? 25.926 -8.617 -36.968 1.00 161.52 ? 271 ILE G CB 1 ATOM 1197 C CG1 . ILE A 1 155 ? 27.314 -8.012 -37.195 1.00 173.62 ? 271 ILE G CG1 1 ATOM 1198 C CG2 . ILE A 1 155 ? 25.366 -8.057 -35.657 1.00 153.88 ? 271 ILE G CG2 1 ATOM 1199 C CD1 . ILE A 1 155 ? 27.317 -6.521 -37.505 1.00 174.53 ? 271 ILE G CD1 1 ATOM 1200 N N . ILE A 1 156 ? 24.527 -11.129 -35.266 1.00 162.78 ? 272 ILE G N 1 ATOM 1201 C CA . ILE A 1 156 ? 23.252 -11.617 -34.781 1.00 154.22 ? 272 ILE G CA 1 ATOM 1202 C C . ILE A 1 156 ? 22.494 -10.535 -34.038 1.00 153.64 ? 272 ILE G C 1 ATOM 1203 O O . ILE A 1 156 ? 22.984 -9.979 -33.053 1.00 155.95 ? 272 ILE G O 1 ATOM 1204 C CB . ILE A 1 156 ? 23.437 -12.806 -33.860 1.00 150.51 ? 272 ILE G CB 1 ATOM 1205 C CG1 . ILE A 1 156 ? 24.352 -13.826 -34.531 1.00 151.80 ? 272 ILE G CG1 1 ATOM 1206 C CG2 . ILE A 1 156 ? 22.086 -13.385 -33.515 1.00 129.31 ? 272 ILE G CG2 1 ATOM 1207 C CD1 . ILE A 1 156 ? 23.819 -14.308 -35.867 1.00 148.34 ? 272 ILE G CD1 1 ATOM 1208 N N . ARG A 1 157 ? 21.288 -10.252 -34.517 1.00 149.88 ? 273 ARG G N 1 ATOM 1209 C CA . ARG A 1 157 ? 20.501 -9.171 -33.943 1.00 149.70 ? 273 ARG G CA 1 ATOM 1210 C C . ARG A 1 157 ? 19.243 -9.739 -33.244 1.00 144.91 ? 273 ARG G C 1 ATOM 1211 O O . ARG A 1 157 ? 18.532 -10.579 -33.830 1.00 142.07 ? 273 ARG G O 1 ATOM 1212 C CB . ARG A 1 157 ? 20.151 -8.176 -35.052 1.00 151.88 ? 273 ARG G CB 1 ATOM 1213 C CG . ARG A 1 157 ? 21.383 -7.676 -35.845 1.00 159.20 ? 273 ARG G CG 1 ATOM 1214 C CD . ARG A 1 157 ? 21.084 -6.539 -36.854 1.00 158.67 ? 273 ARG G CD 1 ATOM 1215 N NE . ARG A 1 157 ? 22.073 -5.466 -36.772 1.00 163.26 ? 273 ARG G NE 1 ATOM 1216 C CZ . ARG A 1 157 ? 23.187 -5.434 -37.498 1.00 166.50 ? 273 ARG G CZ 1 ATOM 1217 N NH1 . ARG A 1 157 ? 23.431 -6.384 -38.386 1.00 166.85 ? 273 ARG G NH1 1 ATOM 1218 N NH2 . ARG A 1 157 ? 24.045 -4.436 -37.365 1.00 169.32 ? 273 ARG G NH2 1 ATOM 1219 N N . SER A 1 158 ? 19.004 -9.402 -31.981 1.00 146.28 ? 274 SER G N 1 ATOM 1220 C CA . SER A 1 158 ? 17.717 -9.734 -31.364 1.00 144.04 ? 274 SER G CA 1 ATOM 1221 C C . SER A 1 158 ? 17.413 -8.921 -30.118 1.00 144.24 ? 274 SER G C 1 ATOM 1222 O O . SER A 1 158 ? 18.326 -8.509 -29.419 1.00 153.75 ? 274 SER G O 1 ATOM 1223 C CB . SER A 1 158 ? 17.617 -11.224 -31.068 1.00 145.74 ? 274 SER G CB 1 ATOM 1224 O OG . SER A 1 158 ? 18.589 -11.604 -30.110 1.00 155.14 ? 274 SER G OG 1 ATOM 1225 N N . GLU A 1 159 ? 16.136 -8.704 -29.821 1.00 133.98 ? 275 GLU G N 1 ATOM 1226 C CA . GLU A 1 159 ? 15.802 -7.906 -28.651 1.00 135.12 ? 275 GLU G CA 1 ATOM 1227 C C . GLU A 1 159 ? 16.233 -8.562 -27.351 1.00 143.07 ? 275 GLU G C 1 ATOM 1228 O O . GLU A 1 159 ? 16.840 -7.924 -26.500 1.00 148.15 ? 275 GLU G O 1 ATOM 1229 C CB . GLU A 1 159 ? 14.304 -7.621 -28.606 1.00 134.10 ? 275 GLU G CB 1 ATOM 1230 C CG . GLU A 1 159 ? 13.954 -6.345 -27.863 1.00 138.11 ? 275 GLU G CG 1 ATOM 1231 C CD . GLU A 1 159 ? 12.464 -6.152 -27.698 1.00 137.84 ? 275 GLU G CD 1 ATOM 1232 O OE1 . GLU A 1 159 ? 11.696 -6.959 -28.247 1.00 139.50 ? 275 GLU G OE1 1 ATOM 1233 O OE2 . GLU A 1 159 ? 12.060 -5.195 -27.014 1.00 133.97 ? 275 GLU G OE2 1 ATOM 1234 N N . ASN A 1 160 ? 15.927 -9.845 -27.210 1.00 143.32 ? 276 ASN G N 1 ATOM 1235 C CA . ASN A 1 160 ? 16.442 -10.664 -26.125 1.00 147.88 ? 276 ASN G CA 1 ATOM 1236 C C . ASN A 1 160 ? 16.746 -12.029 -26.698 1.00 138.56 ? 276 ASN G C 1 ATOM 1237 O O . ASN A 1 160 ? 15.844 -12.729 -27.137 1.00 126.44 ? 276 ASN G O 1 ATOM 1238 C CB . ASN A 1 160 ? 15.410 -10.786 -25.008 1.00 153.87 ? 276 ASN G CB 1 ATOM 1239 C CG . ASN A 1 160 ? 15.625 -9.776 -23.901 1.00 158.78 ? 276 ASN G CG 1 ATOM 1240 O OD1 . ASN A 1 160 ? 16.503 -9.940 -23.059 1.00 153.14 ? 276 ASN G OD1 1 ATOM 1241 N ND2 . ASN A 1 160 ? 14.816 -8.726 -23.893 1.00 163.73 ? 276 ASN G ND2 1 ATOM 1242 N N . LEU A 1 161 ? 18.004 -12.427 -26.681 1.00 145.41 ? 277 LEU G N 1 ATOM 1243 C CA . LEU A 1 161 ? 18.364 -13.700 -27.274 1.00 154.04 ? 277 LEU G CA 1 ATOM 1244 C C . LEU A 1 161 ? 17.703 -14.837 -26.526 1.00 159.10 ? 277 LEU G C 1 ATOM 1245 O O . LEU A 1 161 ? 17.223 -15.793 -27.120 1.00 159.62 ? 277 LEU G O 1 ATOM 1246 C CB . LEU A 1 161 ? 19.875 -13.868 -27.295 1.00 164.90 ? 277 LEU G CB 1 ATOM 1247 C CG . LEU A 1 161 ? 20.583 -12.657 -27.896 1.00 169.00 ? 277 LEU G CG 1 ATOM 1248 C CD1 . LEU A 1 161 ? 20.556 -11.490 -26.922 1.00 173.80 ? 277 LEU G CD1 1 ATOM 1249 C CD2 . LEU A 1 161 ? 22.007 -13.001 -28.294 1.00 173.58 ? 277 LEU G CD2 1 ATOM 1250 N N . THR A 1 162 ? 17.679 -14.720 -25.208 1.00 160.65 ? 278 THR G N 1 ATOM 1251 C CA . THR A 1 162 ? 17.144 -15.767 -24.364 1.00 163.39 ? 278 THR G CA 1 ATOM 1252 C C . THR A 1 162 ? 15.672 -15.983 -24.644 1.00 158.84 ? 278 THR G C 1 ATOM 1253 O O . THR A 1 162 ? 15.189 -17.107 -24.679 1.00 164.36 ? 278 THR G O 1 ATOM 1254 C CB . THR A 1 162 ? 17.311 -15.398 -22.886 1.00 170.10 ? 278 THR G CB 1 ATOM 1255 O OG1 . THR A 1 162 ? 16.300 -14.457 -22.507 1.00 169.91 ? 278 THR G OG1 1 ATOM 1256 C CG2 . THR A 1 162 ? 18.667 -14.770 -22.664 1.00 174.19 ? 278 THR G CG2 1 ATOM 1257 N N . ASN A 1 163 ? 14.965 -14.882 -24.833 1.00 147.27 ? 279 ASN G N 1 ATOM 1258 C CA . ASN A 1 163 ? 13.556 -14.892 -24.941 1.00 135.96 ? 279 ASN G CA 1 ATOM 1259 C C . ASN A 1 163 ? 13.219 -15.513 -26.306 1.00 131.90 ? 279 ASN G C 1 ATOM 1260 O O . ASN A 1 163 ? 13.402 -14.850 -27.350 1.00 133.18 ? 279 ASN G O 1 ATOM 1261 C CB . ASN A 1 163 ? 13.008 -13.497 -24.816 1.00 131.55 ? 279 ASN G CB 1 ATOM 1262 C CG . ASN A 1 163 ? 11.484 -13.465 -24.848 1.00 126.66 ? 279 ASN G CG 1 ATOM 1263 O OD1 . ASN A 1 163 ? 10.811 -14.419 -25.279 1.00 119.93 ? 279 ASN G OD1 1 ATOM 1264 N ND2 . ASN A 1 163 ? 10.929 -12.324 -24.446 1.00 126.60 ? 279 ASN G ND2 1 ATOM 1265 N N . ASN A 1 164 ? 12.722 -16.749 -26.330 1.00 132.25 ? 280 ASN G N 1 ATOM 1266 C CA . ASN A 1 164 ? 12.545 -17.490 -27.591 1.00 129.23 ? 280 ASN G CA 1 ATOM 1267 C C . ASN A 1 164 ? 11.447 -16.839 -28.444 1.00 128.45 ? 280 ASN G C 1 ATOM 1268 O O . ASN A 1 164 ? 11.360 -17.073 -29.661 1.00 136.70 ? 280 ASN G O 1 ATOM 1269 C CB . ASN A 1 164 ? 12.196 -18.955 -27.317 1.00 127.67 ? 280 ASN G CB 1 ATOM 1270 C CG . ASN A 1 164 ? 10.728 -19.167 -26.899 1.00 123.10 ? 280 ASN G CG 1 ATOM 1271 O OD1 . ASN A 1 164 ? 9.785 -18.666 -27.516 1.00 115.16 ? 280 ASN G OD1 1 ATOM 1272 N ND2 . ASN A 1 164 ? 10.546 -19.933 -25.819 1.00 118.94 ? 280 ASN G ND2 1 ATOM 1273 N N . ALA A 1 165 ? 10.685 -15.935 -27.833 1.00 122.45 ? 281 ALA G N 1 ATOM 1274 C CA . ALA A 1 165 ? 9.620 -15.239 -28.522 1.00 115.64 ? 281 ALA G CA 1 ATOM 1275 C C . ALA A 1 165 ? 10.166 -13.956 -29.141 1.00 121.21 ? 281 ALA G C 1 ATOM 1276 O O . ALA A 1 165 ? 9.435 -13.200 -29.786 1.00 118.59 ? 281 ALA G O 1 ATOM 1277 C CB . ALA A 1 165 ? 8.459 -14.943 -27.565 1.00 110.06 ? 281 ALA G CB 1 ATOM 1278 N N . LYS A 1 166 ? 11.468 -13.733 -28.988 1.00 131.64 ? 282 LYS G N 1 ATOM 1279 C CA . LYS A 1 166 ? 12.023 -12.560 -29.621 1.00 135.50 ? 282 LYS G CA 1 ATOM 1280 C C . LYS A 1 166 ? 12.614 -13.074 -30.916 1.00 144.54 ? 282 LYS G C 1 ATOM 1281 O O . LYS A 1 166 ? 13.279 -14.115 -30.935 1.00 137.92 ? 282 LYS G O 1 ATOM 1282 C CB . LYS A 1 166 ? 13.110 -11.903 -28.756 1.00 137.53 ? 282 LYS G CB 1 ATOM 1283 C CG . LYS A 1 166 ? 12.635 -11.240 -27.480 1.00 138.70 ? 282 LYS G CG 1 ATOM 1284 C CD . LYS A 1 166 ? 11.451 -10.337 -27.755 1.00 137.76 ? 282 LYS G CD 1 ATOM 1285 C CE . LYS A 1 166 ? 11.062 -9.561 -26.520 1.00 147.23 ? 282 LYS G CE 1 ATOM 1286 N NZ . LYS A 1 166 ? 9.760 -8.872 -26.715 1.00 147.70 ? 282 LYS G NZ 1 ATOM 1287 N N . THR A 1 167 ? 12.356 -12.325 -31.986 1.00 169.30 ? 283 THR G N 1 ATOM 1288 C CA . THR A 1 167 ? 12.785 -12.669 -33.341 1.00 101.12 ? 283 THR G CA 1 ATOM 1289 C C . THR A 1 167 ? 14.300 -12.575 -33.467 1.00 105.20 ? 283 THR G C 1 ATOM 1290 O O . THR A 1 167 ? 14.907 -11.626 -32.962 1.00 123.86 ? 283 THR G O 1 ATOM 1291 C CB . THR A 1 167 ? 12.096 -11.775 -34.386 1.00 115.05 ? 283 THR G CB 1 ATOM 1292 O OG1 . THR A 1 167 ? 10.677 -11.909 -34.263 1.00 120.75 ? 283 THR G OG1 1 ATOM 1293 C CG2 . THR A 1 167 ? 12.523 -12.170 -35.800 1.00 119.00 ? 283 THR G CG2 1 ATOM 1294 N N . ILE A 1 168 ? 14.921 -13.556 -34.110 1.00 175.10 ? 284 ILE G N 1 ATOM 1295 C CA . ILE A 1 168 ? 16.338 -13.415 -34.417 1.00 152.39 ? 284 ILE G CA 1 ATOM 1296 C C . ILE A 1 168 ? 16.577 -13.054 -35.880 1.00 146.63 ? 284 ILE G C 1 ATOM 1297 O O . ILE A 1 168 ? 16.026 -13.692 -36.764 1.00 147.63 ? 284 ILE G O 1 ATOM 1298 C CB . ILE A 1 168 ? 17.102 -14.712 -34.098 1.00 140.92 ? 284 ILE G CB 1 ATOM 1299 C CG1 . ILE A 1 168 ? 16.859 -15.127 -32.646 1.00 137.70 ? 284 ILE G CG1 1 ATOM 1300 C CG2 . ILE A 1 168 ? 18.581 -14.517 -34.335 1.00 141.94 ? 284 ILE G CG2 1 ATOM 1301 C CD1 . ILE A 1 168 ? 17.541 -16.435 -32.251 1.00 139.21 ? 284 ILE G CD1 1 ATOM 1302 N N . ILE A 1 169 ? 17.344 -12.005 -36.160 1.00 144.73 ? 285 ILE G N 1 ATOM 1303 C CA . ILE A 1 169 ? 17.664 -11.705 -37.568 1.00 140.26 ? 285 ILE G CA 1 ATOM 1304 C C . ILE A 1 169 ? 19.173 -11.878 -37.727 1.00 139.28 ? 285 ILE G C 1 ATOM 1305 O O . ILE A 1 169 ? 19.984 -11.226 -37.039 1.00 142.53 ? 285 ILE G O 1 ATOM 1306 C CB . ILE A 1 169 ? 17.177 -10.321 -38.075 1.00 117.62 ? 285 ILE G CB 1 ATOM 1307 C CG1 . ILE A 1 169 ? 17.951 -9.181 -37.460 1.00 130.34 ? 285 ILE G CG1 1 ATOM 1308 C CG2 . ILE A 1 169 ? 15.707 -10.119 -37.820 1.00 117.81 ? 285 ILE G CG2 1 ATOM 1309 C CD1 . ILE A 1 169 ? 18.668 -8.384 -38.490 1.00 149.02 ? 285 ILE G CD1 1 ATOM 1310 N N . VAL A 1 170 ? 19.565 -12.757 -38.636 1.00 136.79 ? 286 VAL G N 1 ATOM 1311 C CA . VAL A 1 170 ? 20.975 -12.862 -38.916 1.00 141.75 ? 286 VAL G CA 1 ATOM 1312 C C . VAL A 1 170 ? 21.240 -11.930 -40.063 1.00 144.65 ? 286 VAL G C 1 ATOM 1313 O O . VAL A 1 170 ? 20.498 -11.878 -41.043 1.00 143.56 ? 286 VAL G O 1 ATOM 1314 C CB . VAL A 1 170 ? 21.385 -14.283 -39.287 1.00 146.34 ? 286 VAL G CB 1 ATOM 1315 C CG1 . VAL A 1 170 ? 22.879 -14.347 -39.548 1.00 153.27 ? 286 VAL G CG1 1 ATOM 1316 C CG2 . VAL A 1 170 ? 21.007 -15.222 -38.175 1.00 149.22 ? 286 VAL G CG2 1 ATOM 1317 N N . HIS A 1 171 ? 22.341 -11.210 -39.920 1.00 153.47 ? 287 HIS G N 1 ATOM 1318 C CA . HIS A 1 171 ? 22.743 -10.249 -40.905 1.00 159.48 ? 287 HIS G CA 1 ATOM 1319 C C . HIS A 1 171 ? 24.106 -10.656 -41.437 1.00 164.86 ? 287 HIS G C 1 ATOM 1320 O O . HIS A 1 171 ? 25.149 -10.434 -40.797 1.00 174.60 ? 287 HIS G O 1 ATOM 1321 C CB . HIS A 1 171 ? 22.748 -8.863 -40.273 1.00 162.62 ? 287 HIS G CB 1 ATOM 1322 C CG . HIS A 1 171 ? 22.589 -7.746 -41.250 1.00 173.04 ? 287 HIS G CG 1 ATOM 1323 N ND1 . HIS A 1 171 ? 23.658 -7.106 -41.838 1.00 183.19 ? 287 HIS G ND1 1 ATOM 1324 C CD2 . HIS A 1 171 ? 21.476 -7.145 -41.731 1.00 175.77 ? 287 HIS G CD2 1 ATOM 1325 C CE1 . HIS A 1 171 ? 23.210 -6.161 -42.644 1.00 185.76 ? 287 HIS G CE1 1 ATOM 1326 N NE2 . HIS A 1 171 ? 21.890 -6.165 -42.599 1.00 182.40 ? 287 HIS G NE2 1 ATOM 1327 N N . LEU A 1 172 ? 24.054 -11.317 -42.589 1.00 159.54 ? 288 LEU G N 1 ATOM 1328 C CA . LEU A 1 172 ? 25.216 -11.823 -43.307 1.00 161.46 ? 288 LEU G CA 1 ATOM 1329 C C . LEU A 1 172 ? 26.226 -10.737 -43.650 1.00 168.98 ? 288 LEU G C 1 ATOM 1330 O O . LEU A 1 172 ? 25.860 -9.573 -43.877 1.00 163.32 ? 288 LEU G O 1 ATOM 1331 C CB . LEU A 1 172 ? 24.780 -12.512 -44.596 1.00 158.32 ? 288 LEU G CB 1 ATOM 1332 C CG . LEU A 1 172 ? 23.692 -13.557 -44.407 1.00 128.14 ? 288 LEU G CG 1 ATOM 1333 C CD1 . LEU A 1 172 ? 23.304 -14.169 -45.743 1.00 157.47 ? 288 LEU G CD1 1 ATOM 1334 C CD2 . LEU A 1 172 ? 24.175 -14.602 -43.432 1.00 128.90 ? 288 LEU G CD2 1 ATOM 1335 N N . ASN A 1 173 ? 27.495 -11.135 -43.721 1.00 178.92 ? 289 ASN G N 1 ATOM 1336 C CA . ASN A 1 173 ? 28.539 -10.200 -44.108 1.00 183.35 ? 289 ASN G CA 1 ATOM 1337 C C . ASN A 1 173 ? 28.904 -10.312 -45.595 1.00 181.83 ? 289 ASN G C 1 ATOM 1338 O O . ASN A 1 173 ? 29.605 -9.459 -46.135 1.00 181.90 ? 289 ASN G O 1 ATOM 1339 C CB . ASN A 1 173 ? 29.734 -10.319 -43.139 1.00 189.64 ? 289 ASN G CB 1 ATOM 1340 C CG . ASN A 1 173 ? 30.444 -11.675 -43.226 1.00 194.52 ? 289 ASN G CG 1 ATOM 1341 O OD1 . ASN A 1 173 ? 29.850 -12.670 -43.634 1.00 191.62 ? 289 ASN G OD1 1 ATOM 1342 N ND2 . ASN A 1 173 ? 31.727 -11.704 -42.870 1.00 201.32 ? 289 ASN G ND2 1 ATOM 1343 N N . LYS A 1 174 ? 28.395 -11.352 -46.253 1.00 178.61 ? 290 LYS G N 1 ATOM 1344 C CA . LYS A 1 174 ? 28.659 -11.602 -47.674 1.00 163.45 ? 290 LYS G CA 1 ATOM 1345 C C . LYS A 1 174 ? 27.436 -12.283 -48.300 1.00 186.98 ? 290 LYS G C 1 ATOM 1346 O O . LYS A 1 174 ? 27.146 -13.434 -47.999 1.00 173.51 ? 290 LYS G O 1 ATOM 1347 C CB . LYS A 1 174 ? 29.917 -12.468 -47.805 0.00 178.94 ? 290 LYS G CB 1 ATOM 1348 C CG . LYS A 1 174 ? 30.332 -12.697 -49.269 0.00 185.58 ? 290 LYS G CG 1 ATOM 1349 C CD . LYS A 1 174 ? 31.694 -13.373 -49.405 0.00 194.03 ? 290 LYS G CD 1 ATOM 1350 C CE . LYS A 1 174 ? 32.139 -13.420 -50.867 0.00 201.02 ? 290 LYS G CE 1 ATOM 1351 N NZ . LYS A 1 174 ? 33.521 -13.963 -51.029 0.00 210.66 ? 290 LYS G NZ 1 ATOM 1352 N N . SER A 1 175 ? 26.724 -11.576 -49.169 1.00 193.62 ? 291 SER G N 1 ATOM 1353 C CA . SER A 1 175 ? 25.472 -12.082 -49.737 1.00 188.40 ? 291 SER G CA 1 ATOM 1354 C C . SER A 1 175 ? 25.618 -13.328 -50.610 1.00 188.70 ? 291 SER G C 1 ATOM 1355 O O . SER A 1 175 ? 26.706 -13.630 -51.108 1.00 196.65 ? 291 SER G O 1 ATOM 1356 C CB . SER A 1 175 ? 24.777 -10.977 -50.549 1.00 184.38 ? 291 SER G CB 1 ATOM 1357 O OG . SER A 1 175 ? 25.529 -10.609 -51.694 1.00 185.98 ? 291 SER G OG 1 ATOM 1358 N N . VAL A 1 176 ? 24.518 -14.067 -50.766 1.00 180.70 ? 292 VAL G N 1 ATOM 1359 C CA . VAL A 1 176 ? 24.525 -15.253 -51.634 1.00 182.84 ? 292 VAL G CA 1 ATOM 1360 C C . VAL A 1 176 ? 23.313 -15.184 -52.550 1.00 182.68 ? 292 VAL G C 1 ATOM 1361 O O . VAL A 1 176 ? 22.172 -15.107 -52.092 1.00 179.08 ? 292 VAL G O 1 ATOM 1362 C CB . VAL A 1 176 ? 24.506 -16.573 -50.865 1.00 180.15 ? 292 VAL G CB 1 ATOM 1363 C CG1 . VAL A 1 176 ? 24.420 -17.734 -51.842 1.00 184.65 ? 292 VAL G CG1 1 ATOM 1364 C CG2 . VAL A 1 176 ? 25.742 -16.695 -49.992 1.00 185.95 ? 292 VAL G CG2 1 ATOM 1365 N N . GLU A 1 177 ? 23.570 -15.267 -53.848 1.00 185.47 ? 293 GLU G N 1 ATOM 1366 C CA . GLU A 1 177 ? 22.524 -15.157 -54.855 1.00 177.22 ? 293 GLU G CA 1 ATOM 1367 C C . GLU A 1 177 ? 21.574 -16.357 -54.902 1.00 172.65 ? 293 GLU G C 1 ATOM 1368 O O . GLU A 1 177 ? 21.983 -17.510 -54.731 1.00 177.04 ? 293 GLU G O 1 ATOM 1369 C CB . GLU A 1 177 ? 23.197 -14.918 -56.202 1.00 183.22 ? 293 GLU G CB 1 ATOM 1370 C CG . GLU A 1 177 ? 23.790 -13.509 -56.273 1.00 189.98 ? 293 GLU G CG 1 ATOM 1371 C CD . GLU A 1 177 ? 24.330 -13.134 -57.641 1.00 201.69 ? 293 GLU G CD 1 ATOM 1372 O OE1 . GLU A 1 177 ? 24.770 -11.973 -57.815 1.00 201.01 ? 293 GLU G OE1 1 ATOM 1373 O OE2 . GLU A 1 177 ? 24.334 -14.005 -58.532 1.00 210.94 ? 293 GLU G OE2 1 ATOM 1374 N N . ILE A 1 178 ? 20.291 -16.051 -55.086 1.00 163.50 ? 294 ILE G N 1 ATOM 1375 C CA . ILE A 1 178 ? 19.246 -17.048 -55.328 1.00 160.22 ? 294 ILE G CA 1 ATOM 1376 C C . ILE A 1 178 ? 18.464 -16.853 -56.655 1.00 152.77 ? 294 ILE G C 1 ATOM 1377 O O . ILE A 1 178 ? 17.773 -15.835 -56.838 1.00 146.74 ? 294 ILE G O 1 ATOM 1378 C CB . ILE A 1 178 ? 18.252 -17.101 -54.124 1.00 143.48 ? 294 ILE G CB 1 ATOM 1379 C CG1 . ILE A 1 178 ? 17.095 -18.062 -54.406 1.00 144.16 ? 294 ILE G CG1 1 ATOM 1380 C CG2 . ILE A 1 178 ? 17.778 -15.702 -53.726 1.00 136.08 ? 294 ILE G CG2 1 ATOM 1381 C CD1 . ILE A 1 178 ? 16.116 -18.165 -53.277 1.00 139.22 ? 294 ILE G CD1 1 ATOM 1382 N N . ASN A 1 179 ? 18.690 -17.758 -57.610 1.00 166.02 ? 295 ASN G N 1 ATOM 1383 C CA . ASN A 1 179 ? 18.117 -17.662 -58.964 1.00 174.05 ? 295 ASN G CA 1 ATOM 1384 C C . ASN A 1 179 ? 16.758 -18.368 -59.134 1.00 169.21 ? 295 ASN G C 1 ATOM 1385 O O . ASN A 1 179 ? 16.704 -19.589 -59.183 1.00 171.21 ? 295 ASN G O 1 ATOM 1386 C CB . ASN A 1 179 ? 19.090 -18.246 -59.992 1.00 186.61 ? 295 ASN G CB 1 ATOM 1387 C CG . ASN A 1 179 ? 18.730 -17.871 -61.421 1.00 190.40 ? 295 ASN G CG 1 ATOM 1388 O OD1 . ASN A 1 179 ? 17.617 -17.421 -61.697 1.00 184.14 ? 295 ASN G OD1 1 ATOM 1389 N ND2 . ASN A 1 179 ? 19.657 -18.106 -62.346 1.00 200.68 ? 295 ASN G ND2 1 ATOM 1390 N N . CYS A 1 180 ? 15.676 -17.624 -59.310 1.00 160.72 ? 296 CYS G N 1 ATOM 1391 C CA . CYS A 1 180 ? 14.352 -18.244 -59.420 1.00 155.17 ? 296 CYS G CA 1 ATOM 1392 C C . CYS A 1 180 ? 13.778 -18.117 -60.825 1.00 161.16 ? 296 CYS G C 1 ATOM 1393 O O . CYS A 1 180 ? 13.725 -17.030 -61.385 1.00 165.16 ? 296 CYS G O 1 ATOM 1394 C CB . CYS A 1 180 ? 13.393 -17.676 -58.375 1.00 145.05 ? 296 CYS G CB 1 ATOM 1395 S SG . CYS A 1 180 ? 13.823 -18.205 -56.681 1.00 173.30 ? 296 CYS G SG 1 ATOM 1396 N N . THR A 1 181 ? 13.331 -19.249 -61.367 1.00 159.44 ? 297 THR G N 1 ATOM 1397 C CA . THR A 1 181 ? 12.830 -19.343 -62.731 1.00 160.94 ? 297 THR G CA 1 ATOM 1398 C C . THR A 1 181 ? 11.547 -20.146 -62.871 1.00 155.48 ? 297 THR G C 1 ATOM 1399 O O . THR A 1 181 ? 11.327 -21.116 -62.147 1.00 146.14 ? 297 THR G O 1 ATOM 1400 C CB . THR A 1 181 ? 13.874 -20.044 -63.628 1.00 162.64 ? 297 THR G CB 1 ATOM 1401 O OG1 . THR A 1 181 ? 15.169 -19.474 -63.419 1.00 166.23 ? 297 THR G OG1 1 ATOM 1402 C CG2 . THR A 1 181 ? 13.490 -19.975 -65.099 1.00 183.26 ? 297 THR G CG2 1 ATOM 1403 N N . ARG A 1 182 ? 10.693 -19.713 -63.792 1.00 155.64 ? 298 ARG G N 1 ATOM 1404 C CA . ARG A 1 182 ? 9.570 -20.514 -64.250 1.00 155.80 ? 298 ARG G CA 1 ATOM 1405 C C . ARG A 1 182 ? 9.572 -20.531 -65.769 1.00 164.80 ? 298 ARG G C 1 ATOM 1406 O O . ARG A 1 182 ? 9.235 -19.525 -66.396 1.00 160.21 ? 298 ARG G O 1 ATOM 1407 C CB . ARG A 1 182 ? 8.240 -19.959 -63.729 1.00 146.13 ? 298 ARG G CB 1 ATOM 1408 C CG . ARG A 1 182 ? 7.045 -20.864 -64.003 1.00 144.43 ? 298 ARG G CG 1 ATOM 1409 C CD . ARG A 1 182 ? 5.846 -20.075 -64.519 1.00 142.80 ? 298 ARG G CD 1 ATOM 1410 N NE . ARG A 1 182 ? 5.978 -19.782 -65.946 1.00 162.76 ? 298 ARG G NE 1 ATOM 1411 C CZ . ARG A 1 182 ? 5.093 -19.106 -66.679 1.00 174.65 ? 298 ARG G CZ 1 ATOM 1412 N NH1 . ARG A 1 182 ? 3.969 -18.659 -66.136 1.00 175.33 ? 298 ARG G NH1 1 ATOM 1413 N NH2 . ARG A 1 182 ? 5.322 -18.904 -67.973 1.00 183.38 ? 298 ARG G NH2 1 ATOM 1414 N N . PRO A 1 183 ? 9.986 -21.661 -66.367 1.00 174.66 ? 299 PRO G N 1 ATOM 1415 C CA . PRO A 1 183 ? 10.102 -21.801 -67.825 1.00 188.65 ? 299 PRO G CA 1 ATOM 1416 C C . PRO A 1 183 ? 8.786 -21.503 -68.537 1.00 187.69 ? 299 PRO G C 1 ATOM 1417 O O . PRO A 1 183 ? 7.738 -21.562 -67.897 1.00 184.39 ? 299 PRO G O 1 ATOM 1418 C CB . PRO A 1 183 ? 10.489 -23.273 -68.003 1.00 195.75 ? 299 PRO G CB 1 ATOM 1419 C CG . PRO A 1 183 ? 11.140 -23.650 -66.719 1.00 188.31 ? 299 PRO G CG 1 ATOM 1420 C CD . PRO A 1 183 ? 10.415 -22.878 -65.661 1.00 173.47 ? 299 PRO G CD 1 ATOM 1421 N N . SER A 1 184 ? 8.807 -21.253 -69.839 1.00 192.16 ? 300 SER G N 1 ATOM 1422 C CA . SER A 1 184 ? 7.553 -20.927 -70.491 1.00 195.54 ? 300 SER G CA 1 ATOM 1423 C C . SER A 1 184 ? 6.997 -22.218 -71.097 1.00 204.65 ? 300 SER G C 1 ATOM 1424 O O . SER A 1 184 ? 7.565 -23.295 -70.876 1.00 208.53 ? 300 SER G O 1 ATOM 1425 C CB . SER A 1 184 ? 7.752 -19.865 -71.565 1.00 203.36 ? 300 SER G CB 1 ATOM 1426 O OG . SER A 1 184 ? 8.937 -20.117 -72.302 1.00 210.98 ? 300 SER G OG 1 ATOM 1427 N N . ASN A 1 185 ? 5.858 -22.104 -71.785 1.00 205.48 ? 301 ASN G N 1 ATOM 1428 C CA . ASN A 1 185 ? 5.196 -23.201 -72.511 1.00 207.66 ? 301 ASN G CA 1 ATOM 1429 C C . ASN A 1 185 ? 4.331 -24.048 -71.571 1.00 200.73 ? 301 ASN G C 1 ATOM 1430 O O . ASN A 1 185 ? 3.102 -23.964 -71.577 1.00 181.57 ? 301 ASN G O 1 ATOM 1431 C CB . ASN A 1 185 ? 6.199 -24.080 -73.272 1.00 216.04 ? 301 ASN G CB 1 ATOM 1432 C CG . ASN A 1 185 ? 5.530 -24.973 -74.307 1.00 222.51 ? 301 ASN G CG 1 ATOM 1433 O OD1 . ASN A 1 185 ? 4.389 -24.741 -74.705 1.00 209.40 ? 301 ASN G OD1 1 ATOM 1434 N ND2 . ASN A 1 185 ? 6.246 -25.998 -74.749 1.00 230.39 ? 301 ASN G ND2 1 ATOM 1435 N N . ILE A 1 194 ? 2.025 -25.256 -65.085 1.00 172.18 ? 326 ILE G N 1 ATOM 1436 C CA . ILE A 1 194 ? 2.257 -23.826 -65.250 1.00 177.91 ? 326 ILE G CA 1 ATOM 1437 C C . ILE A 1 194 ? 2.680 -23.188 -63.935 1.00 177.44 ? 326 ILE G C 1 ATOM 1438 O O . ILE A 1 194 ? 3.563 -22.336 -63.899 1.00 180.73 ? 326 ILE G O 1 ATOM 1439 C CB . ILE A 1 194 ? 1.006 -23.112 -65.788 1.00 176.76 ? 326 ILE G CB 1 ATOM 1440 C CG1 . ILE A 1 194 ? -0.251 -23.663 -65.116 1.00 174.93 ? 326 ILE G CG1 1 ATOM 1441 C CG2 . ILE A 1 194 ? 0.900 -23.296 -67.281 1.00 182.06 ? 326 ILE G CG2 1 ATOM 1442 C CD1 . ILE A 1 194 ? -1.544 -23.168 -65.733 1.00 172.99 ? 326 ILE G CD1 1 ATOM 1443 N N . ARG A 1 195 ? 2.043 -23.619 -62.855 1.00 169.20 ? 327 ARG G N 1 ATOM 1444 C CA . ARG A 1 195 ? 2.344 -23.110 -61.529 1.00 153.00 ? 327 ARG G CA 1 ATOM 1445 C C . ARG A 1 195 ? 3.662 -23.603 -60.962 1.00 152.26 ? 327 ARG G C 1 ATOM 1446 O O . ARG A 1 195 ? 4.085 -23.195 -59.892 1.00 143.18 ? 327 ARG G O 1 ATOM 1447 C CB . ARG A 1 195 ? 1.379 -23.691 -60.492 0.00 144.84 ? 327 ARG G CB 1 ATOM 1448 C CG . ARG A 1 195 ? -0.057 -23.218 -60.650 0.00 139.53 ? 327 ARG G CG 1 ATOM 1449 C CD . ARG A 1 195 ? -1.007 -23.757 -59.592 0.00 131.38 ? 327 ARG G CD 1 ATOM 1450 N NE . ARG A 1 195 ? -2.384 -23.332 -59.825 0.00 126.74 ? 327 ARG G NE 1 ATOM 1451 C CZ . ARG A 1 195 ? -3.423 -23.754 -59.120 0.00 121.09 ? 327 ARG G CZ 1 ATOM 1452 N NH1 . ARG A 1 195 ? -3.248 -24.615 -58.125 0.00 118.12 ? 327 ARG G NH1 1 ATOM 1453 N NH2 . ARG A 1 195 ? -4.643 -23.315 -59.403 0.00 119.72 ? 327 ARG G NH2 1 ATOM 1454 N N . LYS A 1 196 ? 4.300 -24.508 -61.682 1.00 161.48 ? 328 LYS G N 1 ATOM 1455 C CA . LYS A 1 196 ? 5.568 -25.055 -61.245 1.00 158.98 ? 328 LYS G CA 1 ATOM 1456 C C . LYS A 1 196 ? 6.545 -23.893 -61.297 1.00 152.59 ? 328 LYS G C 1 ATOM 1457 O O . LYS A 1 196 ? 6.284 -22.879 -61.916 1.00 156.34 ? 328 LYS G O 1 ATOM 1458 C CB . LYS A 1 196 ? 5.993 -26.127 -62.241 0.00 172.49 ? 328 LYS G CB 1 ATOM 1459 C CG . LYS A 1 196 ? 7.288 -26.838 -61.886 0.00 181.69 ? 328 LYS G CG 1 ATOM 1460 C CD . LYS A 1 196 ? 7.143 -27.678 -60.627 0.00 182.92 ? 328 LYS G CD 1 ATOM 1461 C CE . LYS A 1 196 ? 8.229 -28.737 -60.552 0.00 194.12 ? 328 LYS G CE 1 ATOM 1462 N NZ . LYS A 1 196 ? 9.566 -28.191 -60.903 0.00 200.92 ? 328 LYS G NZ 1 ATOM 1463 N N . ALA A 1 197 ? 7.678 -24.080 -60.642 1.00 144.44 ? 329 ALA G N 1 ATOM 1464 C CA . ALA A 1 197 ? 8.776 -23.131 -60.574 1.00 145.20 ? 329 ALA G CA 1 ATOM 1465 C C . ALA A 1 197 ? 9.960 -23.689 -59.798 1.00 148.23 ? 329 ALA G C 1 ATOM 1466 O O . ALA A 1 197 ? 9.833 -24.702 -59.111 1.00 151.43 ? 329 ALA G O 1 ATOM 1467 C CB . ALA A 1 197 ? 8.304 -21.853 -59.954 1.00 143.22 ? 329 ALA G CB 1 ATOM 1468 N N . TYR A 1 198 ? 11.134 -23.089 -59.966 1.00 138.08 ? 330 TYR G N 1 ATOM 1469 C CA . TYR A 1 198 ? 12.300 -23.547 -59.212 1.00 139.91 ? 330 TYR G CA 1 ATOM 1470 C C . TYR A 1 198 ? 13.284 -22.431 -58.841 1.00 161.28 ? 330 TYR G C 1 ATOM 1471 O O . TYR A 1 198 ? 13.266 -21.357 -59.429 1.00 140.45 ? 330 TYR G O 1 ATOM 1472 C CB . TYR A 1 198 ? 12.986 -24.675 -60.004 1.00 149.13 ? 330 TYR G CB 1 ATOM 1473 C CG . TYR A 1 198 ? 13.491 -24.234 -61.360 1.00 174.58 ? 330 TYR G CG 1 ATOM 1474 C CD1 . TYR A 1 198 ? 14.775 -23.734 -61.541 1.00 179.74 ? 330 TYR G CD1 1 ATOM 1475 C CD2 . TYR A 1 198 ? 12.658 -24.319 -62.470 1.00 176.27 ? 330 TYR G CD2 1 ATOM 1476 C CE1 . TYR A 1 198 ? 15.207 -23.317 -62.799 1.00 187.03 ? 330 TYR G CE1 1 ATOM 1477 C CE2 . TYR A 1 198 ? 13.075 -23.912 -63.719 1.00 184.52 ? 330 TYR G CE2 1 ATOM 1478 C CZ . TYR A 1 198 ? 14.349 -23.414 -63.887 1.00 190.83 ? 330 TYR G CZ 1 ATOM 1479 O OH . TYR A 1 198 ? 14.745 -23.014 -65.154 1.00 200.28 ? 330 TYR G OH 1 ATOM 1480 N N . CYS A 1 199 ? 14.153 -22.714 -57.871 1.00 159.46 ? 331 CYS G N 1 ATOM 1481 C CA . CYS A 1 199 ? 15.219 -21.802 -57.432 1.00 161.77 ? 331 CYS G CA 1 ATOM 1482 C C . CYS A 1 199 ? 16.572 -22.489 -57.419 1.00 168.91 ? 331 CYS G C 1 ATOM 1483 O O . CYS A 1 199 ? 16.657 -23.704 -57.240 1.00 169.35 ? 331 CYS G O 1 ATOM 1484 C CB . CYS A 1 199 ? 14.961 -21.245 -56.020 1.00 155.17 ? 331 CYS G CB 1 ATOM 1485 S SG . CYS A 1 199 ? 13.639 -20.041 -55.809 1.00 153.12 ? 331 CYS G SG 1 ATOM 1486 N N . GLU A 1 200 ? 17.627 -21.710 -57.621 1.00 177.88 ? 332 GLU G N 1 ATOM 1487 C CA . GLU A 1 200 ? 18.972 -22.243 -57.619 1.00 194.55 ? 332 GLU G CA 1 ATOM 1488 C C . GLU A 1 200 ? 19.914 -21.486 -56.679 1.00 202.06 ? 332 GLU G C 1 ATOM 1489 O O . GLU A 1 200 ? 19.891 -20.251 -56.638 1.00 194.96 ? 332 GLU G O 1 ATOM 1490 C CB . GLU A 1 200 ? 19.510 -22.195 -59.052 1.00 204.37 ? 332 GLU G CB 1 ATOM 1491 C CG . GLU A 1 200 ? 20.949 -22.617 -59.224 1.00 210.40 ? 332 GLU G CG 1 ATOM 1492 C CD . GLU A 1 200 ? 21.402 -22.524 -60.665 1.00 211.35 ? 332 GLU G CD 1 ATOM 1493 O OE1 . GLU A 1 200 ? 20.684 -23.041 -61.547 1.00 212.74 ? 332 GLU G OE1 1 ATOM 1494 O OE2 . GLU A 1 200 ? 22.474 -21.937 -60.917 1.00 211.19 ? 332 GLU G OE2 1 ATOM 1495 N N . ILE A 1 201 ? 20.748 -22.219 -55.939 1.00 216.44 ? 333 ILE G N 1 ATOM 1496 C CA . ILE A 1 201 ? 21.729 -21.581 -55.062 1.00 229.39 ? 333 ILE G CA 1 ATOM 1497 C C . ILE A 1 201 ? 23.030 -22.377 -55.154 1.00 257.53 ? 333 ILE G C 1 ATOM 1498 O O . ILE A 1 201 ? 23.008 -23.625 -55.143 1.00 266.15 ? 333 ILE G O 1 ATOM 1499 C CB . ILE A 1 201 ? 21.265 -21.521 -53.571 1.00 162.76 ? 333 ILE G CB 1 ATOM 1500 C CG1 . ILE A 1 201 ? 19.883 -20.875 -53.412 1.00 154.39 ? 333 ILE G CG1 1 ATOM 1501 C CG2 . ILE A 1 201 ? 22.257 -20.747 -52.720 1.00 163.12 ? 333 ILE G CG2 1 ATOM 1502 C CD1 . ILE A 1 201 ? 18.709 -21.809 -53.604 1.00 140.13 ? 333 ILE G CD1 1 ATOM 1503 N N . ASN A 1 202 ? 24.156 -21.661 -55.140 1.00 285.32 ? 334 ASN G N 1 ATOM 1504 C CA . ASN A 1 202 ? 25.471 -22.286 -55.132 1.00 140.40 ? 334 ASN G CA 1 ATOM 1505 C C . ASN A 1 202 ? 25.703 -22.877 -53.748 1.00 128.90 ? 334 ASN G C 1 ATOM 1506 O O . ASN A 1 202 ? 25.881 -22.138 -52.777 1.00 131.23 ? 334 ASN G O 1 ATOM 1507 C CB . ASN A 1 202 ? 26.565 -21.283 -55.541 1.00 160.47 ? 334 ASN G CB 1 ATOM 1508 C CG . ASN A 1 202 ? 27.955 -21.913 -55.635 1.00 173.19 ? 334 ASN G CG 1 ATOM 1509 O OD1 . ASN A 1 202 ? 28.135 -23.102 -55.380 1.00 178.79 ? 334 ASN G OD1 1 ATOM 1510 N ND2 . ASN A 1 202 ? 28.936 -21.114 -56.051 1.00 173.12 ? 334 ASN G ND2 1 ATOM 1511 N N . GLY A 1 203 ? 25.695 -24.198 -53.660 1.00 260.56 ? 335 GLY G N 1 ATOM 1512 C CA . GLY A 1 203 ? 25.882 -24.889 -52.403 1.00 235.40 ? 335 GLY G CA 1 ATOM 1513 C C . GLY A 1 203 ? 27.116 -24.486 -51.618 1.00 217.01 ? 335 GLY G C 1 ATOM 1514 O O . GLY A 1 203 ? 27.040 -24.309 -50.414 1.00 209.31 ? 335 GLY G O 1 ATOM 1515 N N . THR A 1 204 ? 28.243 -24.315 -52.308 1.00 214.62 ? 336 THR G N 1 ATOM 1516 C CA . THR A 1 204 ? 29.516 -23.948 -51.675 1.00 205.99 ? 336 THR G CA 1 ATOM 1517 C C . THR A 1 204 ? 29.514 -22.614 -50.909 1.00 197.83 ? 336 THR G C 1 ATOM 1518 O O . THR A 1 204 ? 29.826 -22.588 -49.706 1.00 194.74 ? 336 THR G O 1 ATOM 1519 C CB . THR A 1 204 ? 30.640 -23.888 -52.737 1.00 203.30 ? 336 THR G CB 1 ATOM 1520 O OG1 . THR A 1 204 ? 30.739 -25.148 -53.415 1.00 205.67 ? 336 THR G OG1 1 ATOM 1521 C CG2 . THR A 1 204 ? 31.977 -23.542 -52.096 1.00 204.45 ? 336 THR G CG2 1 ATOM 1522 N N . LYS A 1 205 ? 29.147 -21.524 -51.585 1.00 194.55 ? 337 LYS G N 1 ATOM 1523 C CA . LYS A 1 205 ? 29.076 -20.205 -50.948 1.00 188.65 ? 337 LYS G CA 1 ATOM 1524 C C . LYS A 1 205 ? 28.120 -20.263 -49.767 1.00 190.50 ? 337 LYS G C 1 ATOM 1525 O O . LYS A 1 205 ? 28.462 -19.847 -48.652 1.00 191.38 ? 337 LYS G O 1 ATOM 1526 C CB . LYS A 1 205 ? 28.669 -19.103 -51.931 0.00 182.26 ? 337 LYS G CB 1 ATOM 1527 C CG . LYS A 1 205 ? 29.740 -18.798 -52.966 0.00 183.71 ? 337 LYS G CG 1 ATOM 1528 C CD . LYS A 1 205 ? 29.275 -17.804 -54.021 0.00 177.27 ? 337 LYS G CD 1 ATOM 1529 C CE . LYS A 1 205 ? 29.493 -16.371 -53.567 0.00 171.05 ? 337 LYS G CE 1 ATOM 1530 N NZ . LYS A 1 205 ? 29.582 -15.458 -54.737 0.00 170.09 ? 337 LYS G NZ 1 ATOM 1531 N N . TRP A 1 206 ? 26.943 -20.831 -50.006 1.00 191.49 ? 338 TRP G N 1 ATOM 1532 C CA . TRP A 1 206 ? 25.908 -20.914 -48.989 1.00 187.19 ? 338 TRP G CA 1 ATOM 1533 C C . TRP A 1 206 ? 26.415 -21.663 -47.761 1.00 182.04 ? 338 TRP G C 1 ATOM 1534 O O . TRP A 1 206 ? 26.473 -21.092 -46.671 1.00 176.35 ? 338 TRP G O 1 ATOM 1535 C CB . TRP A 1 206 ? 24.684 -21.631 -49.555 1.00 193.47 ? 338 TRP G CB 1 ATOM 1536 C CG . TRP A 1 206 ? 23.584 -21.780 -48.569 1.00 198.71 ? 338 TRP G CG 1 ATOM 1537 C CD1 . TRP A 1 206 ? 23.112 -22.940 -48.027 1.00 201.50 ? 338 TRP G CD1 1 ATOM 1538 C CD2 . TRP A 1 206 ? 22.788 -20.728 -48.022 1.00 199.53 ? 338 TRP G CD2 1 ATOM 1539 N NE1 . TRP A 1 206 ? 22.080 -22.671 -47.160 1.00 198.03 ? 338 TRP G NE1 1 ATOM 1540 C CE2 . TRP A 1 206 ? 21.856 -21.320 -47.146 1.00 195.48 ? 338 TRP G CE2 1 ATOM 1541 C CE3 . TRP A 1 206 ? 22.772 -19.339 -48.188 1.00 202.43 ? 338 TRP G CE3 1 ATOM 1542 C CZ2 . TRP A 1 206 ? 20.933 -20.570 -46.424 1.00 193.06 ? 338 TRP G CZ2 1 ATOM 1543 C CZ3 . TRP A 1 206 ? 21.846 -18.597 -47.480 1.00 198.25 ? 338 TRP G CZ3 1 ATOM 1544 C CH2 . TRP A 1 206 ? 20.936 -19.215 -46.611 1.00 193.43 ? 338 TRP G CH2 1 ATOM 1545 N N . ASN A 1 207 ? 26.767 -22.934 -47.929 1.00 184.65 ? 339 ASN G N 1 ATOM 1546 C CA . ASN A 1 207 ? 27.233 -23.757 -46.817 1.00 184.47 ? 339 ASN G CA 1 ATOM 1547 C C . ASN A 1 207 ? 28.379 -23.096 -46.048 1.00 186.74 ? 339 ASN G C 1 ATOM 1548 O O . ASN A 1 207 ? 28.433 -23.190 -44.820 1.00 185.41 ? 339 ASN G O 1 ATOM 1549 C CB . ASN A 1 207 ? 27.692 -25.133 -47.316 1.00 187.39 ? 339 ASN G CB 1 ATOM 1550 C CG . ASN A 1 207 ? 26.539 -26.037 -47.706 1.00 183.16 ? 339 ASN G CG 1 ATOM 1551 O OD1 . ASN A 1 207 ? 26.287 -27.042 -47.051 1.00 182.75 ? 339 ASN G OD1 1 ATOM 1552 N ND2 . ASN A 1 207 ? 25.841 -25.691 -48.779 1.00 184.40 ? 339 ASN G ND2 1 ATOM 1553 N N . LYS A 1 208 ? 29.302 -22.450 -46.769 1.00 188.94 ? 340 LYS G N 1 ATOM 1554 C CA . LYS A 1 208 ? 30.379 -21.696 -46.115 1.00 188.88 ? 340 LYS G CA 1 ATOM 1555 C C . LYS A 1 208 ? 29.802 -20.640 -45.172 1.00 180.65 ? 340 LYS G C 1 ATOM 1556 O O . LYS A 1 208 ? 30.216 -20.510 -43.998 1.00 180.49 ? 340 LYS G O 1 ATOM 1557 C CB . LYS A 1 208 ? 31.285 -21.030 -47.166 0.00 191.80 ? 340 LYS G CB 1 ATOM 1558 C CG . LYS A 1 208 ? 32.433 -20.175 -46.607 0.00 194.93 ? 340 LYS G CG 1 ATOM 1559 C CD . LYS A 1 208 ? 33.322 -19.617 -47.728 0.00 198.82 ? 340 LYS G CD 1 ATOM 1560 C CE . LYS A 1 208 ? 34.497 -18.807 -47.189 0.00 203.42 ? 340 LYS G CE 1 ATOM 1561 N NZ . LYS A 1 208 ? 35.362 -19.611 -46.279 0.00 209.95 ? 340 LYS G NZ 1 ATOM 1562 N N . VAL A 1 209 ? 28.801 -19.919 -45.675 1.00 174.86 ? 341 VAL G N 1 ATOM 1563 C CA . VAL A 1 209 ? 28.163 -18.888 -44.864 1.00 168.84 ? 341 VAL G CA 1 ATOM 1564 C C . VAL A 1 209 ? 27.392 -19.499 -43.682 1.00 164.87 ? 341 VAL G C 1 ATOM 1565 O O . VAL A 1 209 ? 27.230 -18.855 -42.635 1.00 158.93 ? 341 VAL G O 1 ATOM 1566 C CB . VAL A 1 209 ? 27.231 -18.003 -45.735 1.00 176.20 ? 341 VAL G CB 1 ATOM 1567 C CG1 . VAL A 1 209 ? 26.602 -16.901 -44.908 1.00 172.84 ? 341 VAL G CG1 1 ATOM 1568 C CG2 . VAL A 1 209 ? 28.015 -17.378 -46.884 1.00 177.42 ? 341 VAL G CG2 1 ATOM 1569 N N . LEU A 1 210 ? 26.967 -20.755 -43.819 1.00 168.96 ? 342 LEU G N 1 ATOM 1570 C CA . LEU A 1 210 ? 26.291 -21.430 -42.707 1.00 167.71 ? 342 LEU G CA 1 ATOM 1571 C C . LEU A 1 210 ? 27.311 -21.775 -41.632 1.00 173.20 ? 342 LEU G C 1 ATOM 1572 O O . LEU A 1 210 ? 27.051 -21.548 -40.457 1.00 167.78 ? 342 LEU G O 1 ATOM 1573 C CB . LEU A 1 210 ? 25.503 -22.668 -43.149 1.00 164.15 ? 342 LEU G CB 1 ATOM 1574 C CG . LEU A 1 210 ? 24.053 -22.307 -43.508 1.00 152.25 ? 342 LEU G CG 1 ATOM 1575 C CD1 . LEU A 1 210 ? 24.017 -21.442 -44.742 1.00 148.73 ? 342 LEU G CD1 1 ATOM 1576 C CD2 . LEU A 1 210 ? 23.146 -23.522 -43.674 1.00 150.05 ? 342 LEU G CD2 1 ATOM 1577 N N . LYS A 1 211 ? 28.422 -22.399 -42.019 1.00 183.36 ? 343 LYS G N 1 ATOM 1578 C CA . LYS A 1 211 ? 29.509 -22.656 -41.077 1.00 193.09 ? 343 LYS G CA 1 ATOM 1579 C C . LYS A 1 211 ? 29.775 -21.375 -40.266 1.00 191.97 ? 343 LYS G C 1 ATOM 1580 O O . LYS A 1 211 ? 29.815 -21.406 -39.027 1.00 192.51 ? 343 LYS G O 1 ATOM 1581 C CB . LYS A 1 211 ? 30.757 -23.134 -41.824 1.00 204.83 ? 343 LYS G CB 1 ATOM 1582 C CG . LYS A 1 211 ? 30.579 -24.529 -42.425 1.00 212.56 ? 343 LYS G CG 1 ATOM 1583 C CD . LYS A 1 211 ? 31.650 -24.867 -43.450 1.00 222.43 ? 343 LYS G CD 1 ATOM 1584 C CE . LYS A 1 211 ? 31.604 -26.343 -43.838 1.00 229.23 ? 343 LYS G CE 1 ATOM 1585 N NZ . LYS A 1 211 ? 32.049 -27.250 -42.745 1.00 237.21 ? 343 LYS G NZ 1 ATOM 1586 N N . GLN A 1 212 ? 29.907 -20.242 -40.966 1.00 192.20 ? 344 GLN G N 1 ATOM 1587 C CA . GLN A 1 212 ? 30.272 -18.978 -40.295 1.00 191.60 ? 344 GLN G CA 1 ATOM 1588 C C . GLN A 1 212 ? 29.167 -18.461 -39.341 1.00 178.18 ? 344 GLN G C 1 ATOM 1589 O O . GLN A 1 212 ? 29.435 -18.042 -38.199 1.00 172.07 ? 344 GLN G O 1 ATOM 1590 C CB . GLN A 1 212 ? 30.634 -17.876 -41.313 1.00 196.05 ? 344 GLN G CB 1 ATOM 1591 C CG . GLN A 1 212 ? 31.790 -18.203 -42.274 1.00 203.37 ? 344 GLN G CG 1 ATOM 1592 C CD . GLN A 1 212 ? 32.107 -17.068 -43.254 1.00 202.28 ? 344 GLN G CD 1 ATOM 1593 O OE1 . GLN A 1 212 ? 31.832 -15.895 -42.983 1.00 196.56 ? 344 GLN G OE1 1 ATOM 1594 N NE2 . GLN A 1 212 ? 32.700 -17.419 -44.391 1.00 206.99 ? 344 GLN G NE2 1 ATOM 1595 N N . VAL A 1 213 ? 27.917 -18.533 -39.790 1.00 173.57 ? 345 VAL G N 1 ATOM 1596 C CA . VAL A 1 213 ? 26.808 -18.032 -38.979 1.00 166.65 ? 345 VAL G CA 1 ATOM 1597 C C . VAL A 1 213 ? 26.609 -18.916 -37.756 1.00 162.40 ? 345 VAL G C 1 ATOM 1598 O O . VAL A 1 213 ? 26.389 -18.411 -36.646 1.00 158.95 ? 345 VAL G O 1 ATOM 1599 C CB . VAL A 1 213 ? 25.476 -17.915 -39.765 1.00 187.18 ? 345 VAL G CB 1 ATOM 1600 C CG1 . VAL A 1 213 ? 25.084 -19.222 -40.394 1.00 185.84 ? 345 VAL G CG1 1 ATOM 1601 C CG2 . VAL A 1 213 ? 24.368 -17.461 -38.835 1.00 183.32 ? 345 VAL G CG2 1 ATOM 1602 N N . THR A 1 214 ? 26.699 -20.227 -37.941 1.00 165.52 ? 346 THR G N 1 ATOM 1603 C CA . THR A 1 214 ? 26.548 -21.101 -36.800 1.00 167.44 ? 346 THR G CA 1 ATOM 1604 C C . THR A 1 214 ? 27.694 -20.893 -35.828 1.00 170.43 ? 346 THR G C 1 ATOM 1605 O O . THR A 1 214 ? 27.483 -20.962 -34.623 1.00 165.69 ? 346 THR G O 1 ATOM 1606 C CB . THR A 1 214 ? 26.509 -22.605 -37.187 1.00 173.11 ? 346 THR G CB 1 ATOM 1607 O OG1 . THR A 1 214 ? 27.770 -23.004 -37.737 1.00 178.02 ? 346 THR G OG1 1 ATOM 1608 C CG2 . THR A 1 214 ? 25.404 -22.888 -38.186 1.00 170.09 ? 346 THR G CG2 1 ATOM 1609 N N . GLU A 1 215 ? 28.893 -20.596 -36.315 1.00 180.70 ? 347 GLU G N 1 ATOM 1610 C CA . GLU A 1 215 ? 29.960 -20.353 -35.351 1.00 191.62 ? 347 GLU G CA 1 ATOM 1611 C C . GLU A 1 215 ? 29.732 -19.031 -34.568 1.00 206.35 ? 347 GLU G C 1 ATOM 1612 O O . GLU A 1 215 ? 30.073 -18.967 -33.381 1.00 211.12 ? 347 GLU G O 1 ATOM 1613 C CB . GLU A 1 215 ? 31.356 -20.424 -36.010 1.00 203.30 ? 347 GLU G CB 1 ATOM 1614 C CG . GLU A 1 215 ? 31.720 -19.398 -37.062 1.00 207.65 ? 347 GLU G CG 1 ATOM 1615 C CD . GLU A 1 215 ? 32.743 -19.923 -38.069 1.00 217.45 ? 347 GLU G CD 1 ATOM 1616 O OE1 . GLU A 1 215 ? 33.022 -21.142 -38.066 1.00 222.12 ? 347 GLU G OE1 1 ATOM 1617 O OE2 . GLU A 1 215 ? 33.267 -19.115 -38.866 1.00 220.32 ? 347 GLU G OE2 1 ATOM 1618 N N . LYS A 1 216 ? 29.256 -17.985 -35.228 1.00 199.05 ? 348 LYS G N 1 ATOM 1619 C CA . LYS A 1 216 ? 28.996 -16.740 -34.517 1.00 192.18 ? 348 LYS G CA 1 ATOM 1620 C C . LYS A 1 216 ? 27.855 -16.891 -33.524 1.00 183.28 ? 348 LYS G C 1 ATOM 1621 O O . LYS A 1 216 ? 27.916 -16.407 -32.397 1.00 181.97 ? 348 LYS G O 1 ATOM 1622 C CB . LYS A 1 216 ? 28.689 -15.607 -35.489 1.00 187.19 ? 348 LYS G CB 1 ATOM 1623 C CG . LYS A 1 216 ? 28.827 -14.231 -34.867 1.00 184.34 ? 348 LYS G CG 1 ATOM 1624 C CD . LYS A 1 216 ? 30.277 -13.938 -34.528 1.00 190.27 ? 348 LYS G CD 1 ATOM 1625 C CE . LYS A 1 216 ? 30.422 -12.654 -33.733 1.00 189.98 ? 348 LYS G CE 1 ATOM 1626 N NZ . LYS A 1 216 ? 31.854 -12.344 -33.464 1.00 196.21 ? 348 LYS G NZ 1 ATOM 1627 N N . LEU A 1 217 ? 26.806 -17.568 -33.967 1.00 179.19 ? 349 LEU G N 1 ATOM 1628 C CA . LEU A 1 217 ? 25.623 -17.758 -33.151 1.00 178.35 ? 349 LEU G CA 1 ATOM 1629 C C . LEU A 1 217 ? 25.959 -18.579 -31.927 1.00 178.57 ? 349 LEU G C 1 ATOM 1630 O O . LEU A 1 217 ? 25.555 -18.267 -30.808 1.00 171.01 ? 349 LEU G O 1 ATOM 1631 C CB . LEU A 1 217 ? 24.555 -18.469 -33.973 1.00 177.67 ? 349 LEU G CB 1 ATOM 1632 C CG . LEU A 1 217 ? 23.217 -18.668 -33.280 1.00 176.46 ? 349 LEU G CG 1 ATOM 1633 C CD1 . LEU A 1 217 ? 23.005 -17.572 -32.262 1.00 180.43 ? 349 LEU G CD1 1 ATOM 1634 C CD2 . LEU A 1 217 ? 22.104 -18.691 -34.302 1.00 164.27 ? 349 LEU G CD2 1 ATOM 1635 N N . LYS A 1 218 ? 26.743 -19.619 -32.154 1.00 182.12 ? 350 LYS G N 1 ATOM 1636 C CA . LYS A 1 218 ? 27.150 -20.498 -31.089 1.00 182.21 ? 350 LYS G CA 1 ATOM 1637 C C . LYS A 1 218 ? 27.922 -19.611 -30.157 1.00 182.81 ? 350 LYS G C 1 ATOM 1638 O O . LYS A 1 218 ? 27.778 -19.663 -28.946 1.00 185.70 ? 350 LYS G O 1 ATOM 1639 C CB . LYS A 1 218 ? 28.069 -21.572 -31.663 1.00 186.92 ? 350 LYS G CB 1 ATOM 1640 C CG . LYS A 1 218 ? 28.743 -22.457 -30.642 1.00 195.70 ? 350 LYS G CG 1 ATOM 1641 C CD . LYS A 1 218 ? 29.692 -23.429 -31.318 1.00 178.47 ? 350 LYS G CD 1 ATOM 1642 C CE . LYS A 1 218 ? 29.002 -24.195 -32.435 1.00 174.93 ? 350 LYS G CE 1 ATOM 1643 N NZ . LYS A 1 218 ? 27.884 -25.043 -31.945 1.00 174.72 ? 350 LYS G NZ 1 ATOM 1644 N N . GLU A 1 219 ? 28.729 -18.758 -30.751 1.00 182.24 ? 351 GLU G N 1 ATOM 1645 C CA . GLU A 1 219 ? 29.572 -17.858 -29.974 1.00 183.28 ? 351 GLU G CA 1 ATOM 1646 C C . GLU A 1 219 ? 28.660 -17.211 -28.928 1.00 175.83 ? 351 GLU G C 1 ATOM 1647 O O . GLU A 1 219 ? 29.110 -16.879 -27.832 1.00 177.10 ? 351 GLU G O 1 ATOM 1648 C CB . GLU A 1 219 ? 30.262 -16.816 -30.864 1.00 182.96 ? 351 GLU G CB 1 ATOM 1649 C CG . GLU A 1 219 ? 31.143 -15.812 -30.137 1.00 187.59 ? 351 GLU G CG 1 ATOM 1650 C CD . GLU A 1 219 ? 31.854 -14.867 -31.091 1.00 189.32 ? 351 GLU G CD 1 ATOM 1651 O OE1 . GLU A 1 219 ? 32.843 -15.293 -31.725 1.00 191.85 ? 351 GLU G OE1 1 ATOM 1652 O OE2 . GLU A 1 219 ? 31.421 -13.700 -31.205 1.00 188.74 ? 351 GLU G OE2 1 ATOM 1653 N N . HIS A 1 220 ? 27.377 -17.042 -29.264 1.00 170.92 ? 352 HIS G N 1 ATOM 1654 C CA . HIS A 1 220 ? 26.430 -16.376 -28.345 1.00 173.73 ? 352 HIS G CA 1 ATOM 1655 C C . HIS A 1 220 ? 25.636 -17.330 -27.419 1.00 177.77 ? 352 HIS G C 1 ATOM 1656 O O . HIS A 1 220 ? 24.849 -16.875 -26.585 1.00 171.03 ? 352 HIS G O 1 ATOM 1657 C CB . HIS A 1 220 ? 25.492 -15.423 -29.100 1.00 171.41 ? 352 HIS G CB 1 ATOM 1658 C CG . HIS A 1 220 ? 26.169 -14.225 -29.694 1.00 171.47 ? 352 HIS G CG 1 ATOM 1659 N ND1 . HIS A 1 220 ? 26.965 -14.287 -30.817 1.00 173.67 ? 352 HIS G ND1 1 ATOM 1660 C CD2 . HIS A 1 220 ? 26.132 -12.919 -29.334 1.00 169.91 ? 352 HIS G CD2 1 ATOM 1661 C CE1 . HIS A 1 220 ? 27.412 -13.077 -31.105 1.00 175.66 ? 352 HIS G CE1 1 ATOM 1662 N NE2 . HIS A 1 220 ? 26.920 -12.229 -30.221 1.00 174.11 ? 352 HIS G NE2 1 ATOM 1663 N N . PHE A 1 221 ? 25.856 -18.638 -27.548 1.00 189.52 ? 353 PHE G N 1 ATOM 1664 C CA . PHE A 1 221 ? 25.218 -19.641 -26.676 1.00 190.78 ? 353 PHE G CA 1 ATOM 1665 C C . PHE A 1 221 ? 26.139 -20.559 -25.891 1.00 199.35 ? 353 PHE G C 1 ATOM 1666 O O . PHE A 1 221 ? 25.836 -21.736 -25.669 1.00 202.82 ? 353 PHE G O 1 ATOM 1667 C CB . PHE A 1 221 ? 24.225 -20.480 -27.477 1.00 186.83 ? 353 PHE G CB 1 ATOM 1668 C CG . PHE A 1 221 ? 22.977 -19.753 -27.844 1.00 180.63 ? 353 PHE G CG 1 ATOM 1669 C CD1 . PHE A 1 221 ? 21.887 -19.778 -26.992 1.00 177.33 ? 353 PHE G CD1 1 ATOM 1670 C CD2 . PHE A 1 221 ? 22.864 -19.097 -29.053 1.00 176.74 ? 353 PHE G CD2 1 ATOM 1671 C CE1 . PHE A 1 221 ? 20.723 -19.123 -27.316 1.00 172.78 ? 353 PHE G CE1 1 ATOM 1672 C CE2 . PHE A 1 221 ? 21.696 -18.446 -29.386 1.00 168.24 ? 353 PHE G CE2 1 ATOM 1673 C CZ . PHE A 1 221 ? 20.626 -18.458 -28.516 1.00 165.93 ? 353 PHE G CZ 1 ATOM 1674 N N . ASN A 1 222 ? 27.257 -19.984 -25.467 1.00 207.91 ? 354 ASN G N 1 ATOM 1675 C CA . ASN A 1 222 ? 28.248 -20.633 -24.620 1.00 223.09 ? 354 ASN G CA 1 ATOM 1676 C C . ASN A 1 222 ? 28.786 -21.921 -25.238 1.00 224.48 ? 354 ASN G C 1 ATOM 1677 O O . ASN A 1 222 ? 28.965 -22.916 -24.539 1.00 227.51 ? 354 ASN G O 1 ATOM 1678 C CB . ASN A 1 222 ? 27.645 -20.960 -23.253 1.00 231.73 ? 354 ASN G CB 1 ATOM 1679 C CG . ASN A 1 222 ? 27.217 -19.718 -22.496 1.00 235.28 ? 354 ASN G CG 1 ATOM 1680 O OD1 . ASN A 1 222 ? 27.870 -18.677 -22.563 1.00 239.33 ? 354 ASN G OD1 1 ATOM 1681 N ND2 . ASN A 1 222 ? 26.089 -19.814 -21.796 1.00 233.38 ? 354 ASN G ND2 1 ATOM 1682 N N . ASN A 1 223 ? 29.019 -21.888 -26.549 1.00 220.22 ? 355 ASN G N 1 ATOM 1683 C CA . ASN A 1 223 ? 29.585 -23.007 -27.305 1.00 219.73 ? 355 ASN G CA 1 ATOM 1684 C C . ASN A 1 223 ? 28.759 -24.263 -27.040 1.00 218.24 ? 355 ASN G C 1 ATOM 1685 O O . ASN A 1 223 ? 29.281 -25.251 -26.522 1.00 233.13 ? 355 ASN G O 1 ATOM 1686 C CB . ASN A 1 223 ? 31.063 -23.230 -26.942 1.00 228.17 ? 355 ASN G CB 1 ATOM 1687 C CG . ASN A 1 223 ? 31.780 -24.173 -27.907 1.00 229.93 ? 355 ASN G CG 1 ATOM 1688 O OD1 . ASN A 1 223 ? 31.204 -24.628 -28.894 1.00 222.05 ? 355 ASN G OD1 1 ATOM 1689 N ND2 . ASN A 1 223 ? 33.042 -24.475 -27.612 1.00 239.14 ? 355 ASN G ND2 1 ATOM 1690 N N . LYS A 1 224 ? 27.480 -24.235 -27.400 1.00 204.10 ? 357 LYS G N 1 ATOM 1691 C CA . LYS A 1 224 ? 26.647 -25.431 -27.346 1.00 203.16 ? 357 LYS G CA 1 ATOM 1692 C C . LYS A 1 224 ? 26.273 -25.830 -28.767 1.00 202.44 ? 357 LYS G C 1 ATOM 1693 O O . LYS A 1 224 ? 26.241 -24.973 -29.643 1.00 170.00 ? 357 LYS G O 1 ATOM 1694 C CB . LYS A 1 224 ? 25.442 -25.156 -26.443 1.00 200.13 ? 357 LYS G CB 1 ATOM 1695 C CG . LYS A 1 224 ? 25.681 -24.944 -24.978 1.00 215.01 ? 357 LYS G CG 1 ATOM 1696 C CD . LYS A 1 224 ? 24.339 -24.669 -24.323 1.00 217.01 ? 357 LYS G CD 1 ATOM 1697 C CE . LYS A 1 224 ? 24.490 -24.464 -22.812 1.00 229.05 ? 357 LYS G CE 1 ATOM 1698 N NZ . LYS A 1 224 ? 23.195 -24.164 -22.110 1.00 227.66 ? 357 LYS G NZ 1 ATOM 1699 N N . THR A 1 225 ? 26.039 -27.115 -29.023 1.00 208.78 ? 358 THR G N 1 ATOM 1700 C CA . THR A 1 225 ? 25.733 -27.531 -30.393 1.00 208.88 ? 358 THR G CA 1 ATOM 1701 C C . THR A 1 225 ? 24.446 -26.908 -30.969 1.00 197.75 ? 358 THR G C 1 ATOM 1702 O O . THR A 1 225 ? 23.363 -27.007 -30.385 1.00 196.58 ? 358 THR G O 1 ATOM 1703 C CB . THR A 1 225 ? 25.644 -29.059 -30.488 1.00 212.24 ? 358 THR G CB 1 ATOM 1704 O OG1 . THR A 1 225 ? 26.896 -29.630 -30.093 1.00 218.95 ? 358 THR G OG1 1 ATOM 1705 C CG2 . THR A 1 225 ? 25.309 -29.490 -31.908 1.00 209.77 ? 358 THR G CG2 1 ATOM 1706 N N . ILE A 1 226 ? 24.606 -26.271 -32.128 1.00 190.56 ? 359 ILE G N 1 ATOM 1707 C CA . ILE A 1 226 ? 23.545 -25.599 -32.891 1.00 183.84 ? 359 ILE G CA 1 ATOM 1708 C C . ILE A 1 226 ? 22.957 -26.430 -34.045 1.00 184.15 ? 359 ILE G C 1 ATOM 1709 O O . ILE A 1 226 ? 23.695 -26.901 -34.914 1.00 187.93 ? 359 ILE G O 1 ATOM 1710 C CB . ILE A 1 226 ? 24.019 -24.233 -33.424 1.00 177.75 ? 359 ILE G CB 1 ATOM 1711 C CG1 . ILE A 1 226 ? 23.585 -23.128 -32.455 1.00 175.94 ? 359 ILE G CG1 1 ATOM 1712 C CG2 . ILE A 1 226 ? 23.391 -23.919 -34.769 1.00 167.48 ? 359 ILE G CG2 1 ATOM 1713 C CD1 . ILE A 1 226 ? 24.196 -23.173 -31.085 1.00 182.57 ? 359 ILE G CD1 1 ATOM 1714 N N . ILE A 1 227 ? 21.645 -26.653 -34.042 1.00 179.34 ? 360 ILE G N 1 ATOM 1715 C CA . ILE A 1 227 ? 21.028 -27.404 -35.135 1.00 175.29 ? 360 ILE G CA 1 ATOM 1716 C C . ILE A 1 227 ? 19.831 -26.671 -35.767 1.00 165.28 ? 360 ILE G C 1 ATOM 1717 O O . ILE A 1 227 ? 19.083 -25.964 -35.084 1.00 161.49 ? 360 ILE G O 1 ATOM 1718 C CB . ILE A 1 227 ? 20.576 -28.800 -34.632 1.00 181.99 ? 360 ILE G CB 1 ATOM 1719 C CG1 . ILE A 1 227 ? 21.777 -29.666 -34.240 1.00 193.46 ? 360 ILE G CG1 1 ATOM 1720 C CG2 . ILE A 1 227 ? 19.793 -29.536 -35.714 1.00 179.21 ? 360 ILE G CG2 1 ATOM 1721 C CD1 . ILE A 1 227 ? 21.416 -30.926 -33.504 1.00 199.77 ? 360 ILE G CD1 1 ATOM 1722 N N . PHE A 1 228 ? 19.694 -26.802 -37.090 1.00 161.36 ? 361 PHE G N 1 ATOM 1723 C CA . PHE A 1 228 ? 18.574 -26.196 -37.818 1.00 154.05 ? 361 PHE G CA 1 ATOM 1724 C C . PHE A 1 228 ? 17.471 -27.201 -38.145 1.00 161.20 ? 361 PHE G C 1 ATOM 1725 O O . PHE A 1 228 ? 17.737 -28.383 -38.399 1.00 174.81 ? 361 PHE G O 1 ATOM 1726 C CB . PHE A 1 228 ? 19.046 -25.548 -39.122 1.00 150.47 ? 361 PHE G CB 1 ATOM 1727 C CG . PHE A 1 228 ? 19.904 -24.337 -38.924 1.00 152.34 ? 361 PHE G CG 1 ATOM 1728 C CD1 . PHE A 1 228 ? 19.342 -23.120 -38.584 1.00 149.61 ? 361 PHE G CD1 1 ATOM 1729 C CD2 . PHE A 1 228 ? 21.267 -24.402 -39.130 1.00 159.01 ? 361 PHE G CD2 1 ATOM 1730 C CE1 . PHE A 1 228 ? 20.132 -21.994 -38.412 1.00 148.12 ? 361 PHE G CE1 1 ATOM 1731 C CE2 . PHE A 1 228 ? 22.059 -23.280 -38.964 1.00 158.38 ? 361 PHE G CE2 1 ATOM 1732 C CZ . PHE A 1 228 ? 21.492 -22.076 -38.603 1.00 151.19 ? 361 PHE G CZ 1 ATOM 1733 N N . GLN A 1 229 ? 16.236 -26.710 -38.171 1.00 152.52 ? 362 GLN G N 1 ATOM 1734 C CA . GLN A 1 229 ? 15.066 -27.490 -38.569 1.00 150.73 ? 362 GLN G CA 1 ATOM 1735 C C . GLN A 1 229 ? 14.089 -26.661 -39.386 1.00 137.82 ? 362 GLN G C 1 ATOM 1736 O O . GLN A 1 229 ? 14.045 -25.448 -39.235 1.00 130.24 ? 362 GLN G O 1 ATOM 1737 C CB . GLN A 1 229 ? 14.357 -28.074 -37.339 1.00 156.77 ? 362 GLN G CB 1 ATOM 1738 C CG . GLN A 1 229 ? 15.172 -29.094 -36.598 1.00 165.51 ? 362 GLN G CG 1 ATOM 1739 C CD . GLN A 1 229 ? 15.150 -30.418 -37.318 1.00 176.63 ? 362 GLN G CD 1 ATOM 1740 O OE1 . GLN A 1 229 ? 16.173 -31.087 -37.444 1.00 186.27 ? 362 GLN G OE1 1 ATOM 1741 N NE2 . GLN A 1 229 ? 13.972 -30.809 -37.798 1.00 176.48 ? 362 GLN G NE2 1 ATOM 1742 N N . PRO A 1 230 ? 13.257 -27.326 -40.203 1.00 135.22 ? 363 PRO G N 1 ATOM 1743 C CA . PRO A 1 230 ? 12.201 -26.658 -40.970 1.00 132.25 ? 363 PRO G CA 1 ATOM 1744 C C . PRO A 1 230 ? 11.161 -26.114 -40.011 1.00 132.09 ? 363 PRO G C 1 ATOM 1745 O O . PRO A 1 230 ? 11.182 -26.475 -38.846 1.00 143.74 ? 363 PRO G O 1 ATOM 1746 C CB . PRO A 1 230 ? 11.629 -27.773 -41.848 1.00 133.48 ? 363 PRO G CB 1 ATOM 1747 C CG . PRO A 1 230 ? 11.978 -29.024 -41.145 1.00 136.59 ? 363 PRO G CG 1 ATOM 1748 C CD . PRO A 1 230 ? 13.295 -28.772 -40.476 1.00 137.57 ? 363 PRO G CD 1 ATOM 1749 N N . PRO A 1 231 ? 10.311 -25.200 -40.464 1.00 130.25 ? 364 PRO G N 1 ATOM 1750 C CA . PRO A 1 231 ? 9.297 -24.640 -39.568 1.00 130.04 ? 364 PRO G CA 1 ATOM 1751 C C . PRO A 1 231 ? 8.429 -25.713 -38.936 1.00 130.66 ? 364 PRO G C 1 ATOM 1752 O O . PRO A 1 231 ? 8.156 -26.737 -39.553 1.00 131.71 ? 364 PRO G O 1 ATOM 1753 C CB . PRO A 1 231 ? 8.471 -23.744 -40.491 1.00 135.30 ? 364 PRO G CB 1 ATOM 1754 C CG . PRO A 1 231 ? 8.900 -24.121 -41.894 1.00 139.78 ? 364 PRO G CG 1 ATOM 1755 C CD . PRO A 1 231 ? 10.296 -24.566 -41.786 1.00 138.53 ? 364 PRO G CD 1 ATOM 1756 N N . SER A 1 232 ? 7.929 -25.414 -37.744 1.00 133.84 ? 365 SER G N 1 ATOM 1757 C CA . SER A 1 232 ? 7.152 -26.360 -36.951 1.00 141.10 ? 365 SER G CA 1 ATOM 1758 C C . SER A 1 232 ? 5.662 -26.366 -37.254 1.00 144.29 ? 365 SER G C 1 ATOM 1759 O O . SER A 1 232 ? 4.932 -27.258 -36.801 1.00 147.76 ? 365 SER G O 1 ATOM 1760 C CB . SER A 1 232 ? 7.356 -26.048 -35.469 1.00 142.99 ? 365 SER G CB 1 ATOM 1761 O OG . SER A 1 232 ? 6.956 -24.713 -35.184 1.00 143.33 ? 365 SER G OG 1 ATOM 1762 N N . GLY A 1 233 ? 5.220 -25.374 -38.020 1.00 143.71 ? 366 GLY G N 1 ATOM 1763 C CA . GLY A 1 233 ? 3.819 -25.231 -38.372 1.00 142.08 ? 366 GLY G CA 1 ATOM 1764 C C . GLY A 1 233 ? 3.555 -23.850 -38.923 1.00 136.23 ? 366 GLY G C 1 ATOM 1765 O O . GLY A 1 233 ? 4.482 -23.064 -39.099 1.00 133.61 ? 366 GLY G O 1 ATOM 1766 N N . GLY A 1 234 ? 2.286 -23.548 -39.173 1.00 133.08 ? 367 GLY G N 1 ATOM 1767 C CA . GLY A 1 234 ? 1.874 -22.242 -39.672 1.00 129.95 ? 367 GLY G CA 1 ATOM 1768 C C . GLY A 1 234 ? 1.549 -22.055 -41.145 1.00 126.33 ? 367 GLY G C 1 ATOM 1769 O O . GLY A 1 234 ? 1.744 -22.958 -41.955 1.00 133.91 ? 367 GLY G O 1 ATOM 1770 N N . ASP A 1 235 ? 1.053 -20.867 -41.490 1.00 117.91 ? 368 ASP G N 1 ATOM 1771 C CA . ASP A 1 235 ? 0.643 -20.582 -42.867 1.00 118.87 ? 368 ASP G CA 1 ATOM 1772 C C . ASP A 1 235 ? 1.741 -20.747 -43.913 1.00 118.65 ? 368 ASP G C 1 ATOM 1773 O O . ASP A 1 235 ? 2.938 -20.677 -43.627 1.00 118.28 ? 368 ASP G O 1 ATOM 1774 C CB . ASP A 1 235 ? 0.028 -19.193 -42.962 1.00 116.35 ? 368 ASP G CB 1 ATOM 1775 C CG . ASP A 1 235 ? -1.259 -19.097 -42.179 1.00 123.09 ? 368 ASP G CG 1 ATOM 1776 O OD1 . ASP A 1 235 ? -1.916 -20.148 -41.994 1.00 128.23 ? 368 ASP G OD1 1 ATOM 1777 O OD2 . ASP A 1 235 ? -1.638 -17.977 -41.785 1.00 123.91 ? 368 ASP G OD2 1 ATOM 1778 N N . LEU A 1 236 ? 1.313 -20.968 -45.142 1.00 118.33 ? 369 LEU G N 1 ATOM 1779 C CA . LEU A 1 236 ? 2.253 -21.129 -46.227 1.00 124.32 ? 369 LEU G CA 1 ATOM 1780 C C . LEU A 1 236 ? 3.236 -19.986 -46.470 1.00 130.08 ? 369 LEU G C 1 ATOM 1781 O O . LEU A 1 236 ? 4.369 -20.240 -46.908 1.00 134.23 ? 369 LEU G O 1 ATOM 1782 C CB . LEU A 1 236 ? 1.473 -21.387 -47.507 1.00 125.84 ? 369 LEU G CB 1 ATOM 1783 C CG . LEU A 1 236 ? 0.696 -22.697 -47.504 1.00 125.44 ? 369 LEU G CG 1 ATOM 1784 C CD1 . LEU A 1 236 ? -0.154 -22.783 -48.752 1.00 124.21 ? 369 LEU G CD1 1 ATOM 1785 C CD2 . LEU A 1 236 ? 1.630 -23.870 -47.382 1.00 121.53 ? 369 LEU G CD2 1 ATOM 1786 N N . GLU A 1 237 ? 2.807 -18.745 -46.226 1.00 127.78 ? 370 GLU G N 1 ATOM 1787 C CA . GLU A 1 237 ? 3.693 -17.576 -46.324 1.00 119.75 ? 370 GLU G CA 1 ATOM 1788 C C . GLU A 1 237 ? 4.916 -17.656 -45.388 1.00 114.51 ? 370 GLU G C 1 ATOM 1789 O O . GLU A 1 237 ? 5.961 -17.072 -45.674 1.00 111.95 ? 370 GLU G O 1 ATOM 1790 C CB . GLU A 1 237 ? 2.899 -16.282 -46.091 1.00 120.02 ? 370 GLU G CB 1 ATOM 1791 C CG . GLU A 1 237 ? 1.859 -15.936 -47.176 1.00 121.17 ? 370 GLU G CG 1 ATOM 1792 C CD . GLU A 1 237 ? 0.556 -16.708 -47.035 1.00 121.41 ? 370 GLU G CD 1 ATOM 1793 O OE1 . GLU A 1 237 ? 0.350 -17.312 -45.968 1.00 129.12 ? 370 GLU G OE1 1 ATOM 1794 O OE2 . GLU A 1 237 ? -0.289 -16.675 -47.950 1.00 115.21 ? 370 GLU G OE2 1 ATOM 1795 N N . ILE A 1 238 ? 4.792 -18.427 -44.312 1.00 121.12 ? 371 ILE G N 1 ATOM 1796 C CA . ILE A 1 238 ? 5.815 -18.542 -43.264 1.00 130.69 ? 371 ILE G CA 1 ATOM 1797 C C . ILE A 1 238 ? 6.689 -19.771 -43.392 1.00 132.53 ? 371 ILE G C 1 ATOM 1798 O O . ILE A 1 238 ? 7.904 -19.704 -43.213 1.00 136.03 ? 371 ILE G O 1 ATOM 1799 C CB . ILE A 1 238 ? 5.233 -18.569 -41.829 1.00 135.82 ? 371 ILE G CB 1 ATOM 1800 C CG1 . ILE A 1 238 ? 5.048 -17.157 -41.308 1.00 144.12 ? 371 ILE G CG1 1 ATOM 1801 C CG2 . ILE A 1 238 ? 6.215 -19.183 -40.834 1.00 130.70 ? 371 ILE G CG2 1 ATOM 1802 C CD1 . ILE A 1 238 ? 4.713 -17.156 -39.844 1.00 150.09 ? 371 ILE G CD1 1 ATOM 1803 N N . THR A 1 239 ? 6.090 -20.885 -43.772 1.00 130.52 ? 372 THR G N 1 ATOM 1804 C CA . THR A 1 239 ? 6.839 -22.118 -43.803 1.00 131.67 ? 372 THR G CA 1 ATOM 1805 C C . THR A 1 239 ? 7.691 -22.265 -45.056 1.00 134.98 ? 372 THR G C 1 ATOM 1806 O O . THR A 1 239 ? 8.491 -23.191 -45.161 1.00 141.70 ? 372 THR G O 1 ATOM 1807 C CB . THR A 1 239 ? 5.875 -23.311 -43.676 1.00 130.17 ? 372 THR G CB 1 ATOM 1808 O OG1 . THR A 1 239 ? 4.914 -23.266 -44.734 1.00 135.50 ? 372 THR G OG1 1 ATOM 1809 C CG2 . THR A 1 239 ? 5.129 -23.233 -42.353 1.00 123.28 ? 372 THR G CG2 1 ATOM 1810 N N . MET A 1 240 ? 7.561 -21.325 -45.980 1.00 129.88 ? 373 MET G N 1 ATOM 1811 C CA . MET A 1 240 ? 8.312 -21.388 -47.217 1.00 133.87 ? 373 MET G CA 1 ATOM 1812 C C . MET A 1 240 ? 8.954 -20.040 -47.467 1.00 140.13 ? 373 MET G C 1 ATOM 1813 O O . MET A 1 240 ? 8.463 -19.017 -46.993 1.00 145.08 ? 373 MET G O 1 ATOM 1814 C CB . MET A 1 240 ? 7.429 -21.806 -48.373 1.00 133.32 ? 373 MET G CB 1 ATOM 1815 C CG . MET A 1 240 ? 7.053 -23.241 -48.236 1.00 136.33 ? 373 MET G CG 1 ATOM 1816 S SD . MET A 1 240 ? 6.083 -23.857 -49.595 1.00 163.49 ? 373 MET G SD 1 ATOM 1817 C CE . MET A 1 240 ? 6.283 -25.622 -49.337 1.00 216.91 ? 373 MET G CE 1 ATOM 1818 N N . HIS A 1 241 ? 10.043 -20.019 -48.226 1.00 137.03 ? 374 HIS G N 1 ATOM 1819 C CA . HIS A 1 241 ? 10.557 -18.730 -48.629 1.00 129.76 ? 374 HIS G CA 1 ATOM 1820 C C . HIS A 1 241 ? 9.575 -18.138 -49.605 1.00 122.22 ? 374 HIS G C 1 ATOM 1821 O O . HIS A 1 241 ? 9.404 -18.596 -50.724 1.00 125.61 ? 374 HIS G O 1 ATOM 1822 C CB . HIS A 1 241 ? 11.936 -18.871 -49.262 1.00 136.96 ? 374 HIS G CB 1 ATOM 1823 C CG . HIS A 1 241 ? 12.486 -17.585 -49.786 1.00 138.83 ? 374 HIS G CG 1 ATOM 1824 N ND1 . HIS A 1 241 ? 12.414 -16.403 -49.082 1.00 137.15 ? 374 HIS G ND1 1 ATOM 1825 C CD2 . HIS A 1 241 ? 13.097 -17.291 -50.957 1.00 143.26 ? 374 HIS G CD2 1 ATOM 1826 C CE1 . HIS A 1 241 ? 12.965 -15.437 -49.795 1.00 144.78 ? 374 HIS G CE1 1 ATOM 1827 N NE2 . HIS A 1 241 ? 13.389 -15.950 -50.936 1.00 147.98 ? 374 HIS G NE2 1 ATOM 1828 N N . HIS A 1 242 ? 9.049 -17.001 -49.210 1.00 115.28 ? 375 HIS G N 1 ATOM 1829 C CA . HIS A 1 242 ? 7.919 -16.408 -49.880 1.00 115.36 ? 375 HIS G CA 1 ATOM 1830 C C . HIS A 1 242 ? 8.271 -15.000 -50.276 1.00 116.93 ? 375 HIS G C 1 ATOM 1831 O O . HIS A 1 242 ? 8.739 -14.182 -49.460 1.00 107.70 ? 375 HIS G O 1 ATOM 1832 C CB . HIS A 1 242 ? 6.699 -16.427 -48.958 1.00 108.10 ? 375 HIS G CB 1 ATOM 1833 C CG . HIS A 1 242 ? 5.559 -15.588 -49.439 1.00 108.08 ? 375 HIS G CG 1 ATOM 1834 N ND1 . HIS A 1 242 ? 4.768 -15.941 -50.509 1.00 108.60 ? 375 HIS G ND1 1 ATOM 1835 C CD2 . HIS A 1 242 ? 5.091 -14.395 -49.003 1.00 109.51 ? 375 HIS G CD2 1 ATOM 1836 C CE1 . HIS A 1 242 ? 3.848 -15.012 -50.696 1.00 107.31 ? 375 HIS G CE1 1 ATOM 1837 N NE2 . HIS A 1 242 ? 4.021 -14.063 -49.795 1.00 111.59 ? 375 HIS G NE2 1 ATOM 1838 N N . PHE A 1 243 ? 7.937 -14.685 -51.514 1.00 120.20 ? 376 PHE G N 1 ATOM 1839 C CA . PHE A 1 243 ? 8.264 -13.371 -52.009 1.00 120.53 ? 376 PHE G CA 1 ATOM 1840 C C . PHE A 1 243 ? 7.532 -13.087 -53.272 1.00 125.15 ? 376 PHE G C 1 ATOM 1841 O O . PHE A 1 243 ? 6.912 -13.954 -53.855 1.00 120.98 ? 376 PHE G O 1 ATOM 1842 C CB . PHE A 1 243 ? 9.785 -13.262 -52.193 1.00 120.90 ? 376 PHE G CB 1 ATOM 1843 C CG . PHE A 1 243 ? 10.341 -14.233 -53.186 1.00 128.06 ? 376 PHE G CG 1 ATOM 1844 C CD1 . PHE A 1 243 ? 10.425 -13.931 -54.527 1.00 132.37 ? 376 PHE G CD1 1 ATOM 1845 C CD2 . PHE A 1 243 ? 10.763 -15.484 -52.764 1.00 126.03 ? 376 PHE G CD2 1 ATOM 1846 C CE1 . PHE A 1 243 ? 10.941 -14.870 -55.423 1.00 129.97 ? 376 PHE G CE1 1 ATOM 1847 C CE2 . PHE A 1 243 ? 11.267 -16.415 -53.651 1.00 121.78 ? 376 PHE G CE2 1 ATOM 1848 C CZ . PHE A 1 243 ? 11.355 -16.112 -54.973 1.00 120.68 ? 376 PHE G CZ 1 ATOM 1849 N N . ASN A 1 244 ? 7.556 -11.832 -53.653 1.00 135.43 ? 377 ASN G N 1 ATOM 1850 C CA . ASN A 1 244 ? 6.806 -11.427 -54.797 1.00 146.61 ? 377 ASN G CA 1 ATOM 1851 C C . ASN A 1 244 ? 7.790 -11.133 -55.904 1.00 153.22 ? 377 ASN G C 1 ATOM 1852 O O . ASN A 1 244 ? 8.682 -10.304 -55.747 1.00 160.05 ? 377 ASN G O 1 ATOM 1853 C CB . ASN A 1 244 ? 5.894 -10.256 -54.443 1.00 153.77 ? 377 ASN G CB 1 ATOM 1854 C CG . ASN A 1 244 ? 4.838 -10.017 -55.492 1.00 164.47 ? 377 ASN G CG 1 ATOM 1855 O OD1 . ASN A 1 244 ? 4.277 -10.969 -56.023 1.00 171.65 ? 377 ASN G OD1 1 ATOM 1856 N ND2 . ASN A 1 244 ? 4.478 -8.763 -55.713 1.00 167.63 ? 377 ASN G ND2 1 ATOM 1857 N N . CYS A 1 245 ? 7.672 -11.890 -56.989 1.00 152.89 ? 378 CYS G N 1 ATOM 1858 C CA . CYS A 1 245 ? 8.556 -11.759 -58.141 1.00 149.49 ? 378 CYS G CA 1 ATOM 1859 C C . CYS A 1 245 ? 7.799 -11.452 -59.420 1.00 152.07 ? 378 CYS G C 1 ATOM 1860 O O . CYS A 1 245 ? 6.959 -12.232 -59.864 1.00 155.64 ? 378 CYS G O 1 ATOM 1861 C CB . CYS A 1 245 ? 9.357 -13.047 -58.343 1.00 146.80 ? 378 CYS G CB 1 ATOM 1862 S SG . CYS A 1 245 ? 10.441 -13.046 -59.801 1.00 204.27 ? 378 CYS G SG 1 ATOM 1863 N N . ARG A 1 246 ? 8.145 -10.309 -60.012 1.00 151.29 ? 379 ARG G N 1 ATOM 1864 C CA . ARG A 1 246 ? 7.531 -9.807 -61.238 1.00 147.10 ? 379 ARG G CA 1 ATOM 1865 C C . ARG A 1 246 ? 6.013 -9.906 -61.150 1.00 142.53 ? 379 ARG G C 1 ATOM 1866 O O . ARG A 1 246 ? 5.330 -10.204 -62.130 1.00 134.91 ? 379 ARG G O 1 ATOM 1867 C CB . ARG A 1 246 ? 8.061 -10.610 -62.426 0.00 153.83 ? 379 ARG G CB 1 ATOM 1868 C CG . ARG A 1 246 ? 9.543 -10.369 -62.726 0.00 155.90 ? 379 ARG G CG 1 ATOM 1869 C CD . ARG A 1 246 ? 9.936 -10.798 -64.142 0.00 161.68 ? 379 ARG G CD 1 ATOM 1870 N NE . ARG A 1 246 ? 9.507 -9.915 -65.215 0.00 165.90 ? 379 ARG G NE 1 ATOM 1871 C CZ . ARG A 1 246 ? 9.580 -10.246 -66.500 0.00 171.05 ? 379 ARG G CZ 1 ATOM 1872 N NH1 . ARG A 1 246 ? 10.050 -11.442 -66.839 0.00 172.04 ? 379 ARG G NH1 1 ATOM 1873 N NH2 . ARG A 1 246 ? 9.175 -9.394 -67.443 0.00 175.89 ? 379 ARG G NH2 1 ATOM 1874 N N . GLY A 1 247 ? 5.495 -9.629 -59.958 1.00 136.92 ? 380 GLY G N 1 ATOM 1875 C CA . GLY A 1 247 ? 4.066 -9.584 -59.737 1.00 134.17 ? 380 GLY G CA 1 ATOM 1876 C C . GLY A 1 247 ? 3.501 -10.952 -59.398 1.00 133.63 ? 380 GLY G C 1 ATOM 1877 O O . GLY A 1 247 ? 2.312 -11.087 -59.122 1.00 132.51 ? 380 GLY G O 1 ATOM 1878 N N . GLU A 1 248 ? 4.346 -11.978 -59.387 1.00 135.72 ? 381 GLU G N 1 ATOM 1879 C CA . GLU A 1 248 ? 3.859 -13.307 -59.040 1.00 138.13 ? 381 GLU G CA 1 ATOM 1880 C C . GLU A 1 248 ? 4.267 -13.612 -57.605 1.00 127.96 ? 381 GLU G C 1 ATOM 1881 O O . GLU A 1 248 ? 5.341 -13.202 -57.172 1.00 127.13 ? 381 GLU G O 1 ATOM 1882 C CB . GLU A 1 248 ? 4.443 -14.315 -60.021 1.00 149.70 ? 381 GLU G CB 1 ATOM 1883 C CG . GLU A 1 248 ? 4.127 -13.919 -61.468 1.00 163.25 ? 381 GLU G CG 1 ATOM 1884 C CD . GLU A 1 248 ? 2.761 -14.329 -61.956 1.00 174.41 ? 381 GLU G CD 1 ATOM 1885 O OE1 . GLU A 1 248 ? 1.763 -13.715 -61.523 1.00 169.31 ? 381 GLU G OE1 1 ATOM 1886 O OE2 . GLU A 1 248 ? 2.696 -15.220 -62.830 1.00 188.25 ? 381 GLU G OE2 1 ATOM 1887 N N . PHE A 1 249 ? 3.460 -14.378 -56.881 1.00 123.05 ? 382 PHE G N 1 ATOM 1888 C CA . PHE A 1 249 ? 3.832 -14.712 -55.502 1.00 118.87 ? 382 PHE G CA 1 ATOM 1889 C C . PHE A 1 249 ? 4.449 -16.114 -55.401 1.00 124.31 ? 382 PHE G C 1 ATOM 1890 O O . PHE A 1 249 ? 3.735 -17.119 -55.438 1.00 111.90 ? 382 PHE G O 1 ATOM 1891 C CB . PHE A 1 249 ? 2.607 -14.613 -54.582 1.00 118.61 ? 382 PHE G CB 1 ATOM 1892 C CG . PHE A 1 249 ? 2.055 -13.219 -54.467 1.00 120.26 ? 382 PHE G CG 1 ATOM 1893 C CD1 . PHE A 1 249 ? 2.539 -12.330 -53.529 1.00 118.51 ? 382 PHE G CD1 1 ATOM 1894 C CD2 . PHE A 1 249 ? 1.018 -12.811 -55.296 1.00 125.31 ? 382 PHE G CD2 1 ATOM 1895 C CE1 . PHE A 1 249 ? 2.026 -11.045 -53.445 1.00 114.63 ? 382 PHE G CE1 1 ATOM 1896 C CE2 . PHE A 1 249 ? 0.489 -11.533 -55.206 1.00 121.61 ? 382 PHE G CE2 1 ATOM 1897 C CZ . PHE A 1 249 ? 0.995 -10.650 -54.286 1.00 118.03 ? 382 PHE G CZ 1 ATOM 1898 N N . PHE A 1 250 ? 5.766 -16.158 -55.198 1.00 126.05 ? 383 PHE G N 1 ATOM 1899 C CA . PHE A 1 250 ? 6.477 -17.416 -55.058 1.00 131.18 ? 383 PHE G CA 1 ATOM 1900 C C . PHE A 1 250 ? 6.418 -17.925 -53.635 1.00 131.70 ? 383 PHE G C 1 ATOM 1901 O O . PHE A 1 250 ? 6.437 -17.139 -52.656 1.00 129.84 ? 383 PHE G O 1 ATOM 1902 C CB . PHE A 1 250 ? 7.930 -17.236 -55.489 1.00 131.39 ? 383 PHE G CB 1 ATOM 1903 C CG . PHE A 1 250 ? 8.109 -17.129 -56.982 1.00 137.81 ? 383 PHE G CG 1 ATOM 1904 C CD1 . PHE A 1 250 ? 7.599 -16.030 -57.678 1.00 138.59 ? 383 PHE G CD1 1 ATOM 1905 C CD2 . PHE A 1 250 ? 8.790 -18.107 -57.692 1.00 136.18 ? 383 PHE G CD2 1 ATOM 1906 C CE1 . PHE A 1 250 ? 7.755 -15.918 -59.042 1.00 140.32 ? 383 PHE G CE1 1 ATOM 1907 C CE2 . PHE A 1 250 ? 8.955 -17.992 -59.059 1.00 137.79 ? 383 PHE G CE2 1 ATOM 1908 C CZ . PHE A 1 250 ? 8.439 -16.893 -59.734 1.00 143.02 ? 383 PHE G CZ 1 ATOM 1909 N N . TYR A 1 251 ? 6.488 -19.254 -53.549 1.00 131.53 ? 384 TYR G N 1 ATOM 1910 C CA . TYR A 1 251 ? 6.480 -19.974 -52.297 1.00 126.03 ? 384 TYR G CA 1 ATOM 1911 C C . TYR A 1 251 ? 7.453 -21.155 -52.443 1.00 142.48 ? 384 TYR G C 1 ATOM 1912 O O . TYR A 1 251 ? 7.102 -22.147 -53.094 1.00 154.07 ? 384 TYR G O 1 ATOM 1913 C CB . TYR A 1 251 ? 5.069 -20.503 -52.056 1.00 112.31 ? 384 TYR G CB 1 ATOM 1914 C CG . TYR A 1 251 ? 4.046 -19.486 -51.588 1.00 108.49 ? 384 TYR G CG 1 ATOM 1915 C CD1 . TYR A 1 251 ? 3.551 -18.562 -52.491 1.00 113.96 ? 384 TYR G CD1 1 ATOM 1916 C CD2 . TYR A 1 251 ? 3.517 -19.485 -50.299 1.00 101.19 ? 384 TYR G CD2 1 ATOM 1917 C CE1 . TYR A 1 251 ? 2.600 -17.641 -52.138 1.00 115.50 ? 384 TYR G CE1 1 ATOM 1918 C CE2 . TYR A 1 251 ? 2.545 -18.557 -49.928 1.00 99.68 ? 384 TYR G CE2 1 ATOM 1919 C CZ . TYR A 1 251 ? 2.095 -17.637 -50.865 1.00 113.31 ? 384 TYR G CZ 1 ATOM 1920 O OH . TYR A 1 251 ? 1.143 -16.683 -50.573 1.00 110.77 ? 384 TYR G OH 1 ATOM 1921 N N . CYS A 1 252 ? 8.675 -21.050 -51.927 1.00 143.81 ? 385 CYS G N 1 ATOM 1922 C CA . CYS A 1 252 ? 9.702 -22.077 -52.143 1.00 144.79 ? 385 CYS G CA 1 ATOM 1923 C C . CYS A 1 252 ? 10.030 -22.909 -50.926 1.00 149.88 ? 385 CYS G C 1 ATOM 1924 O O . CYS A 1 252 ? 10.276 -22.381 -49.850 1.00 154.31 ? 385 CYS G O 1 ATOM 1925 C CB . CYS A 1 252 ? 10.972 -21.440 -52.671 1.00 138.55 ? 385 CYS G CB 1 ATOM 1926 S SG . CYS A 1 252 ? 10.615 -20.456 -54.115 1.00 200.40 ? 385 CYS G SG 1 ATOM 1927 N N . ASN A 1 253 ? 10.083 -24.219 -51.118 1.00 153.49 ? 386 ASN G N 1 ATOM 1928 C CA . ASN A 1 253 ? 10.437 -25.123 -50.037 1.00 156.47 ? 386 ASN G CA 1 ATOM 1929 C C . ASN A 1 253 ? 11.918 -25.007 -49.671 1.00 160.51 ? 386 ASN G C 1 ATOM 1930 O O . ASN A 1 253 ? 12.790 -25.248 -50.500 1.00 169.88 ? 386 ASN G O 1 ATOM 1931 C CB . ASN A 1 253 ? 10.087 -26.555 -50.474 1.00 158.39 ? 386 ASN G CB 1 ATOM 1932 C CG . ASN A 1 253 ? 10.033 -27.529 -49.330 1.00 160.67 ? 386 ASN G CG 1 ATOM 1933 O OD1 . ASN A 1 253 ? 10.835 -27.460 -48.410 1.00 166.35 ? 386 ASN G OD1 1 ATOM 1934 N ND2 . ASN A 1 253 ? 9.071 -28.439 -49.374 1.00 160.39 ? 386 ASN G ND2 1 ATOM 1935 N N . THR A 1 254 ? 12.201 -24.661 -48.416 1.00 153.59 ? 387 THR G N 1 ATOM 1936 C CA . THR A 1 254 ? 13.582 -24.403 -48.020 1.00 150.78 ? 387 THR G CA 1 ATOM 1937 C C . THR A 1 254 ? 14.126 -25.569 -47.198 1.00 150.76 ? 387 THR G C 1 ATOM 1938 O O . THR A 1 254 ? 15.223 -25.473 -46.637 1.00 146.45 ? 387 THR G O 1 ATOM 1939 C CB . THR A 1 254 ? 13.729 -23.080 -47.214 1.00 126.09 ? 387 THR G CB 1 ATOM 1940 O OG1 . THR A 1 254 ? 12.781 -23.047 -46.139 1.00 120.63 ? 387 THR G OG1 1 ATOM 1941 C CG2 . THR A 1 254 ? 13.521 -21.870 -48.121 1.00 124.12 ? 387 THR G CG2 1 ATOM 1942 N N . THR A 1 255 ? 13.331 -26.643 -47.111 1.00 156.40 ? 388 THR G N 1 ATOM 1943 C CA . THR A 1 255 ? 13.686 -27.863 -46.376 1.00 159.18 ? 388 THR G CA 1 ATOM 1944 C C . THR A 1 255 ? 15.110 -28.218 -46.745 1.00 161.72 ? 388 THR G C 1 ATOM 1945 O O . THR A 1 255 ? 15.939 -28.553 -45.902 1.00 157.68 ? 388 THR G O 1 ATOM 1946 C CB . THR A 1 255 ? 12.737 -29.056 -46.692 1.00 163.20 ? 388 THR G CB 1 ATOM 1947 O OG1 . THR A 1 255 ? 11.439 -28.810 -46.133 1.00 161.17 ? 388 THR G OG1 1 ATOM 1948 C CG2 . THR A 1 255 ? 13.270 -30.345 -46.106 1.00 167.02 ? 388 THR G CG2 1 ATOM 1949 N N . GLN A 1 256 ? 15.360 -28.102 -48.044 1.00 170.57 ? 389 GLN G N 1 ATOM 1950 C CA . GLN A 1 256 ? 16.600 -28.495 -48.692 1.00 180.34 ? 389 GLN G CA 1 ATOM 1951 C C . GLN A 1 256 ? 17.755 -27.590 -48.285 1.00 178.17 ? 389 GLN G C 1 ATOM 1952 O O . GLN A 1 256 ? 18.900 -28.031 -48.173 1.00 175.21 ? 389 GLN G O 1 ATOM 1953 C CB . GLN A 1 256 ? 16.420 -28.470 -50.231 1.00 187.37 ? 389 GLN G CB 1 ATOM 1954 C CG . GLN A 1 256 ? 15.718 -29.740 -50.714 1.00 194.67 ? 389 GLN G CG 1 ATOM 1955 C CD . GLN A 1 256 ? 14.197 -29.568 -50.724 1.00 195.88 ? 389 GLN G CD 1 ATOM 1956 O OE1 . GLN A 1 256 ? 13.632 -29.030 -49.759 1.00 194.30 ? 389 GLN G OE1 1 ATOM 1957 N NE2 . GLN A 1 256 ? 13.525 -30.238 -51.658 1.00 197.60 ? 389 GLN G NE2 1 ATOM 1958 N N . LEU A 1 257 ? 17.443 -26.317 -48.073 1.00 179.19 ? 390 LEU G N 1 ATOM 1959 C CA . LEU A 1 257 ? 18.450 -25.328 -47.711 1.00 183.30 ? 390 LEU G CA 1 ATOM 1960 C C . LEU A 1 257 ? 19.170 -25.651 -46.408 1.00 186.76 ? 390 LEU G C 1 ATOM 1961 O O . LEU A 1 257 ? 20.393 -25.557 -46.328 1.00 189.13 ? 390 LEU G O 1 ATOM 1962 C CB . LEU A 1 257 ? 17.779 -23.957 -47.655 1.00 181.50 ? 390 LEU G CB 1 ATOM 1963 C CG . LEU A 1 257 ? 18.607 -22.684 -47.594 1.00 182.83 ? 390 LEU G CG 1 ATOM 1964 C CD1 . LEU A 1 257 ? 19.111 -22.323 -48.981 1.00 183.48 ? 390 LEU G CD1 1 ATOM 1965 C CD2 . LEU A 1 257 ? 17.738 -21.567 -47.033 1.00 179.65 ? 390 LEU G CD2 1 ATOM 1966 N N . PHE A 1 258 ? 18.418 -26.022 -45.383 1.00 189.77 ? 391 PHE G N 1 ATOM 1967 C CA . PHE A 1 258 ? 19.022 -26.316 -44.092 1.00 196.81 ? 391 PHE G CA 1 ATOM 1968 C C . PHE A 1 258 ? 19.259 -27.842 -44.026 1.00 208.65 ? 391 PHE G C 1 ATOM 1969 O O . PHE A 1 258 ? 18.555 -28.561 -43.310 1.00 209.31 ? 391 PHE G O 1 ATOM 1970 C CB . PHE A 1 258 ? 18.122 -25.770 -42.972 1.00 188.66 ? 391 PHE G CB 1 ATOM 1971 C CG . PHE A 1 258 ? 17.697 -24.324 -43.186 1.00 182.34 ? 391 PHE G CG 1 ATOM 1972 C CD1 . PHE A 1 258 ? 18.519 -23.277 -42.785 1.00 178.02 ? 391 PHE G CD1 1 ATOM 1973 C CD2 . PHE A 1 258 ? 16.492 -24.014 -43.796 1.00 176.33 ? 391 PHE G CD2 1 ATOM 1974 C CE1 . PHE A 1 258 ? 18.143 -21.955 -42.980 1.00 165.71 ? 391 PHE G CE1 1 ATOM 1975 C CE2 . PHE A 1 258 ? 16.118 -22.692 -43.996 1.00 166.03 ? 391 PHE G CE2 1 ATOM 1976 C CZ . PHE A 1 258 ? 16.944 -21.666 -43.583 1.00 160.10 ? 391 PHE G CZ 1 ATOM 1977 N N . ASN A 1 259 ? 20.265 -28.319 -44.769 1.00 214.77 ? 392 ASN G N 1 ATOM 1978 C CA . ASN A 1 259 ? 20.610 -29.747 -44.801 1.00 219.14 ? 392 ASN G CA 1 ATOM 1979 C C . ASN A 1 259 ? 21.885 -29.968 -43.998 1.00 224.04 ? 392 ASN G C 1 ATOM 1980 O O . ASN A 1 259 ? 22.996 -29.646 -44.424 1.00 228.18 ? 392 ASN G O 1 ATOM 1981 C CB . ASN A 1 259 ? 20.801 -30.277 -46.233 1.00 220.35 ? 392 ASN G CB 1 ATOM 1982 C CG . ASN A 1 259 ? 20.907 -31.800 -46.296 1.00 224.09 ? 392 ASN G CG 1 ATOM 1983 O OD1 . ASN A 1 259 ? 21.974 -32.372 -46.063 1.00 227.88 ? 392 ASN G OD1 1 ATOM 1984 N ND2 . ASN A 1 259 ? 19.800 -32.457 -46.625 1.00 222.22 ? 392 ASN G ND2 1 ATOM 1985 N N . ASN A 1 260 ? 21.680 -30.555 -42.830 1.00 223.56 ? 393 ASN G N 1 ATOM 1986 C CA . ASN A 1 260 ? 22.707 -30.836 -41.840 1.00 228.00 ? 393 ASN G CA 1 ATOM 1987 C C . ASN A 1 260 ? 23.922 -31.649 -42.316 1.00 239.75 ? 393 ASN G C 1 ATOM 1988 O O . ASN A 1 260 ? 25.063 -31.294 -42.023 1.00 244.60 ? 393 ASN G O 1 ATOM 1989 C CB . ASN A 1 260 ? 22.034 -31.507 -40.646 1.00 223.28 ? 393 ASN G CB 1 ATOM 1990 C CG . ASN A 1 260 ? 21.134 -30.543 -39.881 1.00 209.74 ? 393 ASN G CG 1 ATOM 1991 O OD1 . ASN A 1 260 ? 21.475 -29.374 -39.694 1.00 203.27 ? 393 ASN G OD1 1 ATOM 1992 N ND2 . ASN A 1 260 ? 19.968 -31.020 -39.467 1.00 205.36 ? 393 ASN G ND2 1 ATOM 1993 N N . THR A 1 261 ? 23.677 -32.731 -43.049 1.00 245.05 ? 394 THR G N 1 ATOM 1994 C CA . THR A 1 261 ? 24.740 -33.645 -43.480 1.00 258.15 ? 394 THR G CA 1 ATOM 1995 C C . THR A 1 261 ? 25.904 -33.068 -44.308 1.00 265.17 ? 394 THR G C 1 ATOM 1996 O O . THR A 1 261 ? 27.048 -33.493 -44.137 1.00 271.67 ? 394 THR G O 1 ATOM 1997 C CB . THR A 1 261 ? 24.120 -34.800 -44.311 1.00 299.03 ? 394 THR G CB 1 ATOM 1998 O OG1 . THR A 1 261 ? 23.098 -35.451 -43.546 1.00 298.68 ? 394 THR G OG1 1 ATOM 1999 C CG2 . THR A 1 261 ? 25.173 -35.822 -44.728 1.00 307.28 ? 394 THR G CG2 1 ATOM 2000 N N . CYS A 1 262 ? 25.648 -32.094 -45.174 1.00 262.45 ? 395 CYS G N 1 ATOM 2001 C CA . CYS A 1 262 ? 26.731 -31.552 -46.005 1.00 264.63 ? 395 CYS G CA 1 ATOM 2002 C C . CYS A 1 262 ? 27.683 -30.586 -45.294 1.00 254.25 ? 395 CYS G C 1 ATOM 2003 O O . CYS A 1 262 ? 28.555 -29.993 -45.932 1.00 257.76 ? 395 CYS G O 1 ATOM 2004 C CB . CYS A 1 262 ? 26.162 -30.878 -47.246 1.00 269.03 ? 395 CYS G CB 1 ATOM 2005 S SG . CYS A 1 262 ? 27.382 -30.254 -48.375 1.00 270.77 ? 395 CYS G SG 1 ATOM 2006 N N . ILE A 1 263 ? 27.516 -30.414 -43.988 1.00 238.49 ? 396 ILE G N 1 ATOM 2007 C CA . ILE A 1 263 ? 28.387 -29.518 -43.238 1.00 227.08 ? 396 ILE G CA 1 ATOM 2008 C C . ILE A 1 263 ? 29.402 -30.315 -42.416 1.00 237.51 ? 396 ILE G C 1 ATOM 2009 O O . ILE A 1 263 ? 30.473 -30.683 -42.912 1.00 245.47 ? 396 ILE G O 1 ATOM 2010 C CB . ILE A 1 263 ? 27.586 -28.597 -42.301 1.00 208.47 ? 396 ILE G CB 1 ATOM 2011 C CG1 . ILE A 1 263 ? 28.135 -27.174 -42.371 1.00 203.32 ? 396 ILE G CG1 1 ATOM 2012 C CG2 . ILE A 1 263 ? 27.634 -29.110 -40.868 1.00 205.97 ? 396 ILE G CG2 1 ATOM 2013 C CD1 . ILE A 1 263 ? 27.362 -26.190 -41.539 1.00 196.41 ? 396 ILE G CD1 1 ATOM 2014 N N . ASN A 1 272 ? 27.160 -29.679 -51.505 1.00 274.75 ? 411 ASN G N 1 ATOM 2015 C CA . ASN A 1 272 ? 27.925 -28.523 -51.960 1.00 277.45 ? 411 ASN G CA 1 ATOM 2016 C C . ASN A 1 272 ? 27.607 -28.163 -53.404 1.00 270.50 ? 411 ASN G C 1 ATOM 2017 O O . ASN A 1 272 ? 27.675 -26.998 -53.797 1.00 273.37 ? 411 ASN G O 1 ATOM 2018 C CB . ASN A 1 272 ? 29.421 -28.776 -51.792 1.00 293.83 ? 411 ASN G CB 1 ATOM 2019 C CG . ASN A 1 272 ? 29.738 -29.561 -50.536 1.00 301.58 ? 411 ASN G CG 1 ATOM 2020 O OD1 . ASN A 1 272 ? 28.994 -30.463 -50.150 1.00 299.39 ? 411 ASN G OD1 1 ATOM 2021 N ND2 . ASN A 1 272 ? 30.845 -29.219 -49.888 1.00 309.67 ? 411 ASN G ND2 1 ATOM 2022 N N . GLY A 1 273 ? 27.247 -29.169 -54.190 1.00 256.65 ? 412 GLY G N 1 ATOM 2023 C CA . GLY A 1 273 ? 26.871 -28.931 -55.565 1.00 239.39 ? 412 GLY G CA 1 ATOM 2024 C C . GLY A 1 273 ? 25.856 -27.832 -55.383 1.00 218.35 ? 412 GLY G C 1 ATOM 2025 O O . GLY A 1 273 ? 25.333 -27.650 -54.293 1.00 215.46 ? 412 GLY G O 1 ATOM 2026 N N . THR A 1 274 ? 25.585 -27.099 -56.452 1.00 205.98 ? 413 THR G N 1 ATOM 2027 C CA . THR A 1 274 ? 24.496 -26.134 -56.500 1.00 190.37 ? 413 THR G CA 1 ATOM 2028 C C . THR A 1 274 ? 23.227 -26.929 -56.181 1.00 183.30 ? 413 THR G C 1 ATOM 2029 O O . THR A 1 274 ? 22.812 -27.806 -56.934 1.00 181.69 ? 413 THR G O 1 ATOM 2030 C CB . THR A 1 274 ? 24.528 -25.336 -57.819 1.00 180.04 ? 413 THR G CB 1 ATOM 2031 O OG1 . THR A 1 274 ? 25.680 -24.484 -57.825 1.00 168.61 ? 413 THR G OG1 1 ATOM 2032 C CG2 . THR A 1 274 ? 23.285 -24.481 -57.974 1.00 159.99 ? 413 THR G CG2 1 ATOM 2033 N N . ILE A 1 275 ? 22.631 -26.598 -55.041 1.00 180.08 ? 414 ILE G N 1 ATOM 2034 C CA . ILE A 1 275 ? 21.304 -27.035 -54.637 1.00 175.15 ? 414 ILE G CA 1 ATOM 2035 C C . ILE A 1 275 ? 20.144 -26.213 -55.210 1.00 168.50 ? 414 ILE G C 1 ATOM 2036 O O . ILE A 1 275 ? 20.225 -24.990 -55.321 1.00 168.83 ? 414 ILE G O 1 ATOM 2037 C CB . ILE A 1 275 ? 21.240 -27.118 -53.102 1.00 169.73 ? 414 ILE G CB 1 ATOM 2038 C CG1 . ILE A 1 275 ? 21.790 -25.850 -52.451 1.00 158.38 ? 414 ILE G CG1 1 ATOM 2039 C CG2 . ILE A 1 275 ? 22.088 -28.299 -52.618 1.00 177.41 ? 414 ILE G CG2 1 ATOM 2040 C CD1 . ILE A 1 275 ? 20.802 -24.759 -52.311 1.00 150.44 ? 414 ILE G CD1 1 ATOM 2041 N N . THR A 1 276 ? 19.098 -26.915 -55.646 1.00 162.71 ? 415 THR G N 1 ATOM 2042 C CA . THR A 1 276 ? 17.939 -26.273 -56.267 1.00 162.54 ? 415 THR G CA 1 ATOM 2043 C C . THR A 1 276 ? 16.613 -26.593 -55.543 1.00 163.91 ? 415 THR G C 1 ATOM 2044 O O . THR A 1 276 ? 16.224 -27.754 -55.409 1.00 163.28 ? 415 THR G O 1 ATOM 2045 C CB . THR A 1 276 ? 17.804 -26.641 -57.768 1.00 189.39 ? 415 THR G CB 1 ATOM 2046 O OG1 . THR A 1 276 ? 18.969 -26.197 -58.477 1.00 192.67 ? 415 THR G OG1 1 ATOM 2047 C CG2 . THR A 1 276 ? 16.550 -26.021 -58.388 1.00 189.28 ? 415 THR G CG2 1 ATOM 2048 N N . LEU A 1 277 ? 15.938 -25.525 -55.103 1.00 166.66 ? 416 LEU G N 1 ATOM 2049 C CA . LEU A 1 277 ? 14.655 -25.538 -54.370 1.00 160.80 ? 416 LEU G CA 1 ATOM 2050 C C . LEU A 1 277 ? 13.440 -25.651 -55.286 1.00 158.91 ? 416 LEU G C 1 ATOM 2051 O O . LEU A 1 277 ? 13.373 -24.989 -56.311 1.00 165.95 ? 416 LEU G O 1 ATOM 2052 C CB . LEU A 1 277 ? 14.511 -24.287 -53.498 1.00 157.39 ? 416 LEU G CB 1 ATOM 2053 C CG . LEU A 1 277 ? 15.277 -24.150 -52.170 1.00 163.86 ? 416 LEU G CG 1 ATOM 2054 C CD1 . LEU A 1 277 ? 16.631 -24.843 -52.161 1.00 172.17 ? 416 LEU G CD1 1 ATOM 2055 C CD2 . LEU A 1 277 ? 15.422 -22.682 -51.770 1.00 160.02 ? 416 LEU G CD2 1 ATOM 2056 N N . PRO A 1 278 ? 12.461 -26.485 -54.906 1.00 149.30 ? 417 PRO G N 1 ATOM 2057 C CA . PRO A 1 278 ? 11.198 -26.487 -55.649 1.00 146.43 ? 417 PRO G CA 1 ATOM 2058 C C . PRO A 1 278 ? 10.312 -25.339 -55.249 1.00 137.45 ? 417 PRO G C 1 ATOM 2059 O O . PRO A 1 278 ? 9.980 -25.217 -54.076 1.00 128.06 ? 417 PRO G O 1 ATOM 2060 C CB . PRO A 1 278 ? 10.526 -27.798 -55.211 1.00 146.67 ? 417 PRO G CB 1 ATOM 2061 C CG . PRO A 1 278 ? 11.532 -28.515 -54.356 1.00 149.40 ? 417 PRO G CG 1 ATOM 2062 C CD . PRO A 1 278 ? 12.462 -27.476 -53.823 1.00 144.92 ? 417 PRO G CD 1 ATOM 2063 N N . CYS A 1 279 ? 9.923 -24.504 -56.202 1.00 141.13 ? 418 CYS G N 1 ATOM 2064 C CA . CYS A 1 279 ? 9.021 -23.432 -55.847 1.00 142.58 ? 418 CYS G CA 1 ATOM 2065 C C . CYS A 1 279 ? 7.685 -23.500 -56.578 1.00 146.71 ? 418 CYS G C 1 ATOM 2066 O O . CYS A 1 279 ? 7.572 -24.109 -57.647 1.00 158.53 ? 418 CYS G O 1 ATOM 2067 C CB . CYS A 1 279 ? 9.705 -22.100 -56.140 1.00 121.35 ? 418 CYS G CB 1 ATOM 2068 S SG . CYS A 1 279 ? 8.972 -20.688 -55.300 1.00 240.89 ? 418 CYS G SG 1 ATOM 2069 N N . LYS A 1 280 ? 6.668 -22.871 -55.996 1.00 142.18 ? 419 LYS G N 1 ATOM 2070 C CA . LYS A 1 280 ? 5.390 -22.669 -56.692 1.00 121.38 ? 419 LYS G CA 1 ATOM 2071 C C . LYS A 1 280 ? 4.865 -21.200 -56.689 1.00 134.98 ? 419 LYS G C 1 ATOM 2072 O O . LYS A 1 280 ? 5.084 -20.447 -55.744 1.00 126.31 ? 419 LYS G O 1 ATOM 2073 C CB . LYS A 1 280 ? 4.300 -23.620 -56.160 0.00 130.84 ? 419 LYS G CB 1 ATOM 2074 C CG . LYS A 1 280 ? 4.106 -23.761 -54.630 0.00 125.56 ? 419 LYS G CG 1 ATOM 2075 C CD . LYS A 1 280 ? 3.019 -24.823 -54.335 0.00 124.73 ? 419 LYS G CD 1 ATOM 2076 C CE . LYS A 1 280 ? 2.819 -25.091 -52.856 0.00 119.94 ? 419 LYS G CE 1 ATOM 2077 N NZ . LYS A 1 280 ? 1.781 -26.145 -52.604 0.00 120.66 ? 419 LYS G NZ 1 ATOM 2078 N N . ILE A 1 281 ? 4.200 -20.787 -57.762 1.00 142.74 ? 420 ILE G N 1 ATOM 2079 C CA . ILE A 1 281 ? 3.589 -19.456 -57.815 1.00 150.61 ? 420 ILE G CA 1 ATOM 2080 C C . ILE A 1 281 ? 2.101 -19.562 -57.474 1.00 153.57 ? 420 ILE G C 1 ATOM 2081 O O . ILE A 1 281 ? 1.403 -20.391 -58.032 1.00 157.70 ? 420 ILE G O 1 ATOM 2082 C CB . ILE A 1 281 ? 3.721 -18.778 -59.201 1.00 157.62 ? 420 ILE G CB 1 ATOM 2083 C CG1 . ILE A 1 281 ? 5.185 -18.543 -59.559 1.00 160.14 ? 420 ILE G CG1 1 ATOM 2084 C CG2 . ILE A 1 281 ? 3.021 -17.428 -59.206 1.00 159.36 ? 420 ILE G CG2 1 ATOM 2085 C CD1 . ILE A 1 281 ? 5.368 -17.860 -60.901 1.00 166.97 ? 420 ILE G CD1 1 ATOM 2086 N N . LYS A 1 282 ? 1.612 -18.751 -56.544 1.00 149.34 ? 421 LYS G N 1 ATOM 2087 C CA . LYS A 1 282 ? 0.204 -18.843 -56.148 1.00 143.13 ? 421 LYS G CA 1 ATOM 2088 C C . LYS A 1 282 ? -0.652 -17.650 -56.478 1.00 136.88 ? 421 LYS G C 1 ATOM 2089 O O . LYS A 1 282 ? -0.206 -16.510 -56.478 1.00 139.11 ? 421 LYS G O 1 ATOM 2090 C CB . LYS A 1 282 ? 0.052 -19.141 -54.678 1.00 141.69 ? 421 LYS G CB 1 ATOM 2091 C CG . LYS A 1 282 ? 0.617 -20.454 -54.316 1.00 143.51 ? 421 LYS G CG 1 ATOM 2092 C CD . LYS A 1 282 ? 0.710 -20.547 -52.840 1.00 146.86 ? 421 LYS G CD 1 ATOM 2093 C CE . LYS A 1 282 ? 1.592 -21.683 -52.485 1.00 155.45 ? 421 LYS G CE 1 ATOM 2094 N NZ . LYS A 1 282 ? 1.662 -21.762 -51.033 1.00 156.93 ? 421 LYS G NZ 1 ATOM 2095 N N . GLN A 1 283 ? -1.913 -17.967 -56.728 1.00 137.03 ? 422 GLN G N 1 ATOM 2096 C CA . GLN A 1 283 ? -2.955 -17.001 -57.009 1.00 142.82 ? 422 GLN G CA 1 ATOM 2097 C C . GLN A 1 283 ? -3.796 -16.724 -55.756 1.00 128.37 ? 422 GLN G C 1 ATOM 2098 O O . GLN A 1 283 ? -4.427 -15.668 -55.654 1.00 132.53 ? 422 GLN G O 1 ATOM 2099 C CB . GLN A 1 283 ? -3.778 -17.520 -58.207 1.00 160.22 ? 422 GLN G CB 1 ATOM 2100 C CG . GLN A 1 283 ? -5.286 -17.368 -58.169 1.00 170.71 ? 422 GLN G CG 1 ATOM 2101 C CD . GLN A 1 283 ? -5.906 -17.452 -59.566 1.00 183.82 ? 422 GLN G CD 1 ATOM 2102 O OE1 . GLN A 1 283 ? -5.492 -18.262 -60.403 1.00 186.45 ? 422 GLN G OE1 1 ATOM 2103 N NE2 . GLN A 1 283 ? -6.899 -16.601 -59.821 1.00 191.12 ? 422 GLN G NE2 1 ATOM 2104 N N . ILE A 1 284 ? -3.831 -17.672 -54.817 1.00 122.21 ? 423 ILE G N 1 ATOM 2105 C CA . ILE A 1 284 ? -4.538 -17.425 -53.541 1.00 126.14 ? 423 ILE G CA 1 ATOM 2106 C C . ILE A 1 284 ? -3.543 -17.200 -52.388 1.00 120.99 ? 423 ILE G C 1 ATOM 2107 O O . ILE A 1 284 ? -2.747 -18.078 -52.066 1.00 114.78 ? 423 ILE G O 1 ATOM 2108 C CB . ILE A 1 284 ? -5.415 -18.631 -53.095 1.00 150.10 ? 423 ILE G CB 1 ATOM 2109 C CG1 . ILE A 1 284 ? -6.332 -19.137 -54.214 1.00 156.70 ? 423 ILE G CG1 1 ATOM 2110 C CG2 . ILE A 1 284 ? -6.174 -18.293 -51.820 1.00 112.04 ? 423 ILE G CG2 1 ATOM 2111 C CD1 . ILE A 1 284 ? -7.209 -20.315 -53.788 1.00 156.96 ? 423 ILE G CD1 1 ATOM 2112 N N . ILE A 1 285 ? -3.576 -16.032 -51.761 1.00 119.25 ? 424 ILE G N 1 ATOM 2113 C CA . ILE A 1 285 ? -2.566 -15.745 -50.740 1.00 115.07 ? 424 ILE G CA 1 ATOM 2114 C C . ILE A 1 285 ? -3.129 -15.121 -49.471 1.00 115.50 ? 424 ILE G C 1 ATOM 2115 O O . ILE A 1 285 ? -4.189 -14.524 -49.497 1.00 122.33 ? 424 ILE G O 1 ATOM 2116 C CB . ILE A 1 285 ? -1.445 -14.825 -51.275 1.00 118.59 ? 424 ILE G CB 1 ATOM 2117 C CG1 . ILE A 1 285 ? -1.972 -13.391 -51.376 1.00 117.94 ? 424 ILE G CG1 1 ATOM 2118 C CG2 . ILE A 1 285 ? -0.974 -15.251 -52.662 1.00 122.44 ? 424 ILE G CG2 1 ATOM 2119 C CD1 . ILE A 1 285 ? -1.018 -12.425 -52.011 1.00 119.85 ? 424 ILE G CD1 1 ATOM 2120 N N . ASN A 1 286 ? -2.446 -15.293 -48.347 1.00 108.37 ? 425 ASN G N 1 ATOM 2121 C CA . ASN A 1 286 ? -2.839 -14.573 -47.135 1.00 104.39 ? 425 ASN G CA 1 ATOM 2122 C C . ASN A 1 286 ? -2.197 -13.183 -47.115 1.00 101.73 ? 425 ASN G C 1 ATOM 2123 O O . ASN A 1 286 ? -0.966 -13.066 -47.128 1.00 94.64 ? 425 ASN G O 1 ATOM 2124 C CB . ASN A 1 286 ? -2.498 -15.352 -45.860 1.00 104.54 ? 425 ASN G CB 1 ATOM 2125 C CG . ASN A 1 286 ? -3.243 -16.658 -45.757 1.00 104.18 ? 425 ASN G CG 1 ATOM 2126 O OD1 . ASN A 1 286 ? -4.468 -16.691 -45.835 1.00 103.35 ? 425 ASN G OD1 1 ATOM 2127 N ND2 . ASN A 1 286 ? -2.511 -17.744 -45.603 1.00 107.04 ? 425 ASN G ND2 1 ATOM 2128 N N . MET A 1 287 ? -2.991 -12.129 -47.203 1.00 101.97 ? 426 MET G N 1 ATOM 2129 C CA . MET A 1 287 ? -2.334 -10.847 -47.252 1.00 108.18 ? 426 MET G CA 1 ATOM 2130 C C . MET A 1 287 ? -1.533 -10.671 -45.953 1.00 110.71 ? 426 MET G C 1 ATOM 2131 O O . MET A 1 287 ? -2.044 -10.892 -44.848 1.00 115.03 ? 426 MET G O 1 ATOM 2132 C CB . MET A 1 287 ? -3.362 -9.741 -47.458 1.00 109.11 ? 426 MET G CB 1 ATOM 2133 C CG . MET A 1 287 ? -4.012 -9.830 -48.822 1.00 104.32 ? 426 MET G CG 1 ATOM 2134 S SD . MET A 1 287 ? -5.294 -8.602 -49.042 1.00 109.74 ? 426 MET G SD 1 ATOM 2135 C CE . MET A 1 287 ? -4.497 -7.159 -48.345 1.00 172.12 ? 426 MET G CE 1 ATOM 2136 N N . TRP A 1 288 ? -0.312 -10.178 -46.100 1.00 112.83 ? 427 TRP G N 1 ATOM 2137 C CA . TRP A 1 288 ? 0.598 -9.899 -44.997 1.00 109.10 ? 427 TRP G CA 1 ATOM 2138 C C . TRP A 1 288 ? 0.179 -8.560 -44.461 1.00 117.33 ? 427 TRP G C 1 ATOM 2139 O O . TRP A 1 288 ? 0.262 -8.281 -43.272 1.00 108.77 ? 427 TRP G O 1 ATOM 2140 C CB . TRP A 1 288 ? 2.048 -9.878 -45.474 1.00 105.92 ? 427 TRP G CB 1 ATOM 2141 C CG . TRP A 1 288 ? 2.236 -8.848 -46.520 1.00 118.58 ? 427 TRP G CG 1 ATOM 2142 C CD1 . TRP A 1 288 ? 2.174 -9.033 -47.867 1.00 119.64 ? 427 TRP G CD1 1 ATOM 2143 C CD2 . TRP A 1 288 ? 2.497 -7.451 -46.317 1.00 124.20 ? 427 TRP G CD2 1 ATOM 2144 N NE1 . TRP A 1 288 ? 2.368 -7.837 -48.518 1.00 122.48 ? 427 TRP G NE1 1 ATOM 2145 C CE2 . TRP A 1 288 ? 2.574 -6.853 -47.587 1.00 124.40 ? 427 TRP G CE2 1 ATOM 2146 C CE3 . TRP A 1 288 ? 2.671 -6.650 -45.184 1.00 128.39 ? 427 TRP G CE3 1 ATOM 2147 C CZ2 . TRP A 1 288 ? 2.823 -5.495 -47.757 1.00 136.85 ? 427 TRP G CZ2 1 ATOM 2148 C CZ3 . TRP A 1 288 ? 2.913 -5.300 -45.354 1.00 131.82 ? 427 TRP G CZ3 1 ATOM 2149 C CH2 . TRP A 1 288 ? 2.990 -4.735 -46.629 1.00 136.57 ? 427 TRP G CH2 1 ATOM 2150 N N . GLN A 1 289 ? -0.336 -7.763 -45.391 1.00 133.00 ? 428 GLN G N 1 ATOM 2151 C CA . GLN A 1 289 ? -0.718 -6.389 -45.164 1.00 149.30 ? 428 GLN G CA 1 ATOM 2152 C C . GLN A 1 289 ? -1.815 -6.221 -44.125 1.00 156.29 ? 428 GLN G C 1 ATOM 2153 O O . GLN A 1 289 ? -2.133 -5.101 -43.730 1.00 169.64 ? 428 GLN G O 1 ATOM 2154 C CB . GLN A 1 289 ? -1.262 -5.846 -46.486 1.00 160.43 ? 428 GLN G CB 1 ATOM 2155 C CG . GLN A 1 289 ? -1.594 -4.383 -46.525 1.00 174.68 ? 428 GLN G CG 1 ATOM 2156 C CD . GLN A 1 289 ? -1.960 -3.929 -47.925 1.00 188.15 ? 428 GLN G CD 1 ATOM 2157 O OE1 . GLN A 1 289 ? -2.350 -2.777 -48.135 1.00 192.36 ? 428 GLN G OE1 1 ATOM 2158 N NE2 . GLN A 1 289 ? -1.834 -4.831 -48.892 1.00 193.22 ? 428 GLN G NE2 1 ATOM 2159 N N . GLY A 1 290 ? -2.393 -7.324 -43.680 1.00 140.94 ? 429 GLY G N 1 ATOM 2160 C CA . GLY A 1 290 ? -3.466 -7.252 -42.711 1.00 138.88 ? 429 GLY G CA 1 ATOM 2161 C C . GLY A 1 290 ? -4.059 -8.631 -42.809 1.00 143.98 ? 429 GLY G C 1 ATOM 2162 O O . GLY A 1 290 ? -3.360 -9.608 -43.085 1.00 148.27 ? 429 GLY G O 1 ATOM 2163 N N . THR A 1 291 ? -5.374 -8.688 -42.607 1.00 146.40 ? 430 THR G N 1 ATOM 2164 C CA . THR A 1 291 ? -6.113 -9.946 -42.616 1.00 145.16 ? 430 THR G CA 1 ATOM 2165 C C . THR A 1 291 ? -6.926 -10.245 -43.883 1.00 138.47 ? 430 THR G C 1 ATOM 2166 O O . THR A 1 291 ? -7.412 -9.334 -44.562 1.00 127.25 ? 430 THR G O 1 ATOM 2167 C CB . THR A 1 291 ? -7.045 -9.913 -41.366 1.00 170.67 ? 430 THR G CB 1 ATOM 2168 O OG1 . THR A 1 291 ? -6.271 -9.616 -40.198 1.00 169.80 ? 430 THR G OG1 1 ATOM 2169 C CG2 . THR A 1 291 ? -7.743 -11.261 -41.155 1.00 167.21 ? 430 THR G CG2 1 ATOM 2170 N N . GLY A 1 292 ? -7.039 -11.527 -44.205 1.00 139.93 ? 431 GLY G N 1 ATOM 2171 C CA . GLY A 1 292 ? -7.815 -11.964 -45.343 1.00 150.01 ? 431 GLY G CA 1 ATOM 2172 C C . GLY A 1 292 ? -7.030 -12.606 -46.464 1.00 154.43 ? 431 GLY G C 1 ATOM 2173 O O . GLY A 1 292 ? -5.824 -12.371 -46.607 1.00 152.66 ? 431 GLY G O 1 ATOM 2174 N N . GLN A 1 293 ? -7.718 -13.419 -47.265 1.00 156.58 ? 432 GLN G N 1 ATOM 2175 C CA . GLN A 1 293 ? -7.073 -14.072 -48.387 1.00 159.90 ? 432 GLN G CA 1 ATOM 2176 C C . GLN A 1 293 ? -7.360 -13.196 -49.604 1.00 163.71 ? 432 GLN G C 1 ATOM 2177 O O . GLN A 1 293 ? -8.483 -12.721 -49.778 1.00 169.92 ? 432 GLN G O 1 ATOM 2178 C CB . GLN A 1 293 ? -7.619 -15.489 -48.624 1.00 164.03 ? 432 GLN G CB 1 ATOM 2179 C CG . GLN A 1 293 ? -7.421 -16.506 -47.505 1.00 160.37 ? 432 GLN G CG 1 ATOM 2180 C CD . GLN A 1 293 ? -8.212 -17.794 -47.747 1.00 157.29 ? 432 GLN G CD 1 ATOM 2181 O OE1 . GLN A 1 293 ? -9.440 -17.774 -47.853 1.00 158.54 ? 432 GLN G OE1 1 ATOM 2182 N NE2 . GLN A 1 293 ? -7.504 -18.918 -47.839 1.00 151.81 ? 432 GLN G NE2 1 ATOM 2183 N N . ALA A 1 294 ? -6.354 -12.968 -50.439 1.00 158.62 ? 433 ALA G N 1 ATOM 2184 C CA . ALA A 1 294 ? -6.564 -12.265 -51.687 1.00 156.29 ? 433 ALA G CA 1 ATOM 2185 C C . ALA A 1 294 ? -6.449 -13.217 -52.865 1.00 152.66 ? 433 ALA G C 1 ATOM 2186 O O . ALA A 1 294 ? -5.627 -14.150 -52.857 1.00 143.36 ? 433 ALA G O 1 ATOM 2187 C CB . ALA A 1 294 ? -5.575 -11.113 -51.830 1.00 154.66 ? 433 ALA G CB 1 ATOM 2188 N N . MET A 1 295 ? -7.267 -12.964 -53.878 1.00 155.79 ? 434 MET G N 1 ATOM 2189 C CA . MET A 1 295 ? -7.267 -13.777 -55.074 1.00 154.35 ? 434 MET G CA 1 ATOM 2190 C C . MET A 1 295 ? -6.816 -12.896 -56.215 1.00 154.63 ? 434 MET G C 1 ATOM 2191 O O . MET A 1 295 ? -7.527 -11.951 -56.595 1.00 157.04 ? 434 MET G O 1 ATOM 2192 C CB . MET A 1 295 ? -8.639 -14.351 -55.370 1.00 159.46 ? 434 MET G CB 1 ATOM 2193 C CG . MET A 1 295 ? -8.964 -15.607 -54.611 1.00 156.97 ? 434 MET G CG 1 ATOM 2194 S SD . MET A 1 295 ? -10.397 -16.406 -55.349 1.00 211.37 ? 434 MET G SD 1 ATOM 2195 C CE . MET A 1 295 ? -9.980 -16.320 -57.096 1.00 198.59 ? 434 MET G CE 1 ATOM 2196 N N . TYR A 1 296 ? -5.642 -13.217 -56.750 1.00 151.89 ? 435 TYR G N 1 ATOM 2197 C CA . TYR A 1 296 ? -5.098 -12.544 -57.917 1.00 157.72 ? 435 TYR G CA 1 ATOM 2198 C C . TYR A 1 296 ? -5.413 -13.363 -59.165 1.00 162.68 ? 435 TYR G C 1 ATOM 2199 O O . TYR A 1 296 ? -5.815 -14.518 -59.050 1.00 159.38 ? 435 TYR G O 1 ATOM 2200 C CB . TYR A 1 296 ? -3.591 -12.323 -57.734 1.00 155.94 ? 435 TYR G CB 1 ATOM 2201 C CG . TYR A 1 296 ? -3.284 -11.345 -56.607 1.00 149.17 ? 435 TYR G CG 1 ATOM 2202 C CD1 . TYR A 1 296 ? -3.231 -9.979 -56.845 1.00 153.13 ? 435 TYR G CD1 1 ATOM 2203 C CD2 . TYR A 1 296 ? -3.079 -11.777 -55.315 1.00 135.90 ? 435 TYR G CD2 1 ATOM 2204 C CE1 . TYR A 1 296 ? -2.968 -9.081 -55.840 1.00 148.24 ? 435 TYR G CE1 1 ATOM 2205 C CE2 . TYR A 1 296 ? -2.819 -10.878 -54.305 1.00 133.41 ? 435 TYR G CE2 1 ATOM 2206 C CZ . TYR A 1 296 ? -2.765 -9.532 -54.571 1.00 140.88 ? 435 TYR G CZ 1 ATOM 2207 O OH . TYR A 1 296 ? -2.499 -8.624 -53.564 1.00 142.91 ? 435 TYR G OH 1 ATOM 2208 N N . ALA A 1 297 ? -5.248 -12.768 -60.348 1.00 167.57 ? 436 ALA G N 1 ATOM 2209 C CA . ALA A 1 297 ? -5.602 -13.448 -61.594 1.00 169.12 ? 436 ALA G CA 1 ATOM 2210 C C . ALA A 1 297 ? -4.577 -14.545 -61.866 1.00 164.03 ? 436 ALA G C 1 ATOM 2211 O O . ALA A 1 297 ? -3.489 -14.527 -61.281 1.00 139.30 ? 436 ALA G O 1 ATOM 2212 C CB . ALA A 1 297 ? -5.658 -12.456 -62.744 1.00 150.96 ? 436 ALA G CB 1 ATOM 2213 N N . PRO A 1 298 ? -4.901 -15.491 -62.770 1.00 159.79 ? 437 PRO G N 1 ATOM 2214 C CA . PRO A 1 298 ? -3.927 -16.535 -63.110 1.00 155.23 ? 437 PRO G CA 1 ATOM 2215 C C . PRO A 1 298 ? -2.582 -15.947 -63.572 1.00 157.68 ? 437 PRO G C 1 ATOM 2216 O O . PRO A 1 298 ? -2.541 -14.834 -64.109 1.00 160.75 ? 437 PRO G O 1 ATOM 2217 C CB . PRO A 1 298 ? -4.640 -17.324 -64.210 1.00 159.54 ? 437 PRO G CB 1 ATOM 2218 C CG . PRO A 1 298 ? -6.087 -17.139 -63.897 1.00 161.42 ? 437 PRO G CG 1 ATOM 2219 C CD . PRO A 1 298 ? -6.210 -15.742 -63.399 1.00 160.37 ? 437 PRO G CD 1 ATOM 2220 N N . PRO A 1 299 ? -1.491 -16.709 -63.384 1.00 159.95 ? 438 PRO G N 1 ATOM 2221 C CA . PRO A 1 299 ? -0.111 -16.341 -63.734 1.00 144.85 ? 438 PRO G CA 1 ATOM 2222 C C . PRO A 1 299 ? 0.014 -16.098 -65.200 1.00 152.87 ? 438 PRO G C 1 ATOM 2223 O O . PRO A 1 299 ? -0.354 -16.961 -65.996 1.00 165.41 ? 438 PRO G O 1 ATOM 2224 C CB . PRO A 1 299 ? 0.701 -17.569 -63.328 1.00 142.52 ? 438 PRO G CB 1 ATOM 2225 C CG . PRO A 1 299 ? -0.289 -18.678 -63.370 1.00 166.70 ? 438 PRO G CG 1 ATOM 2226 C CD . PRO A 1 299 ? -1.559 -18.078 -62.856 1.00 162.85 ? 438 PRO G CD 1 ATOM 2227 N N . ILE A 1 300 ? 0.542 -14.939 -65.558 1.00 154.39 ? 439 ILE G N 1 ATOM 2228 C CA . ILE A 1 300 ? 0.794 -14.650 -66.960 1.00 176.24 ? 439 ILE G CA 1 ATOM 2229 C C . ILE A 1 300 ? 1.782 -15.616 -67.661 1.00 182.79 ? 439 ILE G C 1 ATOM 2230 O O . ILE A 1 300 ? 2.600 -16.278 -67.017 1.00 182.82 ? 439 ILE G O 1 ATOM 2231 C CB . ILE A 1 300 ? 1.278 -13.166 -67.086 1.00 187.42 ? 439 ILE G CB 1 ATOM 2232 C CG1 . ILE A 1 300 ? 2.382 -12.820 -66.075 1.00 178.89 ? 439 ILE G CG1 1 ATOM 2233 C CG2 . ILE A 1 300 ? 0.100 -12.211 -66.912 1.00 185.58 ? 439 ILE G CG2 1 ATOM 2234 C CD1 . ILE A 1 300 ? 3.787 -13.231 -66.469 1.00 153.81 ? 439 ILE G CD1 1 ATOM 2235 N N . ASP A 1 301 ? 1.675 -15.701 -68.985 1.00 185.98 ? 440 ASP G N 1 ATOM 2236 C CA . ASP A 1 301 ? 2.586 -16.515 -69.786 1.00 193.51 ? 440 ASP G CA 1 ATOM 2237 C C . ASP A 1 301 ? 3.932 -15.858 -70.020 1.00 183.41 ? 440 ASP G C 1 ATOM 2238 O O . ASP A 1 301 ? 4.051 -14.636 -70.030 1.00 179.28 ? 440 ASP G O 1 ATOM 2239 C CB . ASP A 1 301 ? 1.933 -16.917 -71.102 1.00 214.16 ? 440 ASP G CB 1 ATOM 2240 C CG . ASP A 1 301 ? 0.631 -17.661 -70.884 1.00 226.46 ? 440 ASP G CG 1 ATOM 2241 O OD1 . ASP A 1 301 ? 0.670 -18.910 -70.781 1.00 227.36 ? 440 ASP G OD1 1 ATOM 2242 O OD2 . ASP A 1 301 ? -0.423 -16.997 -70.788 1.00 233.32 ? 440 ASP G OD2 1 ATOM 2243 N N . GLY A 1 302 ? 4.925 -16.700 -70.276 1.00 179.46 ? 441 GLY G N 1 ATOM 2244 C CA . GLY A 1 302 ? 6.272 -16.264 -70.573 1.00 174.05 ? 441 GLY G CA 1 ATOM 2245 C C . GLY A 1 302 ? 7.153 -16.695 -69.420 1.00 169.77 ? 441 GLY G C 1 ATOM 2246 O O . GLY A 1 302 ? 6.669 -16.917 -68.310 1.00 165.48 ? 441 GLY G O 1 ATOM 2247 N N . LYS A 1 303 ? 8.439 -16.868 -69.698 1.00 170.02 ? 442 LYS G N 1 ATOM 2248 C CA . LYS A 1 303 ? 9.404 -17.262 -68.679 1.00 169.15 ? 442 LYS G CA 1 ATOM 2249 C C . LYS A 1 303 ? 9.486 -16.097 -67.697 1.00 169.73 ? 442 LYS G C 1 ATOM 2250 O O . LYS A 1 303 ? 9.613 -14.935 -68.107 1.00 176.48 ? 442 LYS G O 1 ATOM 2251 C CB . LYS A 1 303 ? 10.765 -17.629 -69.272 1.00 175.26 ? 442 LYS G CB 1 ATOM 2252 C CG . LYS A 1 303 ? 11.721 -18.223 -68.245 1.00 174.34 ? 442 LYS G CG 1 ATOM 2253 C CD . LYS A 1 303 ? 13.041 -18.648 -68.867 1.00 182.42 ? 442 LYS G CD 1 ATOM 2254 C CE . LYS A 1 303 ? 13.840 -17.443 -69.339 1.00 182.78 ? 442 LYS G CE 1 ATOM 2255 N NZ . LYS A 1 303 ? 14.226 -16.545 -68.212 1.00 171.26 ? 442 LYS G NZ 1 ATOM 2256 N N . ILE A 1 304 ? 9.420 -16.430 -66.407 1.00 162.64 ? 443 ILE G N 1 ATOM 2257 C CA . ILE A 1 304 ? 9.483 -15.463 -65.300 1.00 159.23 ? 443 ILE G CA 1 ATOM 2258 C C . ILE A 1 304 ? 10.664 -15.757 -64.399 1.00 165.42 ? 443 ILE G C 1 ATOM 2259 O O . ILE A 1 304 ? 10.844 -16.887 -63.949 1.00 171.32 ? 443 ILE G O 1 ATOM 2260 C CB . ILE A 1 304 ? 8.212 -15.533 -64.408 1.00 157.73 ? 443 ILE G CB 1 ATOM 2261 C CG1 . ILE A 1 304 ? 6.923 -15.500 -65.232 1.00 166.03 ? 443 ILE G CG1 1 ATOM 2262 C CG2 . ILE A 1 304 ? 8.263 -14.476 -63.322 1.00 147.27 ? 443 ILE G CG2 1 ATOM 2263 C CD1 . ILE A 1 304 ? 5.676 -15.853 -64.434 1.00 143.53 ? 443 ILE G CD1 1 ATOM 2264 N N . ASN A 1 305 ? 11.503 -14.749 -64.182 1.00 167.25 ? 444 ASN G N 1 ATOM 2265 C CA . ASN A 1 305 ? 12.762 -14.964 -63.483 1.00 167.58 ? 444 ASN G CA 1 ATOM 2266 C C . ASN A 1 305 ? 13.259 -13.860 -62.528 1.00 161.87 ? 444 ASN G C 1 ATOM 2267 O O . ASN A 1 305 ? 13.546 -12.748 -62.960 1.00 169.94 ? 444 ASN G O 1 ATOM 2268 C CB . ASN A 1 305 ? 13.824 -15.239 -64.563 1.00 176.64 ? 444 ASN G CB 1 ATOM 2269 C CG . ASN A 1 305 ? 15.229 -15.343 -64.009 1.00 179.37 ? 444 ASN G CG 1 ATOM 2270 O OD1 . ASN A 1 305 ? 15.537 -16.244 -63.235 1.00 180.30 ? 444 ASN G OD1 1 ATOM 2271 N ND2 . ASN A 1 305 ? 16.102 -14.440 -64.438 1.00 181.03 ? 444 ASN G ND2 1 ATOM 2272 N N . CYS A 1 306 ? 13.338 -14.152 -61.229 1.00 155.28 ? 445 CYS G N 1 ATOM 2273 C CA . CYS A 1 306 ? 13.919 -13.191 -60.282 1.00 160.41 ? 445 CYS G CA 1 ATOM 2274 C C . CYS A 1 306 ? 15.209 -13.709 -59.679 1.00 170.40 ? 445 CYS G C 1 ATOM 2275 O O . CYS A 1 306 ? 15.255 -14.816 -59.167 1.00 177.22 ? 445 CYS G O 1 ATOM 2276 C CB . CYS A 1 306 ? 12.974 -12.862 -59.118 1.00 156.65 ? 445 CYS G CB 1 ATOM 2277 S SG . CYS A 1 306 ? 11.751 -11.570 -59.362 1.00 197.49 ? 445 CYS G SG 1 ATOM 2278 N N . VAL A 1 307 ? 16.258 -12.900 -59.734 1.00 170.13 ? 446 VAL G N 1 ATOM 2279 C CA . VAL A 1 307 ? 17.525 -13.230 -59.087 1.00 168.44 ? 446 VAL G CA 1 ATOM 2280 C C . VAL A 1 307 ? 17.796 -12.274 -57.948 1.00 165.18 ? 446 VAL G C 1 ATOM 2281 O O . VAL A 1 307 ? 17.994 -11.079 -58.187 1.00 173.13 ? 446 VAL G O 1 ATOM 2282 C CB . VAL A 1 307 ? 18.696 -13.212 -60.038 1.00 172.91 ? 446 VAL G CB 1 ATOM 2283 C CG1 . VAL A 1 307 ? 19.981 -13.464 -59.262 1.00 170.00 ? 446 VAL G CG1 1 ATOM 2284 C CG2 . VAL A 1 307 ? 18.485 -14.260 -61.116 1.00 180.11 ? 446 VAL G CG2 1 ATOM 2285 N N . SER A 1 308 ? 17.815 -12.780 -56.717 1.00 155.65 ? 447 SER G N 1 ATOM 2286 C CA . SER A 1 308 ? 17.947 -11.885 -55.557 1.00 146.89 ? 447 SER G CA 1 ATOM 2287 C C . SER A 1 308 ? 19.192 -12.160 -54.702 1.00 141.06 ? 447 SER G C 1 ATOM 2288 O O . SER A 1 308 ? 19.791 -13.225 -54.812 1.00 141.82 ? 447 SER G O 1 ATOM 2289 C CB . SER A 1 308 ? 16.686 -11.979 -54.699 1.00 143.62 ? 447 SER G CB 1 ATOM 2290 O OG . SER A 1 308 ? 15.511 -11.855 -55.488 1.00 148.65 ? 447 SER G OG 1 ATOM 2291 N N . ASN A 1 309 ? 19.595 -11.207 -53.860 1.00 141.48 ? 448 ASN G N 1 ATOM 2292 C CA . ASN A 1 309 ? 20.739 -11.455 -52.979 1.00 147.24 ? 448 ASN G CA 1 ATOM 2293 C C . ASN A 1 309 ? 20.280 -11.713 -51.562 1.00 138.79 ? 448 ASN G C 1 ATOM 2294 O O . ASN A 1 309 ? 19.712 -10.839 -50.905 1.00 126.84 ? 448 ASN G O 1 ATOM 2295 C CB . ASN A 1 309 ? 21.709 -10.270 -52.940 1.00 158.65 ? 448 ASN G CB 1 ATOM 2296 C CG . ASN A 1 309 ? 22.399 -10.027 -54.256 1.00 173.57 ? 448 ASN G CG 1 ATOM 2297 O OD1 . ASN A 1 309 ? 23.338 -10.736 -54.613 1.00 182.16 ? 448 ASN G OD1 1 ATOM 2298 N ND2 . ASN A 1 309 ? 21.972 -8.986 -54.967 1.00 176.87 ? 448 ASN G ND2 1 ATOM 2299 N N . ILE A 1 310 ? 20.526 -12.926 -51.088 1.00 140.74 ? 449 ILE G N 1 ATOM 2300 C CA . ILE A 1 310 ? 20.249 -13.219 -49.701 1.00 137.41 ? 449 ILE G CA 1 ATOM 2301 C C . ILE A 1 310 ? 21.275 -12.503 -48.828 1.00 140.79 ? 449 ILE G C 1 ATOM 2302 O O . ILE A 1 310 ? 22.493 -12.745 -48.941 1.00 148.15 ? 449 ILE G O 1 ATOM 2303 C CB . ILE A 1 310 ? 20.293 -14.720 -49.454 1.00 131.87 ? 449 ILE G CB 1 ATOM 2304 C CG1 . ILE A 1 310 ? 19.265 -15.416 -50.349 1.00 126.69 ? 449 ILE G CG1 1 ATOM 2305 C CG2 . ILE A 1 310 ? 20.119 -15.015 -47.968 1.00 127.89 ? 449 ILE G CG2 1 ATOM 2306 C CD1 . ILE A 1 310 ? 19.343 -16.914 -50.315 1.00 131.97 ? 449 ILE G CD1 1 ATOM 2307 N N . THR A 1 311 ? 20.758 -11.637 -47.960 1.00 136.44 ? 450 THR G N 1 ATOM 2308 C CA . THR A 1 311 ? 21.560 -10.797 -47.075 1.00 140.96 ? 450 THR G CA 1 ATOM 2309 C C . THR A 1 311 ? 21.210 -10.991 -45.607 1.00 140.69 ? 450 THR G C 1 ATOM 2310 O O . THR A 1 311 ? 21.861 -10.433 -44.720 1.00 139.59 ? 450 THR G O 1 ATOM 2311 C CB . THR A 1 311 ? 21.403 -9.319 -47.423 1.00 142.16 ? 450 THR G CB 1 ATOM 2312 O OG1 . THR A 1 311 ? 20.022 -8.956 -47.312 1.00 139.90 ? 450 THR G OG1 1 ATOM 2313 C CG2 . THR A 1 311 ? 21.874 -9.065 -48.837 1.00 145.97 ? 450 THR G CG2 1 ATOM 2314 N N . GLY A 1 312 ? 20.108 -11.681 -45.352 1.00 136.04 ? 451 GLY G N 1 ATOM 2315 C CA . GLY A 1 312 ? 19.658 -11.888 -43.991 1.00 130.52 ? 451 GLY G CA 1 ATOM 2316 C C . GLY A 1 312 ? 18.707 -13.050 -43.834 1.00 125.19 ? 451 GLY G C 1 ATOM 2317 O O . GLY A 1 312 ? 18.096 -13.498 -44.798 1.00 127.70 ? 451 GLY G O 1 ATOM 2318 N N . ILE A 1 313 ? 18.568 -13.529 -42.605 1.00 118.43 ? 452 ILE G N 1 ATOM 2319 C CA . ILE A 1 313 ? 17.632 -14.599 -42.319 1.00 120.56 ? 452 ILE G CA 1 ATOM 2320 C C . ILE A 1 313 ? 16.873 -14.346 -41.034 1.00 122.39 ? 452 ILE G C 1 ATOM 2321 O O . ILE A 1 313 ? 17.383 -13.712 -40.116 1.00 122.86 ? 452 ILE G O 1 ATOM 2322 C CB . ILE A 1 313 ? 18.339 -15.936 -42.211 1.00 126.12 ? 452 ILE G CB 1 ATOM 2323 C CG1 . ILE A 1 313 ? 19.121 -16.194 -43.486 1.00 128.77 ? 452 ILE G CG1 1 ATOM 2324 C CG2 . ILE A 1 313 ? 17.329 -17.029 -42.014 1.00 128.34 ? 452 ILE G CG2 1 ATOM 2325 C CD1 . ILE A 1 313 ? 18.359 -15.781 -44.715 1.00 130.92 ? 452 ILE G CD1 1 ATOM 2326 N N . LEU A 1 314 ? 15.652 -14.856 -40.973 1.00 123.81 ? 453 LEU G N 1 ATOM 2327 C CA . LEU A 1 314 ? 14.833 -14.719 -39.781 1.00 123.99 ? 453 LEU G CA 1 ATOM 2328 C C . LEU A 1 314 ? 14.627 -16.076 -39.132 1.00 119.41 ? 453 LEU G C 1 ATOM 2329 O O . LEU A 1 314 ? 14.136 -17.014 -39.759 1.00 112.23 ? 453 LEU G O 1 ATOM 2330 C CB . LEU A 1 314 ? 13.484 -14.118 -40.139 1.00 128.87 ? 453 LEU G CB 1 ATOM 2331 C CG . LEU A 1 314 ? 13.541 -12.845 -40.971 1.00 127.77 ? 453 LEU G CG 1 ATOM 2332 C CD1 . LEU A 1 314 ? 12.136 -12.336 -41.191 1.00 121.58 ? 453 LEU G CD1 1 ATOM 2333 C CD2 . LEU A 1 314 ? 14.384 -11.812 -40.259 1.00 129.93 ? 453 LEU G CD2 1 ATOM 2334 N N . LEU A 1 315 ? 14.985 -16.169 -37.860 1.00 122.45 ? 454 LEU G N 1 ATOM 2335 C CA . LEU A 1 315 ? 14.932 -17.433 -37.158 1.00 119.45 ? 454 LEU G CA 1 ATOM 2336 C C . LEU A 1 315 ? 14.194 -17.346 -35.850 1.00 125.80 ? 454 LEU G C 1 ATOM 2337 O O . LEU A 1 315 ? 14.218 -16.321 -35.182 1.00 124.60 ? 454 LEU G O 1 ATOM 2338 C CB . LEU A 1 315 ? 16.346 -17.909 -36.880 1.00 118.68 ? 454 LEU G CB 1 ATOM 2339 C CG . LEU A 1 315 ? 17.153 -18.161 -38.140 1.00 124.18 ? 454 LEU G CG 1 ATOM 2340 C CD1 . LEU A 1 315 ? 18.565 -18.542 -37.781 1.00 130.09 ? 454 LEU G CD1 1 ATOM 2341 C CD2 . LEU A 1 315 ? 16.491 -19.245 -38.963 1.00 125.80 ? 454 LEU G CD2 1 ATOM 2342 N N . THR A 1 316 ? 13.543 -18.440 -35.487 1.00 135.43 ? 455 THR G N 1 ATOM 2343 C CA . THR A 1 316 ? 12.884 -18.537 -34.204 1.00 144.32 ? 455 THR G CA 1 ATOM 2344 C C . THR A 1 316 ? 13.561 -19.656 -33.431 1.00 163.33 ? 455 THR G C 1 ATOM 2345 O O . THR A 1 316 ? 13.672 -20.772 -33.924 1.00 168.78 ? 455 THR G O 1 ATOM 2346 C CB . THR A 1 316 ? 11.410 -18.884 -34.370 1.00 138.22 ? 455 THR G CB 1 ATOM 2347 O OG1 . THR A 1 316 ? 10.903 -18.245 -35.543 1.00 141.21 ? 455 THR G OG1 1 ATOM 2348 C CG2 . THR A 1 316 ? 10.621 -18.422 -33.168 1.00 131.56 ? 455 THR G CG2 1 ATOM 2349 N N . ARG A 1 317 ? 14.013 -19.365 -32.219 1.00 181.34 ? 456 ARG G N 1 ATOM 2350 C CA . ARG A 1 317 ? 14.652 -20.396 -31.415 1.00 94.05 ? 456 ARG G CA 1 ATOM 2351 C C . ARG A 1 317 ? 13.651 -21.217 -30.624 1.00 96.48 ? 456 ARG G C 1 ATOM 2352 O O . ARG A 1 317 ? 12.748 -20.665 -30.005 1.00 111.83 ? 456 ARG G O 1 ATOM 2353 C CB . ARG A 1 317 ? 15.669 -19.773 -30.463 1.00 103.18 ? 456 ARG G CB 1 ATOM 2354 C CG . ARG A 1 317 ? 16.613 -20.779 -29.829 1.00 105.76 ? 456 ARG G CG 1 ATOM 2355 C CD . ARG A 1 317 ? 17.694 -20.067 -29.030 1.00 112.25 ? 456 ARG G CD 1 ATOM 2356 N NE . ARG A 1 317 ? 17.157 -19.153 -28.027 1.00 120.02 ? 456 ARG G NE 1 ATOM 2357 C CZ . ARG A 1 317 ? 16.502 -19.525 -26.934 1.00 130.98 ? 456 ARG G CZ 1 ATOM 2358 N NH1 . ARG A 1 317 ? 16.321 -20.811 -26.663 1.00 138.35 ? 456 ARG G NH1 1 ATOM 2359 N NH2 . ARG A 1 317 ? 16.051 -18.600 -26.097 1.00 132.78 ? 456 ARG G NH2 1 ATOM 2360 N N . ASP A 1 318 ? 13.804 -22.533 -30.682 1.00 197.70 ? 457 ASP G N 1 ATOM 2361 C CA . ASP A 1 318 ? 12.875 -23.448 -30.045 1.00 180.13 ? 457 ASP G CA 1 ATOM 2362 C C . ASP A 1 318 ? 12.906 -23.312 -28.534 1.00 170.86 ? 457 ASP G C 1 ATOM 2363 O O . ASP A 1 318 ? 13.963 -23.167 -27.935 1.00 170.50 ? 457 ASP G O 1 ATOM 2364 C CB . ASP A 1 318 ? 13.192 -24.886 -30.450 1.00 178.88 ? 457 ASP G CB 1 ATOM 2365 C CG . ASP A 1 318 ? 12.419 -25.328 -31.675 1.00 174.20 ? 457 ASP G CG 1 ATOM 2366 O OD1 . ASP A 1 318 ? 11.287 -24.849 -31.863 1.00 174.94 ? 457 ASP G OD1 1 ATOM 2367 O OD2 . ASP A 1 318 ? 12.937 -26.155 -32.451 1.00 169.49 ? 457 ASP G OD2 1 ATOM 2368 N N . GLY A 1 319 ? 11.726 -23.364 -27.932 1.00 165.67 ? 458 GLY G N 1 ATOM 2369 C CA . GLY A 1 319 ? 11.550 -23.284 -26.493 1.00 167.38 ? 458 GLY G CA 1 ATOM 2370 C C . GLY A 1 319 ? 11.783 -24.605 -25.790 1.00 177.69 ? 458 GLY G C 1 ATOM 2371 O O . GLY A 1 319 ? 11.947 -25.635 -26.436 1.00 182.15 ? 458 GLY G O 1 ATOM 2372 N N . GLY A 1 320 ? 11.782 -24.590 -24.464 1.00 182.80 ? 459 GLY G N 1 ATOM 2373 C CA . GLY A 1 320 ? 11.971 -25.823 -23.726 1.00 193.44 ? 459 GLY G CA 1 ATOM 2374 C C . GLY A 1 320 ? 13.263 -26.513 -24.088 1.00 202.21 ? 459 GLY G C 1 ATOM 2375 O O . GLY A 1 320 ? 13.285 -27.680 -24.467 1.00 204.44 ? 459 GLY G O 1 ATOM 2376 N N . ALA A 1 321 ? 14.347 -25.757 -23.996 1.00 206.81 ? 460 ALA G N 1 ATOM 2377 C CA . ALA A 1 321 ? 15.662 -26.235 -24.381 1.00 210.10 ? 460 ALA G CA 1 ATOM 2378 C C . ALA A 1 321 ? 16.115 -27.440 -23.567 1.00 219.31 ? 460 ALA G C 1 ATOM 2379 O O . ALA A 1 321 ? 16.733 -28.346 -24.118 1.00 223.36 ? 460 ALA G O 1 ATOM 2380 C CB . ALA A 1 321 ? 16.679 -25.113 -24.257 1.00 207.44 ? 460 ALA G CB 1 ATOM 2381 N N . ASN A 1 322 ? 15.840 -27.441 -22.264 1.00 225.15 ? 461 ASN G N 1 ATOM 2382 C CA . ASN A 1 322 ? 16.253 -28.554 -21.404 1.00 233.99 ? 461 ASN G CA 1 ATOM 2383 C C . ASN A 1 322 ? 17.772 -28.780 -21.444 1.00 237.49 ? 461 ASN G C 1 ATOM 2384 O O . ASN A 1 322 ? 18.544 -27.869 -21.149 1.00 239.13 ? 461 ASN G O 1 ATOM 2385 C CB . ASN A 1 322 ? 15.419 -29.832 -21.635 1.00 241.19 ? 461 ASN G CB 1 ATOM 2386 C CG . ASN A 1 322 ? 15.631 -30.893 -20.571 1.00 252.93 ? 461 ASN G CG 1 ATOM 2387 O OD1 . ASN A 1 322 ? 15.902 -30.578 -19.412 1.00 257.06 ? 461 ASN G OD1 1 ATOM 2388 N ND2 . ASN A 1 322 ? 15.508 -32.156 -20.959 1.00 258.01 ? 461 ASN G ND2 1 ATOM 2389 N N . ASN A 1 323 ? 18.200 -29.986 -21.799 1.00 238.99 ? 462 ASN G N 1 ATOM 2390 C CA . ASN A 1 323 ? 19.620 -30.306 -21.843 1.00 241.34 ? 462 ASN G CA 1 ATOM 2391 C C . ASN A 1 323 ? 20.351 -29.397 -22.824 1.00 235.81 ? 462 ASN G C 1 ATOM 2392 O O . ASN A 1 323 ? 19.802 -28.985 -23.840 1.00 229.71 ? 462 ASN G O 1 ATOM 2393 C CB . ASN A 1 323 ? 19.826 -31.770 -22.225 1.00 244.50 ? 462 ASN G CB 1 ATOM 2394 C CG . ASN A 1 323 ? 19.557 -32.714 -21.072 1.00 244.99 ? 462 ASN G CG 1 ATOM 2395 O OD1 . ASN A 1 323 ? 19.633 -32.325 -19.907 1.00 245.71 ? 462 ASN G OD1 1 ATOM 2396 N ND2 . ASN A 1 323 ? 19.240 -33.963 -21.392 1.00 245.22 ? 462 ASN G ND2 1 ATOM 2397 N N . THR A 1 324 ? 21.602 -29.093 -22.502 1.00 238.34 ? 463 THR G N 1 ATOM 2398 C CA . THR A 1 324 ? 22.321 -27.955 -23.044 1.00 235.74 ? 463 THR G CA 1 ATOM 2399 C C . THR A 1 324 ? 22.451 -27.991 -24.556 1.00 245.59 ? 463 THR G C 1 ATOM 2400 O O . THR A 1 324 ? 22.299 -26.971 -25.229 1.00 245.32 ? 463 THR G O 1 ATOM 2401 C CB . THR A 1 324 ? 23.743 -27.918 -22.454 1.00 231.68 ? 463 THR G CB 1 ATOM 2402 O OG1 . THR A 1 324 ? 23.669 -27.747 -21.036 1.00 230.33 ? 463 THR G OG1 1 ATOM 2403 C CG2 . THR A 1 324 ? 24.550 -26.783 -23.045 1.00 229.03 ? 463 THR G CG2 1 ATOM 2404 N N . SER A 1 325 ? 22.730 -29.166 -25.091 1.00 250.84 ? 464 SER G N 1 ATOM 2405 C CA . SER A 1 325 ? 22.970 -29.306 -26.516 1.00 250.27 ? 464 SER G CA 1 ATOM 2406 C C . SER A 1 325 ? 21.715 -29.102 -27.353 1.00 246.53 ? 464 SER G C 1 ATOM 2407 O O . SER A 1 325 ? 20.607 -29.047 -26.833 1.00 248.61 ? 464 SER G O 1 ATOM 2408 C CB . SER A 1 325 ? 23.585 -30.662 -26.830 1.00 252.29 ? 464 SER G CB 1 ATOM 2409 O OG . SER A 1 325 ? 23.720 -30.820 -28.229 1.00 247.92 ? 464 SER G OG 1 ATOM 2410 N N . ASN A 1 326 ? 21.907 -28.988 -28.658 1.00 239.64 ? 465 ASN G N 1 ATOM 2411 C CA . ASN A 1 326 ? 20.791 -28.931 -29.593 1.00 231.61 ? 465 ASN G CA 1 ATOM 2412 C C . ASN A 1 326 ? 19.749 -27.808 -29.489 1.00 223.92 ? 465 ASN G C 1 ATOM 2413 O O . ASN A 1 326 ? 18.547 -28.065 -29.525 1.00 225.46 ? 465 ASN G O 1 ATOM 2414 C CB . ASN A 1 326 ? 20.082 -30.286 -29.608 1.00 234.16 ? 465 ASN G CB 1 ATOM 2415 C CG . ASN A 1 326 ? 20.906 -31.355 -30.278 1.00 239.23 ? 465 ASN G CG 1 ATOM 2416 O OD1 . ASN A 1 326 ? 21.779 -31.056 -31.086 1.00 241.92 ? 465 ASN G OD1 1 ATOM 2417 N ND2 . ASN A 1 326 ? 20.628 -32.612 -29.953 1.00 240.52 ? 465 ASN G ND2 1 ATOM 2418 N N . GLU A 1 327 ? 20.193 -26.564 -29.362 1.00 215.47 ? 466 GLU G N 1 ATOM 2419 C CA . GLU A 1 327 ? 19.282 -25.461 -29.584 1.00 196.77 ? 466 GLU G CA 1 ATOM 2420 C C . GLU A 1 327 ? 18.716 -25.721 -30.957 1.00 184.41 ? 466 GLU G C 1 ATOM 2421 O O . GLU A 1 327 ? 19.456 -26.093 -31.859 1.00 181.27 ? 466 GLU G O 1 ATOM 2422 C CB . GLU A 1 327 ? 20.045 -24.147 -29.589 1.00 190.51 ? 466 GLU G CB 1 ATOM 2423 C CG . GLU A 1 327 ? 20.530 -23.712 -28.220 1.00 192.50 ? 466 GLU G CG 1 ATOM 2424 C CD . GLU A 1 327 ? 19.387 -23.479 -27.261 1.00 188.35 ? 466 GLU G CD 1 ATOM 2425 O OE1 . GLU A 1 327 ? 18.271 -23.944 -27.559 1.00 183.46 ? 466 GLU G OE1 1 ATOM 2426 O OE2 . GLU A 1 327 ? 19.601 -22.831 -26.217 1.00 187.76 ? 466 GLU G OE2 1 ATOM 2427 N N . THR A 1 328 ? 17.418 -25.537 -31.141 1.00 178.38 ? 467 THR G N 1 ATOM 2428 C CA . THR A 1 328 ? 16.849 -25.819 -32.452 1.00 177.00 ? 467 THR G CA 1 ATOM 2429 C C . THR A 1 328 ? 16.321 -24.499 -33.017 1.00 171.52 ? 467 THR G C 1 ATOM 2430 O O . THR A 1 328 ? 15.518 -23.823 -32.376 1.00 171.25 ? 467 THR G O 1 ATOM 2431 C CB . THR A 1 328 ? 15.740 -26.872 -32.406 1.00 181.66 ? 467 THR G CB 1 ATOM 2432 O OG1 . THR A 1 328 ? 16.302 -28.142 -32.057 1.00 194.05 ? 467 THR G OG1 1 ATOM 2433 C CG2 . THR A 1 328 ? 15.080 -26.991 -33.765 1.00 177.52 ? 467 THR G CG2 1 ATOM 2434 N N . PHE A 1 329 ? 16.780 -24.144 -34.207 1.00 169.46 ? 468 PHE G N 1 ATOM 2435 C CA . PHE A 1 329 ? 16.364 -22.903 -34.823 1.00 166.00 ? 468 PHE G CA 1 ATOM 2436 C C . PHE A 1 329 ? 15.516 -23.149 -36.052 1.00 165.25 ? 468 PHE G C 1 ATOM 2437 O O . PHE A 1 329 ? 15.843 -23.980 -36.889 1.00 161.93 ? 468 PHE G O 1 ATOM 2438 C CB . PHE A 1 329 ? 17.582 -22.079 -35.196 1.00 165.63 ? 468 PHE G CB 1 ATOM 2439 C CG . PHE A 1 329 ? 18.368 -21.603 -34.022 1.00 168.33 ? 468 PHE G CG 1 ATOM 2440 C CD1 . PHE A 1 329 ? 19.585 -22.166 -33.712 1.00 170.92 ? 468 PHE G CD1 1 ATOM 2441 C CD2 . PHE A 1 329 ? 17.890 -20.589 -33.225 1.00 167.07 ? 468 PHE G CD2 1 ATOM 2442 C CE1 . PHE A 1 329 ? 20.310 -21.720 -32.633 1.00 168.98 ? 468 PHE G CE1 1 ATOM 2443 C CE2 . PHE A 1 329 ? 18.611 -20.145 -32.144 1.00 166.65 ? 468 PHE G CE2 1 ATOM 2444 C CZ . PHE A 1 329 ? 19.821 -20.711 -31.848 1.00 166.73 ? 468 PHE G CZ 1 ATOM 2445 N N . ARG A 1 330 ? 14.416 -22.432 -36.178 1.00 170.11 ? 469 ARG G N 1 ATOM 2446 C CA . ARG A 1 330 ? 13.590 -22.589 -37.358 1.00 177.68 ? 469 ARG G CA 1 ATOM 2447 C C . ARG A 1 330 ? 13.558 -21.259 -38.085 1.00 167.73 ? 469 ARG G C 1 ATOM 2448 O O . ARG A 1 330 ? 13.320 -20.226 -37.467 1.00 161.63 ? 469 ARG G O 1 ATOM 2449 C CB . ARG A 1 330 ? 12.177 -23.047 -36.992 1.00 190.33 ? 469 ARG G CB 1 ATOM 2450 C CG . ARG A 1 330 ? 11.379 -22.023 -36.201 1.00 201.83 ? 469 ARG G CG 1 ATOM 2451 C CD . ARG A 1 330 ? 10.010 -22.512 -35.754 1.00 213.25 ? 469 ARG G CD 1 ATOM 2452 N NE . ARG A 1 330 ? 9.265 -21.480 -35.040 1.00 222.86 ? 469 ARG G NE 1 ATOM 2453 C CZ . ARG A 1 330 ? 9.415 -21.209 -33.752 1.00 233.19 ? 469 ARG G CZ 1 ATOM 2454 N NH1 . ARG A 1 330 ? 10.291 -21.892 -33.026 1.00 237.60 ? 469 ARG G NH1 1 ATOM 2455 N NH2 . ARG A 1 330 ? 8.693 -20.252 -33.184 1.00 235.57 ? 469 ARG G NH2 1 ATOM 2456 N N . PRO A 1 331 ? 13.796 -21.264 -39.391 1.00 167.52 ? 470 PRO G N 1 ATOM 2457 C CA . PRO A 1 331 ? 13.792 -19.995 -40.102 1.00 169.68 ? 470 PRO G CA 1 ATOM 2458 C C . PRO A 1 331 ? 12.418 -19.452 -39.842 1.00 172.50 ? 470 PRO G C 1 ATOM 2459 O O . PRO A 1 331 ? 11.451 -20.178 -40.023 1.00 172.48 ? 470 PRO G O 1 ATOM 2460 C CB . PRO A 1 331 ? 13.887 -20.436 -41.547 1.00 167.24 ? 470 PRO G CB 1 ATOM 2461 C CG . PRO A 1 331 ? 13.106 -21.688 -41.575 1.00 167.06 ? 470 PRO G CG 1 ATOM 2462 C CD . PRO A 1 331 ? 13.310 -22.357 -40.245 1.00 167.74 ? 470 PRO G CD 1 ATOM 2463 N N . GLY A 1 332 ? 12.321 -18.204 -39.414 1.00 172.23 ? 471 GLY G N 1 ATOM 2464 C CA . GLY A 1 332 ? 11.036 -17.696 -38.996 1.00 172.38 ? 471 GLY G CA 1 ATOM 2465 C C . GLY A 1 332 ? 10.584 -16.424 -39.648 1.00 173.55 ? 471 GLY G C 1 ATOM 2466 O O . GLY A 1 332 ? 11.321 -15.447 -39.697 1.00 177.22 ? 471 GLY G O 1 ATOM 2467 N N . GLY A 1 333 ? 9.351 -16.432 -40.130 1.00 172.97 ? 472 GLY G N 1 ATOM 2468 C CA . GLY A 1 333 ? 8.787 -15.256 -40.749 1.00 171.85 ? 472 GLY G CA 1 ATOM 2469 C C . GLY A 1 333 ? 8.676 -14.123 -39.756 1.00 172.36 ? 472 GLY G C 1 ATOM 2470 O O . GLY A 1 333 ? 8.958 -12.977 -40.081 1.00 176.71 ? 472 GLY G O 1 ATOM 2471 N N . GLY A 1 334 ? 8.263 -14.444 -38.538 1.00 168.64 ? 473 GLY G N 1 ATOM 2472 C CA . GLY A 1 334 ? 8.080 -13.426 -37.528 1.00 169.73 ? 473 GLY G CA 1 ATOM 2473 C C . GLY A 1 334 ? 7.101 -12.386 -38.032 1.00 173.33 ? 473 GLY G C 1 ATOM 2474 O O . GLY A 1 334 ? 6.042 -12.714 -38.562 1.00 180.37 ? 473 GLY G O 1 ATOM 2475 N N . ASN A 1 335 ? 7.471 -11.121 -37.890 1.00 165.20 ? 474 ASN G N 1 ATOM 2476 C CA . ASN A 1 335 ? 6.639 -10.019 -38.341 1.00 154.64 ? 474 ASN G CA 1 ATOM 2477 C C . ASN A 1 335 ? 7.379 -9.252 -39.412 1.00 145.86 ? 474 ASN G C 1 ATOM 2478 O O . ASN A 1 335 ? 8.586 -9.070 -39.317 1.00 149.96 ? 474 ASN G O 1 ATOM 2479 C CB . ASN A 1 335 ? 6.306 -9.096 -37.180 1.00 156.06 ? 474 ASN G CB 1 ATOM 2480 C CG . ASN A 1 335 ? 5.830 -7.752 -37.641 1.00 159.19 ? 474 ASN G CG 1 ATOM 2481 O OD1 . ASN A 1 335 ? 6.124 -7.334 -38.758 1.00 165.04 ? 474 ASN G OD1 1 ATOM 2482 N ND2 . ASN A 1 335 ? 5.091 -7.060 -36.787 1.00 156.23 ? 474 ASN G ND2 1 ATOM 2483 N N . ILE A 1 336 ? 6.674 -8.802 -40.439 1.00 134.67 ? 475 ILE G N 1 ATOM 2484 C CA . ILE A 1 336 ? 7.369 -8.151 -41.533 1.00 129.28 ? 475 ILE G CA 1 ATOM 2485 C C . ILE A 1 336 ? 8.040 -6.852 -41.144 1.00 123.95 ? 475 ILE G C 1 ATOM 2486 O O . ILE A 1 336 ? 9.048 -6.475 -41.733 1.00 125.99 ? 475 ILE G O 1 ATOM 2487 C CB . ILE A 1 336 ? 6.432 -7.782 -42.681 1.00 128.63 ? 475 ILE G CB 1 ATOM 2488 C CG1 . ILE A 1 336 ? 7.243 -7.166 -43.816 1.00 131.75 ? 475 ILE G CG1 1 ATOM 2489 C CG2 . ILE A 1 336 ? 5.377 -6.822 -42.203 1.00 126.44 ? 475 ILE G CG2 1 ATOM 2490 C CD1 . ILE A 1 336 ? 6.438 -6.967 -45.082 1.00 139.13 ? 475 ILE G CD1 1 ATOM 2491 N N . LYS A 1 337 ? 7.526 -6.171 -40.133 1.00 117.47 ? 476 LYS G N 1 ATOM 2492 C CA . LYS A 1 337 ? 8.235 -4.970 -39.726 1.00 113.66 ? 476 LYS G CA 1 ATOM 2493 C C . LYS A 1 337 ? 9.698 -5.292 -39.475 1.00 119.17 ? 476 LYS G C 1 ATOM 2494 O O . LYS A 1 337 ? 10.536 -4.394 -39.442 1.00 118.92 ? 476 LYS G O 1 ATOM 2495 C CB . LYS A 1 337 ? 7.616 -4.490 -38.426 1.00 104.92 ? 476 LYS G CB 1 ATOM 2496 C CG . LYS A 1 337 ? 6.242 -3.939 -38.577 1.00 98.33 ? 476 LYS G CG 1 ATOM 2497 C CD . LYS A 1 337 ? 5.899 -3.134 -37.370 1.00 100.39 ? 476 LYS G CD 1 ATOM 2498 C CE . LYS A 1 337 ? 4.433 -2.778 -37.407 1.00 107.45 ? 476 LYS G CE 1 ATOM 2499 N NZ . LYS A 1 337 ? 4.023 -2.166 -36.116 1.00 113.46 ? 476 LYS G NZ 1 ATOM 2500 N N . ASP A 1 338 ? 9.999 -6.570 -39.254 1.00 121.47 ? 477 ASP G N 1 ATOM 2501 C CA . ASP A 1 338 ? 11.377 -6.973 -39.022 1.00 124.03 ? 477 ASP G CA 1 ATOM 2502 C C . ASP A 1 338 ? 12.244 -6.802 -40.248 1.00 122.30 ? 477 ASP G C 1 ATOM 2503 O O . ASP A 1 338 ? 13.444 -6.575 -40.131 1.00 121.39 ? 477 ASP G O 1 ATOM 2504 C CB . ASP A 1 338 ? 11.465 -8.415 -38.527 1.00 136.22 ? 477 ASP G CB 1 ATOM 2505 C CG . ASP A 1 338 ? 10.848 -8.601 -37.141 1.00 143.08 ? 477 ASP G CG 1 ATOM 2506 O OD1 . ASP A 1 338 ? 10.863 -7.631 -36.337 1.00 141.77 ? 477 ASP G OD1 1 ATOM 2507 O OD2 . ASP A 1 338 ? 10.403 -9.740 -36.840 1.00 146.04 ? 477 ASP G OD2 1 ATOM 2508 N N . ASN A 1 339 ? 11.640 -6.913 -41.426 1.00 123.41 ? 478 ASN G N 1 ATOM 2509 C CA . ASN A 1 339 ? 12.377 -6.653 -42.652 1.00 114.41 ? 478 ASN G CA 1 ATOM 2510 C C . ASN A 1 339 ? 12.858 -5.204 -42.623 1.00 114.96 ? 478 ASN G C 1 ATOM 2511 O O . ASN A 1 339 ? 14.029 -4.934 -42.894 1.00 121.97 ? 478 ASN G O 1 ATOM 2512 C CB . ASN A 1 339 ? 11.523 -6.944 -43.888 1.00 107.45 ? 478 ASN G CB 1 ATOM 2513 C CG . ASN A 1 339 ? 11.069 -8.395 -43.954 1.00 110.20 ? 478 ASN G CG 1 ATOM 2514 O OD1 . ASN A 1 339 ? 11.811 -9.305 -43.607 1.00 117.18 ? 478 ASN G OD1 1 ATOM 2515 N ND2 . ASN A 1 339 ? 9.843 -8.612 -44.396 1.00 107.95 ? 478 ASN G ND2 1 ATOM 2516 N N . TRP A 1 340 ? 11.971 -4.286 -42.235 1.00 107.90 ? 479 TRP G N 1 ATOM 2517 C CA . TRP A 1 340 ? 12.340 -2.871 -42.111 1.00 102.58 ? 479 TRP G CA 1 ATOM 2518 C C . TRP A 1 340 ? 13.355 -2.656 -40.999 1.00 108.09 ? 479 TRP G C 1 ATOM 2519 O O . TRP A 1 340 ? 14.278 -1.868 -41.167 1.00 90.22 ? 479 TRP G O 1 ATOM 2520 C CB . TRP A 1 340 ? 11.101 -1.983 -41.902 1.00 91.66 ? 479 TRP G CB 1 ATOM 2521 C CG . TRP A 1 340 ? 9.920 -2.418 -42.715 1.00 98.10 ? 479 TRP G CG 1 ATOM 2522 C CD1 . TRP A 1 340 ? 8.606 -2.338 -42.359 1.00 101.10 ? 479 TRP G CD1 1 ATOM 2523 C CD2 . TRP A 1 340 ? 9.938 -2.930 -44.060 1.00 100.61 ? 479 TRP G CD2 1 ATOM 2524 N NE1 . TRP A 1 340 ? 7.808 -2.817 -43.374 1.00 101.00 ? 479 TRP G NE1 1 ATOM 2525 C CE2 . TRP A 1 340 ? 8.602 -3.180 -44.428 1.00 98.79 ? 479 TRP G CE2 1 ATOM 2526 C CE3 . TRP A 1 340 ? 10.955 -3.223 -44.975 1.00 99.03 ? 479 TRP G CE3 1 ATOM 2527 C CZ2 . TRP A 1 340 ? 8.259 -3.714 -45.662 1.00 96.59 ? 479 TRP G CZ2 1 ATOM 2528 C CZ3 . TRP A 1 340 ? 10.614 -3.751 -46.191 1.00 100.35 ? 479 TRP G CZ3 1 ATOM 2529 C CH2 . TRP A 1 340 ? 9.276 -3.991 -46.531 1.00 100.56 ? 479 TRP G CH2 1 ATOM 2530 N N . ARG A 1 341 ? 13.170 -3.308 -39.852 1.00 102.48 ? 480 ARG G N 1 ATOM 2531 C CA . ARG A 1 341 ? 14.161 -3.202 -38.793 1.00 95.84 ? 480 ARG G CA 1 ATOM 2532 C C . ARG A 1 341 ? 15.541 -3.591 -39.278 1.00 98.03 ? 480 ARG G C 1 ATOM 2533 O O . ARG A 1 341 ? 16.521 -2.917 -38.977 1.00 99.00 ? 480 ARG G O 1 ATOM 2534 C CB . ARG A 1 341 ? 13.807 -4.048 -37.572 1.00 102.63 ? 480 ARG G CB 1 ATOM 2535 C CG . ARG A 1 341 ? 12.768 -3.411 -36.713 1.00 103.23 ? 480 ARG G CG 1 ATOM 2536 C CD . ARG A 1 341 ? 12.248 -4.281 -35.617 1.00 99.20 ? 480 ARG G CD 1 ATOM 2537 N NE . ARG A 1 341 ? 11.123 -3.567 -35.050 1.00 101.41 ? 480 ARG G NE 1 ATOM 2538 C CZ . ARG A 1 341 ? 9.901 -4.078 -34.989 1.00 115.35 ? 480 ARG G CZ 1 ATOM 2539 N NH1 . ARG A 1 341 ? 9.684 -5.323 -35.416 1.00 115.79 ? 480 ARG G NH1 1 ATOM 2540 N NH2 . ARG A 1 341 ? 8.909 -3.363 -34.475 1.00 122.34 ? 480 ARG G NH2 1 ATOM 2541 N N . SER A 1 342 ? 15.615 -4.658 -40.060 1.00 101.22 ? 481 SER G N 1 ATOM 2542 C CA . SER A 1 342 ? 16.893 -5.097 -40.591 1.00 115.14 ? 481 SER G CA 1 ATOM 2543 C C . SER A 1 342 ? 17.628 -4.056 -41.431 1.00 119.81 ? 481 SER G C 1 ATOM 2544 O O . SER A 1 342 ? 18.810 -4.235 -41.715 1.00 123.13 ? 481 SER G O 1 ATOM 2545 C CB . SER A 1 342 ? 16.695 -6.365 -41.422 1.00 126.02 ? 481 SER G CB 1 ATOM 2546 O OG . SER A 1 342 ? 15.967 -6.092 -42.613 1.00 125.71 ? 481 SER G OG 1 ATOM 2547 N N . GLU A 1 343 ? 16.967 -2.961 -41.806 1.00 125.38 ? 482 GLU G N 1 ATOM 2548 C CA . GLU A 1 343 ? 17.654 -1.934 -42.591 1.00 131.83 ? 482 GLU G CA 1 ATOM 2549 C C . GLU A 1 343 ? 17.712 -0.588 -41.869 1.00 123.39 ? 482 GLU G C 1 ATOM 2550 O O . GLU A 1 343 ? 18.663 0.181 -42.019 1.00 120.04 ? 482 GLU G O 1 ATOM 2551 C CB . GLU A 1 343 ? 16.941 -1.768 -43.933 1.00 139.86 ? 482 GLU G CB 1 ATOM 2552 C CG . GLU A 1 343 ? 17.223 -2.910 -44.882 1.00 149.76 ? 482 GLU G CG 1 ATOM 2553 C CD . GLU A 1 343 ? 18.689 -3.046 -45.213 1.00 159.33 ? 482 GLU G CD 1 ATOM 2554 O OE1 . GLU A 1 343 ? 19.412 -2.030 -45.154 1.00 160.73 ? 482 GLU G OE1 1 ATOM 2555 O OE2 . GLU A 1 343 ? 19.132 -4.189 -45.458 1.00 164.62 ? 482 GLU G OE2 1 ATOM 2556 N N . LEU A 1 344 ? 16.685 -0.334 -41.068 1.00 116.32 ? 483 LEU G N 1 ATOM 2557 C CA . LEU A 1 344 ? 16.530 0.895 -40.297 1.00 111.21 ? 483 LEU G CA 1 ATOM 2558 C C . LEU A 1 344 ? 17.238 0.853 -38.948 1.00 113.78 ? 483 LEU G C 1 ATOM 2559 O O . LEU A 1 344 ? 17.229 1.839 -38.215 1.00 112.90 ? 483 LEU G O 1 ATOM 2560 C CB . LEU A 1 344 ? 15.044 1.180 -40.055 1.00 108.19 ? 483 LEU G CB 1 ATOM 2561 C CG . LEU A 1 344 ? 14.166 1.679 -41.197 1.00 111.52 ? 483 LEU G CG 1 ATOM 2562 C CD1 . LEU A 1 344 ? 12.702 1.632 -40.809 1.00 109.35 ? 483 LEU G CD1 1 ATOM 2563 C CD2 . LEU A 1 344 ? 14.571 3.095 -41.523 1.00 111.69 ? 483 LEU G CD2 1 ATOM 2564 N N . TYR A 1 345 ? 17.784 -0.307 -38.600 1.00 117.32 ? 484 TYR G N 1 ATOM 2565 C CA . TYR A 1 345 ? 18.336 -0.549 -37.264 1.00 115.45 ? 484 TYR G CA 1 ATOM 2566 C C . TYR A 1 345 ? 19.277 0.541 -36.711 1.00 123.91 ? 484 TYR G C 1 ATOM 2567 O O . TYR A 1 345 ? 19.281 0.791 -35.505 1.00 122.00 ? 484 TYR G O 1 ATOM 2568 C CB . TYR A 1 345 ? 19.014 -1.917 -37.249 1.00 113.49 ? 484 TYR G CB 1 ATOM 2569 C CG . TYR A 1 345 ? 20.334 -1.976 -37.954 1.00 112.64 ? 484 TYR G CG 1 ATOM 2570 C CD1 . TYR A 1 345 ? 21.519 -1.795 -37.259 1.00 114.25 ? 484 TYR G CD1 1 ATOM 2571 C CD2 . TYR A 1 345 ? 20.397 -2.238 -39.320 1.00 113.62 ? 484 TYR G CD2 1 ATOM 2572 C CE1 . TYR A 1 345 ? 22.727 -1.852 -37.901 1.00 118.75 ? 484 TYR G CE1 1 ATOM 2573 C CE2 . TYR A 1 345 ? 21.607 -2.304 -39.974 1.00 117.79 ? 484 TYR G CE2 1 ATOM 2574 C CZ . TYR A 1 345 ? 22.772 -2.112 -39.255 1.00 120.27 ? 484 TYR G CZ 1 ATOM 2575 O OH . TYR A 1 345 ? 23.991 -2.167 -39.884 1.00 122.72 ? 484 TYR G OH 1 ATOM 2576 N N . LYS A 1 346 ? 20.120 1.110 -37.573 1.00 134.77 ? 485 LYS G N 1 ATOM 2577 C CA . LYS A 1 346 ? 21.181 2.037 -37.156 1.00 141.21 ? 485 LYS G CA 1 ATOM 2578 C C . LYS A 1 346 ? 20.784 3.512 -37.073 1.00 132.86 ? 485 LYS G C 1 ATOM 2579 O O . LYS A 1 346 ? 21.633 4.355 -36.787 1.00 132.95 ? 485 LYS G O 1 ATOM 2580 C CB . LYS A 1 346 ? 22.382 1.937 -38.087 1.00 150.73 ? 485 LYS G CB 1 ATOM 2581 C CG . LYS A 1 346 ? 22.082 2.347 -39.505 1.00 154.63 ? 485 LYS G CG 1 ATOM 2582 C CD . LYS A 1 346 ? 23.371 2.520 -40.264 1.00 169.67 ? 485 LYS G CD 1 ATOM 2583 C CE . LYS A 1 346 ? 24.224 1.274 -40.180 1.00 183.28 ? 485 LYS G CE 1 ATOM 2584 N NZ . LYS A 1 346 ? 25.560 1.503 -40.798 1.00 193.35 ? 485 LYS G NZ 1 ATOM 2585 N N . TYR A 1 347 ? 19.513 3.829 -37.303 1.00 124.64 ? 486 TYR G N 1 ATOM 2586 C CA . TYR A 1 347 ? 19.076 5.233 -37.314 1.00 120.34 ? 486 TYR G CA 1 ATOM 2587 C C . TYR A 1 347 ? 18.062 5.584 -36.235 1.00 111.14 ? 486 TYR G C 1 ATOM 2588 O O . TYR A 1 347 ? 17.301 4.723 -35.792 1.00 104.39 ? 486 TYR G O 1 ATOM 2589 C CB . TYR A 1 347 ? 18.447 5.613 -38.657 1.00 124.03 ? 486 TYR G CB 1 ATOM 2590 C CG . TYR A 1 347 ? 19.301 5.377 -39.868 1.00 124.77 ? 486 TYR G CG 1 ATOM 2591 C CD1 . TYR A 1 347 ? 20.197 6.333 -40.311 1.00 127.77 ? 486 TYR G CD1 1 ATOM 2592 C CD2 . TYR A 1 347 ? 19.118 4.236 -40.640 1.00 127.26 ? 486 TYR G CD2 1 ATOM 2593 C CE1 . TYR A 1 347 ? 20.952 6.122 -41.454 1.00 136.29 ? 486 TYR G CE1 1 ATOM 2594 C CE2 . TYR A 1 347 ? 19.855 4.015 -41.778 1.00 136.67 ? 486 TYR G CE2 1 ATOM 2595 C CZ . TYR A 1 347 ? 20.773 4.961 -42.190 1.00 139.21 ? 486 TYR G CZ 1 ATOM 2596 O OH . TYR A 1 347 ? 21.521 4.746 -43.330 1.00 139.85 ? 486 TYR G OH 1 ATOM 2597 N N . LYS A 1 348 ? 18.007 6.867 -35.869 1.00 109.96 ? 487 LYS G N 1 ATOM 2598 C CA . LYS A 1 348 ? 16.950 7.352 -34.965 1.00 115.01 ? 487 LYS G CA 1 ATOM 2599 C C . LYS A 1 348 ? 16.688 8.838 -35.170 1.00 118.24 ? 487 LYS G C 1 ATOM 2600 O O . LYS A 1 348 ? 17.591 9.640 -35.421 1.00 110.43 ? 487 LYS G O 1 ATOM 2601 C CB . LYS A 1 348 ? 17.303 7.077 -33.492 1.00 117.07 ? 487 LYS G CB 1 ATOM 2602 C CG . LYS A 1 348 ? 18.564 7.765 -33.011 1.00 127.34 ? 487 LYS G CG 1 ATOM 2603 C CD . LYS A 1 348 ? 18.870 7.569 -31.515 1.00 136.47 ? 487 LYS G CD 1 ATOM 2604 C CE . LYS A 1 348 ? 17.943 8.275 -30.528 1.00 140.84 ? 487 LYS G CE 1 ATOM 2605 N NZ . LYS A 1 348 ? 18.476 8.141 -29.119 1.00 99.14 ? 487 LYS G NZ 1 ATOM 2606 N N . VAL A 1 349 ? 15.422 9.198 -35.025 1.00 126.80 ? 488 VAL G N 1 ATOM 2607 C CA . VAL A 1 349 ? 15.023 10.578 -35.150 1.00 123.43 ? 488 VAL G CA 1 ATOM 2608 C C . VAL A 1 349 ? 15.170 11.206 -33.804 1.00 133.76 ? 488 VAL G C 1 ATOM 2609 O O . VAL A 1 349 ? 14.671 10.713 -32.790 1.00 133.17 ? 488 VAL G O 1 ATOM 2610 C CB . VAL A 1 349 ? 13.573 10.730 -35.617 1.00 124.40 ? 488 VAL G CB 1 ATOM 2611 C CG1 . VAL A 1 349 ? 13.295 12.176 -35.979 1.00 128.70 ? 488 VAL G CG1 1 ATOM 2612 C CG2 . VAL A 1 349 ? 13.291 9.820 -36.800 1.00 125.79 ? 488 VAL G CG2 1 ATOM 2613 N N . VAL A 1 350 ? 15.842 12.342 -33.818 1.00 140.82 ? 489 VAL G N 1 ATOM 2614 C CA . VAL A 1 350 ? 15.939 13.138 -32.629 1.00 141.30 ? 489 VAL G CA 1 ATOM 2615 C C . VAL A 1 350 ? 15.482 14.555 -32.945 1.00 147.97 ? 489 VAL G C 1 ATOM 2616 O O . VAL A 1 350 ? 15.547 15.012 -34.100 1.00 145.50 ? 489 VAL G O 1 ATOM 2617 C CB . VAL A 1 350 ? 17.394 13.088 -32.129 1.00 134.48 ? 489 VAL G CB 1 ATOM 2618 C CG1 . VAL A 1 350 ? 17.795 11.679 -31.716 1.00 136.57 ? 489 VAL G CG1 1 ATOM 2619 C CG2 . VAL A 1 350 ? 18.328 13.726 -33.141 1.00 128.35 ? 489 VAL G CG2 1 ATOM 2620 N N . GLN A 1 351 ? 15.013 15.246 -31.916 1.00 158.69 ? 490 GLN G N 1 ATOM 2621 C CA . GLN A 1 351 ? 14.441 16.572 -32.072 1.00 164.73 ? 490 GLN G CA 1 ATOM 2622 C C . GLN A 1 351 ? 15.366 17.660 -31.559 1.00 178.10 ? 490 GLN G C 1 ATOM 2623 O O . GLN A 1 351 ? 15.707 17.695 -30.384 1.00 190.97 ? 490 GLN G O 1 ATOM 2624 C CB . GLN A 1 351 ? 13.103 16.654 -31.340 1.00 160.95 ? 490 GLN G CB 1 ATOM 2625 C CG . GLN A 1 351 ? 12.566 18.062 -31.175 1.00 158.54 ? 490 GLN G CG 1 ATOM 2626 C CD . GLN A 1 351 ? 11.382 18.118 -30.241 1.00 155.57 ? 490 GLN G CD 1 ATOM 2627 O OE1 . GLN A 1 351 ? 11.493 17.790 -29.066 1.00 154.21 ? 490 GLN G OE1 1 ATOM 2628 N NE2 . GLN A 1 351 ? 10.239 18.534 -30.758 1.00 153.80 ? 490 GLN G NE2 1 ATOM 2629 N N . ILE A 1 352 ? 15.755 18.562 -32.447 1.00 188.64 ? 491 ILE G N 1 ATOM 2630 C CA . ILE A 1 352 ? 16.600 19.678 -32.072 1.00 106.77 ? 491 ILE G CA 1 ATOM 2631 C C . ILE A 1 352 ? 15.818 20.661 -31.223 1.00 119.82 ? 491 ILE G C 1 ATOM 2632 O O . ILE A 1 352 ? 14.594 20.694 -31.284 1.00 117.71 ? 491 ILE G O 1 ATOM 2633 C CB . ILE A 1 352 ? 17.135 20.412 -33.300 1.00 113.68 ? 491 ILE G CB 1 ATOM 2634 C CG1 . ILE A 1 352 ? 17.975 19.464 -34.151 1.00 108.91 ? 491 ILE G CG1 1 ATOM 2635 C CG2 . ILE A 1 352 ? 17.943 21.624 -32.870 1.00 118.50 ? 491 ILE G CG2 1 ATOM 2636 C CD1 . ILE A 1 352 ? 19.396 19.300 -33.668 1.00 105.70 ? 491 ILE G CD1 1 ATOM 2637 N N . VAL B 2 2 ? -11.273 -8.956 -20.877 1.00 128.82 ? 2 VAL H N 1 ATOM 2638 C CA . VAL B 2 2 ? -10.733 -10.189 -21.453 1.00 130.41 ? 2 VAL H CA 1 ATOM 2639 C C . VAL B 2 2 ? -11.302 -11.473 -20.853 1.00 134.13 ? 2 VAL H C 1 ATOM 2640 O O . VAL B 2 2 ? -11.222 -11.681 -19.644 1.00 137.60 ? 2 VAL H O 1 ATOM 2641 C CB . VAL B 2 2 ? -9.191 -10.224 -21.263 1.00 105.54 ? 2 VAL H CB 1 ATOM 2642 C CG1 . VAL B 2 2 ? -8.611 -11.588 -21.589 1.00 95.45 ? 2 VAL H CG1 1 ATOM 2643 C CG2 . VAL B 2 2 ? -8.506 -9.063 -22.004 1.00 115.20 ? 2 VAL H CG2 1 ATOM 2644 N N . GLN B 2 3 ? -11.769 -12.382 -21.709 1.00 134.30 ? 3 GLN H N 1 ATOM 2645 C CA . GLN B 2 3 ? -12.142 -13.735 -21.283 1.00 135.15 ? 3 GLN H CA 1 ATOM 2646 C C . GLN B 2 3 ? -11.536 -14.822 -22.165 1.00 132.64 ? 3 GLN H C 1 ATOM 2647 O O . GLN B 2 3 ? -11.443 -14.667 -23.378 1.00 133.48 ? 3 GLN H O 1 ATOM 2648 C CB . GLN B 2 3 ? -13.670 -13.898 -21.226 1.00 144.31 ? 3 GLN H CB 1 ATOM 2649 C CG . GLN B 2 3 ? -14.390 -12.976 -20.240 1.00 155.00 ? 3 GLN H CG 1 ATOM 2650 C CD . GLN B 2 3 ? -14.636 -11.570 -20.776 1.00 166.00 ? 3 GLN H CD 1 ATOM 2651 O OE1 . GLN B 2 3 ? -15.128 -11.398 -21.891 1.00 169.83 ? 3 GLN H OE1 1 ATOM 2652 N NE2 . GLN B 2 3 ? -14.307 -10.555 -19.967 1.00 168.64 ? 3 GLN H NE2 1 ATOM 2653 N N . LEU B 2 4 ? -11.174 -15.940 -21.543 1.00 129.50 ? 4 LEU H N 1 ATOM 2654 C CA . LEU B 2 4 ? -10.673 -17.121 -22.247 1.00 118.66 ? 4 LEU H CA 1 ATOM 2655 C C . LEU B 2 4 ? -11.435 -18.360 -21.840 1.00 115.95 ? 4 LEU H C 1 ATOM 2656 O O . LEU B 2 4 ? -11.435 -18.728 -20.669 1.00 123.78 ? 4 LEU H O 1 ATOM 2657 C CB . LEU B 2 4 ? -9.193 -17.356 -21.954 1.00 105.71 ? 4 LEU H CB 1 ATOM 2658 C CG . LEU B 2 4 ? -8.149 -16.335 -22.353 1.00 99.21 ? 4 LEU H CG 1 ATOM 2659 C CD1 . LEU B 2 4 ? -6.817 -16.798 -21.823 1.00 91.28 ? 4 LEU H CD1 1 ATOM 2660 C CD2 . LEU B 2 4 ? -8.110 -16.254 -23.865 1.00 96.31 ? 4 LEU H CD2 1 ATOM 2661 N N . VAL B 2 5 ? -12.106 -18.991 -22.790 1.00 109.14 ? 5 VAL H N 1 ATOM 2662 C CA . VAL B 2 5 ? -12.968 -20.106 -22.470 1.00 114.05 ? 5 VAL H CA 1 ATOM 2663 C C . VAL B 2 5 ? -12.558 -21.395 -23.190 1.00 124.34 ? 5 VAL H C 1 ATOM 2664 O O . VAL B 2 5 ? -12.599 -21.465 -24.417 1.00 131.72 ? 5 VAL H O 1 ATOM 2665 C CB . VAL B 2 5 ? -14.409 -19.768 -22.847 1.00 116.58 ? 5 VAL H CB 1 ATOM 2666 C CG1 . VAL B 2 5 ? -15.321 -20.959 -22.604 1.00 118.92 ? 5 VAL H CG1 1 ATOM 2667 C CG2 . VAL B 2 5 ? -14.876 -18.525 -22.098 1.00 118.88 ? 5 VAL H CG2 1 ATOM 2668 N N . GLN B 2 6 ? -12.180 -22.424 -22.440 1.00 124.64 ? 6 GLN H N 1 ATOM 2669 C CA . GLN B 2 6 ? -11.732 -23.681 -23.047 1.00 119.07 ? 6 GLN H CA 1 ATOM 2670 C C . GLN B 2 6 ? -12.851 -24.704 -23.197 1.00 119.45 ? 6 GLN H C 1 ATOM 2671 O O . GLN B 2 6 ? -13.921 -24.558 -22.608 1.00 121.63 ? 6 GLN H O 1 ATOM 2672 C CB . GLN B 2 6 ? -10.581 -24.311 -22.270 1.00 114.23 ? 6 GLN H CB 1 ATOM 2673 C CG . GLN B 2 6 ? -9.367 -23.433 -22.121 1.00 114.10 ? 6 GLN H CG 1 ATOM 2674 C CD . GLN B 2 6 ? -8.250 -24.117 -21.351 1.00 116.89 ? 6 GLN H CD 1 ATOM 2675 O OE1 . GLN B 2 6 ? -7.541 -23.487 -20.573 1.00 119.18 ? 6 GLN H OE1 1 ATOM 2676 N NE2 . GLN B 2 6 ? -8.104 -25.423 -21.554 1.00 117.26 ? 6 GLN H NE2 1 ATOM 2677 N N . SER B 2 7 ? -12.604 -25.723 -24.017 1.00 120.98 ? 7 SER H N 1 ATOM 2678 C CA . SER B 2 7 ? -13.569 -26.797 -24.243 1.00 127.72 ? 7 SER H CA 1 ATOM 2679 C C . SER B 2 7 ? -13.555 -27.688 -23.003 1.00 136.52 ? 7 SER H C 1 ATOM 2680 O O . SER B 2 7 ? -12.698 -27.520 -22.120 1.00 143.61 ? 7 SER H O 1 ATOM 2681 C CB . SER B 2 7 ? -13.227 -27.616 -25.488 1.00 119.14 ? 7 SER H CB 1 ATOM 2682 O OG . SER B 2 7 ? -11.893 -28.087 -25.434 1.00 112.15 ? 7 SER H OG 1 ATOM 2683 N N . GLY B 2 8 ? -14.500 -28.622 -22.911 1.00 133.05 ? 8 GLY H N 1 ATOM 2684 C CA . GLY B 2 8 ? -14.658 -29.365 -21.676 1.00 125.43 ? 8 GLY H CA 1 ATOM 2685 C C . GLY B 2 8 ? -13.725 -30.552 -21.542 1.00 118.63 ? 8 GLY H C 1 ATOM 2686 O O . GLY B 2 8 ? -12.975 -30.883 -22.459 1.00 113.89 ? 8 GLY H O 1 ATOM 2687 N N . ALA B 2 9 ? -13.810 -31.206 -20.388 1.00 127.96 ? 9 ALA H N 1 ATOM 2688 C CA . ALA B 2 9 ? -12.934 -32.316 -20.002 1.00 134.06 ? 9 ALA H CA 1 ATOM 2689 C C . ALA B 2 9 ? -12.993 -33.513 -20.969 1.00 138.50 ? 9 ALA H C 1 ATOM 2690 O O . ALA B 2 9 ? -14.019 -33.771 -21.612 1.00 133.11 ? 9 ALA H O 1 ATOM 2691 C CB . ALA B 2 9 ? -13.247 -32.764 -18.566 1.00 137.23 ? 9 ALA H CB 1 ATOM 2692 N N . GLU B 2 10 ? -11.859 -34.205 -21.095 1.00 140.38 ? 10 GLU H N 1 ATOM 2693 C CA . GLU B 2 10 ? -11.724 -35.316 -22.030 1.00 135.49 ? 10 GLU H CA 1 ATOM 2694 C C . GLU B 2 10 ? -11.163 -36.606 -21.394 1.00 120.08 ? 10 GLU H C 1 ATOM 2695 O O . GLU B 2 10 ? -10.296 -36.563 -20.524 1.00 115.82 ? 10 GLU H O 1 ATOM 2696 C CB . GLU B 2 10 ? -10.781 -34.882 -23.164 1.00 140.40 ? 10 GLU H CB 1 ATOM 2697 C CG . GLU B 2 10 ? -11.202 -33.638 -23.958 1.00 144.71 ? 10 GLU H CG 1 ATOM 2698 C CD . GLU B 2 10 ? -11.895 -33.944 -25.266 1.00 154.12 ? 10 GLU H CD 1 ATOM 2699 O OE1 . GLU B 2 10 ? -12.135 -35.131 -25.571 1.00 164.74 ? 10 GLU H OE1 1 ATOM 2700 O OE2 . GLU B 2 10 ? -12.185 -32.983 -26.005 1.00 153.89 ? 10 GLU H OE2 1 ATOM 2701 N N . VAL B 2 11 ? -11.622 -37.750 -21.896 1.00 112.33 ? 11 VAL H N 1 ATOM 2702 C CA . VAL B 2 11 ? -11.106 -39.065 -21.507 1.00 110.78 ? 11 VAL H CA 1 ATOM 2703 C C . VAL B 2 11 ? -10.731 -39.810 -22.797 1.00 116.69 ? 11 VAL H C 1 ATOM 2704 O O . VAL B 2 11 ? -11.539 -39.946 -23.723 1.00 122.88 ? 11 VAL H O 1 ATOM 2705 C CB . VAL B 2 11 ? -12.113 -39.900 -20.706 1.00 113.24 ? 11 VAL H CB 1 ATOM 2706 C CG1 . VAL B 2 11 ? -11.525 -41.261 -20.382 1.00 116.88 ? 11 VAL H CG1 1 ATOM 2707 C CG2 . VAL B 2 11 ? -12.534 -39.170 -19.449 1.00 113.24 ? 11 VAL H CG2 1 ATOM 2708 N N . LYS B 2 12 ? -9.497 -40.305 -22.831 1.00 113.19 ? 12 LYS H N 1 ATOM 2709 C CA . LYS B 2 12 ? -8.954 -40.940 -24.012 1.00 110.06 ? 12 LYS H CA 1 ATOM 2710 C C . LYS B 2 12 ? -8.192 -42.186 -23.596 1.00 116.39 ? 12 LYS H C 1 ATOM 2711 O O . LYS B 2 12 ? -7.746 -42.286 -22.455 1.00 113.79 ? 12 LYS H O 1 ATOM 2712 C CB . LYS B 2 12 ? -8.011 -39.975 -24.732 1.00 102.31 ? 12 LYS H CB 1 ATOM 2713 C CG . LYS B 2 12 ? -8.676 -38.699 -25.233 1.00 103.06 ? 12 LYS H CG 1 ATOM 2714 C CD . LYS B 2 12 ? -9.571 -38.904 -26.445 1.00 114.53 ? 12 LYS H CD 1 ATOM 2715 C CE . LYS B 2 12 ? -10.109 -37.560 -26.966 1.00 116.41 ? 12 LYS H CE 1 ATOM 2716 N NZ . LYS B 2 12 ? -11.099 -37.756 -28.071 1.00 122.46 ? 12 LYS H NZ 1 ATOM 2717 N N . LYS B 2 13 ? -7.986 -43.105 -24.531 1.00 118.58 ? 13 LYS H N 1 ATOM 2718 C CA . LYS B 2 13 ? -7.178 -44.283 -24.260 1.00 113.50 ? 13 LYS H CA 1 ATOM 2719 C C . LYS B 2 13 ? -5.758 -43.921 -24.703 1.00 117.01 ? 13 LYS H C 1 ATOM 2720 O O . LYS B 2 13 ? -5.601 -43.094 -25.601 1.00 112.36 ? 13 LYS H O 1 ATOM 2721 C CB . LYS B 2 13 ? -7.708 -45.497 -25.014 1.00 109.82 ? 13 LYS H CB 1 ATOM 2722 C CG . LYS B 2 13 ? -9.177 -45.778 -24.788 1.00 118.09 ? 13 LYS H CG 1 ATOM 2723 C CD . LYS B 2 13 ? -9.416 -46.623 -23.550 1.00 130.77 ? 13 LYS H CD 1 ATOM 2724 C CE . LYS B 2 13 ? -10.543 -47.663 -23.747 1.00 140.63 ? 13 LYS H CE 1 ATOM 2725 N NZ . LYS B 2 13 ? -11.435 -47.440 -24.944 1.00 142.43 ? 13 LYS H NZ 1 ATOM 2726 N N . PRO B 2 14 ? -4.722 -44.545 -24.106 1.00 124.07 ? 14 PRO H N 1 ATOM 2727 C CA . PRO B 2 14 ? -3.325 -44.347 -24.534 1.00 123.44 ? 14 PRO H CA 1 ATOM 2728 C C . PRO B 2 14 ? -3.174 -44.571 -26.040 1.00 124.51 ? 14 PRO H C 1 ATOM 2729 O O . PRO B 2 14 ? -3.773 -45.498 -26.575 1.00 129.95 ? 14 PRO H O 1 ATOM 2730 C CB . PRO B 2 14 ? -2.544 -45.400 -23.729 1.00 126.17 ? 14 PRO H CB 1 ATOM 2731 C CG . PRO B 2 14 ? -3.580 -46.358 -23.232 1.00 131.55 ? 14 PRO H CG 1 ATOM 2732 C CD . PRO B 2 14 ? -4.802 -45.509 -23.002 1.00 129.88 ? 14 PRO H CD 1 ATOM 2733 N N . GLY B 2 15 ? -2.420 -43.718 -26.726 1.00 121.90 ? 15 GLY H N 1 ATOM 2734 C CA . GLY B 2 15 ? -2.246 -43.901 -28.153 1.00 126.51 ? 15 GLY H CA 1 ATOM 2735 C C . GLY B 2 15 ? -3.241 -43.074 -28.948 1.00 124.67 ? 15 GLY H C 1 ATOM 2736 O O . GLY B 2 15 ? -3.104 -42.950 -30.166 1.00 130.88 ? 15 GLY H O 1 ATOM 2737 N N . ALA B 2 16 ? -4.281 -42.577 -28.280 1.00 117.89 ? 16 ALA H N 1 ATOM 2738 C CA . ALA B 2 16 ? -5.292 -41.732 -28.925 1.00 115.23 ? 16 ALA H CA 1 ATOM 2739 C C . ALA B 2 16 ? -4.803 -40.276 -29.004 1.00 106.11 ? 16 ALA H C 1 ATOM 2740 O O . ALA B 2 16 ? -3.707 -39.953 -28.541 1.00 102.24 ? 16 ALA H O 1 ATOM 2741 C CB . ALA B 2 16 ? -6.599 -41.746 -28.133 1.00 115.31 ? 16 ALA H CB 1 ATOM 2742 N N . SER B 2 17 ? -5.590 -39.408 -29.632 1.00 102.85 ? 17 SER H N 1 ATOM 2743 C CA . SER B 2 17 ? -5.269 -37.987 -29.642 1.00 104.68 ? 17 SER H CA 1 ATOM 2744 C C . SER B 2 17 ? -6.362 -37.155 -29.007 1.00 106.26 ? 17 SER H C 1 ATOM 2745 O O . SER B 2 17 ? -7.498 -37.598 -28.887 1.00 110.76 ? 17 SER H O 1 ATOM 2746 C CB . SER B 2 17 ? -5.065 -37.531 -31.062 1.00 114.36 ? 17 SER H CB 1 ATOM 2747 O OG . SER B 2 17 ? -6.286 -37.666 -31.756 1.00 123.94 ? 17 SER H OG 1 ATOM 2748 N N . VAL B 2 18 ? -6.028 -35.925 -28.657 1.00 107.45 ? 18 VAL H N 1 ATOM 2749 C CA . VAL B 2 18 ? -6.980 -35.006 -28.047 1.00 118.98 ? 18 VAL H CA 1 ATOM 2750 C C . VAL B 2 18 ? -6.907 -33.592 -28.624 1.00 114.89 ? 18 VAL H C 1 ATOM 2751 O O . VAL B 2 18 ? -5.828 -33.117 -28.970 1.00 111.45 ? 18 VAL H O 1 ATOM 2752 C CB . VAL B 2 18 ? -6.788 -34.950 -26.517 1.00 129.14 ? 18 VAL H CB 1 ATOM 2753 C CG1 . VAL B 2 18 ? -5.435 -34.334 -26.153 1.00 128.64 ? 18 VAL H CG1 1 ATOM 2754 C CG2 . VAL B 2 18 ? -7.945 -34.207 -25.852 1.00 128.55 ? 18 VAL H CG2 1 ATOM 2755 N N . LYS B 2 19 ? -8.053 -32.929 -28.741 1.00 116.40 ? 19 LYS H N 1 ATOM 2756 C CA . LYS B 2 19 ? -8.078 -31.567 -29.265 1.00 120.68 ? 19 LYS H CA 1 ATOM 2757 C C . LYS B 2 19 ? -8.829 -30.601 -28.385 1.00 123.66 ? 19 LYS H C 1 ATOM 2758 O O . LYS B 2 19 ? -10.032 -30.741 -28.171 1.00 132.80 ? 19 LYS H O 1 ATOM 2759 C CB . LYS B 2 19 ? -8.732 -31.514 -30.646 0.00 122.81 ? 19 LYS H CB 1 ATOM 2760 C CG . LYS B 2 19 ? -7.879 -32.191 -31.722 0.00 124.16 ? 19 LYS H CG 1 ATOM 2761 C CD . LYS B 2 19 ? -8.573 -32.272 -33.049 0.00 128.27 ? 19 LYS H CD 1 ATOM 2762 C CE . LYS B 2 19 ? -8.777 -30.884 -33.558 0.00 129.04 ? 19 LYS H CE 1 ATOM 2763 N NZ . LYS B 2 19 ? -9.347 -30.938 -34.908 0.00 133.90 ? 19 LYS H NZ 1 ATOM 2764 N N . VAL B 2 20 ? -8.080 -29.620 -27.874 1.00 115.61 ? 20 VAL H N 1 ATOM 2765 C CA . VAL B 2 20 ? -8.588 -28.631 -26.924 1.00 115.50 ? 20 VAL H CA 1 ATOM 2766 C C . VAL B 2 20 ? -8.748 -27.278 -27.616 1.00 115.57 ? 20 VAL H C 1 ATOM 2767 O O . VAL B 2 20 ? -7.850 -26.829 -28.343 1.00 111.00 ? 20 VAL H O 1 ATOM 2768 C CB . VAL B 2 20 ? -7.635 -28.473 -25.720 1.00 112.23 ? 20 VAL H CB 1 ATOM 2769 C CG1 . VAL B 2 20 ? -8.189 -27.460 -24.732 1.00 113.04 ? 20 VAL H CG1 1 ATOM 2770 C CG2 . VAL B 2 20 ? -7.416 -29.806 -25.044 1.00 109.45 ? 20 VAL H CG2 1 ATOM 2771 N N . SER B 2 21 ? -9.838 -26.587 -27.317 1.00 119.73 ? 21 SER H N 1 ATOM 2772 C CA . SER B 2 21 ? -10.091 -25.301 -27.932 1.00 126.24 ? 21 SER H CA 1 ATOM 2773 C C . SER B 2 21 ? -9.977 -24.204 -26.901 1.00 127.68 ? 21 SER H C 1 ATOM 2774 O O . SER B 2 21 ? -10.027 -24.441 -25.696 1.00 129.68 ? 21 SER H O 1 ATOM 2775 C CB . SER B 2 21 ? -11.463 -25.261 -28.576 1.00 133.91 ? 21 SER H CB 1 ATOM 2776 O OG . SER B 2 21 ? -12.446 -25.412 -27.576 1.00 138.61 ? 21 SER H OG 1 ATOM 2777 N N . CYS B 2 22 ? -9.789 -22.993 -27.384 1.00 128.22 ? 22 CYS H N 1 ATOM 2778 C CA . CYS B 2 22 ? -9.591 -21.885 -26.488 1.00 123.25 ? 22 CYS H CA 1 ATOM 2779 C C . CYS B 2 22 ? -10.167 -20.635 -27.129 1.00 129.22 ? 22 CYS H C 1 ATOM 2780 O O . CYS B 2 22 ? -9.589 -20.087 -28.066 1.00 131.11 ? 22 CYS H O 1 ATOM 2781 C CB . CYS B 2 22 ? -8.114 -21.722 -26.158 1.00 112.45 ? 22 CYS H CB 1 ATOM 2782 S SG . CYS B 2 22 ? -7.733 -20.180 -25.341 1.00 152.88 ? 22 CYS H SG 1 ATOM 2783 N N . LYS B 2 23 ? -11.335 -20.213 -26.658 1.00 129.22 ? 23 LYS H N 1 ATOM 2784 C CA . LYS B 2 23 ? -11.969 -19.036 -27.215 1.00 126.27 ? 23 LYS H CA 1 ATOM 2785 C C . LYS B 2 23 ? -11.631 -17.750 -26.471 1.00 130.74 ? 23 LYS H C 1 ATOM 2786 O O . LYS B 2 23 ? -11.905 -17.609 -25.290 1.00 136.44 ? 23 LYS H O 1 ATOM 2787 C CB . LYS B 2 23 ? -13.485 -19.266 -27.171 1.00 123.44 ? 23 LYS H CB 1 ATOM 2788 C CG . LYS B 2 23 ? -14.371 -18.186 -27.745 1.00 126.06 ? 23 LYS H CG 1 ATOM 2789 C CD . LYS B 2 23 ? -14.112 -17.892 -29.193 1.00 132.13 ? 23 LYS H CD 1 ATOM 2790 C CE . LYS B 2 23 ? -15.035 -16.763 -29.651 1.00 146.99 ? 23 LYS H CE 1 ATOM 2791 N NZ . LYS B 2 23 ? -15.045 -15.569 -28.742 1.00 148.04 ? 23 LYS H NZ 1 ATOM 2792 N N . ALA B 2 24 ? -11.067 -16.798 -27.205 1.00 131.83 ? 24 ALA H N 1 ATOM 2793 C CA . ALA B 2 24 ? -10.600 -15.531 -26.658 1.00 130.15 ? 24 ALA H CA 1 ATOM 2794 C C . ALA B 2 24 ? -11.677 -14.489 -26.951 1.00 139.63 ? 24 ALA H C 1 ATOM 2795 O O . ALA B 2 24 ? -12.211 -14.450 -28.068 1.00 143.52 ? 24 ALA H O 1 ATOM 2796 C CB . ALA B 2 24 ? -9.263 -15.132 -27.248 1.00 124.96 ? 24 ALA H CB 1 ATOM 2797 N N . SER B 2 25 ? -11.964 -13.619 -25.992 1.00 144.99 ? 25 SER H N 1 ATOM 2798 C CA . SER B 2 25 ? -12.731 -12.410 -26.265 1.00 153.10 ? 25 SER H CA 1 ATOM 2799 C C . SER B 2 25 ? -12.178 -11.243 -25.467 1.00 157.95 ? 25 SER H C 1 ATOM 2800 O O . SER B 2 25 ? -11.429 -11.444 -24.509 1.00 158.61 ? 25 SER H O 1 ATOM 2801 C CB . SER B 2 25 ? -14.212 -12.646 -25.969 1.00 152.96 ? 25 SER H CB 1 ATOM 2802 O OG . SER B 2 25 ? -14.417 -12.916 -24.600 1.00 146.28 ? 25 SER H OG 1 ATOM 2803 N N . GLY B 2 26 ? -12.562 -10.030 -25.855 1.00 162.23 ? 26 GLY H N 1 ATOM 2804 C CA . GLY B 2 26 ? -12.275 -8.840 -25.073 1.00 162.47 ? 26 GLY H CA 1 ATOM 2805 C C . GLY B 2 26 ? -10.968 -8.174 -25.464 1.00 160.94 ? 26 GLY H C 1 ATOM 2806 O O . GLY B 2 26 ? -10.502 -7.270 -24.770 1.00 167.84 ? 26 GLY H O 1 ATOM 2807 N N . TYR B 2 27 ? -10.366 -8.643 -26.558 1.00 151.95 ? 27 TYR H N 1 ATOM 2808 C CA . TYR B 2 27 ? -9.157 -8.033 -27.111 1.00 145.27 ? 27 TYR H CA 1 ATOM 2809 C C . TYR B 2 27 ? -8.985 -8.408 -28.581 1.00 143.37 ? 27 TYR H C 1 ATOM 2810 O O . TYR B 2 27 ? -9.695 -9.280 -29.095 1.00 146.52 ? 27 TYR H O 1 ATOM 2811 C CB . TYR B 2 27 ? -7.917 -8.465 -26.331 1.00 140.92 ? 27 TYR H CB 1 ATOM 2812 C CG . TYR B 2 27 ? -7.505 -9.915 -26.529 1.00 139.55 ? 27 TYR H CG 1 ATOM 2813 C CD1 . TYR B 2 27 ? -8.076 -10.945 -25.778 1.00 135.83 ? 27 TYR H CD1 1 ATOM 2814 C CD2 . TYR B 2 27 ? -6.512 -10.251 -27.448 1.00 140.99 ? 27 TYR H CD2 1 ATOM 2815 C CE1 . TYR B 2 27 ? -7.680 -12.271 -25.960 1.00 128.73 ? 27 TYR H CE1 1 ATOM 2816 C CE2 . TYR B 2 27 ? -6.110 -11.572 -27.631 1.00 134.22 ? 27 TYR H CE2 1 ATOM 2817 C CZ . TYR B 2 27 ? -6.697 -12.575 -26.894 1.00 126.42 ? 27 TYR H CZ 1 ATOM 2818 O OH . TYR B 2 27 ? -6.284 -13.870 -27.095 1.00 120.63 ? 27 TYR H OH 1 ATOM 2819 N N . THR B 2 28 ? -8.019 -7.780 -29.250 1.00 143.77 ? 28 THR H N 1 ATOM 2820 C CA . THR B 2 28 ? -7.686 -8.138 -30.632 1.00 142.35 ? 28 THR H CA 1 ATOM 2821 C C . THR B 2 28 ? -6.946 -9.455 -30.687 1.00 136.50 ? 28 THR H C 1 ATOM 2822 O O . THR B 2 28 ? -5.736 -9.506 -30.460 1.00 133.64 ? 28 THR H O 1 ATOM 2823 C CB . THR B 2 28 ? -6.859 -7.056 -31.312 1.00 141.45 ? 28 THR H CB 1 ATOM 2824 O OG1 . THR B 2 28 ? -7.621 -5.843 -31.328 1.00 144.80 ? 28 THR H OG1 1 ATOM 2825 C CG2 . THR B 2 28 ? -6.570 -7.465 -32.742 1.00 143.68 ? 28 THR H CG2 1 ATOM 2826 N N . PHE B 2 29 ? -7.681 -10.495 -31.067 1.00 132.81 ? 29 PHE H N 1 ATOM 2827 C CA . PHE B 2 29 ? -7.222 -11.880 -30.984 1.00 123.86 ? 29 PHE H CA 1 ATOM 2828 C C . PHE B 2 29 ? -5.890 -12.118 -31.680 1.00 116.92 ? 29 PHE H C 1 ATOM 2829 O O . PHE B 2 29 ? -5.028 -12.844 -31.182 1.00 108.53 ? 29 PHE H O 1 ATOM 2830 C CB . PHE B 2 29 ? -8.271 -12.823 -31.564 1.00 127.85 ? 29 PHE H CB 1 ATOM 2831 C CG . PHE B 2 29 ? -7.831 -14.254 -31.594 1.00 119.61 ? 29 PHE H CG 1 ATOM 2832 C CD1 . PHE B 2 29 ? -7.631 -14.944 -30.413 1.00 115.93 ? 29 PHE H CD1 1 ATOM 2833 C CD2 . PHE B 2 29 ? -7.600 -14.902 -32.790 1.00 121.54 ? 29 PHE H CD2 1 ATOM 2834 C CE1 . PHE B 2 29 ? -7.222 -16.257 -30.416 1.00 113.37 ? 29 PHE H CE1 1 ATOM 2835 C CE2 . PHE B 2 29 ? -7.183 -16.220 -32.802 1.00 115.43 ? 29 PHE H CE2 1 ATOM 2836 C CZ . PHE B 2 29 ? -7.001 -16.899 -31.606 1.00 109.75 ? 29 PHE H CZ 1 ATOM 2837 N N . THR B 2 30 ? -5.752 -11.549 -32.864 1.00 123.40 ? 30 THR H N 1 ATOM 2838 C CA . THR B 2 30 ? -4.563 -11.744 -33.671 1.00 124.95 ? 30 THR H CA 1 ATOM 2839 C C . THR B 2 30 ? -3.341 -11.027 -33.076 1.00 125.70 ? 30 THR H C 1 ATOM 2840 O O . THR B 2 30 ? -2.194 -11.336 -33.431 1.00 119.15 ? 30 THR H O 1 ATOM 2841 C CB . THR B 2 30 ? -4.807 -11.202 -35.102 1.00 131.00 ? 30 THR H CB 1 ATOM 2842 O OG1 . THR B 2 30 ? -5.251 -9.836 -35.041 1.00 131.54 ? 30 THR H OG1 1 ATOM 2843 C CG2 . THR B 2 30 ? -5.863 -12.017 -35.799 1.00 137.29 ? 30 THR H CG2 1 ATOM 2844 N N . GLY B 2 31 ? -3.586 -10.164 -32.083 1.00 130.00 ? 31 GLY H N 1 ATOM 2845 C CA . GLY B 2 31 ? -2.550 -9.290 -31.545 1.00 131.18 ? 31 GLY H CA 1 ATOM 2846 C C . GLY B 2 31 ? -1.518 -9.774 -30.553 1.00 127.64 ? 31 GLY H C 1 ATOM 2847 O O . GLY B 2 31 ? -0.517 -9.096 -30.332 1.00 130.48 ? 31 GLY H O 1 ATOM 2848 N N . TYR B 2 32 ? -1.727 -10.955 -29.992 1.00 120.05 ? 32 TYR H N 1 ATOM 2849 C CA . TYR B 2 32 ? -0.965 -11.442 -28.851 1.00 102.78 ? 32 TYR H CA 1 ATOM 2850 C C . TYR B 2 32 ? -0.725 -12.921 -29.074 1.00 95.11 ? 32 TYR H C 1 ATOM 2851 O O . TYR B 2 32 ? -1.646 -13.659 -29.405 1.00 97.34 ? 32 TYR H O 1 ATOM 2852 C CB . TYR B 2 32 ? -1.695 -11.229 -27.512 1.00 109.36 ? 32 TYR H CB 1 ATOM 2853 C CG . TYR B 2 32 ? -2.154 -9.822 -27.143 1.00 128.59 ? 32 TYR H CG 1 ATOM 2854 C CD1 . TYR B 2 32 ? -3.270 -9.243 -27.731 1.00 139.09 ? 32 TYR H CD1 1 ATOM 2855 C CD2 . TYR B 2 32 ? -1.513 -9.111 -26.127 1.00 134.00 ? 32 TYR H CD2 1 ATOM 2856 C CE1 . TYR B 2 32 ? -3.696 -7.958 -27.370 1.00 148.43 ? 32 TYR H CE1 1 ATOM 2857 C CE2 . TYR B 2 32 ? -1.936 -7.837 -25.744 1.00 142.86 ? 32 TYR H CE2 1 ATOM 2858 C CZ . TYR B 2 32 ? -3.031 -7.258 -26.368 1.00 151.94 ? 32 TYR H CZ 1 ATOM 2859 O OH . TYR B 2 32 ? -3.464 -5.983 -25.999 1.00 159.19 ? 32 TYR H OH 1 ATOM 2860 N N . TYR B 2 33 ? 0.489 -13.362 -28.778 1.00 91.79 ? 33 TYR H N 1 ATOM 2861 C CA . TYR B 2 33 ? 0.853 -14.771 -28.820 1.00 95.26 ? 33 TYR H CA 1 ATOM 2862 C C . TYR B 2 33 ? -0.070 -15.525 -27.882 1.00 99.75 ? 33 TYR H C 1 ATOM 2863 O O . TYR B 2 33 ? -0.392 -15.054 -26.799 1.00 100.39 ? 33 TYR H O 1 ATOM 2864 C CB . TYR B 2 33 ? 2.300 -15.025 -28.441 1.00 98.32 ? 33 TYR H CB 1 ATOM 2865 C CG . TYR B 2 33 ? 3.298 -14.739 -29.544 1.00 99.07 ? 33 TYR H CG 1 ATOM 2866 C CD1 . TYR B 2 33 ? 2.949 -14.002 -30.669 1.00 105.40 ? 33 TYR H CD1 1 ATOM 2867 C CD2 . TYR B 2 33 ? 4.581 -15.275 -29.485 1.00 94.57 ? 33 TYR H CD2 1 ATOM 2868 C CE1 . TYR B 2 33 ? 3.872 -13.757 -31.680 1.00 106.52 ? 33 TYR H CE1 1 ATOM 2869 C CE2 . TYR B 2 33 ? 5.503 -15.042 -30.483 1.00 99.29 ? 33 TYR H CE2 1 ATOM 2870 C CZ . TYR B 2 33 ? 5.144 -14.292 -31.577 1.00 101.76 ? 33 TYR H CZ 1 ATOM 2871 O OH . TYR B 2 33 ? 6.087 -14.061 -32.552 1.00 103.83 ? 33 TYR H OH 1 ATOM 2872 N N . MET B 2 34 ? -0.445 -16.730 -28.280 1.00 107.30 ? 34 MET H N 1 ATOM 2873 C CA . MET B 2 34 ? -1.121 -17.645 -27.358 1.00 99.48 ? 34 MET H CA 1 ATOM 2874 C C . MET B 2 34 ? -0.197 -18.773 -26.947 1.00 97.56 ? 34 MET H C 1 ATOM 2875 O O . MET B 2 34 ? 0.323 -19.499 -27.794 1.00 102.20 ? 34 MET H O 1 ATOM 2876 C CB . MET B 2 34 ? -2.343 -18.257 -28.036 1.00 100.39 ? 34 MET H CB 1 ATOM 2877 C CG . MET B 2 34 ? -3.280 -18.981 -27.118 1.00 93.05 ? 34 MET H CG 1 ATOM 2878 S SD . MET B 2 34 ? -4.092 -17.823 -26.047 1.00 113.67 ? 34 MET H SD 1 ATOM 2879 C CE . MET B 2 34 ? -5.300 -17.138 -27.176 1.00 106.78 ? 34 MET H CE 1 ATOM 2880 N N . HIS B 2 35 ? 0.012 -18.890 -25.626 1.00 97.89 ? 35 HIS H N 1 ATOM 2881 C CA . HIS B 2 35 ? 0.767 -20.015 -25.054 1.00 97.55 ? 35 HIS H CA 1 ATOM 2882 C C . HIS B 2 35 ? -0.128 -21.136 -24.527 1.00 97.33 ? 35 HIS H C 1 ATOM 2883 O O . HIS B 2 35 ? -1.304 -20.902 -24.272 1.00 101.64 ? 35 HIS H O 1 ATOM 2884 C CB . HIS B 2 35 ? 1.626 -19.485 -23.901 1.00 93.68 ? 35 HIS H CB 1 ATOM 2885 C CG . HIS B 2 35 ? 2.639 -18.476 -24.328 1.00 101.42 ? 35 HIS H CG 1 ATOM 2886 N ND1 . HIS B 2 35 ? 2.288 -17.185 -24.657 1.00 108.31 ? 35 HIS H ND1 1 ATOM 2887 C CD2 . HIS B 2 35 ? 3.980 -18.555 -24.494 1.00 105.44 ? 35 HIS H CD2 1 ATOM 2888 C CE1 . HIS B 2 35 ? 3.367 -16.512 -25.010 1.00 109.94 ? 35 HIS H CE1 1 ATOM 2889 N NE2 . HIS B 2 35 ? 4.409 -17.320 -24.922 1.00 110.61 ? 35 HIS H NE2 1 ATOM 2890 N N . TRP B 2 36 ? 0.413 -22.353 -24.412 1.00 94.87 ? 36 TRP H N 1 ATOM 2891 C CA . TRP B 2 36 ? -0.265 -23.456 -23.701 1.00 95.44 ? 36 TRP H CA 1 ATOM 2892 C C . TRP B 2 36 ? 0.615 -23.995 -22.556 1.00 97.92 ? 36 TRP H C 1 ATOM 2893 O O . TRP B 2 36 ? 1.817 -24.224 -22.737 1.00 103.04 ? 36 TRP H O 1 ATOM 2894 C CB . TRP B 2 36 ? -0.642 -24.600 -24.676 1.00 92.08 ? 36 TRP H CB 1 ATOM 2895 C CG . TRP B 2 36 ? -1.647 -24.178 -25.710 1.00 83.22 ? 36 TRP H CG 1 ATOM 2896 C CD1 . TRP B 2 36 ? -1.393 -23.519 -26.872 1.00 80.89 ? 36 TRP H CD1 1 ATOM 2897 C CD2 . TRP B 2 36 ? -3.072 -24.336 -25.644 1.00 80.74 ? 36 TRP H CD2 1 ATOM 2898 N NE1 . TRP B 2 36 ? -2.565 -23.277 -27.552 1.00 85.15 ? 36 TRP H NE1 1 ATOM 2899 C CE2 . TRP B 2 36 ? -3.612 -23.758 -26.809 1.00 88.75 ? 36 TRP H CE2 1 ATOM 2900 C CE3 . TRP B 2 36 ? -3.941 -24.919 -24.720 1.00 80.74 ? 36 TRP H CE3 1 ATOM 2901 C CZ2 . TRP B 2 36 ? -4.987 -23.748 -27.073 1.00 93.41 ? 36 TRP H CZ2 1 ATOM 2902 C CZ3 . TRP B 2 36 ? -5.306 -24.900 -24.979 1.00 84.46 ? 36 TRP H CZ3 1 ATOM 2903 C CH2 . TRP B 2 36 ? -5.815 -24.316 -26.139 1.00 88.85 ? 36 TRP H CH2 1 ATOM 2904 N N . VAL B 2 37 ? 0.009 -24.253 -21.401 1.00 95.58 ? 37 VAL H N 1 ATOM 2905 C CA . VAL B 2 37 ? 0.738 -24.733 -20.219 1.00 97.46 ? 37 VAL H CA 1 ATOM 2906 C C . VAL B 2 37 ? -0.072 -25.841 -19.555 1.00 96.29 ? 37 VAL H C 1 ATOM 2907 O O . VAL B 2 37 ? -1.291 -25.741 -19.457 1.00 98.72 ? 37 VAL H O 1 ATOM 2908 C CB . VAL B 2 37 ? 1.023 -23.602 -19.177 1.00 100.60 ? 37 VAL H CB 1 ATOM 2909 C CG1 . VAL B 2 37 ? 1.713 -24.167 -17.936 1.00 101.04 ? 37 VAL H CG1 1 ATOM 2910 C CG2 . VAL B 2 37 ? 1.876 -22.503 -19.784 1.00 100.33 ? 37 VAL H CG2 1 ATOM 2911 N N . ARG B 2 38 ? 0.579 -26.931 -19.176 1.00 93.58 ? 38 ARG H N 1 ATOM 2912 C CA . ARG B 2 38 ? -0.141 -28.006 -18.496 1.00 99.38 ? 38 ARG H CA 1 ATOM 2913 C C . ARG B 2 38 ? 0.395 -28.272 -17.098 1.00 114.60 ? 38 ARG H C 1 ATOM 2914 O O . ARG B 2 38 ? 1.472 -27.783 -16.716 1.00 120.96 ? 38 ARG H O 1 ATOM 2915 C CB . ARG B 2 38 ? -0.089 -29.331 -19.231 1.00 90.56 ? 38 ARG H CB 1 ATOM 2916 C CG . ARG B 2 38 ? 1.234 -30.021 -19.174 1.00 84.58 ? 38 ARG H CG 1 ATOM 2917 C CD . ARG B 2 38 ? 1.056 -31.348 -19.842 1.00 91.01 ? 38 ARG H CD 1 ATOM 2918 N NE . ARG B 2 38 ? 2.233 -32.191 -19.747 1.00 107.36 ? 38 ARG H NE 1 ATOM 2919 C CZ . ARG B 2 38 ? 2.294 -33.420 -20.245 1.00 120.97 ? 38 ARG H CZ 1 ATOM 2920 N NH1 . ARG B 2 38 ? 1.269 -33.913 -20.926 1.00 115.14 ? 38 ARG H NH1 1 ATOM 2921 N NH2 . ARG B 2 38 ? 3.392 -34.145 -20.083 1.00 134.46 ? 38 ARG H NH2 1 ATOM 2922 N N . GLN B 2 39 ? -0.362 -29.052 -16.331 1.00 119.07 ? 39 GLN H N 1 ATOM 2923 C CA . GLN B 2 39 ? -0.005 -29.340 -14.948 1.00 117.78 ? 39 GLN H CA 1 ATOM 2924 C C . GLN B 2 39 ? -0.577 -30.727 -14.739 1.00 108.58 ? 39 GLN H C 1 ATOM 2925 O O . GLN B 2 39 ? -1.786 -30.975 -14.787 1.00 103.53 ? 39 GLN H O 1 ATOM 2926 C CB . GLN B 2 39 ? -0.611 -28.384 -13.905 1.00 121.40 ? 39 GLN H CB 1 ATOM 2927 C CG . GLN B 2 39 ? -2.153 -28.459 -13.772 1.00 123.30 ? 39 GLN H CG 1 ATOM 2928 C CD . GLN B 2 39 ? -2.695 -27.695 -12.586 1.00 121.24 ? 39 GLN H CD 1 ATOM 2929 O OE1 . GLN B 2 39 ? -1.922 -27.253 -11.741 1.00 128.72 ? 39 GLN H OE1 1 ATOM 2930 N NE2 . GLN B 2 39 ? -4.022 -27.606 -12.470 1.00 112.06 ? 39 GLN H NE2 1 ATOM 2931 N N . ALA B 2 40 ? 0.338 -31.680 -14.678 1.00 106.83 ? 40 ALA H N 1 ATOM 2932 C CA . ALA B 2 40 ? -0.054 -33.025 -14.351 1.00 123.28 ? 40 ALA H CA 1 ATOM 2933 C C . ALA B 2 40 ? 0.018 -33.233 -12.850 1.00 132.94 ? 40 ALA H C 1 ATOM 2934 O O . ALA B 2 40 ? 0.774 -32.520 -12.185 1.00 141.19 ? 40 ALA H O 1 ATOM 2935 C CB . ALA B 2 40 ? 0.833 -34.020 -15.080 1.00 131.52 ? 40 ALA H CB 1 ATOM 2936 N N . PRO B 2 41 ? -0.780 -34.161 -12.302 1.00 131.36 ? 41 PRO H N 1 ATOM 2937 C CA . PRO B 2 41 ? -0.702 -34.370 -10.855 1.00 138.66 ? 41 PRO H CA 1 ATOM 2938 C C . PRO B 2 41 ? 0.768 -34.668 -10.492 1.00 144.32 ? 41 PRO H C 1 ATOM 2939 O O . PRO B 2 41 ? 1.488 -35.184 -11.363 1.00 137.34 ? 41 PRO H O 1 ATOM 2940 C CB . PRO B 2 41 ? -1.649 -35.545 -10.608 1.00 140.05 ? 41 PRO H CB 1 ATOM 2941 C CG . PRO B 2 41 ? -2.614 -35.489 -11.749 1.00 135.47 ? 41 PRO H CG 1 ATOM 2942 C CD . PRO B 2 41 ? -1.940 -34.834 -12.908 1.00 128.91 ? 41 PRO H CD 1 ATOM 2943 N N . GLY B 2 42 ? 1.221 -34.333 -9.283 1.00 151.67 ? 42 GLY H N 1 ATOM 2944 C CA . GLY B 2 42 ? 2.614 -34.552 -8.914 1.00 155.72 ? 42 GLY H CA 1 ATOM 2945 C C . GLY B 2 42 ? 3.640 -33.960 -9.873 1.00 151.18 ? 42 GLY H C 1 ATOM 2946 O O . GLY B 2 42 ? 4.820 -34.302 -9.826 1.00 154.24 ? 42 GLY H O 1 ATOM 2947 N N . GLN B 2 43 ? 3.196 -33.082 -10.760 1.00 145.21 ? 43 GLN H N 1 ATOM 2948 C CA . GLN B 2 43 ? 4.099 -32.358 -11.634 1.00 148.14 ? 43 GLN H CA 1 ATOM 2949 C C . GLN B 2 43 ? 3.856 -30.872 -11.407 1.00 145.52 ? 43 GLN H C 1 ATOM 2950 O O . GLN B 2 43 ? 2.765 -30.455 -11.016 1.00 147.15 ? 43 GLN H O 1 ATOM 2951 C CB . GLN B 2 43 ? 3.980 -32.835 -13.088 1.00 156.23 ? 43 GLN H CB 1 ATOM 2952 C CG . GLN B 2 43 ? 4.970 -33.932 -13.507 1.00 168.42 ? 43 GLN H CG 1 ATOM 2953 C CD . GLN B 2 43 ? 5.025 -34.136 -15.029 1.00 172.62 ? 43 GLN H CD 1 ATOM 2954 O OE1 . GLN B 2 43 ? 4.272 -33.515 -15.783 1.00 173.85 ? 43 GLN H OE1 1 ATOM 2955 N NE2 . GLN B 2 43 ? 5.926 -35.009 -15.480 1.00 174.06 ? 43 GLN H NE2 1 ATOM 2956 N N . GLY B 2 44 ? 4.903 -30.093 -11.646 1.00 143.40 ? 44 GLY H N 1 ATOM 2957 C CA . GLY B 2 44 ? 4.835 -28.644 -11.714 1.00 139.22 ? 44 GLY H CA 1 ATOM 2958 C C . GLY B 2 44 ? 4.147 -28.215 -12.989 1.00 133.30 ? 44 GLY H C 1 ATOM 2959 O O . GLY B 2 44 ? 3.595 -29.025 -13.741 1.00 136.94 ? 44 GLY H O 1 ATOM 2960 N N . LEU B 2 45 ? 4.144 -26.912 -13.229 1.00 123.28 ? 45 LEU H N 1 ATOM 2961 C CA . LEU B 2 45 ? 3.487 -26.405 -14.422 1.00 114.61 ? 45 LEU H CA 1 ATOM 2962 C C . LEU B 2 45 ? 4.490 -26.518 -15.549 1.00 121.12 ? 45 LEU H C 1 ATOM 2963 O O . LEU B 2 45 ? 5.685 -26.249 -15.397 1.00 127.14 ? 45 LEU H O 1 ATOM 2964 C CB . LEU B 2 45 ? 2.979 -24.963 -14.296 1.00 98.38 ? 45 LEU H CB 1 ATOM 2965 C CG . LEU B 2 45 ? 2.020 -24.392 -13.260 1.00 86.75 ? 45 LEU H CG 1 ATOM 2966 C CD1 . LEU B 2 45 ? 1.966 -22.887 -13.469 1.00 78.48 ? 45 LEU H CD1 1 ATOM 2967 C CD2 . LEU B 2 45 ? 0.632 -24.995 -13.404 1.00 83.45 ? 45 LEU H CD2 1 ATOM 2968 N N . GLU B 2 46 ? 3.985 -26.949 -16.689 1.00 119.97 ? 46 GLU H N 1 ATOM 2969 C CA . GLU B 2 46 ? 4.828 -27.190 -17.820 1.00 122.31 ? 46 GLU H CA 1 ATOM 2970 C C . GLU B 2 46 ? 4.278 -26.517 -19.073 1.00 123.24 ? 46 GLU H C 1 ATOM 2971 O O . GLU B 2 46 ? 3.167 -26.812 -19.531 1.00 120.80 ? 46 GLU H O 1 ATOM 2972 C CB . GLU B 2 46 ? 4.974 -28.704 -17.938 1.00 129.58 ? 46 GLU H CB 1 ATOM 2973 C CG . GLU B 2 46 ? 5.918 -29.271 -18.956 1.00 138.78 ? 46 GLU H CG 1 ATOM 2974 C CD . GLU B 2 46 ? 5.982 -30.793 -18.833 1.00 149.93 ? 46 GLU H CD 1 ATOM 2975 O OE1 . GLU B 2 46 ? 4.932 -31.420 -18.518 1.00 148.85 ? 46 GLU H OE1 1 ATOM 2976 O OE2 . GLU B 2 46 ? 7.075 -31.360 -19.061 1.00 156.10 ? 46 GLU H OE2 1 ATOM 2977 N N . TRP B 2 47 ? 5.082 -25.567 -19.575 1.00 121.90 ? 47 TRP H N 1 ATOM 2978 C CA . TRP B 2 47 ? 4.859 -24.867 -20.835 1.00 107.78 ? 47 TRP H CA 1 ATOM 2979 C C . TRP B 2 47 ? 5.068 -25.792 -21.967 1.00 99.53 ? 47 TRP H C 1 ATOM 2980 O O . TRP B 2 47 ? 6.062 -26.505 -22.030 1.00 99.14 ? 47 TRP H O 1 ATOM 2981 C CB . TRP B 2 47 ? 5.813 -23.670 -20.962 1.00 107.80 ? 47 TRP H CB 1 ATOM 2982 C CG . TRP B 2 47 ? 5.741 -22.860 -22.279 1.00 106.89 ? 47 TRP H CG 1 ATOM 2983 C CD1 . TRP B 2 47 ? 4.873 -21.845 -22.586 1.00 106.41 ? 47 TRP H CD1 1 ATOM 2984 C CD2 . TRP B 2 47 ? 6.657 -22.946 -23.395 1.00 103.74 ? 47 TRP H CD2 1 ATOM 2985 N NE1 . TRP B 2 47 ? 5.152 -21.347 -23.842 1.00 105.10 ? 47 TRP H NE1 1 ATOM 2986 C CE2 . TRP B 2 47 ? 6.247 -21.996 -24.349 1.00 102.04 ? 47 TRP H CE2 1 ATOM 2987 C CE3 . TRP B 2 47 ? 7.767 -23.747 -23.677 1.00 102.24 ? 47 TRP H CE3 1 ATOM 2988 C CZ2 . TRP B 2 47 ? 6.908 -21.822 -25.562 1.00 102.26 ? 47 TRP H CZ2 1 ATOM 2989 C CZ3 . TRP B 2 47 ? 8.419 -23.576 -24.874 1.00 105.93 ? 47 TRP H CZ3 1 ATOM 2990 C CH2 . TRP B 2 47 ? 7.985 -22.621 -25.811 1.00 106.16 ? 47 TRP H CH2 1 ATOM 2991 N N . MET B 2 48 ? 4.141 -25.712 -22.906 1.00 101.89 ? 48 MET H N 1 ATOM 2992 C CA . MET B 2 48 ? 4.207 -26.533 -24.086 1.00 112.56 ? 48 MET H CA 1 ATOM 2993 C C . MET B 2 48 ? 4.640 -25.802 -25.343 1.00 112.77 ? 48 MET H C 1 ATOM 2994 O O . MET B 2 48 ? 5.366 -26.361 -26.181 1.00 115.18 ? 48 MET H O 1 ATOM 2995 C CB . MET B 2 48 ? 2.848 -27.173 -24.321 1.00 112.74 ? 48 MET H CB 1 ATOM 2996 C CG . MET B 2 48 ? 2.350 -27.941 -23.156 1.00 109.00 ? 48 MET H CG 1 ATOM 2997 S SD . MET B 2 48 ? 0.758 -28.671 -23.483 1.00 99.91 ? 48 MET H SD 1 ATOM 2998 C CE . MET B 2 48 ? 1.208 -29.794 -24.805 1.00 137.33 ? 48 MET H CE 1 ATOM 2999 N N . GLY B 2 49 ? 4.213 -24.557 -25.491 1.00 104.57 ? 49 GLY H N 1 ATOM 3000 C CA . GLY B 2 49 ? 4.478 -23.885 -26.737 1.00 107.76 ? 49 GLY H CA 1 ATOM 3001 C C . GLY B 2 49 ? 3.599 -22.686 -26.904 1.00 105.55 ? 49 GLY H C 1 ATOM 3002 O O . GLY B 2 49 ? 2.724 -22.440 -26.073 1.00 102.56 ? 49 GLY H O 1 ATOM 3003 N N . TRP B 2 50 ? 3.855 -21.940 -27.976 1.00 98.03 ? 50 TRP H N 1 ATOM 3004 C CA . TRP B 2 50 ? 3.041 -20.793 -28.359 1.00 91.68 ? 50 TRP H CA 1 ATOM 3005 C C . TRP B 2 50 ? 2.765 -20.838 -29.836 1.00 100.16 ? 50 TRP H C 1 ATOM 3006 O O . TRP B 2 50 ? 3.452 -21.540 -30.585 1.00 103.70 ? 50 TRP H O 1 ATOM 3007 C CB . TRP B 2 50 ? 3.689 -19.448 -27.965 1.00 86.64 ? 50 TRP H CB 1 ATOM 3008 C CG . TRP B 2 50 ? 5.074 -19.139 -28.497 1.00 89.86 ? 50 TRP H CG 1 ATOM 3009 C CD1 . TRP B 2 50 ? 6.232 -19.105 -27.773 1.00 90.23 ? 50 TRP H CD1 1 ATOM 3010 C CD2 . TRP B 2 50 ? 5.431 -18.737 -29.826 1.00 91.70 ? 50 TRP H CD2 1 ATOM 3011 N NE1 . TRP B 2 50 ? 7.290 -18.759 -28.578 1.00 94.38 ? 50 TRP H NE1 1 ATOM 3012 C CE2 . TRP B 2 50 ? 6.824 -18.525 -29.841 1.00 91.27 ? 50 TRP H CE2 1 ATOM 3013 C CE3 . TRP B 2 50 ? 4.714 -18.548 -31.004 1.00 91.41 ? 50 TRP H CE3 1 ATOM 3014 C CZ2 . TRP B 2 50 ? 7.505 -18.131 -30.982 1.00 93.73 ? 50 TRP H CZ2 1 ATOM 3015 C CZ3 . TRP B 2 50 ? 5.392 -18.164 -32.139 1.00 98.47 ? 50 TRP H CZ3 1 ATOM 3016 C CH2 . TRP B 2 50 ? 6.775 -17.953 -32.119 1.00 101.66 ? 50 TRP H CH2 1 ATOM 3017 N N . ILE B 2 51 ? 1.705 -20.131 -30.220 1.00 104.11 ? 51 ILE H N 1 ATOM 3018 C CA . ILE B 2 51 ? 1.358 -19.821 -31.607 1.00 101.16 ? 51 ILE H CA 1 ATOM 3019 C C . ILE B 2 51 ? 1.239 -18.288 -31.785 1.00 103.44 ? 51 ILE H C 1 ATOM 3020 O O . ILE B 2 51 ? 0.682 -17.579 -30.929 1.00 99.26 ? 51 ILE H O 1 ATOM 3021 C CB . ILE B 2 51 ? 0.043 -20.550 -31.968 1.00 98.10 ? 51 ILE H CB 1 ATOM 3022 C CG1 . ILE B 2 51 ? -0.362 -20.338 -33.412 1.00 96.68 ? 51 ILE H CG1 1 ATOM 3023 C CG2 . ILE B 2 51 ? -1.096 -20.095 -31.085 1.00 101.11 ? 51 ILE H CG2 1 ATOM 3024 C CD1 . ILE B 2 51 ? -1.237 -21.445 -33.891 1.00 95.20 ? 51 ILE H CD1 1 ATOM 3025 N N . ASN B 2 52 ? 1.753 -17.792 -32.910 1.00 109.63 ? 52 ASN H N 1 ATOM 3026 C CA . ASN B 2 52 ? 1.511 -16.419 -33.373 1.00 113.65 ? 52 ASN H CA 1 ATOM 3027 C C . ASN B 2 52 ? 0.264 -16.384 -34.247 1.00 115.20 ? 52 ASN H C 1 ATOM 3028 O O . ASN B 2 52 ? 0.256 -16.933 -35.348 1.00 119.83 ? 52 ASN H O 1 ATOM 3029 C CB . ASN B 2 52 ? 2.725 -15.890 -34.155 1.00 116.58 ? 52 ASN H CB 1 ATOM 3030 C CG . ASN B 2 52 ? 2.496 -14.501 -34.780 1.00 122.19 ? 52 ASN H CG 1 ATOM 3031 O OD1 . ASN B 2 52 ? 1.369 -14.015 -34.904 1.00 120.04 ? 52 ASN H OD1 1 ATOM 3032 N ND2 . ASN B 2 52 ? 3.590 -13.868 -35.193 1.00 128.81 ? 52 ASN H ND2 1 ATOM 3033 N N . PRO B 2 53 A -0.799 -15.785 -33.746 1.00 109.18 ? 52 PRO H N 1 ATOM 3034 C CA . PRO B 2 53 A -2.107 -15.941 -34.367 1.00 104.57 ? 52 PRO H CA 1 ATOM 3035 C C . PRO B 2 53 A -2.209 -15.400 -35.772 1.00 112.23 ? 52 PRO H C 1 ATOM 3036 O O . PRO B 2 53 A -2.844 -16.057 -36.589 1.00 130.26 ? 52 PRO H O 1 ATOM 3037 C CB . PRO B 2 53 A -3.013 -15.162 -33.438 1.00 105.65 ? 52 PRO H CB 1 ATOM 3038 C CG . PRO B 2 53 A -2.395 -15.372 -32.108 1.00 101.92 ? 52 PRO H CG 1 ATOM 3039 C CD . PRO B 2 53 A -0.912 -15.487 -32.314 1.00 102.45 ? 52 PRO H CD 1 ATOM 3040 N N . ASN B 2 54 ? -1.632 -14.240 -36.060 1.00 102.93 ? 53 ASN H N 1 ATOM 3041 C CA . ASN B 2 54 ? -1.762 -13.722 -37.406 1.00 123.41 ? 53 ASN H CA 1 ATOM 3042 C C . ASN B 2 54 ? -1.095 -14.672 -38.379 1.00 126.92 ? 53 ASN H C 1 ATOM 3043 O O . ASN B 2 54 ? -1.686 -15.061 -39.375 1.00 136.73 ? 53 ASN H O 1 ATOM 3044 C CB . ASN B 2 54 ? -1.107 -12.348 -37.524 1.00 138.37 ? 53 ASN H CB 1 ATOM 3045 C CG . ASN B 2 54 ? -1.441 -11.436 -36.365 1.00 148.85 ? 53 ASN H CG 1 ATOM 3046 O OD1 . ASN B 2 54 ? -0.675 -10.533 -36.041 1.00 147.24 ? 53 ASN H OD1 1 ATOM 3047 N ND2 . ASN B 2 54 ? -2.588 -11.661 -35.735 1.00 157.23 ? 53 ASN H ND2 1 ATOM 3048 N N . SER B 2 55 ? 0.126 -15.078 -38.063 1.00 122.82 ? 54 SER H N 1 ATOM 3049 C CA . SER B 2 55 ? 0.862 -16.035 -38.883 1.00 122.57 ? 54 SER H CA 1 ATOM 3050 C C . SER B 2 55 ? 0.321 -17.459 -38.879 1.00 122.00 ? 54 SER H C 1 ATOM 3051 O O . SER B 2 55 ? 0.278 -18.124 -39.904 1.00 136.27 ? 54 SER H O 1 ATOM 3052 C CB . SER B 2 55 ? 2.339 -16.037 -38.503 1.00 126.22 ? 54 SER H CB 1 ATOM 3053 O OG . SER B 2 55 ? 2.600 -16.999 -37.502 1.00 131.53 ? 54 SER H OG 1 ATOM 3054 N N . GLY B 2 56 ? -0.079 -17.925 -37.706 1.00 114.45 ? 55 GLY H N 1 ATOM 3055 C CA . GLY B 2 56 ? -0.320 -19.335 -37.490 1.00 117.73 ? 55 GLY H CA 1 ATOM 3056 C C . GLY B 2 56 ? 0.982 -20.039 -37.146 1.00 119.71 ? 55 GLY H C 1 ATOM 3057 O O . GLY B 2 56 ? 1.021 -21.254 -36.996 1.00 109.48 ? 55 GLY H O 1 ATOM 3058 N N . GLY B 2 57 ? 2.050 -19.262 -37.013 1.00 126.33 ? 56 GLY H N 1 ATOM 3059 C CA . GLY B 2 57 ? 3.365 -19.786 -36.687 1.00 121.93 ? 56 GLY H CA 1 ATOM 3060 C C . GLY B 2 57 ? 3.461 -20.300 -35.270 1.00 122.58 ? 56 GLY H C 1 ATOM 3061 O O . GLY B 2 57 ? 2.757 -19.818 -34.393 1.00 123.04 ? 56 GLY H O 1 ATOM 3062 N N . THR B 2 58 ? 4.325 -21.283 -35.042 1.00 129.36 ? 57 THR H N 1 ATOM 3063 C CA . THR B 2 58 ? 4.407 -21.931 -33.743 1.00 121.45 ? 57 THR H CA 1 ATOM 3064 C C . THR B 2 58 ? 5.813 -22.172 -33.240 1.00 119.11 ? 57 THR H C 1 ATOM 3065 O O . THR B 2 58 ? 6.728 -22.381 -34.019 1.00 122.62 ? 57 THR H O 1 ATOM 3066 C CB . THR B 2 58 ? 3.748 -23.304 -33.806 1.00 114.65 ? 57 THR H CB 1 ATOM 3067 O OG1 . THR B 2 58 ? 4.582 -24.182 -34.565 1.00 125.41 ? 57 THR H OG1 1 ATOM 3068 C CG2 . THR B 2 58 ? 2.415 -23.203 -34.487 1.00 115.19 ? 57 THR H CG2 1 ATOM 3069 N N . ASN B 2 59 ? 5.967 -22.174 -31.922 1.00 119.95 ? 58 ASN H N 1 ATOM 3070 C CA . ASN B 2 59 ? 7.139 -22.716 -31.299 1.00 128.29 ? 58 ASN H CA 1 ATOM 3071 C C . ASN B 2 59 ? 6.697 -23.691 -30.243 1.00 131.20 ? 58 ASN H C 1 ATOM 3072 O O . ASN B 2 59 ? 5.783 -23.427 -29.472 1.00 127.25 ? 58 ASN H O 1 ATOM 3073 C CB . ASN B 2 59 ? 7.925 -21.552 -30.684 1.00 127.06 ? 58 ASN H CB 1 ATOM 3074 C CG . ASN B 2 59 ? 9.200 -21.969 -29.998 1.00 132.78 ? 58 ASN H CG 1 ATOM 3075 O OD1 . ASN B 2 59 ? 9.372 -23.113 -29.573 1.00 139.15 ? 58 ASN H OD1 1 ATOM 3076 N ND2 . ASN B 2 59 ? 10.112 -21.012 -29.867 1.00 129.82 ? 58 ASN H ND2 1 ATOM 3077 N N . TYR B 2 60 ? 7.428 -24.792 -30.167 1.00 131.57 ? 59 TYR H N 1 ATOM 3078 C CA . TYR B 2 60 ? 7.101 -25.846 -29.234 1.00 127.17 ? 59 TYR H CA 1 ATOM 3079 C C . TYR B 2 60 ? 8.250 -26.118 -28.301 1.00 127.76 ? 59 TYR H C 1 ATOM 3080 O O . TYR B 2 60 ? 9.414 -26.019 -28.692 1.00 133.84 ? 59 TYR H O 1 ATOM 3081 C CB . TYR B 2 60 ? 6.728 -27.139 -29.956 1.00 124.26 ? 59 TYR H CB 1 ATOM 3082 C CG . TYR B 2 60 ? 5.627 -27.049 -30.981 1.00 119.58 ? 59 TYR H CG 1 ATOM 3083 C CD1 . TYR B 2 60 ? 4.402 -26.486 -30.660 1.00 115.41 ? 59 TYR H CD1 1 ATOM 3084 C CD2 . TYR B 2 60 ? 5.772 -27.620 -32.229 1.00 131.44 ? 59 TYR H CD2 1 ATOM 3085 C CE1 . TYR B 2 60 ? 3.361 -26.456 -31.567 1.00 116.56 ? 59 TYR H CE1 1 ATOM 3086 C CE2 . TYR B 2 60 ? 4.742 -27.587 -33.147 1.00 136.96 ? 59 TYR H CE2 1 ATOM 3087 C CZ . TYR B 2 60 ? 3.535 -27.011 -32.803 1.00 129.84 ? 59 TYR H CZ 1 ATOM 3088 O OH . TYR B 2 60 ? 2.515 -26.960 -33.725 1.00 137.43 ? 59 TYR H OH 1 ATOM 3089 N N . ALA B 2 61 ? 7.907 -26.532 -27.084 1.00 123.36 ? 60 ALA H N 1 ATOM 3090 C CA . ALA B 2 61 ? 8.897 -26.945 -26.110 1.00 133.18 ? 60 ALA H CA 1 ATOM 3091 C C . ALA B 2 61 ? 9.529 -28.149 -26.762 1.00 146.00 ? 60 ALA H C 1 ATOM 3092 O O . ALA B 2 61 ? 8.826 -28.971 -27.360 1.00 147.82 ? 60 ALA H O 1 ATOM 3093 C CB . ALA B 2 61 ? 8.265 -27.277 -24.777 1.00 133.30 ? 60 ALA H CB 1 ATOM 3094 N N . GLN B 2 62 ? 10.849 -28.268 -26.670 1.00 154.35 ? 61 GLN H N 1 ATOM 3095 C CA . GLN B 2 62 ? 11.455 -29.314 -27.456 1.00 159.75 ? 61 GLN H CA 1 ATOM 3096 C C . GLN B 2 62 ? 11.017 -30.692 -27.026 1.00 149.35 ? 61 GLN H C 1 ATOM 3097 O O . GLN B 2 62 ? 10.999 -31.583 -27.875 1.00 146.39 ? 61 GLN H O 1 ATOM 3098 C CB . GLN B 2 62 ? 12.989 -29.197 -27.398 1.00 174.47 ? 61 GLN H CB 1 ATOM 3099 C CG . GLN B 2 62 ? 13.542 -27.934 -28.093 1.00 182.34 ? 61 GLN H CG 1 ATOM 3100 C CD . GLN B 2 62 ? 15.069 -27.889 -28.181 1.00 193.03 ? 61 GLN H CD 1 ATOM 3101 O OE1 . GLN B 2 62 ? 15.648 -26.881 -28.596 1.00 193.49 ? 61 GLN H OE1 1 ATOM 3102 N NE2 . GLN B 2 62 ? 15.721 -28.978 -27.794 1.00 201.20 ? 61 GLN H NE2 1 ATOM 3103 N N . LYS B 2 63 ? 10.705 -30.936 -25.754 1.00 147.41 ? 62 LYS H N 1 ATOM 3104 C CA . LYS B 2 63 ? 10.438 -32.335 -25.529 1.00 158.38 ? 62 LYS H CA 1 ATOM 3105 C C . LYS B 2 63 ? 9.121 -32.713 -26.244 1.00 152.42 ? 62 LYS H C 1 ATOM 3106 O O . LYS B 2 63 ? 8.881 -33.879 -26.565 1.00 151.56 ? 62 LYS H O 1 ATOM 3107 C CB . LYS B 2 63 ? 10.342 -32.588 -24.026 1.00 164.84 ? 62 LYS H CB 1 ATOM 3108 C CG . LYS B 2 63 ? 9.134 -31.900 -23.392 1.00 164.23 ? 62 LYS H CG 1 ATOM 3109 C CD . LYS B 2 63 ? 8.960 -32.214 -21.900 1.00 171.34 ? 62 LYS H CD 1 ATOM 3110 C CE . LYS B 2 63 ? 9.769 -31.297 -20.980 1.00 174.59 ? 62 LYS H CE 1 ATOM 3111 N NZ . LYS B 2 63 ? 10.289 -32.020 -19.771 1.00 178.59 ? 62 LYS H NZ 1 ATOM 3112 N N . PHE B 2 64 ? 8.292 -31.693 -26.501 1.00 142.95 ? 63 PHE H N 1 ATOM 3113 C CA . PHE B 2 64 ? 7.012 -31.802 -27.228 1.00 130.10 ? 63 PHE H CA 1 ATOM 3114 C C . PHE B 2 64 ? 6.997 -31.843 -28.749 1.00 123.37 ? 63 PHE H C 1 ATOM 3115 O O . PHE B 2 64 ? 5.960 -32.156 -29.336 1.00 112.64 ? 63 PHE H O 1 ATOM 3116 C CB . PHE B 2 64 ? 6.050 -30.722 -26.748 1.00 123.85 ? 63 PHE H CB 1 ATOM 3117 C CG . PHE B 2 64 ? 5.522 -30.983 -25.370 1.00 126.19 ? 63 PHE H CG 1 ATOM 3118 C CD1 . PHE B 2 64 ? 5.412 -32.288 -24.909 1.00 125.45 ? 63 PHE H CD1 1 ATOM 3119 C CD2 . PHE B 2 64 ? 5.129 -29.950 -24.537 1.00 129.33 ? 63 PHE H CD2 1 ATOM 3120 C CE1 . PHE B 2 64 ? 4.925 -32.562 -23.641 1.00 122.87 ? 63 PHE H CE1 1 ATOM 3121 C CE2 . PHE B 2 64 ? 4.645 -30.221 -23.257 1.00 127.49 ? 63 PHE H CE2 1 ATOM 3122 C CZ . PHE B 2 64 ? 4.537 -31.528 -22.813 1.00 123.90 ? 63 PHE H CZ 1 ATOM 3123 N N . GLN B 2 65 ? 8.133 -31.568 -29.381 1.00 127.12 ? 64 GLN H N 1 ATOM 3124 C CA . GLN B 2 65 ? 8.266 -31.783 -30.818 1.00 132.81 ? 64 GLN H CA 1 ATOM 3125 C C . GLN B 2 65 ? 7.782 -33.100 -31.352 1.00 129.48 ? 64 GLN H C 1 ATOM 3126 O O . GLN B 2 65 ? 8.157 -34.168 -30.889 1.00 126.48 ? 64 GLN H O 1 ATOM 3127 C CB . GLN B 2 65 ? 9.708 -31.563 -31.269 1.00 144.06 ? 64 GLN H CB 1 ATOM 3128 C CG . GLN B 2 65 ? 10.121 -30.105 -31.238 1.00 144.69 ? 64 GLN H CG 1 ATOM 3129 C CD . GLN B 2 65 ? 9.411 -29.311 -32.328 1.00 145.23 ? 64 GLN H CD 1 ATOM 3130 O OE1 . GLN B 2 65 ? 9.091 -29.854 -33.389 1.00 145.54 ? 64 GLN H OE1 1 ATOM 3131 N NE2 . GLN B 2 65 ? 9.181 -28.020 -32.083 1.00 144.82 ? 64 GLN H NE2 1 ATOM 3132 N N . GLY B 2 66 ? 6.935 -32.981 -32.361 1.00 132.52 ? 65 GLY H N 1 ATOM 3133 C CA . GLY B 2 66 ? 6.545 -34.118 -33.152 1.00 139.97 ? 65 GLY H CA 1 ATOM 3134 C C . GLY B 2 66 ? 5.188 -34.618 -32.727 1.00 141.46 ? 65 GLY H C 1 ATOM 3135 O O . GLY B 2 66 ? 4.554 -35.374 -33.463 1.00 150.68 ? 65 GLY H O 1 ATOM 3136 N N . ARG B 2 67 ? 4.731 -34.244 -31.538 1.00 129.74 ? 66 ARG H N 1 ATOM 3137 C CA . ARG B 2 67 ? 3.449 -34.777 -31.126 1.00 122.74 ? 66 ARG H CA 1 ATOM 3138 C C . ARG B 2 67 ? 2.391 -33.751 -30.746 1.00 120.71 ? 66 ARG H C 1 ATOM 3139 O O . ARG B 2 67 ? 1.230 -34.088 -30.517 1.00 125.91 ? 66 ARG H O 1 ATOM 3140 C CB . ARG B 2 67 ? 3.844 -35.655 -29.919 1.00 123.59 ? 66 ARG H CB 1 ATOM 3141 C CG . ARG B 2 67 ? 2.834 -36.687 -29.471 1.00 121.86 ? 66 ARG H CG 1 ATOM 3142 C CD . ARG B 2 67 ? 3.176 -37.371 -28.131 1.00 118.11 ? 66 ARG H CD 1 ATOM 3143 N NE . ARG B 2 67 ? 3.902 -36.554 -27.156 1.00 113.85 ? 66 ARG H NE 1 ATOM 3144 C CZ . ARG B 2 67 ? 3.511 -36.365 -25.893 1.00 111.22 ? 66 ARG H CZ 1 ATOM 3145 N NH1 . ARG B 2 67 ? 2.369 -36.882 -25.452 1.00 106.22 ? 66 ARG H NH1 1 ATOM 3146 N NH2 . ARG B 2 67 ? 4.261 -35.647 -25.067 1.00 113.50 ? 66 ARG H NH2 1 ATOM 3147 N N . VAL B 2 68 ? 2.801 -32.493 -30.674 1.00 118.47 ? 67 VAL H N 1 ATOM 3148 C CA . VAL B 2 68 ? 1.907 -31.371 -30.365 1.00 105.76 ? 67 VAL H CA 1 ATOM 3149 C C . VAL B 2 68 ? 1.566 -30.549 -31.634 1.00 106.73 ? 67 VAL H C 1 ATOM 3150 O O . VAL B 2 68 ? 2.467 -30.284 -32.424 1.00 104.07 ? 67 VAL H O 1 ATOM 3151 C CB . VAL B 2 68 ? 2.474 -30.455 -29.270 1.00 96.11 ? 67 VAL H CB 1 ATOM 3152 C CG1 . VAL B 2 68 ? 3.843 -29.956 -29.672 1.00 106.77 ? 67 VAL H CG1 1 ATOM 3153 C CG2 . VAL B 2 68 ? 1.555 -29.278 -29.042 1.00 81.71 ? 67 VAL H CG2 1 ATOM 3154 N N . THR B 2 69 ? 0.307 -30.186 -31.867 1.00 104.52 ? 68 THR H N 1 ATOM 3155 C CA . THR B 2 69 ? -0.014 -29.306 -32.999 1.00 105.69 ? 68 THR H CA 1 ATOM 3156 C C . THR B 2 69 ? -0.816 -28.108 -32.549 1.00 104.09 ? 68 THR H C 1 ATOM 3157 O O . THR B 2 69 ? -1.938 -28.265 -32.082 1.00 109.85 ? 68 THR H O 1 ATOM 3158 C CB . THR B 2 69 ? -0.870 -29.998 -34.055 1.00 113.22 ? 68 THR H CB 1 ATOM 3159 O OG1 . THR B 2 69 ? -0.171 -31.138 -34.570 1.00 123.47 ? 68 THR H OG1 1 ATOM 3160 C CG2 . THR B 2 69 ? -1.122 -29.058 -35.192 1.00 117.89 ? 68 THR H CG2 1 ATOM 3161 N N . MET B 2 70 ? -0.321 -26.905 -32.811 1.00 103.50 ? 69 MET H N 1 ATOM 3162 C CA . MET B 2 70 ? -1.121 -25.742 -32.467 1.00 105.69 ? 69 MET H CA 1 ATOM 3163 C C . MET B 2 70 ? -1.627 -25.028 -33.719 1.00 104.47 ? 69 MET H C 1 ATOM 3164 O O . MET B 2 70 ? -0.868 -24.764 -34.657 1.00 105.00 ? 69 MET H O 1 ATOM 3165 C CB . MET B 2 70 ? -0.290 -24.808 -31.588 1.00 106.92 ? 69 MET H CB 1 ATOM 3166 C CG . MET B 2 70 ? 0.006 -25.401 -30.216 1.00 102.50 ? 69 MET H CG 1 ATOM 3167 S SD . MET B 2 70 ? 1.229 -24.507 -29.229 1.00 104.65 ? 69 MET H SD 1 ATOM 3168 C CE . MET B 2 70 ? 1.323 -25.536 -27.760 1.00 69.19 ? 69 MET H CE 1 ATOM 3169 N N . THR B 2 71 ? -2.891 -24.621 -33.678 1.00 106.08 ? 70 THR H N 1 ATOM 3170 C CA . THR B 2 71 ? -3.511 -23.955 -34.822 1.00 113.86 ? 70 THR H CA 1 ATOM 3171 C C . THR B 2 71 ? -4.453 -22.899 -34.281 1.00 120.89 ? 70 THR H C 1 ATOM 3172 O O . THR B 2 71 ? -4.559 -22.748 -33.061 1.00 118.02 ? 70 THR H O 1 ATOM 3173 C CB . THR B 2 71 ? -4.301 -24.933 -35.719 1.00 117.14 ? 70 THR H CB 1 ATOM 3174 O OG1 . THR B 2 71 ? -5.307 -25.603 -34.951 1.00 113.16 ? 70 THR H OG1 1 ATOM 3175 C CG2 . THR B 2 71 ? -3.383 -25.959 -36.369 1.00 119.30 ? 70 THR H CG2 1 ATOM 3176 N N . ARG B 2 72 ? -5.039 -22.081 -35.151 1.00 126.01 ? 71 ARG H N 1 ATOM 3177 C CA . ARG B 2 72 ? -6.086 -21.167 -34.689 1.00 122.78 ? 71 ARG H CA 1 ATOM 3178 C C . ARG B 2 72 ? -7.080 -20.898 -35.820 1.00 123.63 ? 71 ARG H C 1 ATOM 3179 O O . ARG B 2 72 ? -6.734 -21.020 -36.994 1.00 123.46 ? 71 ARG H O 1 ATOM 3180 C CB . ARG B 2 72 ? -5.488 -19.868 -34.146 1.00 118.98 ? 71 ARG H CB 1 ATOM 3181 C CG . ARG B 2 72 ? -5.274 -18.814 -35.175 1.00 120.21 ? 71 ARG H CG 1 ATOM 3182 C CD . ARG B 2 72 ? -4.159 -19.241 -36.070 1.00 117.56 ? 71 ARG H CD 1 ATOM 3183 N NE . ARG B 2 72 ? -3.853 -18.241 -37.067 1.00 120.24 ? 71 ARG H NE 1 ATOM 3184 C CZ . ARG B 2 72 ? -3.532 -18.556 -38.304 1.00 122.24 ? 71 ARG H CZ 1 ATOM 3185 N NH1 . ARG B 2 72 ? -3.258 -17.616 -39.191 1.00 130.64 ? 71 ARG H NH1 1 ATOM 3186 N NH2 . ARG B 2 72 ? -3.448 -19.829 -38.632 1.00 128.78 ? 71 ARG H NH2 1 ATOM 3187 N N . ASP B 2 73 ? -8.279 -20.450 -35.456 1.00 129.37 ? 72 ASP H N 1 ATOM 3188 C CA . ASP B 2 73 ? -9.301 -20.030 -36.405 1.00 141.83 ? 72 ASP H CA 1 ATOM 3189 C C . ASP B 2 73 ? -9.703 -18.603 -36.042 1.00 139.32 ? 72 ASP H C 1 ATOM 3190 O O . ASP B 2 73 ? -10.414 -18.367 -35.053 1.00 132.51 ? 72 ASP H O 1 ATOM 3191 C CB . ASP B 2 73 ? -10.514 -20.982 -36.368 1.00 150.38 ? 72 ASP H CB 1 ATOM 3192 C CG . ASP B 2 73 ? -11.607 -20.629 -37.401 1.00 160.70 ? 72 ASP H CG 1 ATOM 3193 O OD1 . ASP B 2 73 ? -11.652 -19.493 -37.925 1.00 163.00 ? 72 ASP H OD1 1 ATOM 3194 O OD2 . ASP B 2 73 ? -12.452 -21.506 -37.680 1.00 164.52 ? 72 ASP H OD2 1 ATOM 3195 N N . THR B 2 74 ? -9.187 -17.658 -36.820 1.00 142.22 ? 73 THR H N 1 ATOM 3196 C CA . THR B 2 74 ? -9.352 -16.239 -36.560 1.00 144.61 ? 73 THR H CA 1 ATOM 3197 C C . THR B 2 74 ? -10.795 -15.792 -36.800 1.00 154.66 ? 73 THR H C 1 ATOM 3198 O O . THR B 2 74 ? -11.247 -14.809 -36.212 1.00 162.62 ? 73 THR H O 1 ATOM 3199 C CB . THR B 2 74 ? -8.424 -15.390 -37.470 1.00 133.42 ? 73 THR H CB 1 ATOM 3200 O OG1 . THR B 2 74 ? -8.692 -15.695 -38.840 1.00 142.86 ? 73 THR H OG1 1 ATOM 3201 C CG2 . THR B 2 74 ? -6.961 -15.667 -37.189 1.00 120.19 ? 73 THR H CG2 1 ATOM 3202 N N . SER B 2 75 ? -11.521 -16.522 -37.645 1.00 153.83 ? 74 SER H N 1 ATOM 3203 C CA . SER B 2 75 ? -12.904 -16.158 -37.955 1.00 153.30 ? 74 SER H CA 1 ATOM 3204 C C . SER B 2 75 ? -13.780 -16.249 -36.722 1.00 141.19 ? 74 SER H C 1 ATOM 3205 O O . SER B 2 75 ? -14.840 -15.627 -36.648 1.00 142.25 ? 74 SER H O 1 ATOM 3206 C CB . SER B 2 75 ? -13.484 -17.073 -39.044 1.00 158.37 ? 74 SER H CB 1 ATOM 3207 O OG . SER B 2 75 ? -12.617 -17.197 -40.160 1.00 162.07 ? 74 SER H OG 1 ATOM 3208 N N . ILE B 2 76 ? -13.346 -17.069 -35.774 1.00 129.57 ? 75 ILE H N 1 ATOM 3209 C CA . ILE B 2 76 ? -14.044 -17.216 -34.514 1.00 125.75 ? 75 ILE H CA 1 ATOM 3210 C C . ILE B 2 76 ? -13.137 -16.992 -33.314 1.00 126.94 ? 75 ILE H C 1 ATOM 3211 O O . ILE B 2 76 ? -13.480 -17.427 -32.223 1.00 127.12 ? 75 ILE H O 1 ATOM 3212 C CB . ILE B 2 76 ? -14.693 -18.601 -34.423 1.00 120.00 ? 75 ILE H CB 1 ATOM 3213 C CG1 . ILE B 2 76 ? -13.655 -19.655 -34.791 1.00 114.82 ? 75 ILE H CG1 1 ATOM 3214 C CG2 . ILE B 2 76 ? -15.847 -18.720 -35.398 1.00 121.44 ? 75 ILE H CG2 1 ATOM 3215 C CD1 . ILE B 2 76 ? -14.055 -21.063 -34.448 1.00 119.24 ? 75 ILE H CD1 1 ATOM 3216 N N . SER B 2 77 ? -12.019 -16.286 -33.506 1.00 128.55 ? 76 SER H N 1 ATOM 3217 C CA . SER B 2 77 ? -11.085 -15.956 -32.413 1.00 123.05 ? 76 SER H CA 1 ATOM 3218 C C . SER B 2 77 ? -10.776 -17.141 -31.478 1.00 108.54 ? 76 SER H C 1 ATOM 3219 O O . SER B 2 77 ? -10.803 -17.001 -30.266 1.00 110.38 ? 76 SER H O 1 ATOM 3220 C CB . SER B 2 77 ? -11.633 -14.779 -31.605 1.00 132.16 ? 76 SER H CB 1 ATOM 3221 O OG . SER B 2 77 ? -11.838 -13.650 -32.442 1.00 145.47 ? 76 SER H OG 1 ATOM 3222 N N . THR B 2 78 ? -10.479 -18.300 -32.057 1.00 103.68 ? 77 THR H N 1 ATOM 3223 C CA . THR B 2 78 ? -10.216 -19.523 -31.297 1.00 96.64 ? 77 THR H CA 1 ATOM 3224 C C . THR B 2 78 ? -8.840 -20.186 -31.530 1.00 99.20 ? 77 THR H C 1 ATOM 3225 O O . THR B 2 78 ? -8.415 -20.301 -32.645 1.00 111.83 ? 77 THR H O 1 ATOM 3226 C CB . THR B 2 78 ? -11.298 -20.588 -31.660 1.00 113.66 ? 77 THR H CB 1 ATOM 3227 O OG1 . THR B 2 78 ? -12.628 -20.063 -31.492 1.00 109.94 ? 77 THR H OG1 1 ATOM 3228 C CG2 . THR B 2 78 ? -11.097 -21.877 -30.870 1.00 112.79 ? 77 THR H CG2 1 ATOM 3229 N N . ALA B 2 79 ? -8.096 -20.540 -30.492 1.00 98.77 ? 78 ALA H N 1 ATOM 3230 C CA . ALA B 2 79 ? -6.845 -21.318 -30.657 1.00 98.18 ? 78 ALA H CA 1 ATOM 3231 C C . ALA B 2 79 ? -7.068 -22.804 -30.368 1.00 94.73 ? 78 ALA H C 1 ATOM 3232 O O . ALA B 2 79 ? -7.970 -23.148 -29.610 1.00 100.50 ? 78 ALA H O 1 ATOM 3233 C CB . ALA B 2 79 ? -5.733 -20.784 -29.771 1.00 98.38 ? 78 ALA H CB 1 ATOM 3234 N N . TYR B 2 80 ? -6.302 -23.695 -30.996 1.00 91.16 ? 79 TYR H N 1 ATOM 3235 C CA . TYR B 2 80 ? -6.538 -25.119 -30.785 1.00 87.50 ? 79 TYR H CA 1 ATOM 3236 C C . TYR B 2 80 ? -5.189 -25.754 -30.489 1.00 89.05 ? 79 TYR H C 1 ATOM 3237 O O . TYR B 2 80 ? -4.185 -25.442 -31.137 1.00 90.72 ? 79 TYR H O 1 ATOM 3238 C CB . TYR B 2 80 ? -7.123 -25.780 -32.034 1.00 88.47 ? 79 TYR H CB 1 ATOM 3239 C CG . TYR B 2 80 ? -8.454 -25.238 -32.462 1.00 98.27 ? 79 TYR H CG 1 ATOM 3240 C CD1 . TYR B 2 80 ? -9.630 -25.654 -31.861 1.00 100.59 ? 79 TYR H CD1 1 ATOM 3241 C CD2 . TYR B 2 80 ? -8.529 -24.298 -33.483 1.00 102.56 ? 79 TYR H CD2 1 ATOM 3242 C CE1 . TYR B 2 80 ? -10.849 -25.139 -32.263 1.00 108.37 ? 79 TYR H CE1 1 ATOM 3243 C CE2 . TYR B 2 80 ? -9.738 -23.779 -33.897 1.00 104.58 ? 79 TYR H CE2 1 ATOM 3244 C CZ . TYR B 2 80 ? -10.894 -24.209 -33.289 1.00 108.79 ? 79 TYR H CZ 1 ATOM 3245 O OH . TYR B 2 80 ? -12.096 -23.691 -33.701 1.00 111.08 ? 79 TYR H OH 1 ATOM 3246 N N . MET B 2 81 ? -5.192 -26.704 -29.564 1.00 89.07 ? 80 MET H N 1 ATOM 3247 C CA . MET B 2 81 ? -4.017 -27.509 -29.253 1.00 93.45 ? 80 MET H CA 1 ATOM 3248 C C . MET B 2 81 ? -4.362 -28.990 -29.371 1.00 93.55 ? 80 MET H C 1 ATOM 3249 O O . MET B 2 81 ? -5.321 -29.446 -28.761 1.00 100.15 ? 80 MET H O 1 ATOM 3250 C CB . MET B 2 81 ? -3.496 -27.128 -27.859 1.00 102.97 ? 80 MET H CB 1 ATOM 3251 C CG . MET B 2 81 ? -2.189 -27.771 -27.337 1.00 108.40 ? 80 MET H CG 1 ATOM 3252 S SD . MET B 2 81 ? -2.211 -29.530 -26.931 1.00 111.01 ? 80 MET H SD 1 ATOM 3253 C CE . MET B 2 81 ? -3.487 -29.531 -25.675 1.00 101.43 ? 80 MET H CE 1 ATOM 3254 N N . GLU B 2 82 ? -3.688 -29.715 -30.248 1.00 88.69 ? 81 GLU H N 1 ATOM 3255 C CA . GLU B 2 82 ? -3.910 -31.152 -30.368 1.00 93.90 ? 81 GLU H CA 1 ATOM 3256 C C . GLU B 2 82 ? -2.703 -31.938 -29.881 1.00 103.11 ? 81 GLU H C 1 ATOM 3257 O O . GLU B 2 82 ? -1.581 -31.642 -30.274 1.00 109.45 ? 81 GLU H O 1 ATOM 3258 C CB . GLU B 2 82 ? -4.268 -31.570 -31.786 1.00 103.23 ? 81 GLU H CB 1 ATOM 3259 C CG . GLU B 2 82 ? -4.495 -33.059 -31.900 1.00 107.02 ? 81 GLU H CG 1 ATOM 3260 C CD . GLU B 2 82 ? -5.077 -33.426 -33.234 1.00 119.56 ? 81 GLU H CD 1 ATOM 3261 O OE1 . GLU B 2 82 ? -4.855 -32.638 -34.162 1.00 124.28 ? 81 GLU H OE1 1 ATOM 3262 O OE2 . GLU B 2 82 ? -5.769 -34.469 -33.360 1.00 123.99 ? 81 GLU H OE2 1 ATOM 3263 N N . LEU B 2 83 ? -2.907 -32.887 -28.975 1.00 100.52 ? 82 LEU H N 1 ATOM 3264 C CA . LEU B 2 83 ? -1.789 -33.712 -28.514 1.00 97.20 ? 82 LEU H CA 1 ATOM 3265 C C . LEU B 2 83 ? -2.075 -35.152 -28.938 1.00 104.75 ? 82 LEU H C 1 ATOM 3266 O O . LEU B 2 83 ? -3.122 -35.719 -28.620 1.00 114.37 ? 82 LEU H O 1 ATOM 3267 C CB . LEU B 2 83 ? -1.579 -33.578 -27.002 1.00 96.32 ? 82 LEU H CB 1 ATOM 3268 C CG . LEU B 2 83 ? -0.382 -34.354 -26.448 1.00 97.41 ? 82 LEU H CG 1 ATOM 3269 C CD1 . LEU B 2 83 ? 0.902 -33.846 -27.105 1.00 96.73 ? 82 LEU H CD1 1 ATOM 3270 C CD2 . LEU B 2 83 ? -0.299 -34.167 -24.950 1.00 85.70 ? 82 LEU H CD2 1 ATOM 3271 N N . SER B 2 84 A -1.174 -35.697 -29.748 1.00 106.67 ? 82 SER H N 1 ATOM 3272 C CA . SER B 2 84 A -1.344 -37.025 -30.330 1.00 117.34 ? 82 SER H CA 1 ATOM 3273 C C . SER B 2 84 A -0.607 -38.111 -29.577 1.00 119.73 ? 82 SER H C 1 ATOM 3274 O O . SER B 2 84 A 0.214 -37.814 -28.712 1.00 115.35 ? 82 SER H O 1 ATOM 3275 C CB . SER B 2 84 A -0.834 -37.014 -31.770 1.00 122.81 ? 82 SER H CB 1 ATOM 3276 O OG . SER B 2 84 A -1.522 -36.057 -32.547 1.00 129.77 ? 82 SER H OG 1 ATOM 3277 N N . ARG B 2 85 B -0.947 -39.366 -29.872 1.00 117.82 ? 82 ARG H N 1 ATOM 3278 C CA . ARG B 2 85 B -0.247 -40.513 -29.309 1.00 116.91 ? 82 ARG H CA 1 ATOM 3279 C C . ARG B 2 85 B -0.143 -40.398 -27.799 1.00 120.67 ? 82 ARG H C 1 ATOM 3280 O O . ARG B 2 85 B 0.956 -40.380 -27.230 1.00 123.54 ? 82 ARG H O 1 ATOM 3281 C CB . ARG B 2 85 B 1.128 -40.684 -29.930 1.00 117.25 ? 82 ARG H CB 1 ATOM 3282 C CG . ARG B 2 85 B 1.086 -40.890 -31.412 1.00 128.38 ? 82 ARG H CG 1 ATOM 3283 C CD . ARG B 2 85 B 2.348 -41.608 -31.835 1.00 141.62 ? 82 ARG H CD 1 ATOM 3284 N NE . ARG B 2 85 B 3.544 -41.006 -31.258 1.00 144.21 ? 82 ARG H NE 1 ATOM 3285 C CZ . ARG B 2 85 B 4.121 -39.898 -31.710 1.00 147.28 ? 82 ARG H CZ 1 ATOM 3286 N NH1 . ARG B 2 85 B 3.645 -39.285 -32.788 1.00 149.78 ? 82 ARG H NH1 1 ATOM 3287 N NH2 . ARG B 2 85 B 5.213 -39.441 -31.114 1.00 148.74 ? 82 ARG H NH2 1 ATOM 3288 N N . LEU B 2 86 C -1.292 -40.244 -27.159 1.00 115.82 ? 82 LEU H N 1 ATOM 3289 C CA . LEU B 2 86 C -1.319 -39.945 -25.748 1.00 109.41 ? 82 LEU H CA 1 ATOM 3290 C C . LEU B 2 86 C -0.732 -41.041 -24.875 1.00 116.74 ? 82 LEU H C 1 ATOM 3291 O O . LEU B 2 86 C -0.904 -42.238 -25.128 1.00 118.32 ? 82 LEU H O 1 ATOM 3292 C CB . LEU B 2 86 C -2.754 -39.669 -25.328 1.00 104.11 ? 82 LEU H CB 1 ATOM 3293 C CG . LEU B 2 86 C -3.196 -38.331 -25.912 1.00 100.25 ? 82 LEU H CG 1 ATOM 3294 C CD1 . LEU B 2 86 C -4.706 -38.179 -25.835 1.00 100.37 ? 82 LEU H CD1 1 ATOM 3295 C CD2 . LEU B 2 86 C -2.478 -37.180 -25.230 1.00 97.70 ? 82 LEU H CD2 1 ATOM 3296 N N . ARG B 2 87 ? -0.040 -40.617 -23.834 1.00 118.03 ? 83 ARG H N 1 ATOM 3297 C CA . ARG B 2 87 ? 0.491 -41.545 -22.878 1.00 117.38 ? 83 ARG H CA 1 ATOM 3298 C C . ARG B 2 87 ? -0.240 -41.244 -21.607 1.00 119.94 ? 83 ARG H C 1 ATOM 3299 O O . ARG B 2 87 ? -0.773 -40.156 -21.438 1.00 124.57 ? 83 ARG H O 1 ATOM 3300 C CB . ARG B 2 87 ? 2.001 -41.446 -22.723 0.00 127.71 ? 83 ARG H CB 1 ATOM 3301 C CG . ARG B 2 87 ? 2.709 -41.844 -23.999 0.00 138.43 ? 83 ARG H CG 1 ATOM 3302 C CD . ARG B 2 87 ? 3.908 -40.969 -24.295 0.00 144.87 ? 83 ARG H CD 1 ATOM 3303 N NE . ARG B 2 87 ? 4.859 -41.131 -23.200 0.00 153.03 ? 83 ARG H NE 1 ATOM 3304 C CZ . ARG B 2 87 ? 5.753 -42.119 -23.142 0.00 163.86 ? 83 ARG H CZ 1 ATOM 3305 N NH1 . ARG B 2 87 ? 5.806 -43.033 -24.109 0.00 169.87 ? 83 ARG H NH1 1 ATOM 3306 N NH2 . ARG B 2 87 ? 6.588 -42.209 -22.114 0.00 167.73 ? 83 ARG H NH2 1 ATOM 3307 N N . SER B 2 88 ? -0.303 -42.222 -20.729 1.00 123.78 ? 84 SER H N 1 ATOM 3308 C CA . SER B 2 88 ? -0.944 -42.036 -19.450 1.00 122.44 ? 84 SER H CA 1 ATOM 3309 C C . SER B 2 88 ? -0.392 -40.856 -18.638 1.00 123.69 ? 84 SER H C 1 ATOM 3310 O O . SER B 2 88 ? -1.182 -40.127 -18.049 1.00 120.33 ? 84 SER H O 1 ATOM 3311 C CB . SER B 2 88 ? -0.856 -43.344 -18.662 1.00 122.59 ? 84 SER H CB 1 ATOM 3312 O OG . SER B 2 88 ? 0.481 -43.804 -18.613 1.00 124.05 ? 84 SER H OG 1 ATOM 3313 N N . ASP B 2 89 ? 0.917 -40.597 -18.662 1.00 127.16 ? 85 ASP H N 1 ATOM 3314 C CA . ASP B 2 89 ? 1.425 -39.411 -17.945 1.00 131.50 ? 85 ASP H CA 1 ATOM 3315 C C . ASP B 2 89 ? 1.154 -38.072 -18.635 1.00 124.19 ? 85 ASP H C 1 ATOM 3316 O O . ASP B 2 89 ? 1.625 -37.025 -18.187 1.00 124.37 ? 85 ASP H O 1 ATOM 3317 C CB . ASP B 2 89 ? 2.930 -39.551 -17.621 1.00 141.99 ? 85 ASP H CB 1 ATOM 3318 C CG . ASP B 2 89 ? 3.841 -39.484 -18.847 1.00 151.74 ? 85 ASP H CG 1 ATOM 3319 O OD1 . ASP B 2 89 ? 3.429 -39.019 -19.927 1.00 157.09 ? 85 ASP H OD1 1 ATOM 3320 O OD2 . ASP B 2 89 ? 5.020 -39.870 -18.712 1.00 157.88 ? 85 ASP H OD2 1 ATOM 3321 N N . ASP B 2 90 ? 0.390 -38.115 -19.718 1.00 121.91 ? 86 ASP H N 1 ATOM 3322 C CA . ASP B 2 90 ? -0.194 -36.914 -20.294 1.00 119.87 ? 86 ASP H CA 1 ATOM 3323 C C . ASP B 2 90 ? -1.501 -36.533 -19.582 1.00 124.88 ? 86 ASP H C 1 ATOM 3324 O O . ASP B 2 90 ? -2.124 -35.510 -19.905 1.00 111.07 ? 86 ASP H O 1 ATOM 3325 C CB . ASP B 2 90 ? -0.424 -37.102 -21.804 1.00 118.13 ? 86 ASP H CB 1 ATOM 3326 C CG . ASP B 2 90 ? 0.887 -37.179 -22.603 1.00 117.48 ? 86 ASP H CG 1 ATOM 3327 O OD1 . ASP B 2 90 ? 1.848 -36.444 -22.283 1.00 114.45 ? 86 ASP H OD1 1 ATOM 3328 O OD2 . ASP B 2 90 ? 0.948 -37.960 -23.579 1.00 119.68 ? 86 ASP H OD2 1 ATOM 3329 N N . THR B 2 91 ? -1.908 -37.350 -18.608 1.00 150.18 ? 87 THR H N 1 ATOM 3330 C CA . THR B 2 91 ? -3.068 -37.016 -17.785 1.00 96.81 ? 87 THR H CA 1 ATOM 3331 C C . THR B 2 91 ? -2.714 -35.728 -17.098 1.00 89.61 ? 87 THR H C 1 ATOM 3332 O O . THR B 2 91 ? -1.734 -35.676 -16.355 1.00 104.12 ? 87 THR H O 1 ATOM 3333 C CB . THR B 2 91 ? -3.369 -38.067 -16.723 1.00 113.86 ? 87 THR H CB 1 ATOM 3334 O OG1 . THR B 2 91 ? -2.134 -38.514 -16.154 1.00 126.10 ? 87 THR H OG1 1 ATOM 3335 C CG2 . THR B 2 91 ? -4.061 -39.231 -17.309 1.00 113.34 ? 87 THR H CG2 1 ATOM 3336 N N . ALA B 2 92 ? -3.545 -34.712 -17.298 1.00 140.77 ? 88 ALA H N 1 ATOM 3337 C CA . ALA B 2 92 ? -3.222 -33.378 -16.822 1.00 118.75 ? 88 ALA H CA 1 ATOM 3338 C C . ALA B 2 92 ? -4.325 -32.367 -17.073 1.00 105.21 ? 88 ALA H C 1 ATOM 3339 O O . ALA B 2 92 ? -5.295 -32.638 -17.794 1.00 91.33 ? 88 ALA H O 1 ATOM 3340 C CB . ALA B 2 92 ? -1.938 -32.893 -17.496 1.00 114.60 ? 88 ALA H CB 1 ATOM 3341 N N . VAL B 2 93 ? -4.206 -31.212 -16.420 1.00 110.02 ? 89 VAL H N 1 ATOM 3342 C CA . VAL B 2 93 ? -5.024 -30.091 -16.845 1.00 110.48 ? 89 VAL H CA 1 ATOM 3343 C C . VAL B 2 93 ? -4.235 -29.278 -17.894 1.00 110.61 ? 89 VAL H C 1 ATOM 3344 O O . VAL B 2 93 ? -3.054 -28.927 -17.693 1.00 114.77 ? 89 VAL H O 1 ATOM 3345 C CB . VAL B 2 93 ? -5.426 -29.199 -15.658 1.00 102.72 ? 89 VAL H CB 1 ATOM 3346 C CG1 . VAL B 2 93 ? -6.268 -28.034 -16.143 1.00 93.32 ? 89 VAL H CG1 1 ATOM 3347 C CG2 . VAL B 2 93 ? -6.232 -30.001 -14.694 1.00 100.83 ? 89 VAL H CG2 1 ATOM 3348 N N . TYR B 2 94 ? -4.860 -29.060 -19.045 1.00 100.31 ? 90 TYR H N 1 ATOM 3349 C CA . TYR B 2 94 ? -4.236 -28.284 -20.103 1.00 97.25 ? 90 TYR H CA 1 ATOM 3350 C C . TYR B 2 94 ? -4.887 -26.915 -20.118 1.00 102.90 ? 90 TYR H C 1 ATOM 3351 O O . TYR B 2 94 ? -6.123 -26.830 -20.188 1.00 112.38 ? 90 TYR H O 1 ATOM 3352 C CB . TYR B 2 94 ? -4.355 -29.003 -21.468 1.00 101.35 ? 90 TYR H CB 1 ATOM 3353 C CG . TYR B 2 94 ? -3.514 -30.267 -21.513 1.00 102.17 ? 90 TYR H CG 1 ATOM 3354 C CD1 . TYR B 2 94 ? -3.949 -31.443 -20.872 1.00 100.77 ? 90 TYR H CD1 1 ATOM 3355 C CD2 . TYR B 2 94 ? -2.270 -30.276 -22.145 1.00 101.18 ? 90 TYR H CD2 1 ATOM 3356 C CE1 . TYR B 2 94 ? -3.176 -32.594 -20.859 1.00 100.63 ? 90 TYR H CE1 1 ATOM 3357 C CE2 . TYR B 2 94 ? -1.487 -31.422 -22.137 1.00 107.31 ? 90 TYR H CE2 1 ATOM 3358 C CZ . TYR B 2 94 ? -1.944 -32.583 -21.492 1.00 103.40 ? 90 TYR H CZ 1 ATOM 3359 O OH . TYR B 2 94 ? -1.175 -33.728 -21.498 1.00 97.29 ? 90 TYR H OH 1 ATOM 3360 N N . TYR B 2 95 ? -4.068 -25.862 -20.037 1.00 97.73 ? 91 TYR H N 1 ATOM 3361 C CA . TYR B 2 95 ? -4.531 -24.465 -20.046 1.00 97.23 ? 91 TYR H CA 1 ATOM 3362 C C . TYR B 2 95 ? -4.012 -23.684 -21.248 1.00 93.99 ? 91 TYR H C 1 ATOM 3363 O O . TYR B 2 95 ? -2.854 -23.851 -21.631 1.00 88.27 ? 91 TYR H O 1 ATOM 3364 C CB . TYR B 2 95 ? -4.117 -23.685 -18.787 1.00 100.66 ? 91 TYR H CB 1 ATOM 3365 C CG . TYR B 2 95 ? -4.641 -24.161 -17.460 1.00 103.67 ? 91 TYR H CG 1 ATOM 3366 C CD1 . TYR B 2 95 ? -5.898 -23.773 -17.028 1.00 106.00 ? 91 TYR H CD1 1 ATOM 3367 C CD2 . TYR B 2 95 ? -3.813 -24.825 -16.557 1.00 100.85 ? 91 TYR H CD2 1 ATOM 3368 C CE1 . TYR B 2 95 ? -6.379 -24.160 -15.781 1.00 104.86 ? 91 TYR H CE1 1 ATOM 3369 C CE2 . TYR B 2 95 ? -4.274 -25.204 -15.291 1.00 96.37 ? 91 TYR H CE2 1 ATOM 3370 C CZ . TYR B 2 95 ? -5.562 -24.859 -14.901 1.00 100.35 ? 91 TYR H CZ 1 ATOM 3371 O OH . TYR B 2 95 ? -6.053 -25.218 -13.655 1.00 104.40 ? 91 TYR H OH 1 ATOM 3372 N N . CYS B 2 96 ? -4.780 -22.712 -21.727 1.00 90.58 ? 92 CYS H N 1 ATOM 3373 C CA . CYS B 2 96 ? -4.229 -21.713 -22.644 1.00 99.36 ? 92 CYS H CA 1 ATOM 3374 C C . CYS B 2 96 ? -4.060 -20.364 -21.950 1.00 106.70 ? 92 CYS H C 1 ATOM 3375 O O . CYS B 2 96 ? -4.892 -19.988 -21.143 1.00 112.64 ? 92 CYS H O 1 ATOM 3376 C CB . CYS B 2 96 ? -5.071 -21.579 -23.914 1.00 94.86 ? 92 CYS H CB 1 ATOM 3377 S SG . CYS B 2 96 ? -6.686 -20.796 -23.761 1.00 113.71 ? 92 CYS H SG 1 ATOM 3378 N N . ALA B 2 97 ? -2.967 -19.671 -22.237 1.00 108.49 ? 93 ALA H N 1 ATOM 3379 C CA . ALA B 2 97 ? -2.635 -18.459 -21.516 1.00 99.68 ? 93 ALA H CA 1 ATOM 3380 C C . ALA B 2 97 ? -2.138 -17.358 -22.432 1.00 102.20 ? 93 ALA H C 1 ATOM 3381 O O . ALA B 2 97 ? -1.609 -17.625 -23.498 1.00 103.05 ? 93 ALA H O 1 ATOM 3382 C CB . ALA B 2 97 ? -1.592 -18.765 -20.467 1.00 98.51 ? 93 ALA H CB 1 ATOM 3383 N N . ARG B 2 98 ? -2.295 -16.118 -21.989 1.00 106.84 ? 94 ARG H N 1 ATOM 3384 C CA . ARG B 2 98 ? -1.954 -14.955 -22.791 1.00 110.37 ? 94 ARG H CA 1 ATOM 3385 C C . ARG B 2 98 ? -1.128 -13.946 -21.999 1.00 129.39 ? 94 ARG H C 1 ATOM 3386 O O . ARG B 2 98 ? -1.247 -13.852 -20.790 1.00 114.88 ? 94 ARG H O 1 ATOM 3387 C CB . ARG B 2 98 ? -3.234 -14.301 -23.308 1.00 117.60 ? 94 ARG H CB 1 ATOM 3388 C CG . ARG B 2 98 ? -3.024 -13.264 -24.392 1.00 118.49 ? 94 ARG H CG 1 ATOM 3389 C CD . ARG B 2 98 ? -2.655 -11.927 -23.782 1.00 144.68 ? 94 ARG H CD 1 ATOM 3390 N NE . ARG B 2 98 ? -3.615 -10.876 -24.104 1.00 147.19 ? 94 ARG H NE 1 ATOM 3391 C CZ . ARG B 2 98 ? -3.701 -9.726 -23.447 1.00 150.08 ? 94 ARG H CZ 1 ATOM 3392 N NH1 . ARG B 2 98 ? -2.888 -9.484 -22.432 1.00 149.00 ? 94 ARG H NH1 1 ATOM 3393 N NH2 . ARG B 2 98 ? -4.598 -8.820 -23.803 1.00 141.88 ? 94 ARG H NH2 1 ATOM 3394 N N . GLY B 2 99 ? -0.300 -13.187 -22.702 1.00 134.64 ? 95 GLY H N 1 ATOM 3395 C CA . GLY B 2 99 ? 0.596 -12.228 -22.083 1.00 133.22 ? 95 GLY H CA 1 ATOM 3396 C C . GLY B 2 99 ? -0.095 -11.019 -21.491 1.00 137.12 ? 95 GLY H C 1 ATOM 3397 O O . GLY B 2 99 ? -1.213 -10.687 -21.858 1.00 127.63 ? 95 GLY H O 1 ATOM 3398 N N . LYS B 2 100 ? 0.571 -10.372 -20.543 1.00 141.30 ? 96 LYS H N 1 ATOM 3399 C CA . LYS B 2 100 ? -0.010 -9.245 -19.829 1.00 141.57 ? 96 LYS H CA 1 ATOM 3400 C C . LYS B 2 100 ? -0.298 -8.063 -20.729 1.00 147.33 ? 96 LYS H C 1 ATOM 3401 O O . LYS B 2 100 ? 0.521 -7.695 -21.563 1.00 140.15 ? 96 LYS H O 1 ATOM 3402 C CB . LYS B 2 100 ? 0.929 -8.794 -18.715 1.00 141.16 ? 96 LYS H CB 1 ATOM 3403 C CG . LYS B 2 100 ? 0.213 -8.232 -17.502 1.00 143.29 ? 96 LYS H CG 1 ATOM 3404 C CD . LYS B 2 100 ? 0.869 -6.954 -17.012 1.00 146.65 ? 96 LYS H CD 1 ATOM 3405 C CE . LYS B 2 100 ? -0.112 -6.111 -16.216 1.00 174.41 ? 96 LYS H CE 1 ATOM 3406 N NZ . LYS B 2 100 ? -1.127 -6.937 -15.507 1.00 168.13 ? 96 LYS H NZ 1 ATOM 3407 N N . TYR B 2 101 ? -1.459 -7.452 -20.529 1.00 162.14 ? 97 TYR H N 1 ATOM 3408 C CA . TYR B 2 101 ? -1.853 -6.287 -21.302 1.00 178.06 ? 97 TYR H CA 1 ATOM 3409 C C . TYR B 2 101 ? -0.954 -5.114 -20.984 1.00 191.76 ? 97 TYR H C 1 ATOM 3410 O O . TYR B 2 101 ? -0.561 -4.924 -19.843 1.00 197.15 ? 97 TYR H O 1 ATOM 3411 C CB . TYR B 2 101 ? -3.301 -5.906 -21.008 1.00 186.98 ? 97 TYR H CB 1 ATOM 3412 C CG . TYR B 2 101 ? -3.735 -4.643 -21.714 1.00 203.42 ? 97 TYR H CG 1 ATOM 3413 C CD1 . TYR B 2 101 ? -4.048 -4.650 -23.067 1.00 207.19 ? 97 TYR H CD1 1 ATOM 3414 C CD2 . TYR B 2 101 ? -3.825 -3.439 -21.031 1.00 210.95 ? 97 TYR H CD2 1 ATOM 3415 C CE1 . TYR B 2 101 ? -4.442 -3.494 -23.717 1.00 215.15 ? 97 TYR H CE1 1 ATOM 3416 C CE2 . TYR B 2 101 ? -4.216 -2.280 -21.673 1.00 217.58 ? 97 TYR H CE2 1 ATOM 3417 C CZ . TYR B 2 101 ? -4.525 -2.313 -23.014 1.00 218.42 ? 97 TYR H CZ 1 ATOM 3418 O OH . TYR B 2 101 ? -4.916 -1.160 -23.654 1.00 223.57 ? 97 TYR H OH 1 ATOM 3419 N N . CYS B 2 102 ? -0.631 -4.321 -21.994 1.00 200.94 ? 98 CYS H N 1 ATOM 3420 C CA . CYS B 2 102 ? 0.191 -3.140 -21.788 1.00 210.34 ? 98 CYS H CA 1 ATOM 3421 C C . CYS B 2 102 ? -0.022 -2.124 -22.905 1.00 213.12 ? 98 CYS H C 1 ATOM 3422 O O . CYS B 2 102 ? -1.127 -1.615 -23.094 1.00 212.50 ? 98 CYS H O 1 ATOM 3423 C CB . CYS B 2 102 ? 1.668 -3.524 -21.694 1.00 210.16 ? 98 CYS H CB 1 ATOM 3424 S SG . CYS B 2 102 ? 1.984 -5.142 -20.958 1.00 185.85 ? 98 CYS H SG 1 ATOM 3425 N N . TYR B 2 107 D 4.970 -5.296 -24.864 1.00 179.46 ? 99 TYR H N 1 ATOM 3426 C CA . TYR B 2 107 D 4.719 -6.125 -23.695 1.00 176.86 ? 99 TYR H CA 1 ATOM 3427 C C . TYR B 2 107 D 5.717 -7.268 -23.620 1.00 170.25 ? 99 TYR H C 1 ATOM 3428 O O . TYR B 2 107 D 6.251 -7.711 -24.632 1.00 160.35 ? 99 TYR H O 1 ATOM 3429 C CB . TYR B 2 107 D 3.303 -6.688 -23.740 1.00 173.52 ? 99 TYR H CB 1 ATOM 3430 C CG . TYR B 2 107 D 3.057 -7.600 -24.913 1.00 162.08 ? 99 TYR H CG 1 ATOM 3431 C CD1 . TYR B 2 107 D 3.309 -8.958 -24.824 1.00 152.95 ? 99 TYR H CD1 1 ATOM 3432 C CD2 . TYR B 2 107 D 2.576 -7.106 -26.111 1.00 167.29 ? 99 TYR H CD2 1 ATOM 3433 C CE1 . TYR B 2 107 D 3.086 -9.798 -25.892 1.00 152.11 ? 99 TYR H CE1 1 ATOM 3434 C CE2 . TYR B 2 107 D 2.351 -7.939 -27.186 1.00 166.89 ? 99 TYR H CE2 1 ATOM 3435 C CZ . TYR B 2 107 D 2.609 -9.285 -27.068 1.00 159.25 ? 99 TYR H CZ 1 ATOM 3436 O OH . TYR B 2 107 D 2.392 -10.127 -28.130 1.00 154.52 ? 99 TYR H OH 1 ATOM 3437 N N . TYR B 2 108 ? 5.984 -7.733 -22.403 1.00 171.00 ? 100 TYR H N 1 ATOM 3438 C CA . TYR B 2 108 ? 6.916 -8.837 -22.190 1.00 163.95 ? 100 TYR H CA 1 ATOM 3439 C C . TYR B 2 108 ? 6.410 -10.118 -22.844 1.00 160.49 ? 100 TYR H C 1 ATOM 3440 O O . TYR B 2 108 ? 7.179 -10.868 -23.446 1.00 164.54 ? 100 TYR H O 1 ATOM 3441 C CB . TYR B 2 108 ? 7.144 -9.064 -20.694 1.00 159.13 ? 100 TYR H CB 1 ATOM 3442 C CG . TYR B 2 108 ? 8.153 -10.147 -20.386 1.00 159.71 ? 100 TYR H CG 1 ATOM 3443 C CD1 . TYR B 2 108 ? 9.218 -10.395 -21.243 1.00 163.93 ? 100 TYR H CD1 1 ATOM 3444 C CD2 . TYR B 2 108 ? 8.042 -10.921 -19.239 1.00 157.89 ? 100 TYR H CD2 1 ATOM 3445 C CE1 . TYR B 2 108 ? 10.143 -11.384 -20.965 1.00 163.42 ? 100 TYR H CE1 1 ATOM 3446 C CE2 . TYR B 2 108 ? 8.962 -11.911 -18.953 1.00 158.48 ? 100 TYR H CE2 1 ATOM 3447 C CZ . TYR B 2 108 ? 10.010 -12.139 -19.819 1.00 160.62 ? 100 TYR H CZ 1 ATOM 3448 O OH . TYR B 2 108 ? 10.929 -13.124 -19.539 1.00 162.25 ? 100 TYR H OH 1 ATOM 3449 N N . ASN B 2 109 ? 5.109 -10.358 -22.722 1.00 155.17 ? 101 ASN H N 1 ATOM 3450 C CA . ASN B 2 109 ? 4.474 -11.518 -23.324 1.00 148.81 ? 101 ASN H CA 1 ATOM 3451 C C . ASN B 2 109 ? 4.643 -12.861 -22.640 1.00 140.11 ? 101 ASN H C 1 ATOM 3452 O O . ASN B 2 109 ? 4.372 -13.893 -23.236 1.00 142.96 ? 101 ASN H O 1 ATOM 3453 C CB . ASN B 2 109 ? 5.032 -11.678 -24.738 1.00 147.23 ? 101 ASN H CB 1 ATOM 3454 C CG . ASN B 2 109 ? 4.293 -12.729 -25.534 1.00 135.49 ? 101 ASN H CG 1 ATOM 3455 O OD1 . ASN B 2 109 ? 4.681 -13.891 -25.552 1.00 123.78 ? 101 ASN H OD1 1 ATOM 3456 N ND2 . ASN B 2 109 ? 3.208 -12.330 -26.177 1.00 134.20 ? 101 ASN H ND2 1 ATOM 3457 N N . TRP B 2 110 ? 5.060 -12.859 -21.384 1.00 135.36 ? 102 TRP H N 1 ATOM 3458 C CA . TRP B 2 110 ? 5.224 -14.110 -20.663 1.00 134.36 ? 102 TRP H CA 1 ATOM 3459 C C . TRP B 2 110 ? 4.461 -14.001 -19.366 1.00 135.72 ? 102 TRP H C 1 ATOM 3460 O O . TRP B 2 110 ? 3.952 -14.979 -18.834 1.00 128.20 ? 102 TRP H O 1 ATOM 3461 C CB . TRP B 2 110 ? 6.666 -14.414 -20.298 1.00 132.56 ? 102 TRP H CB 1 ATOM 3462 C CG . TRP B 2 110 ? 7.421 -15.067 -21.379 1.00 127.70 ? 102 TRP H CG 1 ATOM 3463 C CD1 . TRP B 2 110 ? 8.560 -14.622 -21.949 1.00 125.23 ? 102 TRP H CD1 1 ATOM 3464 C CD2 . TRP B 2 110 ? 7.100 -16.297 -22.024 1.00 121.54 ? 102 TRP H CD2 1 ATOM 3465 N NE1 . TRP B 2 110 ? 8.974 -15.492 -22.918 1.00 122.13 ? 102 TRP H NE1 1 ATOM 3466 C CE2 . TRP B 2 110 ? 8.092 -16.534 -22.980 1.00 122.30 ? 102 TRP H CE2 1 ATOM 3467 C CE3 . TRP B 2 110 ? 6.067 -17.221 -21.886 1.00 110.03 ? 102 TRP H CE3 1 ATOM 3468 C CZ2 . TRP B 2 110 ? 8.086 -17.650 -23.796 1.00 116.78 ? 102 TRP H CZ2 1 ATOM 3469 C CZ3 . TRP B 2 110 ? 6.063 -18.329 -22.698 1.00 104.17 ? 102 TRP H CZ3 1 ATOM 3470 C CH2 . TRP B 2 110 ? 7.064 -18.535 -23.639 1.00 103.93 ? 102 TRP H CH2 1 ATOM 3471 N N . ASP B 2 111 ? 4.381 -12.792 -18.855 1.00 138.83 ? 103 ASP H N 1 ATOM 3472 C CA . ASP B 2 111 ? 3.753 -12.589 -17.591 1.00 131.20 ? 103 ASP H CA 1 ATOM 3473 C C . ASP B 2 111 ? 2.331 -13.005 -17.864 1.00 123.60 ? 103 ASP H C 1 ATOM 3474 O O . ASP B 2 111 ? 1.581 -12.276 -18.492 1.00 124.16 ? 103 ASP H O 1 ATOM 3475 C CB . ASP B 2 111 ? 3.861 -11.130 -17.167 1.00 141.97 ? 103 ASP H CB 1 ATOM 3476 C CG . ASP B 2 111 ? 5.270 -10.752 -16.751 1.00 151.63 ? 103 ASP H CG 1 ATOM 3477 O OD1 . ASP B 2 111 ? 5.963 -11.599 -16.145 1.00 162.97 ? 103 ASP H OD1 1 ATOM 3478 O OD2 . ASP B 2 111 ? 5.684 -9.606 -17.033 1.00 147.70 ? 103 ASP H OD2 1 ATOM 3479 N N . PHE B 2 112 ? 1.922 -14.120 -17.305 1.00 115.37 ? 104 PHE H N 1 ATOM 3480 C CA . PHE B 2 112 ? 0.634 -14.681 -17.653 1.00 113.56 ? 104 PHE H CA 1 ATOM 3481 C C . PHE B 2 112 ? -0.551 -14.199 -16.830 1.00 117.55 ? 104 PHE H C 1 ATOM 3482 O O . PHE B 2 112 ? -0.951 -14.787 -15.835 1.00 132.34 ? 104 PHE H O 1 ATOM 3483 C CB . PHE B 2 112 ? 0.692 -16.198 -17.729 1.00 123.64 ? 104 PHE H CB 1 ATOM 3484 C CG . PHE B 2 112 ? 1.743 -16.718 -18.680 1.00 119.23 ? 104 PHE H CG 1 ATOM 3485 C CD1 . PHE B 2 112 ? 1.898 -16.110 -19.936 1.00 115.44 ? 104 PHE H CD1 1 ATOM 3486 C CD2 . PHE B 2 112 ? 2.482 -17.867 -18.396 1.00 119.51 ? 104 PHE H CD2 1 ATOM 3487 C CE1 . PHE B 2 112 ? 2.830 -16.582 -20.872 1.00 108.80 ? 104 PHE H CE1 1 ATOM 3488 C CE2 . PHE B 2 112 ? 3.408 -18.361 -19.320 1.00 98.69 ? 104 PHE H CE2 1 ATOM 3489 C CZ . PHE B 2 112 ? 3.581 -17.715 -20.569 1.00 107.45 ? 104 PHE H CZ 1 ATOM 3490 N N . GLN B 2 113 ? -1.147 -13.144 -17.349 1.00 121.30 ? 105 GLN H N 1 ATOM 3491 C CA . GLN B 2 113 ? -2.159 -12.320 -16.719 1.00 129.90 ? 105 GLN H CA 1 ATOM 3492 C C . GLN B 2 113 ? -3.502 -13.008 -16.878 1.00 125.91 ? 105 GLN H C 1 ATOM 3493 O O . GLN B 2 113 ? -4.337 -12.956 -15.975 1.00 129.17 ? 105 GLN H O 1 ATOM 3494 C CB . GLN B 2 113 ? -2.178 -10.929 -17.367 1.00 139.66 ? 105 GLN H CB 1 ATOM 3495 C CG . GLN B 2 113 ? -3.210 -9.933 -16.839 1.00 146.00 ? 105 GLN H CG 1 ATOM 3496 C CD . GLN B 2 113 ? -3.368 -9.946 -15.341 1.00 145.25 ? 105 GLN H CD 1 ATOM 3497 O OE1 . GLN B 2 113 ? -2.391 -9.953 -14.599 1.00 149.84 ? 105 GLN H OE1 1 ATOM 3498 N NE2 . GLN B 2 113 ? -4.613 -9.947 -14.886 1.00 145.08 ? 105 GLN H NE2 1 ATOM 3499 N N . HIS B 2 114 ? -3.701 -13.682 -18.009 1.00 125.98 ? 106 HIS H N 1 ATOM 3500 C CA . HIS B 2 114 ? -4.994 -14.285 -18.271 1.00 121.67 ? 106 HIS H CA 1 ATOM 3501 C C . HIS B 2 114 ? -4.899 -15.780 -18.573 1.00 115.56 ? 106 HIS H C 1 ATOM 3502 O O . HIS B 2 114 ? -4.078 -16.207 -19.380 1.00 111.52 ? 106 HIS H O 1 ATOM 3503 C CB . HIS B 2 114 ? -5.608 -13.644 -19.509 1.00 123.94 ? 106 HIS H CB 1 ATOM 3504 C CG . HIS B 2 114 ? -5.841 -12.174 -19.402 1.00 136.32 ? 106 HIS H CG 1 ATOM 3505 N ND1 . HIS B 2 114 ? -6.841 -11.627 -18.629 1.00 142.03 ? 106 HIS H ND1 1 ATOM 3506 C CD2 . HIS B 2 114 ? -5.225 -11.134 -20.014 1.00 136.60 ? 106 HIS H CD2 1 ATOM 3507 C CE1 . HIS B 2 114 ? -6.815 -10.312 -18.753 1.00 148.86 ? 106 HIS H CE1 1 ATOM 3508 N NE2 . HIS B 2 114 ? -5.847 -9.987 -19.590 1.00 143.45 ? 106 HIS H NE2 1 ATOM 3509 N N . TRP B 2 115 ? -5.735 -16.569 -17.896 1.00 118.78 ? 107 TRP H N 1 ATOM 3510 C CA . TRP B 2 115 ? -5.795 -18.030 -18.080 1.00 118.23 ? 107 TRP H CA 1 ATOM 3511 C C . TRP B 2 115 ? -7.194 -18.514 -18.510 1.00 127.02 ? 107 TRP H C 1 ATOM 3512 O O . TRP B 2 115 ? -8.209 -17.966 -18.066 1.00 139.57 ? 107 TRP H O 1 ATOM 3513 C CB . TRP B 2 115 ? -5.339 -18.781 -16.830 1.00 118.22 ? 107 TRP H CB 1 ATOM 3514 C CG . TRP B 2 115 ? -3.910 -18.510 -16.476 1.00 116.57 ? 107 TRP H CG 1 ATOM 3515 C CD1 . TRP B 2 115 ? -3.371 -17.322 -16.069 1.00 120.15 ? 107 TRP H CD1 1 ATOM 3516 C CD2 . TRP B 2 115 ? -2.821 -19.435 -16.558 1.00 109.39 ? 107 TRP H CD2 1 ATOM 3517 N NE1 . TRP B 2 115 ? -2.021 -17.460 -15.865 1.00 116.47 ? 107 TRP H NE1 1 ATOM 3518 C CE2 . TRP B 2 115 ? -1.656 -18.745 -16.161 1.00 110.59 ? 107 TRP H CE2 1 ATOM 3519 C CE3 . TRP B 2 115 ? -2.717 -20.778 -16.932 1.00 106.68 ? 107 TRP H CE3 1 ATOM 3520 C CZ2 . TRP B 2 115 ? -0.410 -19.351 -16.118 1.00 102.62 ? 107 TRP H CZ2 1 ATOM 3521 C CZ3 . TRP B 2 115 ? -1.478 -21.381 -16.890 1.00 106.66 ? 107 TRP H CZ3 1 ATOM 3522 C CH2 . TRP B 2 115 ? -0.339 -20.666 -16.483 1.00 108.87 ? 107 TRP H CH2 1 ATOM 3523 N N . GLY B 2 116 ? -7.262 -19.529 -19.365 1.00 121.02 ? 108 GLY H N 1 ATOM 3524 C CA . GLY B 2 116 ? -8.512 -20.255 -19.559 1.00 120.99 ? 108 GLY H CA 1 ATOM 3525 C C . GLY B 2 116 ? -8.913 -20.953 -18.261 1.00 119.39 ? 108 GLY H C 1 ATOM 3526 O O . GLY B 2 116 ? -8.100 -21.035 -17.336 1.00 113.59 ? 108 GLY H O 1 ATOM 3527 N N . GLN B 2 117 ? -10.117 -21.531 -18.211 1.00 124.25 ? 109 GLN H N 1 ATOM 3528 C CA . GLN B 2 117 ? -10.573 -22.192 -16.983 1.00 122.10 ? 109 GLN H CA 1 ATOM 3529 C C . GLN B 2 117 ? -9.942 -23.564 -16.921 1.00 115.33 ? 109 GLN H C 1 ATOM 3530 O O . GLN B 2 117 ? -10.056 -24.270 -15.925 1.00 120.31 ? 109 GLN H O 1 ATOM 3531 C CB . GLN B 2 117 ? -12.101 -22.343 -16.882 1.00 125.23 ? 109 GLN H CB 1 ATOM 3532 C CG . GLN B 2 117 ? -12.729 -23.589 -17.527 1.00 125.69 ? 109 GLN H CG 1 ATOM 3533 C CD . GLN B 2 117 ? -13.027 -23.477 -19.005 1.00 125.79 ? 109 GLN H CD 1 ATOM 3534 O OE1 . GLN B 2 117 ? -12.493 -22.620 -19.708 1.00 126.41 ? 109 GLN H OE1 1 ATOM 3535 N NE2 . GLN B 2 117 ? -13.922 -24.337 -19.480 1.00 123.57 ? 109 GLN H NE2 1 ATOM 3536 N N . GLY B 2 118 ? -9.304 -23.969 -18.004 1.00 106.71 ? 110 GLY H N 1 ATOM 3537 C CA . GLY B 2 118 ? -8.731 -25.285 -18.000 1.00 104.32 ? 110 GLY H CA 1 ATOM 3538 C C . GLY B 2 118 ? -9.587 -26.367 -18.608 1.00 112.21 ? 110 GLY H C 1 ATOM 3539 O O . GLY B 2 118 ? -10.823 -26.327 -18.611 1.00 111.80 ? 110 GLY H O 1 ATOM 3540 N N . THR B 2 119 ? -8.890 -27.314 -19.208 1.00 114.13 ? 111 THR H N 1 ATOM 3541 C CA . THR B 2 119 ? -9.546 -28.479 -19.732 1.00 109.19 ? 111 THR H CA 1 ATOM 3542 C C . THR B 2 119 ? -8.815 -29.663 -19.141 1.00 109.71 ? 111 THR H C 1 ATOM 3543 O O . THR B 2 119 ? -7.604 -29.799 -19.299 1.00 108.35 ? 111 THR H O 1 ATOM 3544 C CB . THR B 2 119 ? -9.507 -28.494 -21.257 1.00 106.96 ? 111 THR H CB 1 ATOM 3545 O OG1 . THR B 2 119 ? -10.210 -27.341 -21.747 1.00 110.94 ? 111 THR H OG1 1 ATOM 3546 C CG2 . THR B 2 119 ? -10.171 -29.744 -21.807 1.00 113.98 ? 111 THR H CG2 1 ATOM 3547 N N . LEU B 2 120 ? -9.559 -30.495 -18.417 1.00 109.45 ? 112 LEU H N 1 ATOM 3548 C CA . LEU B 2 120 ? -8.997 -31.719 -17.878 1.00 111.68 ? 112 LEU H CA 1 ATOM 3549 C C . LEU B 2 120 ? -8.950 -32.824 -18.899 1.00 120.28 ? 112 LEU H C 1 ATOM 3550 O O . LEU B 2 120 ? -9.962 -33.149 -19.519 1.00 121.44 ? 112 LEU H O 1 ATOM 3551 C CB . LEU B 2 120 ? -9.814 -32.185 -16.693 1.00 125.35 ? 112 LEU H CB 1 ATOM 3552 C CG . LEU B 2 120 ? -9.442 -33.558 -16.147 1.00 130.88 ? 112 LEU H CG 1 ATOM 3553 C CD1 . LEU B 2 120 ? -8.028 -33.548 -15.555 1.00 130.11 ? 112 LEU H CD1 1 ATOM 3554 C CD2 . LEU B 2 120 ? -10.484 -33.970 -15.113 1.00 141.81 ? 112 LEU H CD2 1 ATOM 3555 N N . VAL B 2 121 ? -7.780 -33.439 -19.033 1.00 123.46 ? 113 VAL H N 1 ATOM 3556 C CA . VAL B 2 121 ? -7.643 -34.629 -19.857 1.00 115.53 ? 113 VAL H CA 1 ATOM 3557 C C . VAL B 2 121 ? -7.150 -35.827 -19.071 1.00 121.16 ? 113 VAL H C 1 ATOM 3558 O O . VAL B 2 121 ? -6.048 -35.817 -18.517 1.00 114.57 ? 113 VAL H O 1 ATOM 3559 C CB . VAL B 2 121 ? -6.686 -34.386 -21.027 1.00 103.55 ? 113 VAL H CB 1 ATOM 3560 C CG1 . VAL B 2 121 ? -6.537 -35.647 -21.856 1.00 101.90 ? 113 VAL H CG1 1 ATOM 3561 C CG2 . VAL B 2 121 ? -7.187 -33.236 -21.874 1.00 100.12 ? 113 VAL H CG2 1 ATOM 3562 N N . THR B 2 122 ? -7.985 -36.853 -18.996 1.00 130.16 ? 114 THR H N 1 ATOM 3563 C CA . THR B 2 122 ? -7.549 -38.104 -18.403 1.00 130.98 ? 114 THR H CA 1 ATOM 3564 C C . THR B 2 122 ? -7.287 -39.176 -19.485 1.00 130.82 ? 114 THR H C 1 ATOM 3565 O O . THR B 2 122 ? -8.135 -39.479 -20.331 1.00 123.58 ? 114 THR H O 1 ATOM 3566 C CB . THR B 2 122 ? -8.534 -38.614 -17.309 1.00 124.38 ? 114 THR H CB 1 ATOM 3567 O OG1 . THR B 2 122 ? -8.638 -37.670 -16.237 1.00 125.57 ? 114 THR H OG1 1 ATOM 3568 C CG2 . THR B 2 122 ? -8.001 -39.887 -16.732 1.00 130.52 ? 114 THR H CG2 1 ATOM 3569 N N . VAL B 2 123 ? -6.053 -39.670 -19.448 1.00 148.07 ? 115 VAL H N 1 ATOM 3570 C CA . VAL B 2 123 ? -5.512 -40.728 -20.286 1.00 93.74 ? 115 VAL H CA 1 ATOM 3571 C C . VAL B 2 123 ? -5.279 -41.990 -19.438 1.00 97.96 ? 115 VAL H C 1 ATOM 3572 O O . VAL B 2 123 ? -4.494 -42.014 -18.482 1.00 105.71 ? 115 VAL H O 1 ATOM 3573 C CB . VAL B 2 123 ? -4.204 -40.328 -20.949 1.00 101.73 ? 115 VAL H CB 1 ATOM 3574 C CG1 . VAL B 2 123 ? -3.744 -41.435 -21.877 1.00 95.79 ? 115 VAL H CG1 1 ATOM 3575 C CG2 . VAL B 2 123 ? -4.377 -39.016 -21.693 1.00 104.70 ? 115 VAL H CG2 1 ATOM 3576 N N . SER B 2 124 ? -5.942 -43.058 -19.829 1.00 188.06 ? 116 SER H N 1 ATOM 3577 C CA . SER B 2 124 ? -5.907 -44.288 -19.079 1.00 162.48 ? 116 SER H CA 1 ATOM 3578 C C . SER B 2 124 ? -6.335 -45.391 -19.981 1.00 150.26 ? 116 SER H C 1 ATOM 3579 O O . SER B 2 124 ? -7.210 -45.221 -20.822 1.00 148.55 ? 116 SER H O 1 ATOM 3580 C CB . SER B 2 124 ? -6.826 -44.243 -17.876 1.00 160.67 ? 116 SER H CB 1 ATOM 3581 O OG . SER B 2 124 ? -6.835 -45.508 -17.239 1.00 157.81 ? 116 SER H OG 1 ATOM 3582 N N . SER B 2 125 ? -5.802 -46.565 -19.717 1.00 146.43 ? 117 SER H N 1 ATOM 3583 C CA . SER B 2 125 ? -6.154 -47.712 -20.512 1.00 150.81 ? 117 SER H CA 1 ATOM 3584 C C . SER B 2 125 ? -7.493 -48.247 -20.021 1.00 141.61 ? 117 SER H C 1 ATOM 3585 O O . SER B 2 125 ? -8.099 -49.112 -20.656 1.00 151.96 ? 117 SER H O 1 ATOM 3586 C CB . SER B 2 125 ? -5.037 -48.747 -20.439 1.00 157.61 ? 117 SER H CB 1 ATOM 3587 O OG . SER B 2 125 ? -4.846 -49.178 -19.106 1.00 159.09 ? 117 SER H OG 1 ATOM 3588 N N . ALA B 2 126 ? -7.973 -47.672 -18.917 1.00 120.66 ? 118 ALA H N 1 ATOM 3589 C CA . ALA B 2 126 ? -9.201 -48.099 -18.262 1.00 117.01 ? 118 ALA H CA 1 ATOM 3590 C C . ALA B 2 126 ? -10.357 -47.651 -19.149 1.00 128.88 ? 118 ALA H C 1 ATOM 3591 O O . ALA B 2 126 ? -10.158 -46.855 -20.076 1.00 146.49 ? 118 ALA H O 1 ATOM 3592 C CB . ALA B 2 126 ? -9.321 -47.505 -16.900 1.00 98.36 ? 118 ALA H CB 1 ATOM 3593 N N . SER B 2 127 ? -11.546 -48.198 -18.928 1.00 105.24 ? 119 SER H N 1 ATOM 3594 C CA . SER B 2 127 ? -12.724 -47.745 -19.663 1.00 118.82 ? 119 SER H CA 1 ATOM 3595 C C . SER B 2 127 ? -13.805 -47.208 -18.760 1.00 105.86 ? 119 SER H C 1 ATOM 3596 O O . SER B 2 127 ? -13.790 -47.485 -17.569 1.00 105.56 ? 119 SER H O 1 ATOM 3597 C CB . SER B 2 127 ? -13.285 -48.877 -20.515 1.00 122.25 ? 119 SER H CB 1 ATOM 3598 O OG . SER B 2 127 ? -12.388 -49.208 -21.568 1.00 132.02 ? 119 SER H OG 1 ATOM 3599 N N . THR B 2 128 ? -14.673 -46.353 -19.300 1.00 118.34 ? 120 THR H N 1 ATOM 3600 C CA . THR B 2 128 ? -15.778 -45.765 -18.538 1.00 118.62 ? 120 THR H CA 1 ATOM 3601 C C . THR B 2 128 ? -16.466 -46.886 -17.784 1.00 120.73 ? 120 THR H C 1 ATOM 3602 O O . THR B 2 128 ? -16.802 -47.906 -18.369 1.00 128.59 ? 120 THR H O 1 ATOM 3603 C CB . THR B 2 128 ? -16.797 -45.021 -19.420 1.00 129.55 ? 120 THR H CB 1 ATOM 3604 O OG1 . THR B 2 128 ? -16.176 -43.886 -20.043 1.00 142.46 ? 120 THR H OG1 1 ATOM 3605 C CG2 . THR B 2 128 ? -17.952 -44.527 -18.568 1.00 124.76 ? 120 THR H CG2 1 ATOM 3606 N N . LYS B 2 129 ? -16.703 -46.697 -16.498 1.00 117.64 ? 121 LYS H N 1 ATOM 3607 C CA . LYS B 2 129 ? -17.299 -47.741 -15.693 1.00 118.47 ? 121 LYS H CA 1 ATOM 3608 C C . LYS B 2 129 ? -18.097 -47.207 -14.511 1.00 117.50 ? 121 LYS H C 1 ATOM 3609 O O . LYS B 2 129 ? -17.657 -46.301 -13.818 1.00 110.67 ? 121 LYS H O 1 ATOM 3610 C CB . LYS B 2 129 ? -16.223 -48.698 -15.180 1.00 119.70 ? 121 LYS H CB 1 ATOM 3611 C CG . LYS B 2 129 ? -16.826 -49.815 -14.333 1.00 121.30 ? 121 LYS H CG 1 ATOM 3612 C CD . LYS B 2 129 ? -15.871 -50.931 -13.956 1.00 119.95 ? 121 LYS H CD 1 ATOM 3613 C CE . LYS B 2 129 ? -16.625 -52.002 -13.170 1.00 124.78 ? 121 LYS H CE 1 ATOM 3614 N NZ . LYS B 2 129 ? -16.999 -51.520 -11.803 1.00 125.19 ? 121 LYS H NZ 1 ATOM 3615 N N . GLY B 2 130 ? -19.294 -47.754 -14.328 1.00 125.23 ? 122 GLY H N 1 ATOM 3616 C CA . GLY B 2 130 ? -20.146 -47.394 -13.212 1.00 129.83 ? 122 GLY H CA 1 ATOM 3617 C C . GLY B 2 130 ? -19.550 -48.018 -11.963 1.00 131.46 ? 122 GLY H C 1 ATOM 3618 O O . GLY B 2 130 ? -18.876 -49.046 -12.046 1.00 137.93 ? 122 GLY H O 1 ATOM 3619 N N . PRO B 2 131 ? -19.769 -47.395 -10.795 1.00 127.98 ? 123 PRO H N 1 ATOM 3620 C CA . PRO B 2 131 ? -19.242 -47.986 -9.558 1.00 124.41 ? 123 PRO H CA 1 ATOM 3621 C C . PRO B 2 131 ? -20.014 -49.172 -8.993 1.00 122.69 ? 123 PRO H C 1 ATOM 3622 O O . PRO B 2 131 ? -21.190 -49.397 -9.296 1.00 118.72 ? 123 PRO H O 1 ATOM 3623 C CB . PRO B 2 131 ? -19.348 -46.831 -8.555 1.00 121.21 ? 123 PRO H CB 1 ATOM 3624 C CG . PRO B 2 131 ? -20.500 -46.021 -9.060 1.00 123.90 ? 123 PRO H CG 1 ATOM 3625 C CD . PRO B 2 131 ? -20.380 -46.074 -10.562 1.00 129.32 ? 123 PRO H CD 1 ATOM 3626 N N . SER B 2 132 ? -19.309 -49.909 -8.138 1.00 121.35 ? 124 SER H N 1 ATOM 3627 C CA . SER B 2 132 ? -19.891 -50.904 -7.253 1.00 116.14 ? 124 SER H CA 1 ATOM 3628 C C . SER B 2 132 ? -20.088 -50.238 -5.902 1.00 104.32 ? 124 SER H C 1 ATOM 3629 O O . SER B 2 132 ? -19.216 -49.490 -5.482 1.00 93.43 ? 124 SER H O 1 ATOM 3630 C CB . SER B 2 132 ? -18.943 -52.103 -7.119 1.00 120.00 ? 124 SER H CB 1 ATOM 3631 O OG . SER B 2 132 ? -18.944 -52.915 -8.282 1.00 123.29 ? 124 SER H OG 1 ATOM 3632 N N . VAL B 2 133 ? -21.186 -50.519 -5.206 1.00 111.46 ? 125 VAL H N 1 ATOM 3633 C CA . VAL B 2 133 ? -21.436 -49.857 -3.915 1.00 113.82 ? 125 VAL H CA 1 ATOM 3634 C C . VAL B 2 133 ? -21.632 -50.851 -2.755 1.00 115.79 ? 125 VAL H C 1 ATOM 3635 O O . VAL B 2 133 ? -22.589 -51.635 -2.745 1.00 117.72 ? 125 VAL H O 1 ATOM 3636 C CB . VAL B 2 133 ? -22.645 -48.908 -3.977 1.00 116.22 ? 125 VAL H CB 1 ATOM 3637 C CG1 . VAL B 2 133 ? -22.890 -48.277 -2.609 1.00 116.28 ? 125 VAL H CG1 1 ATOM 3638 C CG2 . VAL B 2 133 ? -22.423 -47.837 -5.026 1.00 111.68 ? 125 VAL H CG2 1 ATOM 3639 N N . PHE B 2 134 ? -20.734 -50.815 -1.776 1.00 112.68 ? 126 PHE H N 1 ATOM 3640 C CA . PHE B 2 134 ? -20.795 -51.797 -0.711 1.00 107.76 ? 126 PHE H CA 1 ATOM 3641 C C . PHE B 2 134 ? -21.111 -51.140 0.637 1.00 98.79 ? 126 PHE H C 1 ATOM 3642 O O . PHE B 2 134 ? -20.655 -50.050 0.913 1.00 96.68 ? 126 PHE H O 1 ATOM 3643 C CB . PHE B 2 134 ? -19.474 -52.555 -0.637 1.00 107.96 ? 126 PHE H CB 1 ATOM 3644 C CG . PHE B 2 134 ? -19.120 -53.271 -1.914 1.00 111.99 ? 126 PHE H CG 1 ATOM 3645 C CD1 . PHE B 2 134 ? -19.991 -54.203 -2.472 1.00 108.43 ? 126 PHE H CD1 1 ATOM 3646 C CD2 . PHE B 2 134 ? -17.861 -53.107 -2.493 1.00 110.53 ? 126 PHE H CD2 1 ATOM 3647 C CE1 . PHE B 2 134 ? -19.647 -54.883 -3.635 1.00 106.50 ? 126 PHE H CE1 1 ATOM 3648 C CE2 . PHE B 2 134 ? -17.505 -53.806 -3.647 1.00 100.73 ? 126 PHE H CE2 1 ATOM 3649 C CZ . PHE B 2 134 ? -18.397 -54.690 -4.213 1.00 101.80 ? 126 PHE H CZ 1 ATOM 3650 N N . PRO B 2 135 ? -21.898 -51.803 1.482 1.00 95.62 ? 127 PRO H N 1 ATOM 3651 C CA . PRO B 2 135 ? -22.160 -51.188 2.782 1.00 97.89 ? 127 PRO H CA 1 ATOM 3652 C C . PRO B 2 135 ? -21.004 -51.239 3.775 1.00 105.04 ? 127 PRO H C 1 ATOM 3653 O O . PRO B 2 135 ? -20.219 -52.204 3.745 1.00 106.31 ? 127 PRO H O 1 ATOM 3654 C CB . PRO B 2 135 ? -23.327 -52.018 3.316 1.00 99.36 ? 127 PRO H CB 1 ATOM 3655 C CG . PRO B 2 135 ? -23.071 -53.366 2.712 1.00 107.71 ? 127 PRO H CG 1 ATOM 3656 C CD . PRO B 2 135 ? -22.628 -53.063 1.318 1.00 102.49 ? 127 PRO H CD 1 ATOM 3657 N N . LEU B 2 136 ? -20.842 -50.187 4.580 1.00 104.43 ? 128 LEU H N 1 ATOM 3658 C CA . LEU B 2 136 ? -19.980 -50.302 5.746 1.00 104.88 ? 128 LEU H CA 1 ATOM 3659 C C . LEU B 2 136 ? -20.804 -50.362 7.044 1.00 108.61 ? 128 LEU H C 1 ATOM 3660 O O . LEU B 2 136 ? -21.155 -49.314 7.622 1.00 112.53 ? 128 LEU H O 1 ATOM 3661 C CB . LEU B 2 136 ? -18.983 -49.156 5.810 1.00 100.07 ? 128 LEU H CB 1 ATOM 3662 C CG . LEU B 2 136 ? -17.964 -49.132 4.687 1.00 92.63 ? 128 LEU H CG 1 ATOM 3663 C CD1 . LEU B 2 136 ? -17.305 -47.780 4.703 1.00 98.78 ? 128 LEU H CD1 1 ATOM 3664 C CD2 . LEU B 2 136 ? -16.946 -50.247 4.842 1.00 83.47 ? 128 LEU H CD2 1 ATOM 3665 N N . ALA B 2 137 ? -21.079 -51.579 7.503 1.00 112.42 ? 129 ALA H N 1 ATOM 3666 C CA . ALA B 2 137 ? -22.120 -51.830 8.501 1.00 115.52 ? 129 ALA H CA 1 ATOM 3667 C C . ALA B 2 137 ? -21.639 -51.466 9.899 1.00 118.06 ? 129 ALA H C 1 ATOM 3668 O O . ALA B 2 137 ? -20.457 -51.643 10.188 1.00 115.92 ? 129 ALA H O 1 ATOM 3669 C CB . ALA B 2 137 ? -22.574 -53.268 8.455 1.00 123.61 ? 129 ALA H CB 1 ATOM 3670 N N . PRO B 2 138 ? -22.530 -50.930 10.752 1.00 128.13 ? 130 PRO H N 1 ATOM 3671 C CA . PRO B 2 138 ? -22.189 -50.418 12.085 1.00 132.45 ? 130 PRO H CA 1 ATOM 3672 C C . PRO B 2 138 ? -21.222 -51.323 12.878 1.00 141.67 ? 130 PRO H C 1 ATOM 3673 O O . PRO B 2 138 ? -21.612 -52.166 13.703 1.00 144.52 ? 130 PRO H O 1 ATOM 3674 C CB . PRO B 2 138 ? -23.550 -50.338 12.771 1.00 131.52 ? 130 PRO H CB 1 ATOM 3675 C CG . PRO B 2 138 ? -24.492 -50.040 11.665 1.00 130.36 ? 130 PRO H CG 1 ATOM 3676 C CD . PRO B 2 138 ? -23.955 -50.725 10.440 1.00 131.92 ? 130 PRO H CD 1 ATOM 3677 N N . THR B 2 147 ? -21.057 -45.917 21.193 1.00 216.82 ? 139 THR H N 1 ATOM 3678 C CA . THR B 2 147 ? -20.600 -45.003 20.157 1.00 212.62 ? 139 THR H CA 1 ATOM 3679 C C . THR B 2 147 ? -20.549 -45.739 18.799 1.00 206.21 ? 139 THR H C 1 ATOM 3680 O O . THR B 2 147 ? -20.126 -46.906 18.772 1.00 205.80 ? 139 THR H O 1 ATOM 3681 C CB . THR B 2 147 ? -19.189 -44.474 20.530 1.00 139.60 ? 139 THR H CB 1 ATOM 3682 O OG1 . THR B 2 147 ? -19.248 -43.704 21.737 1.00 142.43 ? 139 THR H OG1 1 ATOM 3683 C CG2 . THR B 2 147 ? -18.584 -43.663 19.409 1.00 136.67 ? 139 THR H CG2 1 ATOM 3684 N N . ALA B 2 148 ? -20.927 -45.087 17.682 1.00 198.07 ? 140 ALA H N 1 ATOM 3685 C CA . ALA B 2 148 ? -20.918 -45.796 16.378 1.00 188.27 ? 140 ALA H CA 1 ATOM 3686 C C . ALA B 2 148 ? -20.780 -44.939 15.091 1.00 180.14 ? 140 ALA H C 1 ATOM 3687 O O . ALA B 2 148 ? -21.294 -43.812 14.983 1.00 188.33 ? 140 ALA H O 1 ATOM 3688 C CB . ALA B 2 148 ? -22.177 -46.639 16.268 1.00 182.66 ? 140 ALA H CB 1 ATOM 3689 N N . ALA B 2 149 ? -20.147 -45.577 14.099 1.00 160.25 ? 141 ALA H N 1 ATOM 3690 C CA . ALA B 2 149 ? -20.036 -45.233 12.663 1.00 138.49 ? 141 ALA H CA 1 ATOM 3691 C C . ALA B 2 149 ? -20.645 -46.153 11.590 1.00 129.70 ? 141 ALA H C 1 ATOM 3692 O O . ALA B 2 149 ? -20.643 -47.371 11.750 1.00 134.57 ? 141 ALA H O 1 ATOM 3693 C CB . ALA B 2 149 ? -18.569 -45.050 12.337 1.00 136.50 ? 141 ALA H CB 1 ATOM 3694 N N . LEU B 2 150 ? -21.100 -45.579 10.473 1.00 125.09 ? 142 LEU H N 1 ATOM 3695 C CA . LEU B 2 150 ? -21.603 -46.403 9.359 1.00 119.48 ? 142 LEU H CA 1 ATOM 3696 C C . LEU B 2 150 ? -21.261 -45.712 8.035 1.00 122.96 ? 142 LEU H C 1 ATOM 3697 O O . LEU B 2 150 ? -20.939 -44.524 8.026 1.00 123.37 ? 142 LEU H O 1 ATOM 3698 C CB . LEU B 2 150 ? -23.111 -46.632 9.487 1.00 113.24 ? 142 LEU H CB 1 ATOM 3699 C CG . LEU B 2 150 ? -24.048 -45.421 9.401 1.00 111.18 ? 142 LEU H CG 1 ATOM 3700 C CD1 . LEU B 2 150 ? -24.481 -45.150 7.976 1.00 113.99 ? 142 LEU H CD1 1 ATOM 3701 C CD2 . LEU B 2 150 ? -25.264 -45.600 10.300 1.00 111.38 ? 142 LEU H CD2 1 ATOM 3702 N N . GLY B 2 151 ? -21.331 -46.437 6.914 1.00 120.84 ? 143 GLY H N 1 ATOM 3703 C CA . GLY B 2 151 ? -20.968 -45.832 5.632 1.00 116.34 ? 143 GLY H CA 1 ATOM 3704 C C . GLY B 2 151 ? -21.246 -46.575 4.336 1.00 113.79 ? 143 GLY H C 1 ATOM 3705 O O . GLY B 2 151 ? -21.963 -47.563 4.304 1.00 117.89 ? 143 GLY H O 1 ATOM 3706 N N . CYS B 2 152 ? -20.683 -46.055 3.251 1.00 110.13 ? 144 CYS H N 1 ATOM 3707 C CA . CYS B 2 152 ? -20.728 -46.695 1.948 1.00 107.81 ? 144 CYS H CA 1 ATOM 3708 C C . CYS B 2 152 ? -19.350 -46.681 1.356 1.00 110.02 ? 144 CYS H C 1 ATOM 3709 O O . CYS B 2 152 ? -18.611 -45.705 1.464 1.00 116.57 ? 144 CYS H O 1 ATOM 3710 C CB . CYS B 2 152 ? -21.645 -45.961 0.969 1.00 91.49 ? 144 CYS H CB 1 ATOM 3711 S SG . CYS B 2 152 ? -23.393 -46.233 1.127 1.00 231.47 ? 144 CYS H SG 1 ATOM 3712 N N . LEU B 2 153 ? -19.008 -47.792 0.734 1.00 100.98 ? 145 LEU H N 1 ATOM 3713 C CA . LEU B 2 153 ? -17.758 -47.935 0.045 1.00 99.38 ? 145 LEU H CA 1 ATOM 3714 C C . LEU B 2 153 ? -18.048 -47.946 -1.451 1.00 113.84 ? 145 LEU H C 1 ATOM 3715 O O . LEU B 2 153 ? -18.714 -48.844 -1.944 1.00 116.49 ? 145 LEU H O 1 ATOM 3716 C CB . LEU B 2 153 ? -17.046 -49.206 0.502 1.00 91.65 ? 145 LEU H CB 1 ATOM 3717 C CG . LEU B 2 153 ? -15.769 -49.600 -0.237 1.00 93.80 ? 145 LEU H CG 1 ATOM 3718 C CD1 . LEU B 2 153 ? -14.704 -48.558 -0.016 1.00 99.73 ? 145 LEU H CD1 1 ATOM 3719 C CD2 . LEU B 2 153 ? -15.263 -50.961 0.252 1.00 95.65 ? 145 LEU H CD2 1 ATOM 3720 N N . VAL B 2 154 ? -17.512 -46.964 -2.164 1.00 117.63 ? 146 VAL H N 1 ATOM 3721 C CA . VAL B 2 154 ? -17.837 -46.702 -3.568 1.00 111.28 ? 146 VAL H CA 1 ATOM 3722 C C . VAL B 2 154 ? -16.629 -47.074 -4.427 1.00 106.89 ? 146 VAL H C 1 ATOM 3723 O O . VAL B 2 154 ? -15.682 -46.285 -4.539 1.00 91.34 ? 146 VAL H O 1 ATOM 3724 C CB . VAL B 2 154 ? -18.253 -45.230 -3.830 1.00 82.97 ? 146 VAL H CB 1 ATOM 3725 C CG1 . VAL B 2 154 ? -18.534 -45.022 -5.303 1.00 89.44 ? 146 VAL H CG1 1 ATOM 3726 C CG2 . VAL B 2 154 ? -19.482 -44.853 -3.017 1.00 85.77 ? 146 VAL H CG2 1 ATOM 3727 N N . LYS B 2 155 ? -16.640 -48.292 -4.977 1.00 119.14 ? 147 LYS H N 1 ATOM 3728 C CA . LYS B 2 155 ? -15.413 -48.927 -5.459 1.00 120.97 ? 147 LYS H CA 1 ATOM 3729 C C . LYS B 2 155 ? -15.455 -49.203 -6.974 1.00 122.66 ? 147 LYS H C 1 ATOM 3730 O O . LYS B 2 155 ? -16.522 -49.447 -7.531 1.00 120.33 ? 147 LYS H O 1 ATOM 3731 C CB . LYS B 2 155 ? -15.162 -50.229 -4.658 1.00 119.42 ? 147 LYS H CB 1 ATOM 3732 C CG . LYS B 2 155 ? -13.806 -50.882 -4.918 1.00 120.29 ? 147 LYS H CG 1 ATOM 3733 C CD . LYS B 2 155 ? -13.448 -51.935 -3.884 1.00 123.65 ? 147 LYS H CD 1 ATOM 3734 C CE . LYS B 2 155 ? -12.000 -52.451 -4.061 1.00 126.44 ? 147 LYS H CE 1 ATOM 3735 N NZ . LYS B 2 155 ? -11.742 -53.228 -5.324 1.00 121.41 ? 147 LYS H NZ 1 ATOM 3736 N N . ASP B 2 156 ? -14.300 -49.086 -7.637 1.00 129.12 ? 148 ASP H N 1 ATOM 3737 C CA . ASP B 2 156 ? -14.129 -49.495 -9.040 1.00 134.23 ? 148 ASP H CA 1 ATOM 3738 C C . ASP B 2 156 ? -14.922 -48.726 -10.092 1.00 132.14 ? 148 ASP H C 1 ATOM 3739 O O . ASP B 2 156 ? -15.572 -49.328 -10.949 1.00 139.84 ? 148 ASP H O 1 ATOM 3740 C CB . ASP B 2 156 ? -14.370 -50.999 -9.217 1.00 143.69 ? 148 ASP H CB 1 ATOM 3741 C CG . ASP B 2 156 ? -13.306 -51.847 -8.531 1.00 151.08 ? 148 ASP H CG 1 ATOM 3742 O OD1 . ASP B 2 156 ? -12.207 -51.314 -8.256 1.00 148.88 ? 148 ASP H OD1 1 ATOM 3743 O OD2 . ASP B 2 156 ? -13.557 -53.048 -8.291 1.00 158.00 ? 148 ASP H OD2 1 ATOM 3744 N N . TYR B 2 157 ? -14.892 -47.403 -10.012 1.00 125.71 ? 149 TYR H N 1 ATOM 3745 C CA . TYR B 2 157 ? -15.505 -46.586 -11.045 1.00 127.53 ? 149 TYR H CA 1 ATOM 3746 C C . TYR B 2 157 ? -14.455 -45.831 -11.840 1.00 120.70 ? 149 TYR H C 1 ATOM 3747 O O . TYR B 2 157 ? -13.313 -45.725 -11.407 1.00 122.02 ? 149 TYR H O 1 ATOM 3748 C CB . TYR B 2 157 ? -16.514 -45.627 -10.411 1.00 132.20 ? 149 TYR H CB 1 ATOM 3749 C CG . TYR B 2 157 ? -15.918 -44.515 -9.568 1.00 135.07 ? 149 TYR H CG 1 ATOM 3750 C CD1 . TYR B 2 157 ? -15.716 -44.689 -8.195 1.00 131.55 ? 149 TYR H CD1 1 ATOM 3751 C CD2 . TYR B 2 157 ? -15.599 -43.276 -10.127 1.00 138.73 ? 149 TYR H CD2 1 ATOM 3752 C CE1 . TYR B 2 157 ? -15.192 -43.675 -7.405 1.00 128.25 ? 149 TYR H CE1 1 ATOM 3753 C CE2 . TYR B 2 157 ? -15.066 -42.257 -9.341 1.00 138.50 ? 149 TYR H CE2 1 ATOM 3754 C CZ . TYR B 2 157 ? -14.873 -42.466 -7.977 1.00 132.52 ? 149 TYR H CZ 1 ATOM 3755 O OH . TYR B 2 157 ? -14.355 -41.470 -7.187 1.00 133.60 ? 149 TYR H OH 1 ATOM 3756 N N . PHE B 2 158 ? -14.825 -45.357 -13.022 1.00 114.54 ? 150 PHE H N 1 ATOM 3757 C CA . PHE B 2 158 ? -13.934 -44.505 -13.795 1.00 115.90 ? 150 PHE H CA 1 ATOM 3758 C C . PHE B 2 158 ? -14.701 -43.751 -14.883 1.00 120.43 ? 150 PHE H C 1 ATOM 3759 O O . PHE B 2 158 ? -15.607 -44.308 -15.507 1.00 125.52 ? 150 PHE H O 1 ATOM 3760 C CB . PHE B 2 158 ? -12.826 -45.381 -14.406 1.00 116.35 ? 150 PHE H CB 1 ATOM 3761 C CG . PHE B 2 158 ? -11.867 -44.653 -15.318 1.00 119.07 ? 150 PHE H CG 1 ATOM 3762 C CD1 . PHE B 2 158 ? -12.148 -44.502 -16.666 1.00 118.30 ? 150 PHE H CD1 1 ATOM 3763 C CD2 . PHE B 2 158 ? -10.662 -44.157 -14.831 1.00 121.16 ? 150 PHE H CD2 1 ATOM 3764 C CE1 . PHE B 2 158 ? -11.262 -43.859 -17.494 1.00 122.57 ? 150 PHE H CE1 1 ATOM 3765 C CE2 . PHE B 2 158 ? -9.774 -43.513 -15.667 1.00 118.70 ? 150 PHE H CE2 1 ATOM 3766 C CZ . PHE B 2 158 ? -10.079 -43.364 -16.993 1.00 121.84 ? 150 PHE H CZ 1 ATOM 3767 N N . PRO B 2 159 ? -14.339 -42.478 -15.137 1.00 117.40 ? 151 PRO H N 1 ATOM 3768 C CA . PRO B 2 159 ? -13.367 -41.615 -14.450 1.00 115.22 ? 151 PRO H CA 1 ATOM 3769 C C . PRO B 2 159 ? -13.966 -40.845 -13.245 1.00 112.81 ? 151 PRO H C 1 ATOM 3770 O O . PRO B 2 159 ? -15.151 -41.020 -12.952 1.00 116.64 ? 151 PRO H O 1 ATOM 3771 C CB . PRO B 2 159 ? -12.964 -40.644 -15.542 1.00 115.91 ? 151 PRO H CB 1 ATOM 3772 C CG . PRO B 2 159 ? -14.204 -40.509 -16.365 1.00 115.25 ? 151 PRO H CG 1 ATOM 3773 C CD . PRO B 2 159 ? -14.943 -41.806 -16.295 1.00 113.77 ? 151 PRO H CD 1 ATOM 3774 N N . GLU B 2 160 ? -13.174 -39.975 -12.636 1.00 107.63 ? 152 GLU H N 1 ATOM 3775 C CA . GLU B 2 160 ? -13.672 -39.131 -11.577 1.00 110.10 ? 152 GLU H CA 1 ATOM 3776 C C . GLU B 2 160 ? -14.685 -38.278 -12.283 1.00 111.60 ? 152 GLU H C 1 ATOM 3777 O O . GLU B 2 160 ? -14.590 -38.101 -13.481 1.00 120.69 ? 152 GLU H O 1 ATOM 3778 C CB . GLU B 2 160 ? -12.558 -38.266 -11.013 1.00 120.25 ? 152 GLU H CB 1 ATOM 3779 C CG . GLU B 2 160 ? -11.861 -38.850 -9.802 1.00 118.76 ? 152 GLU H CG 1 ATOM 3780 C CD . GLU B 2 160 ? -12.720 -38.791 -8.562 1.00 124.03 ? 152 GLU H CD 1 ATOM 3781 O OE1 . GLU B 2 160 ? -13.958 -38.787 -8.695 1.00 124.65 ? 152 GLU H OE1 1 ATOM 3782 O OE2 . GLU B 2 160 ? -12.161 -38.746 -7.450 1.00 127.62 ? 152 GLU H OE2 1 ATOM 3783 N N . PRO B 2 161 ? -15.702 -37.815 -11.581 1.00 107.76 ? 153 PRO H N 1 ATOM 3784 C CA . PRO B 2 161 ? -15.776 -37.905 -10.134 1.00 113.76 ? 153 PRO H CA 1 ATOM 3785 C C . PRO B 2 161 ? -17.163 -38.314 -9.715 1.00 109.07 ? 153 PRO H C 1 ATOM 3786 O O . PRO B 2 161 ? -18.096 -38.194 -10.497 1.00 119.09 ? 153 PRO H O 1 ATOM 3787 C CB . PRO B 2 161 ? -15.566 -36.463 -9.722 1.00 118.36 ? 153 PRO H CB 1 ATOM 3788 C CG . PRO B 2 161 ? -16.296 -35.702 -10.787 1.00 110.55 ? 153 PRO H CG 1 ATOM 3789 C CD . PRO B 2 161 ? -16.205 -36.520 -12.055 1.00 107.55 ? 153 PRO H CD 1 ATOM 3790 N N . VAL B 2 162 ? -17.293 -38.790 -8.490 1.00 89.64 ? 154 VAL H N 1 ATOM 3791 C CA . VAL B 2 162 ? -18.580 -39.206 -7.989 1.00 102.12 ? 154 VAL H CA 1 ATOM 3792 C C . VAL B 2 162 ? -18.986 -38.368 -6.800 1.00 108.57 ? 154 VAL H C 1 ATOM 3793 O O . VAL B 2 162 ? -18.146 -37.895 -6.055 1.00 111.28 ? 154 VAL H O 1 ATOM 3794 C CB . VAL B 2 162 ? -18.556 -40.676 -7.594 1.00 102.03 ? 154 VAL H CB 1 ATOM 3795 C CG1 . VAL B 2 162 ? -19.274 -41.496 -8.622 1.00 110.12 ? 154 VAL H CG1 1 ATOM 3796 C CG2 . VAL B 2 162 ? -17.132 -41.151 -7.451 1.00 95.17 ? 154 VAL H CG2 1 ATOM 3797 N N . THR B 2 163 ? -20.285 -38.154 -6.660 1.00 113.98 ? 155 THR H N 1 ATOM 3798 C CA . THR B 2 163 ? -20.847 -37.445 -5.504 1.00 121.35 ? 155 THR H CA 1 ATOM 3799 C C . THR B 2 163 ? -21.657 -38.389 -4.622 1.00 124.03 ? 155 THR H C 1 ATOM 3800 O O . THR B 2 163 ? -22.299 -39.315 -5.121 1.00 124.45 ? 155 THR H O 1 ATOM 3801 C CB . THR B 2 163 ? -21.736 -36.266 -5.853 1.00 125.58 ? 155 THR H CB 1 ATOM 3802 O OG1 . THR B 2 163 ? -22.934 -36.743 -6.467 1.00 130.63 ? 155 THR H OG1 1 ATOM 3803 C CG2 . THR B 2 163 ? -20.995 -35.244 -6.725 1.00 129.81 ? 155 THR H CG2 1 ATOM 3804 N N . VAL B 2 164 ? -21.652 -38.123 -3.318 1.00 124.76 ? 156 VAL H N 1 ATOM 3805 C CA . VAL B 2 164 ? -22.424 -38.905 -2.361 1.00 116.61 ? 156 VAL H CA 1 ATOM 3806 C C . VAL B 2 164 ? -23.235 -37.940 -1.515 1.00 116.01 ? 156 VAL H C 1 ATOM 3807 O O . VAL B 2 164 ? -22.707 -36.981 -0.957 1.00 112.14 ? 156 VAL H O 1 ATOM 3808 C CB . VAL B 2 164 ? -21.532 -39.710 -1.427 1.00 103.68 ? 156 VAL H CB 1 ATOM 3809 C CG1 . VAL B 2 164 ? -22.390 -40.544 -0.478 1.00 102.78 ? 156 VAL H CG1 1 ATOM 3810 C CG2 . VAL B 2 164 ? -20.559 -40.558 -2.222 1.00 94.21 ? 156 VAL H CG2 1 ATOM 3811 N N . SER B 2 165 ? -24.520 -38.248 -1.387 1.00 118.29 ? 157 SER H N 1 ATOM 3812 C CA . SER B 2 165 ? -25.359 -37.662 -0.365 1.00 123.56 ? 157 SER H CA 1 ATOM 3813 C C . SER B 2 165 ? -25.907 -38.749 0.533 1.00 122.01 ? 157 SER H C 1 ATOM 3814 O O . SER B 2 165 ? -25.757 -39.932 0.243 1.00 113.61 ? 157 SER H O 1 ATOM 3815 C CB . SER B 2 165 ? -26.485 -36.863 -1.004 1.00 132.10 ? 157 SER H CB 1 ATOM 3816 O OG . SER B 2 165 ? -27.344 -37.728 -1.718 1.00 138.47 ? 157 SER H OG 1 ATOM 3817 N N . TRP B 2 166 ? -26.525 -38.339 1.635 1.00 123.00 ? 158 TRP H N 1 ATOM 3818 C CA . TRP B 2 166 ? -27.193 -39.276 2.517 1.00 117.64 ? 158 TRP H CA 1 ATOM 3819 C C . TRP B 2 166 ? -28.673 -39.011 2.768 1.00 116.40 ? 158 TRP H C 1 ATOM 3820 O O . TRP B 2 166 ? -29.051 -37.888 3.098 1.00 107.51 ? 158 TRP H O 1 ATOM 3821 C CB . TRP B 2 166 ? -26.425 -39.286 3.830 1.00 117.98 ? 158 TRP H CB 1 ATOM 3822 C CG . TRP B 2 166 ? -25.117 -40.020 3.703 1.00 114.18 ? 158 TRP H CG 1 ATOM 3823 C CD1 . TRP B 2 166 ? -23.903 -39.484 3.342 1.00 107.61 ? 158 TRP H CD1 1 ATOM 3824 C CD2 . TRP B 2 166 ? -24.893 -41.417 3.899 1.00 111.93 ? 158 TRP H CD2 1 ATOM 3825 N NE1 . TRP B 2 166 ? -22.940 -40.464 3.324 1.00 101.37 ? 158 TRP H NE1 1 ATOM 3826 C CE2 . TRP B 2 166 ? -23.519 -41.659 3.659 1.00 104.68 ? 158 TRP H CE2 1 ATOM 3827 C CE3 . TRP B 2 166 ? -25.717 -42.487 4.258 1.00 114.68 ? 158 TRP H CE3 1 ATOM 3828 C CZ2 . TRP B 2 166 ? -22.955 -42.924 3.769 1.00 105.64 ? 158 TRP H CZ2 1 ATOM 3829 C CZ3 . TRP B 2 166 ? -25.154 -43.748 4.371 1.00 116.00 ? 158 TRP H CZ3 1 ATOM 3830 C CH2 . TRP B 2 166 ? -23.784 -43.956 4.128 1.00 111.83 ? 158 TRP H CH2 1 ATOM 3831 N N . ASN B 2 167 ? -29.500 -40.040 2.589 1.00 125.98 ? 159 ASN H N 1 ATOM 3832 C CA . ASN B 2 167 ? -30.932 -39.913 2.839 1.00 138.37 ? 159 ASN H CA 1 ATOM 3833 C C . ASN B 2 167 ? -31.466 -38.770 2.025 1.00 145.62 ? 159 ASN H C 1 ATOM 3834 O O . ASN B 2 167 ? -32.250 -37.957 2.518 1.00 149.02 ? 159 ASN H O 1 ATOM 3835 C CB . ASN B 2 167 ? -31.242 -39.709 4.323 1.00 142.87 ? 159 ASN H CB 1 ATOM 3836 C CG . ASN B 2 167 ? -30.932 -40.939 5.159 1.00 142.59 ? 159 ASN H CG 1 ATOM 3837 O OD1 . ASN B 2 167 ? -30.665 -42.015 4.624 1.00 142.03 ? 159 ASN H OD1 1 ATOM 3838 N ND2 . ASN B 2 167 ? -30.980 -40.787 6.479 1.00 141.79 ? 159 ASN H ND2 1 ATOM 3839 N N . SER B 2 168 ? -30.998 -38.716 0.780 1.00 148.31 ? 160 SER H N 1 ATOM 3840 C CA . SER B 2 168 ? -31.481 -37.768 -0.213 1.00 154.46 ? 160 SER H CA 1 ATOM 3841 C C . SER B 2 168 ? -31.218 -36.347 0.260 1.00 159.55 ? 160 SER H C 1 ATOM 3842 O O . SER B 2 168 ? -31.972 -35.424 -0.046 1.00 168.02 ? 160 SER H O 1 ATOM 3843 C CB . SER B 2 168 ? -32.969 -37.989 -0.476 1.00 157.32 ? 160 SER H CB 1 ATOM 3844 O OG . SER B 2 168 ? -33.185 -39.303 -0.953 1.00 156.46 ? 160 SER H OG 1 ATOM 3845 N N . GLY B 2 169 ? -30.157 -36.188 1.048 1.00 154.69 ? 161 GLY H N 1 ATOM 3846 C CA . GLY B 2 169 ? -29.700 -34.867 1.421 1.00 157.88 ? 161 GLY H CA 1 ATOM 3847 C C . GLY B 2 169 ? -30.163 -34.499 2.816 1.00 161.54 ? 161 GLY H C 1 ATOM 3848 O O . GLY B 2 169 ? -29.685 -33.525 3.388 1.00 159.16 ? 161 GLY H O 1 ATOM 3849 N N . ALA B 2 170 ? -31.072 -35.290 3.379 1.00 166.08 ? 162 ALA H N 1 ATOM 3850 C CA . ALA B 2 170 ? -31.623 -34.999 4.700 1.00 164.96 ? 162 ALA H CA 1 ATOM 3851 C C . ALA B 2 170 ? -30.631 -35.299 5.820 1.00 156.39 ? 162 ALA H C 1 ATOM 3852 O O . ALA B 2 170 ? -30.804 -34.841 6.949 1.00 156.65 ? 162 ALA H O 1 ATOM 3853 C CB . ALA B 2 170 ? -32.915 -35.783 4.915 1.00 166.39 ? 162 ALA H CB 1 ATOM 3854 N N . LEU B 2 171 ? -29.602 -36.080 5.510 1.00 148.22 ? 163 LEU H N 1 ATOM 3855 C CA . LEU B 2 171 ? -28.544 -36.376 6.474 1.00 142.17 ? 163 LEU H CA 1 ATOM 3856 C C . LEU B 2 171 ? -27.179 -35.802 6.122 1.00 143.35 ? 163 LEU H C 1 ATOM 3857 O O . LEU B 2 171 ? -26.444 -36.394 5.338 1.00 147.34 ? 163 LEU H O 1 ATOM 3858 C CB . LEU B 2 171 ? -28.362 -37.896 6.629 1.00 133.42 ? 163 LEU H CB 1 ATOM 3859 C CG . LEU B 2 171 ? -27.278 -38.438 7.560 1.00 120.46 ? 163 LEU H CG 1 ATOM 3860 C CD1 . LEU B 2 171 ? -27.367 -37.778 8.907 1.00 124.79 ? 163 LEU H CD1 1 ATOM 3861 C CD2 . LEU B 2 171 ? -27.442 -39.932 7.709 1.00 113.08 ? 163 LEU H CD2 1 ATOM 3862 N N . THR B 2 172 ? -26.839 -34.651 6.697 1.00 142.28 ? 164 THR H N 1 ATOM 3863 C CA . THR B 2 172 ? -25.559 -34.019 6.386 1.00 140.72 ? 164 THR H CA 1 ATOM 3864 C C . THR B 2 172 ? -24.522 -33.905 7.493 1.00 140.42 ? 164 THR H C 1 ATOM 3865 O O . THR B 2 172 ? -23.314 -33.919 7.244 1.00 135.48 ? 164 THR H O 1 ATOM 3866 C CB . THR B 2 172 ? -25.893 -32.599 5.935 1.00 144.09 ? 164 THR H CB 1 ATOM 3867 O OG1 . THR B 2 172 ? -26.540 -31.909 7.012 1.00 149.17 ? 164 THR H OG1 1 ATOM 3868 C CG2 . THR B 2 172 ? -26.812 -32.631 4.722 1.00 146.68 ? 164 THR H CG2 1 ATOM 3869 N N . SER B 2 173 ? -25.006 -33.764 8.719 1.00 144.42 ? 165 SER H N 1 ATOM 3870 C CA . SER B 2 173 ? -24.130 -33.639 9.872 1.00 138.66 ? 165 SER H CA 1 ATOM 3871 C C . SER B 2 173 ? -23.416 -34.963 10.153 1.00 121.96 ? 165 SER H C 1 ATOM 3872 O O . SER B 2 173 ? -24.011 -36.034 10.055 1.00 109.59 ? 165 SER H O 1 ATOM 3873 C CB . SER B 2 173 ? -24.928 -33.139 11.080 1.00 141.27 ? 165 SER H CB 1 ATOM 3874 O OG . SER B 2 173 ? -25.932 -34.057 11.462 1.00 140.39 ? 165 SER H OG 1 ATOM 3875 N N . GLY B 2 174 ? -22.144 -34.879 10.519 1.00 122.48 ? 166 GLY H N 1 ATOM 3876 C CA . GLY B 2 174 ? -21.389 -36.062 10.880 1.00 123.02 ? 166 GLY H CA 1 ATOM 3877 C C . GLY B 2 174 ? -20.901 -36.851 9.682 1.00 120.20 ? 166 GLY H C 1 ATOM 3878 O O . GLY B 2 174 ? -20.324 -37.933 9.839 1.00 117.73 ? 166 GLY H O 1 ATOM 3879 N N . VAL B 2 175 ? -21.192 -36.341 8.483 1.00 119.56 ? 167 VAL H N 1 ATOM 3880 C CA . VAL B 2 175 ? -20.795 -36.992 7.230 1.00 106.99 ? 167 VAL H CA 1 ATOM 3881 C C . VAL B 2 175 ? -19.348 -36.628 6.837 1.00 106.72 ? 167 VAL H C 1 ATOM 3882 O O . VAL B 2 175 ? -18.961 -35.457 6.895 1.00 111.87 ? 167 VAL H O 1 ATOM 3883 C CB . VAL B 2 175 ? -21.755 -36.602 6.085 1.00 93.95 ? 167 VAL H CB 1 ATOM 3884 C CG1 . VAL B 2 175 ? -21.224 -37.104 4.756 1.00 94.51 ? 167 VAL H CG1 1 ATOM 3885 C CG2 . VAL B 2 175 ? -23.137 -37.186 6.326 1.00 86.63 ? 167 VAL H CG2 1 ATOM 3886 N N . HIS B 2 176 ? -18.549 -37.625 6.469 1.00 101.58 ? 168 HIS H N 1 ATOM 3887 C CA . HIS B 2 176 ? -17.272 -37.384 5.816 1.00 110.17 ? 168 HIS H CA 1 ATOM 3888 C C . HIS B 2 176 ? -17.197 -38.176 4.512 1.00 116.01 ? 168 HIS H C 1 ATOM 3889 O O . HIS B 2 176 ? -17.168 -39.404 4.529 1.00 123.42 ? 168 HIS H O 1 ATOM 3890 C CB . HIS B 2 176 ? -16.105 -37.785 6.716 1.00 116.50 ? 168 HIS H CB 1 ATOM 3891 C CG . HIS B 2 176 ? -15.974 -36.961 7.956 1.00 126.83 ? 168 HIS H CG 1 ATOM 3892 N ND1 . HIS B 2 176 ? -15.975 -37.515 9.221 1.00 126.12 ? 168 HIS H ND1 1 ATOM 3893 C CD2 . HIS B 2 176 ? -15.811 -35.628 8.130 1.00 134.72 ? 168 HIS H CD2 1 ATOM 3894 C CE1 . HIS B 2 176 ? -15.832 -36.558 10.120 1.00 132.67 ? 168 HIS H CE1 1 ATOM 3895 N NE2 . HIS B 2 176 ? -15.725 -35.403 9.484 1.00 138.09 ? 168 HIS H NE2 1 ATOM 3896 N N . THR B 2 177 ? -17.186 -37.477 3.384 1.00 113.17 ? 169 THR H N 1 ATOM 3897 C CA . THR B 2 177 ? -16.913 -38.090 2.088 1.00 107.22 ? 169 THR H CA 1 ATOM 3898 C C . THR B 2 177 ? -15.469 -37.856 1.665 1.00 104.16 ? 169 THR H C 1 ATOM 3899 O O . THR B 2 177 ? -15.057 -36.709 1.480 1.00 104.99 ? 169 THR H O 1 ATOM 3900 C CB . THR B 2 177 ? -17.841 -37.600 1.017 1.00 109.76 ? 169 THR H CB 1 ATOM 3901 O OG1 . THR B 2 177 ? -19.177 -37.950 1.380 1.00 113.56 ? 169 THR H OG1 1 ATOM 3902 C CG2 . THR B 2 177 ? -17.490 -38.265 -0.292 1.00 107.35 ? 169 THR H CG2 1 ATOM 3903 N N . PHE B 2 178 ? -14.688 -38.918 1.544 1.00 100.86 ? 170 PHE H N 1 ATOM 3904 C CA . PHE B 2 178 ? -13.249 -38.770 1.319 1.00 104.08 ? 170 PHE H CA 1 ATOM 3905 C C . PHE B 2 178 ? -12.825 -38.525 -0.140 1.00 103.28 ? 170 PHE H C 1 ATOM 3906 O O . PHE B 2 178 ? -13.525 -38.915 -1.073 1.00 101.23 ? 170 PHE H O 1 ATOM 3907 C CB . PHE B 2 178 ? -12.553 -40.033 1.806 1.00 106.93 ? 170 PHE H CB 1 ATOM 3908 C CG . PHE B 2 178 ? -12.598 -40.218 3.287 1.00 104.88 ? 170 PHE H CG 1 ATOM 3909 C CD1 . PHE B 2 178 ? -13.749 -40.692 3.901 1.00 98.54 ? 170 PHE H CD1 1 ATOM 3910 C CD2 . PHE B 2 178 ? -11.490 -39.934 4.070 1.00 104.40 ? 170 PHE H CD2 1 ATOM 3911 C CE1 . PHE B 2 178 ? -13.792 -40.870 5.269 1.00 93.03 ? 170 PHE H CE1 1 ATOM 3912 C CE2 . PHE B 2 178 ? -11.531 -40.116 5.436 1.00 98.17 ? 170 PHE H CE2 1 ATOM 3913 C CZ . PHE B 2 178 ? -12.680 -40.585 6.033 1.00 92.65 ? 170 PHE H CZ 1 ATOM 3914 N N . PRO B 2 179 ? -11.668 -37.865 -0.330 1.00 105.15 ? 171 PRO H N 1 ATOM 3915 C CA . PRO B 2 179 ? -11.037 -37.796 -1.647 1.00 111.14 ? 171 PRO H CA 1 ATOM 3916 C C . PRO B 2 179 ? -10.861 -39.183 -2.213 1.00 108.47 ? 171 PRO H C 1 ATOM 3917 O O . PRO B 2 179 ? -10.459 -40.067 -1.468 1.00 102.50 ? 171 PRO H O 1 ATOM 3918 C CB . PRO B 2 179 ? -9.682 -37.143 -1.366 1.00 117.66 ? 171 PRO H CB 1 ATOM 3919 C CG . PRO B 2 179 ? -9.859 -36.428 -0.087 1.00 116.86 ? 171 PRO H CG 1 ATOM 3920 C CD . PRO B 2 179 ? -10.849 -37.216 0.704 1.00 107.81 ? 171 PRO H CD 1 ATOM 3921 N N . ALA B 2 180 ? -11.138 -39.379 -3.499 1.00 112.91 ? 172 ALA H N 1 ATOM 3922 C CA . ALA B 2 180 ? -10.852 -40.667 -4.109 1.00 105.48 ? 172 ALA H CA 1 ATOM 3923 C C . ALA B 2 180 ? -9.360 -40.998 -4.151 1.00 105.31 ? 172 ALA H C 1 ATOM 3924 O O . ALA B 2 180 ? -8.507 -40.108 -4.206 1.00 113.74 ? 172 ALA H O 1 ATOM 3925 C CB . ALA B 2 180 ? -11.430 -40.694 -5.497 1.00 108.70 ? 172 ALA H CB 1 ATOM 3926 N N . VAL B 2 181 ? -9.068 -42.294 -4.154 1.00 105.70 ? 173 VAL H N 1 ATOM 3927 C CA . VAL B 2 181 ? -7.752 -42.853 -4.461 1.00 115.21 ? 173 VAL H CA 1 ATOM 3928 C C . VAL B 2 181 ? -7.717 -43.631 -5.778 1.00 111.39 ? 173 VAL H C 1 ATOM 3929 O O . VAL B 2 181 ? -8.724 -44.222 -6.168 1.00 106.61 ? 173 VAL H O 1 ATOM 3930 C CB . VAL B 2 181 ? -7.273 -43.774 -3.319 1.00 132.04 ? 173 VAL H CB 1 ATOM 3931 C CG1 . VAL B 2 181 ? -7.208 -43.018 -2.006 1.00 139.93 ? 173 VAL H CG1 1 ATOM 3932 C CG2 . VAL B 2 181 ? -8.207 -44.950 -3.167 1.00 137.02 ? 173 VAL H CG2 1 ATOM 3933 N N . LEU B 2 182 ? -6.588 -43.607 -6.486 1.00 116.65 ? 174 LEU H N 1 ATOM 3934 C CA . LEU B 2 182 ? -6.453 -44.410 -7.705 1.00 116.89 ? 174 LEU H CA 1 ATOM 3935 C C . LEU B 2 182 ? -5.826 -45.781 -7.411 1.00 118.74 ? 174 LEU H C 1 ATOM 3936 O O . LEU B 2 182 ? -4.664 -45.844 -7.009 1.00 125.33 ? 174 LEU H O 1 ATOM 3937 C CB . LEU B 2 182 ? -5.612 -43.659 -8.732 1.00 120.61 ? 174 LEU H CB 1 ATOM 3938 C CG . LEU B 2 182 ? -5.405 -44.346 -10.079 1.00 122.78 ? 174 LEU H CG 1 ATOM 3939 C CD1 . LEU B 2 182 ? -6.762 -44.660 -10.698 1.00 122.83 ? 174 LEU H CD1 1 ATOM 3940 C CD2 . LEU B 2 182 ? -4.565 -43.465 -10.989 1.00 124.96 ? 174 LEU H CD2 1 ATOM 3941 N N . GLN B 2 183 ? -6.556 -46.866 -7.686 1.00 115.22 ? 175 GLN H N 1 ATOM 3942 C CA . GLN B 2 183 ? -6.075 -48.236 -7.434 1.00 114.45 ? 175 GLN H CA 1 ATOM 3943 C C . GLN B 2 183 ? -5.158 -48.770 -8.504 1.00 113.94 ? 175 GLN H C 1 ATOM 3944 O O . GLN B 2 183 ? -5.108 -48.222 -9.595 1.00 121.08 ? 175 GLN H O 1 ATOM 3945 C CB . GLN B 2 183 ? -7.247 -49.203 -7.339 1.00 116.75 ? 175 GLN H CB 1 ATOM 3946 C CG . GLN B 2 183 ? -8.258 -48.912 -6.270 1.00 113.58 ? 175 GLN H CG 1 ATOM 3947 C CD . GLN B 2 183 ? -9.552 -49.660 -6.529 1.00 114.57 ? 175 GLN H CD 1 ATOM 3948 O OE1 . GLN B 2 183 ? -10.551 -49.431 -5.856 1.00 117.18 ? 175 GLN H OE1 1 ATOM 3949 N NE2 . GLN B 2 183 ? -9.541 -50.551 -7.522 1.00 115.50 ? 175 GLN H NE2 1 ATOM 3950 N N . SER B 2 184 ? -4.434 -49.842 -8.189 1.00 120.90 ? 176 SER H N 1 ATOM 3951 C CA . SER B 2 184 ? -3.578 -50.497 -9.177 1.00 130.92 ? 176 SER H CA 1 ATOM 3952 C C . SER B 2 184 ? -4.391 -50.994 -10.385 1.00 132.19 ? 176 SER H C 1 ATOM 3953 O O . SER B 2 184 ? -3.893 -51.050 -11.514 1.00 124.36 ? 176 SER H O 1 ATOM 3954 C CB . SER B 2 184 ? -2.839 -51.669 -8.532 1.00 138.42 ? 176 SER H CB 1 ATOM 3955 O OG . SER B 2 184 ? -3.626 -52.245 -7.501 1.00 142.97 ? 176 SER H OG 1 ATOM 3956 N N . SER B 2 185 ? -5.659 -51.324 -10.138 1.00 136.13 ? 177 SER H N 1 ATOM 3957 C CA . SER B 2 185 ? -6.563 -51.813 -11.183 1.00 133.15 ? 177 SER H CA 1 ATOM 3958 C C . SER B 2 185 ? -6.839 -50.801 -12.300 1.00 126.64 ? 177 SER H C 1 ATOM 3959 O O . SER B 2 185 ? -7.305 -51.162 -13.374 1.00 124.31 ? 177 SER H O 1 ATOM 3960 C CB . SER B 2 185 ? -7.884 -52.261 -10.549 1.00 130.64 ? 177 SER H CB 1 ATOM 3961 O OG . SER B 2 185 ? -8.565 -51.167 -9.967 1.00 127.40 ? 177 SER H OG 1 ATOM 3962 N N . GLY B 2 186 ? -6.538 -49.536 -12.035 1.00 130.00 ? 178 GLY H N 1 ATOM 3963 C CA . GLY B 2 186 ? -6.801 -48.448 -12.961 1.00 131.10 ? 178 GLY H CA 1 ATOM 3964 C C . GLY B 2 186 ? -8.108 -47.737 -12.644 1.00 127.72 ? 178 GLY H C 1 ATOM 3965 O O . GLY B 2 186 ? -8.442 -46.722 -13.250 1.00 128.65 ? 178 GLY H O 1 ATOM 3966 N N . LEU B 2 187 ? -8.840 -48.259 -11.667 1.00 123.91 ? 179 LEU H N 1 ATOM 3967 C CA . LEU B 2 187 ? -10.132 -47.693 -11.290 1.00 117.69 ? 179 LEU H CA 1 ATOM 3968 C C . LEU B 2 187 ? -10.055 -46.867 -9.990 1.00 114.28 ? 179 LEU H C 1 ATOM 3969 O O . LEU B 2 187 ? -9.264 -47.171 -9.097 1.00 112.52 ? 179 LEU H O 1 ATOM 3970 C CB . LEU B 2 187 ? -11.142 -48.827 -11.133 1.00 110.43 ? 179 LEU H CB 1 ATOM 3971 C CG . LEU B 2 187 ? -11.245 -49.738 -12.352 1.00 100.06 ? 179 LEU H CG 1 ATOM 3972 C CD1 . LEU B 2 187 ? -12.167 -50.905 -12.074 1.00 92.56 ? 179 LEU H CD1 1 ATOM 3973 C CD2 . LEU B 2 187 ? -11.732 -48.929 -13.527 1.00 105.77 ? 179 LEU H CD2 1 ATOM 3974 N N . TYR B 2 188 ? -10.886 -45.833 -9.878 1.00 113.60 ? 180 TYR H N 1 ATOM 3975 C CA . TYR B 2 188 ? -10.914 -45.040 -8.658 1.00 110.29 ? 180 TYR H CA 1 ATOM 3976 C C . TYR B 2 188 ? -11.824 -45.691 -7.637 1.00 113.91 ? 180 TYR H C 1 ATOM 3977 O O . TYR B 2 188 ? -12.757 -46.407 -8.011 1.00 111.99 ? 180 TYR H O 1 ATOM 3978 C CB . TYR B 2 188 ? -11.373 -43.614 -8.967 1.00 110.32 ? 180 TYR H CB 1 ATOM 3979 C CG . TYR B 2 188 ? -10.403 -42.843 -9.831 1.00 107.03 ? 180 TYR H CG 1 ATOM 3980 C CD1 . TYR B 2 188 ? -9.365 -42.133 -9.256 1.00 106.93 ? 180 TYR H CD1 1 ATOM 3981 C CD2 . TYR B 2 188 ? -10.512 -42.844 -11.216 1.00 107.11 ? 180 TYR H CD2 1 ATOM 3982 C CE1 . TYR B 2 188 ? -8.476 -41.431 -10.019 1.00 114.61 ? 180 TYR H CE1 1 ATOM 3983 C CE2 . TYR B 2 188 ? -9.618 -42.138 -11.997 1.00 111.87 ? 180 TYR H CE2 1 ATOM 3984 C CZ . TYR B 2 188 ? -8.599 -41.432 -11.387 1.00 118.68 ? 180 TYR H CZ 1 ATOM 3985 O OH . TYR B 2 188 ? -7.682 -40.717 -12.120 1.00 126.35 ? 180 TYR H OH 1 ATOM 3986 N N . SER B 2 189 ? -11.579 -45.382 -6.362 1.00 120.93 ? 181 SER H N 1 ATOM 3987 C CA . SER B 2 189 ? -12.404 -45.783 -5.216 1.00 122.41 ? 181 SER H CA 1 ATOM 3988 C C . SER B 2 189 ? -12.464 -44.766 -4.075 1.00 117.00 ? 181 SER H C 1 ATOM 3989 O O . SER B 2 189 ? -11.432 -44.216 -3.699 1.00 122.44 ? 181 SER H O 1 ATOM 3990 C CB . SER B 2 189 ? -11.918 -47.108 -4.649 1.00 125.79 ? 181 SER H CB 1 ATOM 3991 O OG . SER B 2 189 ? -12.702 -47.487 -3.532 1.00 130.79 ? 181 SER H OG 1 ATOM 3992 N N . LEU B 2 190 ? -13.648 -44.489 -3.535 1.00 108.71 ? 182 LEU H N 1 ATOM 3993 C CA . LEU B 2 190 ? -13.714 -43.655 -2.328 1.00 109.16 ? 182 LEU H CA 1 ATOM 3994 C C . LEU B 2 190 ? -14.736 -44.171 -1.303 1.00 109.91 ? 182 LEU H C 1 ATOM 3995 O O . LEU B 2 190 ? -15.558 -45.011 -1.624 1.00 111.36 ? 182 LEU H O 1 ATOM 3996 C CB . LEU B 2 190 ? -14.022 -42.187 -2.713 1.00 106.62 ? 182 LEU H CB 1 ATOM 3997 C CG . LEU B 2 190 ? -15.397 -41.662 -3.181 1.00 101.74 ? 182 LEU H CG 1 ATOM 3998 C CD1 . LEU B 2 190 ? -16.520 -41.733 -2.163 1.00 90.71 ? 182 LEU H CD1 1 ATOM 3999 C CD2 . LEU B 2 190 ? -15.256 -40.214 -3.626 1.00 111.34 ? 182 LEU H CD2 1 ATOM 4000 N N . SER B 2 191 ? -14.656 -43.680 -0.064 1.00 108.13 ? 183 SER H N 1 ATOM 4001 C CA . SER B 2 191 ? -15.624 -44.044 0.972 1.00 104.16 ? 183 SER H CA 1 ATOM 4002 C C . SER B 2 191 ? -16.357 -42.801 1.507 1.00 103.90 ? 183 SER H C 1 ATOM 4003 O O . SER B 2 191 ? -15.776 -41.707 1.609 1.00 104.82 ? 183 SER H O 1 ATOM 4004 C CB . SER B 2 191 ? -14.936 -44.789 2.123 1.00 104.61 ? 183 SER H CB 1 ATOM 4005 O OG . SER B 2 191 ? -14.050 -45.784 1.638 1.00 109.47 ? 183 SER H OG 1 ATOM 4006 N N . SER B 2 192 ? -17.624 -42.981 1.876 1.00 96.37 ? 184 SER H N 1 ATOM 4007 C CA . SER B 2 192 ? -18.377 -41.950 2.583 1.00 91.07 ? 184 SER H CA 1 ATOM 4008 C C . SER B 2 192 ? -18.961 -42.519 3.833 1.00 98.93 ? 184 SER H C 1 ATOM 4009 O O . SER B 2 192 ? -19.577 -43.564 3.818 1.00 104.47 ? 184 SER H O 1 ATOM 4010 C CB . SER B 2 192 ? -19.508 -41.358 1.768 1.00 90.60 ? 184 SER H CB 1 ATOM 4011 O OG . SER B 2 192 ? -20.149 -40.379 2.576 1.00 91.64 ? 184 SER H OG 1 ATOM 4012 N N . VAL B 2 193 ? -18.751 -41.831 4.934 1.00 100.20 ? 185 VAL H N 1 ATOM 4013 C CA . VAL B 2 193 ? -19.171 -42.330 6.223 1.00 94.93 ? 185 VAL H CA 1 ATOM 4014 C C . VAL B 2 193 ? -19.962 -41.266 6.968 1.00 107.52 ? 185 VAL H C 1 ATOM 4015 O O . VAL B 2 193 ? -19.868 -40.078 6.674 1.00 110.29 ? 185 VAL H O 1 ATOM 4016 C CB . VAL B 2 193 ? -17.951 -42.761 7.041 1.00 86.16 ? 185 VAL H CB 1 ATOM 4017 C CG1 . VAL B 2 193 ? -17.108 -43.750 6.278 1.00 77.03 ? 185 VAL H CG1 1 ATOM 4018 C CG2 . VAL B 2 193 ? -17.114 -41.557 7.362 1.00 95.37 ? 185 VAL H CG2 1 ATOM 4019 N N . VAL B 2 194 ? -20.761 -41.684 7.932 1.00 115.26 ? 186 VAL H N 1 ATOM 4020 C CA . VAL B 2 194 ? -21.414 -40.720 8.791 1.00 120.02 ? 186 VAL H CA 1 ATOM 4021 C C . VAL B 2 194 ? -21.348 -41.381 10.144 1.00 125.82 ? 186 VAL H C 1 ATOM 4022 O O . VAL B 2 194 ? -21.432 -42.624 10.247 1.00 122.98 ? 186 VAL H O 1 ATOM 4023 C CB . VAL B 2 194 ? -22.870 -40.395 8.370 1.00 104.39 ? 186 VAL H CB 1 ATOM 4024 C CG1 . VAL B 2 194 ? -23.721 -41.654 8.363 1.00 99.64 ? 186 VAL H CG1 1 ATOM 4025 C CG2 . VAL B 2 194 ? -23.478 -39.387 9.316 1.00 108.07 ? 186 VAL H CG2 1 ATOM 4026 N N . THR B 2 195 ? -21.200 -40.539 11.171 1.00 133.31 ? 187 THR H N 1 ATOM 4027 C CA . THR B 2 195 ? -21.233 -40.960 12.570 1.00 131.95 ? 187 THR H CA 1 ATOM 4028 C C . THR B 2 195 ? -22.497 -40.570 13.274 1.00 130.91 ? 187 THR H C 1 ATOM 4029 O O . THR B 2 195 ? -23.024 -39.465 13.111 1.00 126.00 ? 187 THR H O 1 ATOM 4030 C CB . THR B 2 195 ? -20.085 -40.348 13.404 1.00 131.04 ? 187 THR H CB 1 ATOM 4031 O OG1 . THR B 2 195 ? -20.008 -38.933 13.164 1.00 129.87 ? 187 THR H OG1 1 ATOM 4032 C CG2 . THR B 2 195 ? -18.776 -40.997 13.067 1.00 130.38 ? 187 THR H CG2 1 ATOM 4033 N N . VAL B 2 196 ? -22.981 -41.508 14.074 1.00 137.98 ? 188 VAL H N 1 ATOM 4034 C CA . VAL B 2 196 ? -24.247 -41.306 14.730 1.00 144.93 ? 188 VAL H CA 1 ATOM 4035 C C . VAL B 2 196 ? -24.235 -41.904 16.138 1.00 151.13 ? 188 VAL H C 1 ATOM 4036 O O . VAL B 2 196 ? -23.371 -42.719 16.494 1.00 148.52 ? 188 VAL H O 1 ATOM 4037 C CB . VAL B 2 196 ? -25.412 -41.938 13.880 1.00 133.57 ? 188 VAL H CB 1 ATOM 4038 C CG1 . VAL B 2 196 ? -25.568 -41.256 12.529 1.00 129.42 ? 188 VAL H CG1 1 ATOM 4039 C CG2 . VAL B 2 196 ? -25.222 -43.442 13.714 1.00 136.55 ? 188 VAL H CG2 1 ATOM 4040 N N . PRO B 2 197 ? -25.183 -41.465 16.962 1.00 159.59 ? 189 PRO H N 1 ATOM 4041 C CA . PRO B 2 197 ? -25.402 -42.084 18.262 1.00 165.89 ? 189 PRO H CA 1 ATOM 4042 C C . PRO B 2 197 ? -25.865 -43.495 17.998 1.00 164.90 ? 189 PRO H C 1 ATOM 4043 O O . PRO B 2 197 ? -26.703 -43.710 17.121 1.00 160.58 ? 189 PRO H O 1 ATOM 4044 C CB . PRO B 2 197 ? -26.468 -41.206 18.921 1.00 169.90 ? 189 PRO H CB 1 ATOM 4045 C CG . PRO B 2 197 ? -26.444 -39.935 18.141 1.00 167.92 ? 189 PRO H CG 1 ATOM 4046 C CD . PRO B 2 197 ? -26.061 -40.303 16.759 1.00 162.98 ? 189 PRO H CD 1 ATOM 4047 N N . SER B 2 198 ? -25.304 -44.439 18.735 1.00 168.01 ? 190 SER H N 1 ATOM 4048 C CA . SER B 2 198 ? -25.664 -45.836 18.612 1.00 166.53 ? 190 SER H CA 1 ATOM 4049 C C . SER B 2 198 ? -27.177 -45.930 18.741 1.00 162.90 ? 190 SER H C 1 ATOM 4050 O O . SER B 2 198 ? -27.837 -46.710 18.055 1.00 161.40 ? 190 SER H O 1 ATOM 4051 C CB . SER B 2 198 ? -24.965 -46.640 19.700 1.00 173.78 ? 190 SER H CB 1 ATOM 4052 O OG . SER B 2 198 ? -23.567 -46.423 19.643 1.00 176.64 ? 190 SER H OG 1 ATOM 4053 N N . SER B 2 199 ? -27.704 -45.067 19.597 1.00 162.21 ? 191 SER H N 1 ATOM 4054 C CA . SER B 2 199 ? -29.105 -45.011 19.981 1.00 162.42 ? 191 SER H CA 1 ATOM 4055 C C . SER B 2 199 ? -30.043 -44.688 18.808 1.00 161.62 ? 191 SER H C 1 ATOM 4056 O O . SER B 2 199 ? -31.251 -44.894 18.904 1.00 160.09 ? 191 SER H O 1 ATOM 4057 C CB . SER B 2 199 ? -29.288 -43.975 21.093 1.00 161.91 ? 191 SER H CB 1 ATOM 4058 O OG . SER B 2 199 ? -28.532 -42.804 20.827 1.00 158.10 ? 191 SER H OG 1 ATOM 4059 N N . SER B 2 200 ? -29.482 -44.223 17.694 1.00 160.55 ? 192 SER H N 1 ATOM 4060 C CA . SER B 2 200 ? -30.282 -43.806 16.533 1.00 158.49 ? 192 SER H CA 1 ATOM 4061 C C . SER B 2 200 ? -30.695 -44.856 15.483 1.00 153.76 ? 192 SER H C 1 ATOM 4062 O O . SER B 2 200 ? -31.583 -44.589 14.672 1.00 157.43 ? 192 SER H O 1 ATOM 4063 C CB . SER B 2 200 ? -29.515 -42.694 15.810 1.00 154.87 ? 192 SER H CB 1 ATOM 4064 O OG . SER B 2 200 ? -28.282 -43.187 15.293 1.00 153.61 ? 192 SER H OG 1 ATOM 4065 N N . LEU B 2 201 ? -30.059 -46.020 15.473 1.00 143.19 ? 193 LEU H N 1 ATOM 4066 C CA . LEU B 2 201 ? -30.360 -47.042 14.466 1.00 135.99 ? 193 LEU H CA 1 ATOM 4067 C C . LEU B 2 201 ? -31.850 -47.420 14.447 1.00 133.19 ? 193 LEU H C 1 ATOM 4068 O O . LEU B 2 201 ? -32.249 -48.419 13.849 1.00 128.43 ? 193 LEU H O 1 ATOM 4069 C CB . LEU B 2 201 ? -29.511 -48.292 14.717 1.00 138.07 ? 193 LEU H CB 1 ATOM 4070 C CG . LEU B 2 201 ? -27.997 -48.095 14.551 1.00 139.53 ? 193 LEU H CG 1 ATOM 4071 C CD1 . LEU B 2 201 ? -27.208 -49.340 14.923 1.00 137.64 ? 193 LEU H CD1 1 ATOM 4072 C CD2 . LEU B 2 201 ? -27.636 -47.632 13.149 1.00 142.93 ? 193 LEU H CD2 1 ATOM 4073 N N . GLN B 2 204 ? -34.662 -46.386 12.599 1.00 141.63 ? 196 GLN H N 1 ATOM 4074 C CA . GLN B 2 204 ? -34.554 -45.387 11.535 1.00 143.65 ? 196 GLN H CA 1 ATOM 4075 C C . GLN B 2 204 ? -33.768 -45.812 10.284 1.00 144.40 ? 196 GLN H C 1 ATOM 4076 O O . GLN B 2 204 ? -32.778 -46.540 10.372 1.00 141.21 ? 196 GLN H O 1 ATOM 4077 C CB . GLN B 2 204 ? -33.924 -44.104 12.079 1.00 142.09 ? 196 GLN H CB 1 ATOM 4078 C CG . GLN B 2 204 ? -33.327 -43.252 10.968 1.00 145.03 ? 196 GLN H CG 1 ATOM 4079 C CD . GLN B 2 204 ? -33.551 -41.779 11.140 1.00 154.99 ? 196 GLN H CD 1 ATOM 4080 O OE1 . GLN B 2 204 ? -33.714 -41.293 12.260 1.00 166.94 ? 196 GLN H OE1 1 ATOM 4081 N NE2 . GLN B 2 204 ? -33.582 -41.051 10.022 1.00 149.26 ? 196 GLN H NE2 1 ATOM 4082 N N . THR B 2 205 ? -34.230 -45.365 9.117 1.00 146.10 ? 197 THR H N 1 ATOM 4083 C CA . THR B 2 205 ? -33.639 -45.790 7.860 1.00 138.49 ? 197 THR H CA 1 ATOM 4084 C C . THR B 2 205 ? -32.509 -44.853 7.376 1.00 126.40 ? 197 THR H C 1 ATOM 4085 O O . THR B 2 205 ? -32.608 -43.628 7.498 1.00 118.38 ? 197 THR H O 1 ATOM 4086 C CB . THR B 2 205 ? -34.757 -45.903 6.778 1.00 186.39 ? 197 THR H CB 1 ATOM 4087 O OG1 . THR B 2 205 ? -35.378 -44.625 6.578 1.00 188.35 ? 197 THR H OG1 1 ATOM 4088 C CG2 . THR B 2 205 ? -35.826 -46.940 7.161 1.00 190.26 ? 197 THR H CG2 1 ATOM 4089 N N . TYR B 2 206 ? -31.416 -45.451 6.884 1.00 128.80 ? 198 TYR H N 1 ATOM 4090 C CA . TYR B 2 206 ? -30.256 -44.720 6.334 1.00 132.47 ? 198 TYR H CA 1 ATOM 4091 C C . TYR B 2 206 ? -29.842 -45.185 4.940 1.00 138.16 ? 198 TYR H C 1 ATOM 4092 O O . TYR B 2 206 ? -29.502 -46.349 4.747 1.00 144.96 ? 198 TYR H O 1 ATOM 4093 C CB . TYR B 2 206 ? -29.024 -44.819 7.238 1.00 130.31 ? 198 TYR H CB 1 ATOM 4094 C CG . TYR B 2 206 ? -29.193 -44.202 8.594 1.00 138.04 ? 198 TYR H CG 1 ATOM 4095 C CD1 . TYR B 2 206 ? -29.869 -43.002 8.743 1.00 145.15 ? 198 TYR H CD1 1 ATOM 4096 C CD2 . TYR B 2 206 ? -28.638 -44.788 9.721 1.00 136.80 ? 198 TYR H CD2 1 ATOM 4097 C CE1 . TYR B 2 206 ? -30.022 -42.419 9.980 1.00 146.40 ? 198 TYR H CE1 1 ATOM 4098 C CE2 . TYR B 2 206 ? -28.781 -44.209 10.966 1.00 142.87 ? 198 TYR H CE2 1 ATOM 4099 C CZ . TYR B 2 206 ? -29.476 -43.023 11.089 1.00 146.07 ? 198 TYR H CZ 1 ATOM 4100 O OH . TYR B 2 206 ? -29.633 -42.434 12.321 1.00 150.24 ? 198 TYR H OH 1 ATOM 4101 N N . ILE B 2 207 ? -29.835 -44.271 3.978 1.00 135.24 ? 199 ILE H N 1 ATOM 4102 C CA . ILE B 2 207 ? -29.542 -44.612 2.585 1.00 123.88 ? 199 ILE H CA 1 ATOM 4103 C C . ILE B 2 207 ? -28.568 -43.600 1.993 1.00 118.45 ? 199 ILE H C 1 ATOM 4104 O O . ILE B 2 207 ? -28.767 -42.391 2.089 1.00 117.19 ? 199 ILE H O 1 ATOM 4105 C CB . ILE B 2 207 ? -30.810 -44.714 1.746 1.00 120.63 ? 199 ILE H CB 1 ATOM 4106 C CG1 . ILE B 2 207 ? -31.646 -45.883 2.271 1.00 114.79 ? 199 ILE H CG1 1 ATOM 4107 C CG2 . ILE B 2 207 ? -30.458 -44.979 0.291 1.00 123.93 ? 199 ILE H CG2 1 ATOM 4108 C CD1 . ILE B 2 207 ? -33.031 -45.960 1.711 1.00 123.82 ? 199 ILE H CD1 1 ATOM 4109 N N . CYS B 2 208 ? -27.524 -44.103 1.358 1.00 114.32 ? 200 CYS H N 1 ATOM 4110 C CA . CYS B 2 208 ? -26.593 -43.230 0.683 1.00 116.72 ? 200 CYS H CA 1 ATOM 4111 C C . CYS B 2 208 ? -26.916 -43.178 -0.787 1.00 126.75 ? 200 CYS H C 1 ATOM 4112 O O . CYS B 2 208 ? -27.229 -44.194 -1.401 1.00 129.25 ? 200 CYS H O 1 ATOM 4113 C CB . CYS B 2 208 ? -25.148 -43.685 0.856 1.00 112.41 ? 200 CYS H CB 1 ATOM 4114 S SG . CYS B 2 208 ? -24.744 -45.219 -0.018 1.00 131.07 ? 200 CYS H SG 1 ATOM 4115 N N . ASN B 2 209 ? -26.909 -41.969 -1.328 1.00 128.96 ? 201 ASN H N 1 ATOM 4116 C CA . ASN B 2 209 ? -27.259 -41.748 -2.709 1.00 127.56 ? 201 ASN H CA 1 ATOM 4117 C C . ASN B 2 209 ? -25.970 -41.387 -3.414 1.00 123.84 ? 201 ASN H C 1 ATOM 4118 O O . ASN B 2 209 ? -25.332 -40.380 -3.121 1.00 125.48 ? 201 ASN H O 1 ATOM 4119 C CB . ASN B 2 209 ? -28.285 -40.623 -2.867 1.00 130.85 ? 201 ASN H CB 1 ATOM 4120 C CG . ASN B 2 209 ? -29.283 -40.579 -1.736 1.00 139.41 ? 201 ASN H CG 1 ATOM 4121 O OD1 . ASN B 2 209 ? -29.235 -39.691 -0.892 1.00 141.07 ? 201 ASN H OD1 1 ATOM 4122 N ND2 . ASN B 2 209 ? -30.226 -41.510 -1.741 1.00 148.36 ? 201 ASN H ND2 1 ATOM 4123 N N . VAL B 2 210 ? -25.569 -42.268 -4.313 1.00 117.74 ? 202 VAL H N 1 ATOM 4124 C CA . VAL B 2 210 ? -24.283 -42.202 -4.968 1.00 110.85 ? 202 VAL H CA 1 ATOM 4125 C C . VAL B 2 210 ? -24.552 -41.920 -6.431 1.00 115.41 ? 202 VAL H C 1 ATOM 4126 O O . VAL B 2 210 ? -25.358 -42.600 -7.070 1.00 117.44 ? 202 VAL H O 1 ATOM 4127 C CB . VAL B 2 210 ? -23.477 -43.497 -4.810 1.00 108.15 ? 202 VAL H CB 1 ATOM 4128 C CG1 . VAL B 2 210 ? -22.200 -43.428 -5.615 1.00 109.22 ? 202 VAL H CG1 1 ATOM 4129 C CG2 . VAL B 2 210 ? -23.183 -43.755 -3.347 1.00 109.36 ? 202 VAL H CG2 1 ATOM 4130 N N . ASN B 2 211 ? -23.870 -40.921 -6.968 1.00 120.29 ? 203 ASN H N 1 ATOM 4131 C CA . ASN B 2 211 ? -24.057 -40.567 -8.355 1.00 127.54 ? 203 ASN H CA 1 ATOM 4132 C C . ASN B 2 211 ? -22.734 -40.488 -9.098 1.00 128.00 ? 203 ASN H C 1 ATOM 4133 O O . ASN B 2 211 ? -21.806 -39.764 -8.695 1.00 131.98 ? 203 ASN H O 1 ATOM 4134 C CB . ASN B 2 211 ? -24.815 -39.259 -8.477 1.00 136.25 ? 203 ASN H CB 1 ATOM 4135 C CG . ASN B 2 211 ? -25.344 -39.045 -9.864 1.00 145.77 ? 203 ASN H CG 1 ATOM 4136 O OD1 . ASN B 2 211 ? -26.493 -39.385 -10.163 1.00 152.31 ? 203 ASN H OD1 1 ATOM 4137 N ND2 . ASN B 2 211 ? -24.504 -38.507 -10.736 1.00 144.96 ? 203 ASN H ND2 1 ATOM 4138 N N . HIS B 2 212 ? -22.675 -41.225 -10.203 1.00 123.18 ? 204 HIS H N 1 ATOM 4139 C CA . HIS B 2 212 ? -21.560 -41.161 -11.132 1.00 119.13 ? 204 HIS H CA 1 ATOM 4140 C C . HIS B 2 212 ? -21.990 -40.716 -12.485 1.00 137.34 ? 204 HIS H C 1 ATOM 4141 O O . HIS B 2 212 ? -22.459 -41.533 -13.281 1.00 147.75 ? 204 HIS H O 1 ATOM 4142 C CB . HIS B 2 212 ? -20.945 -42.548 -11.315 1.00 111.09 ? 204 HIS H CB 1 ATOM 4143 C CG . HIS B 2 212 ? -19.717 -42.568 -12.172 1.00 107.12 ? 204 HIS H CG 1 ATOM 4144 N ND1 . HIS B 2 212 ? -19.603 -43.382 -13.278 1.00 101.55 ? 204 HIS H ND1 1 ATOM 4145 C CD2 . HIS B 2 212 ? -18.528 -41.931 -12.050 1.00 107.80 ? 204 HIS H CD2 1 ATOM 4146 C CE1 . HIS B 2 212 ? -18.410 -43.220 -13.821 1.00 95.13 ? 204 HIS H CE1 1 ATOM 4147 N NE2 . HIS B 2 212 ? -17.737 -42.347 -13.094 1.00 106.26 ? 204 HIS H NE2 1 ATOM 4148 N N . LYS B 2 213 ? -21.784 -39.435 -12.770 1.00 144.16 ? 205 LYS H N 1 ATOM 4149 C CA . LYS B 2 213 ? -22.353 -38.856 -13.967 1.00 145.79 ? 205 LYS H CA 1 ATOM 4150 C C . LYS B 2 213 ? -21.742 -39.491 -15.233 1.00 138.93 ? 205 LYS H C 1 ATOM 4151 O O . LYS B 2 213 ? -22.480 -39.743 -16.178 1.00 145.18 ? 205 LYS H O 1 ATOM 4152 C CB . LYS B 2 213 ? -22.168 -37.333 -13.948 1.00 153.80 ? 205 LYS H CB 1 ATOM 4153 C CG . LYS B 2 213 ? -22.954 -36.591 -12.873 1.00 161.33 ? 205 LYS H CG 1 ATOM 4154 C CD . LYS B 2 213 ? -22.708 -35.079 -12.891 1.00 171.74 ? 205 LYS H CD 1 ATOM 4155 C CE . LYS B 2 213 ? -23.532 -34.369 -11.816 1.00 176.31 ? 205 LYS H CE 1 ATOM 4156 N NZ . LYS B 2 213 ? -23.283 -32.893 -11.806 1.00 183.51 ? 205 LYS H NZ 1 ATOM 4157 N N . PRO B 2 214 ? -20.417 -39.818 -15.239 1.00 131.92 ? 206 PRO H N 1 ATOM 4158 C CA . PRO B 2 214 ? -19.840 -40.334 -16.501 1.00 135.91 ? 206 PRO H CA 1 ATOM 4159 C C . PRO B 2 214 ? -20.481 -41.612 -17.073 1.00 148.51 ? 206 PRO H C 1 ATOM 4160 O O . PRO B 2 214 ? -20.534 -41.771 -18.292 1.00 149.72 ? 206 PRO H O 1 ATOM 4161 C CB . PRO B 2 214 ? -18.380 -40.607 -16.131 1.00 128.48 ? 206 PRO H CB 1 ATOM 4162 C CG . PRO B 2 214 ? -18.081 -39.627 -15.062 1.00 126.89 ? 206 PRO H CG 1 ATOM 4163 C CD . PRO B 2 214 ? -19.350 -39.517 -14.257 1.00 126.93 ? 206 PRO H CD 1 ATOM 4164 N N . SER B 2 215 ? -20.897 -42.524 -16.202 1.00 171.08 ? 207 SER H N 1 ATOM 4165 C CA . SER B 2 215 ? -21.509 -43.783 -16.617 1.00 89.37 ? 207 SER H CA 1 ATOM 4166 C C . SER B 2 215 ? -23.025 -43.744 -16.448 1.00 99.45 ? 207 SER H C 1 ATOM 4167 O O . SER B 2 215 ? -23.691 -44.770 -16.592 1.00 117.74 ? 207 SER H O 1 ATOM 4168 C CB . SER B 2 215 ? -20.925 -44.948 -15.827 1.00 100.52 ? 207 SER H CB 1 ATOM 4169 O OG . SER B 2 215 ? -21.323 -44.857 -14.473 1.00 111.99 ? 207 SER H OG 1 ATOM 4170 N N . ASN B 2 216 ? -23.554 -42.552 -16.163 1.00 204.43 ? 208 ASN H N 1 ATOM 4171 C CA . ASN B 2 216 ? -24.977 -42.325 -15.891 1.00 195.11 ? 208 ASN H CA 1 ATOM 4172 C C . ASN B 2 216 ? -25.476 -43.334 -14.845 1.00 183.57 ? 208 ASN H C 1 ATOM 4173 O O . ASN B 2 216 ? -26.599 -43.834 -14.896 1.00 186.70 ? 208 ASN H O 1 ATOM 4174 C CB . ASN B 2 216 ? -25.765 -42.453 -17.219 1.00 194.06 ? 208 ASN H CB 1 ATOM 4175 C CG . ASN B 2 216 ? -27.161 -41.832 -17.172 1.00 202.71 ? 208 ASN H CG 1 ATOM 4176 O OD1 . ASN B 2 216 ? -28.151 -42.521 -16.919 1.00 202.83 ? 208 ASN H OD1 1 ATOM 4177 N ND2 . ASN B 2 216 ? -27.247 -40.540 -17.473 1.00 211.91 ? 208 ASN H ND2 1 ATOM 4178 N N . THR B 2 217 ? -24.630 -43.583 -13.853 1.00 170.03 ? 209 THR H N 1 ATOM 4179 C CA . THR B 2 217 ? -24.979 -44.472 -12.766 1.00 160.24 ? 209 THR H CA 1 ATOM 4180 C C . THR B 2 217 ? -25.453 -43.686 -11.554 1.00 161.82 ? 209 THR H C 1 ATOM 4181 O O . THR B 2 217 ? -24.838 -42.699 -11.153 1.00 165.12 ? 209 THR H O 1 ATOM 4182 C CB . THR B 2 217 ? -23.784 -45.355 -12.390 1.00 152.35 ? 209 THR H CB 1 ATOM 4183 O OG1 . THR B 2 217 ? -23.384 -46.101 -13.544 1.00 147.69 ? 209 THR H OG1 1 ATOM 4184 C CG2 . THR B 2 217 ? -24.145 -46.322 -11.266 1.00 146.65 ? 209 THR H CG2 1 ATOM 4185 N N . LYS B 2 218 ? -26.557 -44.130 -10.980 1.00 156.21 ? 210 LYS H N 1 ATOM 4186 C CA . LYS B 2 218 ? -27.070 -43.585 -9.740 1.00 155.46 ? 210 LYS H CA 1 ATOM 4187 C C . LYS B 2 218 ? -27.579 -44.746 -8.898 1.00 152.47 ? 210 LYS H C 1 ATOM 4188 O O . LYS B 2 218 ? -28.459 -45.489 -9.328 1.00 158.69 ? 210 LYS H O 1 ATOM 4189 C CB . LYS B 2 218 ? -28.090 -42.484 -10.004 1.00 164.99 ? 210 LYS H CB 1 ATOM 4190 C CG . LYS B 2 218 ? -28.845 -42.624 -11.284 1.00 175.08 ? 210 LYS H CG 1 ATOM 4191 C CD . LYS B 2 218 ? -29.642 -41.357 -11.568 1.00 194.87 ? 210 LYS H CD 1 ATOM 4192 C CE . LYS B 2 218 ? -30.829 -41.163 -10.660 1.00 204.40 ? 210 LYS H CE 1 ATOM 4193 N NZ . LYS B 2 218 ? -31.299 -39.746 -10.706 1.00 217.03 ? 210 LYS H NZ 1 ATOM 4194 N N . VAL B 2 219 ? -26.963 -44.948 -7.737 1.00 145.41 ? 211 VAL H N 1 ATOM 4195 C CA . VAL B 2 219 ? -27.352 -46.031 -6.826 1.00 135.55 ? 211 VAL H CA 1 ATOM 4196 C C . VAL B 2 219 ? -27.792 -45.437 -5.480 1.00 136.00 ? 211 VAL H C 1 ATOM 4197 O O . VAL B 2 219 ? -27.191 -44.501 -4.979 1.00 141.22 ? 211 VAL H O 1 ATOM 4198 C CB . VAL B 2 219 ? -26.186 -47.037 -6.612 1.00 100.54 ? 211 VAL H CB 1 ATOM 4199 C CG1 . VAL B 2 219 ? -26.602 -48.155 -5.694 1.00 96.02 ? 211 VAL H CG1 1 ATOM 4200 C CG2 . VAL B 2 219 ? -25.734 -47.618 -7.933 1.00 104.05 ? 211 VAL H CG2 1 ATOM 4201 N N . ASP B 2 220 ? -28.857 -45.985 -4.904 1.00 134.06 ? 212 ASP H N 1 ATOM 4202 C CA . ASP B 2 220 ? -29.157 -45.736 -3.500 1.00 141.08 ? 212 ASP H CA 1 ATOM 4203 C C . ASP B 2 220 ? -28.890 -47.017 -2.723 1.00 138.43 ? 212 ASP H C 1 ATOM 4204 O O . ASP B 2 220 ? -29.446 -48.068 -3.038 1.00 133.87 ? 212 ASP H O 1 ATOM 4205 C CB . ASP B 2 220 ? -30.620 -45.305 -3.318 1.00 147.86 ? 212 ASP H CB 1 ATOM 4206 C CG . ASP B 2 220 ? -30.925 -43.950 -3.946 1.00 154.11 ? 212 ASP H CG 1 ATOM 4207 O OD1 . ASP B 2 220 ? -30.043 -43.066 -3.932 1.00 160.71 ? 212 ASP H OD1 1 ATOM 4208 O OD2 . ASP B 2 220 ? -32.065 -43.761 -4.428 1.00 149.52 ? 212 ASP H OD2 1 ATOM 4209 N N . LYS B 2 221 ? -28.048 -46.929 -1.699 1.00 140.36 ? 213 LYS H N 1 ATOM 4210 C CA . LYS B 2 221 ? -27.838 -48.072 -0.831 1.00 138.95 ? 213 LYS H CA 1 ATOM 4211 C C . LYS B 2 221 ? -28.296 -47.925 0.608 1.00 143.33 ? 213 LYS H C 1 ATOM 4212 O O . LYS B 2 221 ? -27.859 -47.029 1.330 1.00 151.84 ? 213 LYS H O 1 ATOM 4213 C CB . LYS B 2 221 ? -26.338 -48.398 -0.815 1.00 136.04 ? 213 LYS H CB 1 ATOM 4214 C CG . LYS B 2 221 ? -25.993 -49.798 -0.340 1.00 133.89 ? 213 LYS H CG 1 ATOM 4215 C CD . LYS B 2 221 ? -25.960 -50.833 -1.431 1.00 135.83 ? 213 LYS H CD 1 ATOM 4216 C CE . LYS B 2 221 ? -25.646 -52.189 -0.827 1.00 132.08 ? 213 LYS H CE 1 ATOM 4217 N NZ . LYS B 2 221 ? -25.865 -53.272 -1.809 1.00 135.65 ? 213 LYS H NZ 1 ATOM 4218 N N . ARG B 2 222 ? -29.233 -48.787 0.998 1.00 137.32 ? 214 ARG H N 1 ATOM 4219 C CA . ARG B 2 222 ? -29.636 -48.898 2.389 1.00 133.53 ? 214 ARG H CA 1 ATOM 4220 C C . ARG B 2 222 ? -28.555 -49.627 3.171 1.00 129.84 ? 214 ARG H C 1 ATOM 4221 O O . ARG B 2 222 ? -28.138 -50.719 2.794 1.00 121.91 ? 214 ARG H O 1 ATOM 4222 C CB . ARG B 2 222 ? -30.974 -49.620 2.515 1.00 129.38 ? 214 ARG H CB 1 ATOM 4223 C CG . ARG B 2 222 ? -31.546 -49.633 3.909 1.00 132.25 ? 214 ARG H CG 1 ATOM 4224 C CD . ARG B 2 222 ? -32.818 -50.437 3.960 1.00 139.03 ? 214 ARG H CD 1 ATOM 4225 N NE . ARG B 2 222 ? -33.512 -50.237 5.227 1.00 154.53 ? 214 ARG H NE 1 ATOM 4226 C CZ . ARG B 2 222 ? -34.764 -50.619 5.477 1.00 162.15 ? 214 ARG H CZ 1 ATOM 4227 N NH1 . ARG B 2 222 ? -35.485 -51.224 4.535 1.00 160.96 ? 214 ARG H NH1 1 ATOM 4228 N NH2 . ARG B 2 222 ? -35.297 -50.390 6.677 1.00 165.23 ? 214 ARG H NH2 1 ATOM 4229 N N . VAL B 2 223 ? -28.157 -49.070 4.298 1.00 142.11 ? 215 VAL H N 1 ATOM 4230 C CA . VAL B 2 223 ? -27.132 -49.690 5.121 1.00 144.84 ? 215 VAL H CA 1 ATOM 4231 C C . VAL B 2 223 ? -27.770 -50.224 6.422 1.00 155.43 ? 215 VAL H C 1 ATOM 4232 O O . VAL B 2 223 ? -28.213 -49.452 7.270 1.00 148.59 ? 215 VAL H O 1 ATOM 4233 C CB . VAL B 2 223 ? -25.976 -48.714 5.381 1.00 142.79 ? 215 VAL H CB 1 ATOM 4234 C CG1 . VAL B 2 223 ? -25.166 -48.537 4.100 1.00 136.43 ? 215 VAL H CG1 1 ATOM 4235 C CG2 . VAL B 2 223 ? -26.504 -47.368 5.844 1.00 156.13 ? 215 VAL H CG2 1 ATOM 4236 N N . GLU B 2 224 ? -27.899 -51.546 6.530 1.00 118.60 ? 216 GLU H N 1 ATOM 4237 C CA . GLU B 2 224 ? -28.557 -52.158 7.681 1.00 131.11 ? 216 GLU H CA 1 ATOM 4238 C C . GLU B 2 224 ? -27.545 -52.824 8.611 1.00 120.73 ? 216 GLU H C 1 ATOM 4239 O O . GLU B 2 224 ? -27.529 -52.558 9.819 1.00 167.59 ? 216 GLU H O 1 ATOM 4240 C CB . GLU B 2 224 ? -29.598 -53.180 7.219 1.00 154.17 ? 216 GLU H CB 1 ATOM 4241 C CG . GLU B 2 224 ? -30.787 -52.571 6.492 1.00 183.72 ? 216 GLU H CG 1 ATOM 4242 C CD . GLU B 2 224 ? -31.759 -53.620 5.988 1.00 220.85 ? 216 GLU H CD 1 ATOM 4243 O OE1 . GLU B 2 224 ? -31.418 -54.820 6.035 1.00 229.00 ? 216 GLU H OE1 1 ATOM 4244 O OE2 . GLU B 2 224 ? -32.864 -53.244 5.542 1.00 218.94 ? 216 GLU H OE2 1 ATOM 4245 N N . VAL C 3 3 ? 17.853 -24.555 -13.944 1.00 217.56 ? 3 VAL L N 1 ATOM 4246 C CA . VAL C 3 3 ? 16.398 -24.625 -13.954 1.00 212.59 ? 3 VAL L CA 1 ATOM 4247 C C . VAL C 3 3 ? 15.863 -23.739 -12.821 1.00 208.74 ? 3 VAL L C 1 ATOM 4248 O O . VAL C 3 3 ? 16.554 -22.830 -12.365 1.00 210.26 ? 3 VAL L O 1 ATOM 4249 C CB . VAL C 3 3 ? 15.892 -26.095 -13.817 1.00 213.43 ? 3 VAL L CB 1 ATOM 4250 C CG1 . VAL C 3 3 ? 14.564 -26.292 -14.562 1.00 207.40 ? 3 VAL L CG1 1 ATOM 4251 C CG2 . VAL C 3 3 ? 16.927 -27.070 -14.368 1.00 217.37 ? 3 VAL L CG2 1 ATOM 4252 N N . LEU C 3 4 ? 14.646 -24.005 -12.362 1.00 203.20 ? 4 LEU L N 1 ATOM 4253 C CA . LEU C 3 4 ? 14.050 -23.218 -11.286 1.00 196.39 ? 4 LEU L CA 1 ATOM 4254 C C . LEU C 3 4 ? 13.820 -24.068 -10.052 1.00 186.82 ? 4 LEU L C 1 ATOM 4255 O O . LEU C 3 4 ? 12.982 -24.971 -10.069 1.00 184.51 ? 4 LEU L O 1 ATOM 4256 C CB . LEU C 3 4 ? 12.722 -22.593 -11.725 1.00 195.00 ? 4 LEU L CB 1 ATOM 4257 C CG . LEU C 3 4 ? 12.752 -21.486 -12.778 1.00 191.28 ? 4 LEU L CG 1 ATOM 4258 C CD1 . LEU C 3 4 ? 11.370 -20.886 -12.942 1.00 185.51 ? 4 LEU L CD1 1 ATOM 4259 C CD2 . LEU C 3 4 ? 13.751 -20.428 -12.393 1.00 191.38 ? 4 LEU L CD2 1 ATOM 4260 N N . THR C 3 5 ? 14.566 -23.791 -8.983 1.00 181.38 ? 5 THR L N 1 ATOM 4261 C CA . THR C 3 5 ? 14.363 -24.542 -7.741 1.00 174.01 ? 5 THR L CA 1 ATOM 4262 C C . THR C 3 5 ? 13.622 -23.724 -6.688 1.00 162.04 ? 5 THR L C 1 ATOM 4263 O O . THR C 3 5 ? 14.148 -22.771 -6.133 1.00 153.05 ? 5 THR L O 1 ATOM 4264 C CB . THR C 3 5 ? 15.688 -25.030 -7.127 1.00 178.95 ? 5 THR L CB 1 ATOM 4265 O OG1 . THR C 3 5 ? 16.544 -23.913 -6.864 1.00 183.80 ? 5 THR L OG1 1 ATOM 4266 C CG2 . THR C 3 5 ? 16.383 -26.023 -8.048 1.00 178.09 ? 5 THR L CG2 1 ATOM 4267 N N . GLN C 3 6 ? 12.434 -24.196 -6.342 1.00 157.38 ? 6 GLN L N 1 ATOM 4268 C CA . GLN C 3 6 ? 11.519 -23.485 -5.463 1.00 152.01 ? 6 GLN L CA 1 ATOM 4269 C C . GLN C 3 6 ? 11.532 -24.261 -4.141 1.00 154.59 ? 6 GLN L C 1 ATOM 4270 O O . GLN C 3 6 ? 11.480 -25.497 -4.124 1.00 153.94 ? 6 GLN L O 1 ATOM 4271 C CB . GLN C 3 6 ? 10.115 -23.395 -6.080 1.00 142.79 ? 6 GLN L CB 1 ATOM 4272 C CG . GLN C 3 6 ? 9.161 -22.392 -5.434 1.00 136.98 ? 6 GLN L CG 1 ATOM 4273 C CD . GLN C 3 6 ? 7.805 -22.315 -6.151 1.00 125.90 ? 6 GLN L CD 1 ATOM 4274 O OE1 . GLN C 3 6 ? 7.701 -22.593 -7.348 1.00 116.80 ? 6 GLN L OE1 1 ATOM 4275 N NE2 . GLN C 3 6 ? 6.768 -21.923 -5.417 1.00 124.26 ? 6 GLN L NE2 1 ATOM 4276 N N . SER C 3 7 ? 11.602 -23.531 -3.034 1.00 154.73 ? 7 SER L N 1 ATOM 4277 C CA . SER C 3 7 ? 11.588 -24.154 -1.729 1.00 156.51 ? 7 SER L CA 1 ATOM 4278 C C . SER C 3 7 ? 10.879 -23.238 -0.734 1.00 157.20 ? 7 SER L C 1 ATOM 4279 O O . SER C 3 7 ? 10.751 -22.065 -0.984 1.00 152.94 ? 7 SER L O 1 ATOM 4280 C CB . SER C 3 7 ? 13.035 -24.432 -1.311 1.00 164.01 ? 7 SER L CB 1 ATOM 4281 O OG . SER C 3 7 ? 13.735 -23.214 -1.106 1.00 168.38 ? 7 SER L OG 1 ATOM 4282 N N . PRO C 3 8 ? 10.356 -23.796 0.373 1.00 162.05 ? 8 PRO L N 1 ATOM 4283 C CA . PRO C 3 8 ? 10.404 -25.235 0.641 1.00 163.30 ? 8 PRO L CA 1 ATOM 4284 C C . PRO C 3 8 ? 9.297 -25.932 -0.132 1.00 158.70 ? 8 PRO L C 1 ATOM 4285 O O . PRO C 3 8 ? 8.442 -25.255 -0.693 1.00 162.72 ? 8 PRO L O 1 ATOM 4286 C CB . PRO C 3 8 ? 10.157 -25.310 2.147 1.00 164.89 ? 8 PRO L CB 1 ATOM 4287 C CG . PRO C 3 8 ? 9.254 -24.135 2.410 1.00 161.25 ? 8 PRO L CG 1 ATOM 4288 C CD . PRO C 3 8 ? 9.732 -23.049 1.483 1.00 160.86 ? 8 PRO L CD 1 ATOM 4289 N N . ALA C 3 9 ? 9.339 -27.257 -0.189 1.00 152.69 ? 9 ALA L N 1 ATOM 4290 C CA . ALA C 3 9 ? 8.316 -28.046 -0.871 1.00 148.25 ? 9 ALA L CA 1 ATOM 4291 C C . ALA C 3 9 ? 6.904 -27.818 -0.334 1.00 144.96 ? 9 ALA L C 1 ATOM 4292 O O . ALA C 3 9 ? 5.962 -27.571 -1.104 1.00 137.61 ? 9 ALA L O 1 ATOM 4293 C CB . ALA C 3 9 ? 8.668 -29.533 -0.800 1.00 151.61 ? 9 ALA L CB 1 ATOM 4294 N N . THR C 3 10 ? 6.765 -27.869 0.986 1.00 149.72 ? 10 THR L N 1 ATOM 4295 C CA . THR C 3 10 ? 5.461 -27.707 1.603 1.00 151.31 ? 10 THR L CA 1 ATOM 4296 C C . THR C 3 10 ? 5.475 -26.728 2.759 1.00 156.20 ? 10 THR L C 1 ATOM 4297 O O . THR C 3 10 ? 6.530 -26.397 3.305 1.00 162.16 ? 10 THR L O 1 ATOM 4298 C CB . THR C 3 10 ? 4.969 -29.053 2.194 1.00 148.48 ? 10 THR L CB 1 ATOM 4299 O OG1 . THR C 3 10 ? 5.891 -29.487 3.200 1.00 150.04 ? 10 THR L OG1 1 ATOM 4300 C CG2 . THR C 3 10 ? 4.898 -30.127 1.130 1.00 145.62 ? 10 THR L CG2 1 ATOM 4301 N N . LEU C 3 11 ? 4.304 -26.195 3.074 1.00 153.41 ? 11 LEU L N 1 ATOM 4302 C CA . LEU C 3 11 ? 4.254 -25.160 4.075 1.00 155.67 ? 11 LEU L CA 1 ATOM 4303 C C . LEU C 3 11 ? 2.931 -25.241 4.832 1.00 158.62 ? 11 LEU L C 1 ATOM 4304 O O . LEU C 3 11 ? 1.879 -24.906 4.290 1.00 153.43 ? 11 LEU L O 1 ATOM 4305 C CB . LEU C 3 11 ? 4.427 -23.820 3.382 1.00 149.84 ? 11 LEU L CB 1 ATOM 4306 C CG . LEU C 3 11 ? 4.973 -22.729 4.280 1.00 152.77 ? 11 LEU L CG 1 ATOM 4307 C CD1 . LEU C 3 11 ? 6.151 -23.299 5.036 1.00 159.37 ? 11 LEU L CD1 1 ATOM 4308 C CD2 . LEU C 3 11 ? 5.412 -21.560 3.441 1.00 151.35 ? 11 LEU L CD2 1 ATOM 4309 N N . SER C 3 12 ? 2.991 -25.683 6.086 1.00 166.08 ? 12 SER L N 1 ATOM 4310 C CA . SER C 3 12 ? 1.803 -25.790 6.924 1.00 170.29 ? 12 SER L CA 1 ATOM 4311 C C . SER C 3 12 ? 1.731 -24.598 7.867 1.00 173.98 ? 12 SER L C 1 ATOM 4312 O O . SER C 3 12 ? 2.558 -24.466 8.762 1.00 177.78 ? 12 SER L O 1 ATOM 4313 C CB . SER C 3 12 ? 1.829 -27.099 7.696 1.00 178.45 ? 12 SER L CB 1 ATOM 4314 O OG . SER C 3 12 ? 1.908 -28.183 6.789 1.00 178.09 ? 12 SER L OG 1 ATOM 4315 N N . LEU C 3 13 ? 0.767 -23.710 7.663 1.00 176.92 ? 13 LEU L N 1 ATOM 4316 C CA . LEU C 3 13 ? 0.711 -22.513 8.503 1.00 189.74 ? 13 LEU L CA 1 ATOM 4317 C C . LEU C 3 13 ? -0.675 -22.108 8.982 1.00 193.64 ? 13 LEU L C 1 ATOM 4318 O O . LEU C 3 13 ? -1.688 -22.479 8.390 1.00 190.37 ? 13 LEU L O 1 ATOM 4319 C CB . LEU C 3 13 ? 1.346 -21.328 7.781 1.00 192.15 ? 13 LEU L CB 1 ATOM 4320 C CG . LEU C 3 13 ? 2.838 -21.436 7.467 1.00 191.47 ? 13 LEU L CG 1 ATOM 4321 C CD1 . LEU C 3 13 ? 3.285 -20.236 6.630 1.00 187.93 ? 13 LEU L CD1 1 ATOM 4322 C CD2 . LEU C 3 13 ? 3.661 -21.565 8.744 1.00 194.89 ? 13 LEU L CD2 1 ATOM 4323 N N . SER C 3 14 ? -0.705 -21.354 10.076 1.00 199.78 ? 14 SER L N 1 ATOM 4324 C CA . SER C 3 14 ? -1.960 -20.881 10.631 1.00 204.35 ? 14 SER L CA 1 ATOM 4325 C C . SER C 3 14 ? -2.265 -19.528 9.995 1.00 201.86 ? 14 SER L C 1 ATOM 4326 O O . SER C 3 14 ? -1.347 -18.820 9.590 1.00 206.24 ? 14 SER L O 1 ATOM 4327 C CB . SER C 3 14 ? -1.849 -20.745 12.142 1.00 218.19 ? 14 SER L CB 1 ATOM 4328 O OG . SER C 3 14 ? -1.201 -21.873 12.682 1.00 222.68 ? 14 SER L OG 1 ATOM 4329 N N . PRO C 3 15 ? -3.552 -19.152 9.926 1.00 197.81 ? 15 PRO L N 1 ATOM 4330 C CA . PRO C 3 15 ? -3.999 -17.815 9.492 1.00 197.23 ? 15 PRO L CA 1 ATOM 4331 C C . PRO C 3 15 ? -3.405 -16.644 10.286 1.00 199.38 ? 15 PRO L C 1 ATOM 4332 O O . PRO C 3 15 ? -3.386 -16.702 11.510 1.00 203.83 ? 15 PRO L O 1 ATOM 4333 C CB . PRO C 3 15 ? -5.515 -17.876 9.688 1.00 201.11 ? 15 PRO L CB 1 ATOM 4334 C CG . PRO C 3 15 ? -5.846 -19.326 9.597 1.00 197.34 ? 15 PRO L CG 1 ATOM 4335 C CD . PRO C 3 15 ? -4.684 -20.057 10.189 1.00 197.60 ? 15 PRO L CD 1 ATOM 4336 N N . GLY C 3 16 ? -2.931 -15.600 9.610 1.00 196.05 ? 16 GLY L N 1 ATOM 4337 C CA . GLY C 3 16 ? -2.332 -14.494 10.330 1.00 199.87 ? 16 GLY L CA 1 ATOM 4338 C C . GLY C 3 16 ? -0.823 -14.442 10.194 1.00 196.79 ? 16 GLY L C 1 ATOM 4339 O O . GLY C 3 16 ? -0.219 -13.368 10.174 1.00 200.00 ? 16 GLY L O 1 ATOM 4340 N N . GLU C 3 17 ? -0.215 -15.620 10.102 1.00 191.90 ? 17 GLU L N 1 ATOM 4341 C CA . GLU C 3 17 ? 1.234 -15.738 9.997 1.00 191.72 ? 17 GLU L CA 1 ATOM 4342 C C . GLU C 3 17 ? 1.714 -15.267 8.630 1.00 190.02 ? 17 GLU L C 1 ATOM 4343 O O . GLU C 3 17 ? 0.912 -14.876 7.786 1.00 182.53 ? 17 GLU L O 1 ATOM 4344 C CB . GLU C 3 17 ? 1.656 -17.197 10.233 1.00 187.32 ? 17 GLU L CB 1 ATOM 4345 C CG . GLU C 3 17 ? 1.262 -17.752 11.606 1.00 196.92 ? 17 GLU L CG 1 ATOM 4346 C CD . GLU C 3 17 ? 1.696 -19.202 11.835 1.00 194.63 ? 17 GLU L CD 1 ATOM 4347 O OE1 . GLU C 3 17 ? 1.883 -19.593 13.014 1.00 200.07 ? 17 GLU L OE1 1 ATOM 4348 O OE2 . GLU C 3 17 ? 1.831 -19.954 10.843 1.00 181.75 ? 17 GLU L OE2 1 ATOM 4349 N N . THR C 3 18 ? 3.027 -15.280 8.425 1.00 195.66 ? 18 THR L N 1 ATOM 4350 C CA . THR C 3 18 ? 3.591 -14.889 7.140 1.00 194.76 ? 18 THR L CA 1 ATOM 4351 C C . THR C 3 18 ? 4.324 -16.066 6.500 1.00 191.32 ? 18 THR L C 1 ATOM 4352 O O . THR C 3 18 ? 5.091 -16.759 7.167 1.00 196.02 ? 18 THR L O 1 ATOM 4353 C CB . THR C 3 18 ? 4.550 -13.689 7.288 1.00 196.55 ? 18 THR L CB 1 ATOM 4354 O OG1 . THR C 3 18 ? 3.818 -12.537 7.724 1.00 202.64 ? 18 THR L OG1 1 ATOM 4355 C CG2 . THR C 3 18 ? 5.254 -13.385 5.967 1.00 185.90 ? 18 THR L CG2 1 ATOM 4356 N N . ALA C 3 19 ? 4.072 -16.298 5.211 1.00 179.61 ? 19 ALA L N 1 ATOM 4357 C CA . ALA C 3 19 ? 4.736 -17.373 4.465 1.00 171.84 ? 19 ALA L CA 1 ATOM 4358 C C . ALA C 3 19 ? 5.907 -16.861 3.624 1.00 164.42 ? 19 ALA L C 1 ATOM 4359 O O . ALA C 3 19 ? 5.756 -15.876 2.903 1.00 165.32 ? 19 ALA L O 1 ATOM 4360 C CB . ALA C 3 19 ? 3.735 -18.088 3.587 1.00 168.95 ? 19 ALA L CB 1 ATOM 4361 N N . ILE C 3 20 ? 7.072 -17.518 3.716 1.00 160.07 ? 20 ILE L N 1 ATOM 4362 C CA . ILE C 3 20 ? 8.225 -17.158 2.879 1.00 157.12 ? 20 ILE L CA 1 ATOM 4363 C C . ILE C 3 20 ? 8.701 -18.269 1.934 1.00 161.04 ? 20 ILE L C 1 ATOM 4364 O O . ILE C 3 20 ? 9.354 -19.230 2.349 1.00 165.76 ? 20 ILE L O 1 ATOM 4365 C CB . ILE C 3 20 ? 9.449 -16.721 3.715 1.00 158.98 ? 20 ILE L CB 1 ATOM 4366 C CG1 . ILE C 3 20 ? 9.170 -15.418 4.479 1.00 160.02 ? 20 ILE L CG1 1 ATOM 4367 C CG2 . ILE C 3 20 ? 10.674 -16.539 2.809 1.00 157.94 ? 20 ILE L CG2 1 ATOM 4368 C CD1 . ILE C 3 20 ? 8.381 -15.577 5.773 1.00 161.61 ? 20 ILE L CD1 1 ATOM 4369 N N . ILE C 3 21 ? 8.339 -18.125 0.662 1.00 160.87 ? 21 ILE L N 1 ATOM 4370 C CA . ILE C 3 21 ? 8.754 -19.037 -0.403 1.00 159.24 ? 21 ILE L CA 1 ATOM 4371 C C . ILE C 3 21 ? 9.980 -18.506 -1.146 1.00 159.21 ? 21 ILE L C 1 ATOM 4372 O O . ILE C 3 21 ? 10.079 -17.304 -1.388 1.00 163.56 ? 21 ILE L O 1 ATOM 4373 C CB . ILE C 3 21 ? 7.627 -19.258 -1.400 1.00 159.59 ? 21 ILE L CB 1 ATOM 4374 C CG1 . ILE C 3 21 ? 6.356 -19.665 -0.678 1.00 164.92 ? 21 ILE L CG1 1 ATOM 4375 C CG2 . ILE C 3 21 ? 8.049 -20.272 -2.461 1.00 156.51 ? 21 ILE L CG2 1 ATOM 4376 C CD1 . ILE C 3 21 ? 5.145 -19.661 -1.568 1.00 162.43 ? 21 ILE L CD1 1 ATOM 4377 N N . SER C 3 22 ? 10.917 -19.377 -1.485 1.00 157.08 ? 22 SER L N 1 ATOM 4378 C CA . SER C 3 22 ? 12.171 -18.980 -2.122 1.00 161.27 ? 22 SER L CA 1 ATOM 4379 C C . SER C 3 22 ? 12.268 -19.650 -3.488 1.00 165.98 ? 22 SER L C 1 ATOM 4380 O O . SER C 3 22 ? 11.690 -20.719 -3.700 1.00 164.73 ? 22 SER L O 1 ATOM 4381 C CB . SER C 3 22 ? 13.373 -19.358 -1.267 1.00 163.08 ? 22 SER L CB 1 ATOM 4382 O OG . SER C 3 22 ? 14.573 -18.908 -1.878 1.00 161.38 ? 22 SER L OG 1 ATOM 4383 N N . CYS C 3 23 ? 12.983 -19.026 -4.425 1.00 173.23 ? 23 CYS L N 1 ATOM 4384 C CA . CYS C 3 23 ? 13.141 -19.561 -5.779 1.00 172.46 ? 23 CYS L CA 1 ATOM 4385 C C . CYS C 3 23 ? 14.532 -19.258 -6.343 1.00 168.27 ? 23 CYS L C 1 ATOM 4386 O O . CYS C 3 23 ? 14.945 -18.120 -6.370 1.00 156.88 ? 23 CYS L O 1 ATOM 4387 C CB . CYS C 3 23 ? 12.060 -18.962 -6.688 1.00 169.85 ? 23 CYS L CB 1 ATOM 4388 S SG . CYS C 3 23 ? 11.802 -19.777 -8.283 1.00 183.38 ? 23 CYS L SG 1 ATOM 4389 N N . ARG C 3 24 ? 15.260 -20.296 -6.750 1.00 174.45 ? 24 ARG L N 1 ATOM 4390 C CA . ARG C 3 24 ? 16.566 -20.141 -7.380 1.00 179.36 ? 24 ARG L CA 1 ATOM 4391 C C . ARG C 3 24 ? 16.610 -20.377 -8.890 1.00 181.52 ? 24 ARG L C 1 ATOM 4392 O O . ARG C 3 24 ? 16.228 -21.420 -9.407 1.00 180.82 ? 24 ARG L O 1 ATOM 4393 C CB . ARG C 3 24 ? 17.556 -21.068 -6.731 0.00 183.04 ? 24 ARG L CB 1 ATOM 4394 C CG . ARG C 3 24 ? 18.968 -20.833 -7.161 0.00 187.26 ? 24 ARG L CG 1 ATOM 4395 C CD . ARG C 3 24 ? 19.894 -21.765 -6.426 0.00 191.89 ? 24 ARG L CD 1 ATOM 4396 N NE . ARG C 3 24 ? 19.728 -21.623 -4.992 0.00 194.41 ? 24 ARG L NE 1 ATOM 4397 C CZ . ARG C 3 24 ? 20.321 -20.685 -4.268 0.00 198.49 ? 24 ARG L CZ 1 ATOM 4398 N NH1 . ARG C 3 24 ? 21.089 -19.782 -4.868 0.00 200.46 ? 24 ARG L NH1 1 ATOM 4399 N NH2 . ARG C 3 24 ? 20.116 -20.628 -2.958 0.00 200.91 ? 24 ARG L NH2 1 ATOM 4400 N N . THR C 3 25 ? 17.108 -19.361 -9.561 1.00 185.70 ? 25 THR L N 1 ATOM 4401 C CA . THR C 3 25 ? 17.310 -19.322 -10.993 1.00 188.63 ? 25 THR L CA 1 ATOM 4402 C C . THR C 3 25 ? 18.813 -19.322 -11.196 1.00 192.76 ? 25 THR L C 1 ATOM 4403 O O . THR C 3 25 ? 19.570 -19.071 -10.260 1.00 196.84 ? 25 THR L O 1 ATOM 4404 C CB . THR C 3 25 ? 16.855 -18.015 -11.600 1.00 192.50 ? 25 THR L CB 1 ATOM 4405 O OG1 . THR C 3 25 ? 17.762 -16.981 -11.237 1.00 199.62 ? 25 THR L OG1 1 ATOM 4406 C CG2 . THR C 3 25 ? 15.463 -17.682 -11.112 1.00 191.43 ? 25 THR L CG2 1 ATOM 4407 N N . SER C 3 26 ? 19.233 -19.568 -12.436 1.00 194.21 ? 26 SER L N 1 ATOM 4408 C CA . SER C 3 26 ? 20.660 -19.559 -12.762 1.00 200.17 ? 26 SER L CA 1 ATOM 4409 C C . SER C 3 26 ? 20.907 -18.609 -13.937 1.00 196.45 ? 26 SER L C 1 ATOM 4410 O O . SER C 3 26 ? 22.058 -18.312 -14.290 1.00 198.36 ? 26 SER L O 1 ATOM 4411 C CB . SER C 3 26 ? 21.071 -20.972 -13.121 1.00 207.08 ? 26 SER L CB 1 ATOM 4412 O OG . SER C 3 26 ? 20.342 -21.412 -14.245 1.00 207.47 ? 26 SER L OG 1 ATOM 4413 N N . GLN C 3 27 ? 19.805 -18.097 -14.483 1.00 192.78 ? 27 GLN L N 1 ATOM 4414 C CA . GLN C 3 27 ? 19.709 -17.243 -15.677 1.00 191.01 ? 27 GLN L CA 1 ATOM 4415 C C . GLN C 3 27 ? 19.057 -15.967 -15.230 1.00 187.00 ? 27 GLN L C 1 ATOM 4416 O O . GLN C 3 27 ? 18.078 -16.012 -14.489 1.00 181.89 ? 27 GLN L O 1 ATOM 4417 C CB . GLN C 3 27 ? 18.947 -17.873 -16.861 1.00 187.71 ? 27 GLN L CB 1 ATOM 4418 C CG . GLN C 3 27 ? 19.350 -19.276 -17.252 1.00 189.34 ? 27 GLN L CG 1 ATOM 4419 C CD . GLN C 3 27 ? 20.194 -19.322 -18.578 1.00 225.82 ? 27 GLN L CD 1 ATOM 4420 O OE1 . GLN C 3 27 ? 19.964 -18.539 -19.522 1.00 224.60 ? 27 GLN L OE1 1 ATOM 4421 N NE2 . GLN C 3 27 ? 21.193 -20.199 -18.610 1.00 230.75 ? 27 GLN L NE2 1 ATOM 4422 N N . SER C 3 28 ? 19.549 -14.800 -15.639 1.00 191.70 ? 28 SER L N 1 ATOM 4423 C CA . SER C 3 28 ? 18.857 -13.607 -15.192 1.00 192.70 ? 28 SER L CA 1 ATOM 4424 C C . SER C 3 28 ? 17.765 -13.184 -16.146 1.00 184.40 ? 28 SER L C 1 ATOM 4425 O O . SER C 3 28 ? 17.763 -13.526 -17.322 1.00 183.74 ? 28 SER L O 1 ATOM 4426 C CB . SER C 3 28 ? 19.839 -12.466 -14.971 1.00 203.22 ? 28 SER L CB 1 ATOM 4427 O OG . SER C 3 28 ? 20.599 -12.700 -13.798 1.00 212.41 ? 28 SER L OG 1 ATOM 4428 N N . GLY C 3 29 ? 16.798 -12.461 -15.582 1.00 177.31 ? 29 GLY L N 1 ATOM 4429 C CA . GLY C 3 29 ? 15.566 -12.086 -16.277 1.00 166.47 ? 29 GLY L CA 1 ATOM 4430 C C . GLY C 3 29 ? 14.405 -12.076 -15.312 1.00 151.51 ? 29 GLY L C 1 ATOM 4431 O O . GLY C 3 29 ? 14.516 -12.531 -14.177 1.00 146.20 ? 29 GLY L O 1 ATOM 4432 N N . SER C 3 30 ? 13.297 -11.529 -15.792 1.00 143.30 ? 30 SER L N 1 ATOM 4433 C CA . SER C 3 30 ? 12.007 -11.383 -15.083 1.00 136.21 ? 30 SER L CA 1 ATOM 4434 C C . SER C 3 30 ? 11.575 -12.667 -14.413 1.00 133.06 ? 30 SER L C 1 ATOM 4435 O O . SER C 3 30 ? 11.482 -13.682 -15.102 1.00 129.06 ? 30 SER L O 1 ATOM 4436 C CB . SER C 3 30 ? 10.978 -11.022 -16.163 1.00 141.35 ? 30 SER L CB 1 ATOM 4437 O OG . SER C 3 30 ? 11.361 -9.930 -16.972 1.00 147.68 ? 30 SER L OG 1 ATOM 4438 N N . LEU C 3 31 ? 11.301 -12.644 -13.116 1.00 140.14 ? 31 LEU L N 1 ATOM 4439 C CA . LEU C 3 31 ? 10.802 -13.841 -12.429 1.00 133.86 ? 31 LEU L CA 1 ATOM 4440 C C . LEU C 3 31 ? 9.410 -13.476 -11.941 1.00 127.17 ? 31 LEU L C 1 ATOM 4441 O O . LEU C 3 31 ? 9.194 -12.381 -11.444 1.00 128.36 ? 31 LEU L O 1 ATOM 4442 C CB . LEU C 3 31 ? 11.643 -14.348 -11.278 1.00 133.11 ? 31 LEU L CB 1 ATOM 4443 C CG . LEU C 3 31 ? 11.018 -15.590 -10.626 1.00 134.63 ? 31 LEU L CG 1 ATOM 4444 C CD1 . LEU C 3 31 ? 12.085 -16.606 -10.303 1.00 138.34 ? 31 LEU L CD1 1 ATOM 4445 C CD2 . LEU C 3 31 ? 10.247 -15.250 -9.349 1.00 138.80 ? 31 LEU L CD2 1 ATOM 4446 N N . ALA C 3 32 ? 8.471 -14.400 -12.066 1.00 120.18 ? 32 ALA L N 1 ATOM 4447 C CA . ALA C 3 32 ? 7.104 -14.099 -11.711 1.00 117.42 ? 32 ALA L CA 1 ATOM 4448 C C . ALA C 3 32 ? 6.557 -15.135 -10.731 1.00 119.63 ? 32 ALA L C 1 ATOM 4449 O O . ALA C 3 32 ? 7.090 -16.225 -10.630 1.00 130.15 ? 32 ALA L O 1 ATOM 4450 C CB . ALA C 3 32 ? 6.244 -14.049 -12.957 1.00 113.73 ? 32 ALA L CB 1 ATOM 4451 N N . TRP C 3 33 ? 5.516 -14.779 -9.983 1.00 111.82 ? 33 TRP L N 1 ATOM 4452 C CA . TRP C 3 33 ? 4.929 -15.733 -9.066 1.00 111.38 ? 33 TRP L CA 1 ATOM 4453 C C . TRP C 3 33 ? 3.449 -15.894 -9.386 1.00 109.40 ? 33 TRP L C 1 ATOM 4454 O O . TRP C 3 33 ? 2.743 -14.913 -9.671 1.00 109.70 ? 33 TRP L O 1 ATOM 4455 C CB . TRP C 3 33 ? 5.059 -15.261 -7.613 1.00 118.25 ? 33 TRP L CB 1 ATOM 4456 C CG . TRP C 3 33 ? 6.455 -15.195 -7.042 1.00 123.79 ? 33 TRP L CG 1 ATOM 4457 C CD1 . TRP C 3 33 ? 7.244 -14.088 -6.936 1.00 125.01 ? 33 TRP L CD1 1 ATOM 4458 C CD2 . TRP C 3 33 ? 7.204 -16.274 -6.467 1.00 126.00 ? 33 TRP L CD2 1 ATOM 4459 N NE1 . TRP C 3 33 ? 8.441 -14.411 -6.349 1.00 127.26 ? 33 TRP L NE1 1 ATOM 4460 C CE2 . TRP C 3 33 ? 8.441 -15.747 -6.046 1.00 126.65 ? 33 TRP L CE2 1 ATOM 4461 C CE3 . TRP C 3 33 ? 6.955 -17.640 -6.278 1.00 126.93 ? 33 TRP L CE3 1 ATOM 4462 C CZ2 . TRP C 3 33 ? 9.428 -16.538 -5.440 1.00 130.15 ? 33 TRP L CZ2 1 ATOM 4463 C CZ3 . TRP C 3 33 ? 7.937 -18.420 -5.673 1.00 129.93 ? 33 TRP L CZ3 1 ATOM 4464 C CH2 . TRP C 3 33 ? 9.156 -17.867 -5.265 1.00 131.18 ? 33 TRP L CH2 1 ATOM 4465 N N . TYR C 3 34 ? 3.000 -17.149 -9.336 1.00 111.64 ? 34 TYR L N 1 ATOM 4466 C CA . TYR C 3 34 ? 1.609 -17.514 -9.541 1.00 109.99 ? 34 TYR L CA 1 ATOM 4467 C C . TYR C 3 34 ? 1.037 -18.233 -8.324 1.00 105.07 ? 34 TYR L C 1 ATOM 4468 O O . TYR C 3 34 ? 1.727 -19.007 -7.633 1.00 98.43 ? 34 TYR L O 1 ATOM 4469 C CB . TYR C 3 34 ? 1.480 -18.396 -10.779 1.00 107.20 ? 34 TYR L CB 1 ATOM 4470 C CG . TYR C 3 34 ? 1.957 -17.719 -12.041 1.00 107.03 ? 34 TYR L CG 1 ATOM 4471 C CD1 . TYR C 3 34 ? 3.291 -17.768 -12.406 1.00 110.36 ? 34 TYR L CD1 1 ATOM 4472 C CD2 . TYR C 3 34 ? 1.062 -17.067 -12.894 1.00 109.78 ? 34 TYR L CD2 1 ATOM 4473 C CE1 . TYR C 3 34 ? 3.739 -17.162 -13.561 1.00 117.01 ? 34 TYR L CE1 1 ATOM 4474 C CE2 . TYR C 3 34 ? 1.502 -16.460 -14.058 1.00 112.36 ? 34 TYR L CE2 1 ATOM 4475 C CZ . TYR C 3 34 ? 2.844 -16.515 -14.385 1.00 116.55 ? 34 TYR L CZ 1 ATOM 4476 O OH . TYR C 3 34 ? 3.327 -15.925 -15.537 1.00 117.88 ? 34 TYR L OH 1 ATOM 4477 N N . GLN C 3 35 ? -0.263 -18.079 -8.153 1.00 105.78 ? 35 GLN L N 1 ATOM 4478 C CA . GLN C 3 35 ? -0.980 -18.794 -7.133 1.00 117.06 ? 35 GLN L CA 1 ATOM 4479 C C . GLN C 3 35 ? -2.034 -19.633 -7.752 1.00 120.80 ? 35 GLN L C 1 ATOM 4480 O O . GLN C 3 35 ? -2.836 -19.139 -8.542 1.00 124.05 ? 35 GLN L O 1 ATOM 4481 C CB . GLN C 3 35 ? -1.686 -17.844 -6.197 1.00 125.83 ? 35 GLN L CB 1 ATOM 4482 C CG . GLN C 3 35 ? -2.460 -18.580 -5.155 1.00 134.80 ? 35 GLN L CG 1 ATOM 4483 C CD . GLN C 3 35 ? -3.602 -17.762 -4.614 1.00 141.59 ? 35 GLN L CD 1 ATOM 4484 O OE1 . GLN C 3 35 ? -3.979 -17.889 -3.443 1.00 144.87 ? 35 GLN L OE1 1 ATOM 4485 N NE2 . GLN C 3 35 ? -4.193 -16.941 -5.477 1.00 141.26 ? 35 GLN L NE2 1 ATOM 4486 N N . GLN C 3 36 ? -2.049 -20.908 -7.420 1.00 119.58 ? 36 GLN L N 1 ATOM 4487 C CA . GLN C 3 36 ? -3.112 -21.704 -7.940 1.00 114.87 ? 36 GLN L CA 1 ATOM 4488 C C . GLN C 3 36 ? -3.925 -22.268 -6.795 1.00 115.01 ? 36 GLN L C 1 ATOM 4489 O O . GLN C 3 36 ? -3.419 -23.079 -6.013 1.00 103.49 ? 36 GLN L O 1 ATOM 4490 C CB . GLN C 3 36 ? -2.577 -22.775 -8.856 1.00 115.27 ? 36 GLN L CB 1 ATOM 4491 C CG . GLN C 3 36 ? -3.687 -23.560 -9.473 1.00 116.98 ? 36 GLN L CG 1 ATOM 4492 C CD . GLN C 3 36 ? -3.152 -24.651 -10.298 1.00 115.79 ? 36 GLN L CD 1 ATOM 4493 O OE1 . GLN C 3 36 ? -2.016 -25.087 -10.095 1.00 117.80 ? 36 GLN L OE1 1 ATOM 4494 N NE2 . GLN C 3 36 ? -3.920 -25.057 -11.304 1.00 113.61 ? 36 GLN L NE2 1 ATOM 4495 N N . ARG C 3 37 ? -5.192 -21.880 -6.748 1.00 129.10 ? 37 ARG L N 1 ATOM 4496 C CA . ARG C 3 37 ? -6.123 -22.372 -5.750 1.00 146.12 ? 37 ARG L CA 1 ATOM 4497 C C . ARG C 3 37 ? -6.690 -23.666 -6.276 1.00 150.30 ? 37 ARG L C 1 ATOM 4498 O O . ARG C 3 37 ? -6.708 -23.874 -7.490 1.00 155.28 ? 37 ARG L O 1 ATOM 4499 C CB . ARG C 3 37 ? -7.197 -21.330 -5.444 1.00 157.26 ? 37 ARG L CB 1 ATOM 4500 C CG . ARG C 3 37 ? -6.722 -19.977 -4.979 1.00 163.32 ? 37 ARG L CG 1 ATOM 4501 C CD . ARG C 3 37 ? -7.941 -19.093 -4.825 1.00 168.54 ? 37 ARG L CD 1 ATOM 4502 N NE . ARG C 3 37 ? -7.642 -17.789 -4.255 1.00 178.71 ? 37 ARG L NE 1 ATOM 4503 C CZ . ARG C 3 37 ? -8.573 -16.893 -3.947 1.00 188.52 ? 37 ARG L CZ 1 ATOM 4504 N NH1 . ARG C 3 37 ? -9.850 -17.162 -4.190 1.00 186.61 ? 37 ARG L NH1 1 ATOM 4505 N NH2 . ARG C 3 37 ? -8.229 -15.721 -3.423 1.00 197.53 ? 37 ARG L NH2 1 ATOM 4506 N N . PRO C 3 38 ? -7.121 -24.551 -5.367 1.00 154.80 ? 38 PRO L N 1 ATOM 4507 C CA . PRO C 3 38 ? -7.630 -25.888 -5.689 1.00 159.18 ? 38 PRO L CA 1 ATOM 4508 C C . PRO C 3 38 ? -8.777 -25.767 -6.703 1.00 156.85 ? 38 PRO L C 1 ATOM 4509 O O . PRO C 3 38 ? -9.834 -25.226 -6.394 1.00 162.00 ? 38 PRO L O 1 ATOM 4510 C CB . PRO C 3 38 ? -8.112 -26.410 -4.325 1.00 165.30 ? 38 PRO L CB 1 ATOM 4511 C CG . PRO C 3 38 ? -7.973 -25.247 -3.363 1.00 167.44 ? 38 PRO L CG 1 ATOM 4512 C CD . PRO C 3 38 ? -6.864 -24.428 -3.914 1.00 161.08 ? 38 PRO L CD 1 ATOM 4513 N N . GLY C 3 39 ? -8.558 -26.266 -7.910 1.00 145.59 ? 39 GLY L N 1 ATOM 4514 C CA . GLY C 3 39 ? -9.596 -26.338 -8.914 1.00 138.83 ? 39 GLY L CA 1 ATOM 4515 C C . GLY C 3 39 ? -9.830 -25.100 -9.761 1.00 133.69 ? 39 GLY L C 1 ATOM 4516 O O . GLY C 3 39 ? -10.831 -25.014 -10.481 1.00 139.30 ? 39 GLY L O 1 ATOM 4517 N N . GLN C 3 40 ? -8.923 -24.133 -9.680 1.00 122.68 ? 40 GLN L N 1 ATOM 4518 C CA . GLN C 3 40 ? -9.069 -22.915 -10.468 1.00 114.06 ? 40 GLN L CA 1 ATOM 4519 C C . GLN C 3 40 ? -7.786 -22.760 -11.269 1.00 109.20 ? 40 GLN L C 1 ATOM 4520 O O . GLN C 3 40 ? -6.753 -23.325 -10.886 1.00 111.13 ? 40 GLN L O 1 ATOM 4521 C CB . GLN C 3 40 ? -9.359 -21.683 -9.604 0.00 115.23 ? 40 GLN L CB 1 ATOM 4522 C CG . GLN C 3 40 ? -10.692 -21.729 -8.858 0.00 117.43 ? 40 GLN L CG 1 ATOM 4523 C CD . GLN C 3 40 ? -10.573 -22.234 -7.437 0.00 119.67 ? 40 GLN L CD 1 ATOM 4524 O OE1 . GLN C 3 40 ? -9.519 -22.697 -7.018 0.00 119.03 ? 40 GLN L OE1 1 ATOM 4525 N NE2 . GLN C 3 40 ? -11.662 -22.137 -6.684 0.00 122.71 ? 40 GLN L NE2 1 ATOM 4526 N N . ALA C 3 41 ? -7.824 -21.911 -12.296 1.00 104.55 ? 41 ALA L N 1 ATOM 4527 C CA . ALA C 3 41 ? -6.636 -21.593 -13.089 1.00 101.95 ? 41 ALA L CA 1 ATOM 4528 C C . ALA C 3 41 ? -5.686 -20.731 -12.288 1.00 109.35 ? 41 ALA L C 1 ATOM 4529 O O . ALA C 3 41 ? -6.127 -19.836 -11.562 1.00 115.39 ? 41 ALA L O 1 ATOM 4530 C CB . ALA C 3 41 ? -7.030 -20.893 -14.358 1.00 94.13 ? 41 ALA L CB 1 ATOM 4531 N N . PRO C 3 42 ? -4.374 -20.963 -12.433 1.00 107.86 ? 42 PRO L N 1 ATOM 4532 C CA . PRO C 3 42 ? -3.450 -20.052 -11.745 1.00 112.46 ? 42 PRO L CA 1 ATOM 4533 C C . PRO C 3 42 ? -3.740 -18.578 -12.028 1.00 116.88 ? 42 PRO L C 1 ATOM 4534 O O . PRO C 3 42 ? -4.256 -18.231 -13.093 1.00 118.49 ? 42 PRO L O 1 ATOM 4535 C CB . PRO C 3 42 ? -2.087 -20.428 -12.337 1.00 108.96 ? 42 PRO L CB 1 ATOM 4536 C CG . PRO C 3 42 ? -2.238 -21.859 -12.750 1.00 106.46 ? 42 PRO L CG 1 ATOM 4537 C CD . PRO C 3 42 ? -3.676 -22.011 -13.197 1.00 103.56 ? 42 PRO L CD 1 ATOM 4538 N N . ARG C 3 43 ? -3.466 -17.722 -11.057 1.00 120.26 ? 43 ARG L N 1 ATOM 4539 C CA . ARG C 3 43 ? -3.586 -16.293 -11.285 1.00 121.44 ? 43 ARG L CA 1 ATOM 4540 C C . ARG C 3 43 ? -2.235 -15.678 -11.012 1.00 117.98 ? 43 ARG L C 1 ATOM 4541 O O . ARG C 3 43 ? -1.601 -15.969 -9.995 1.00 118.51 ? 43 ARG L O 1 ATOM 4542 C CB . ARG C 3 43 ? -4.741 -15.676 -10.507 1.00 126.96 ? 43 ARG L CB 1 ATOM 4543 C CG . ARG C 3 43 ? -4.786 -15.844 -9.050 1.00 134.28 ? 43 ARG L CG 1 ATOM 4544 C CD . ARG C 3 43 ? -6.165 -15.357 -8.647 1.00 145.57 ? 43 ARG L CD 1 ATOM 4545 N NE . ARG C 3 43 ? -6.183 -14.571 -7.419 1.00 160.88 ? 43 ARG L NE 1 ATOM 4546 C CZ . ARG C 3 43 ? -7.123 -14.685 -6.488 1.00 164.12 ? 43 ARG L CZ 1 ATOM 4547 N NH1 . ARG C 3 43 ? -8.109 -15.565 -6.664 1.00 162.79 ? 43 ARG L NH1 1 ATOM 4548 N NH2 . ARG C 3 43 ? -7.074 -13.928 -5.392 1.00 162.79 ? 43 ARG L NH2 1 ATOM 4549 N N . LEU C 3 44 ? -1.795 -14.854 -11.958 1.00 116.24 ? 44 LEU L N 1 ATOM 4550 C CA . LEU C 3 44 ? -0.590 -14.063 -11.789 1.00 119.56 ? 44 LEU L CA 1 ATOM 4551 C C . LEU C 3 44 ? -0.693 -13.202 -10.548 1.00 124.69 ? 44 LEU L C 1 ATOM 4552 O O . LEU C 3 44 ? -1.663 -12.466 -10.342 1.00 127.76 ? 44 LEU L O 1 ATOM 4553 C CB . LEU C 3 44 ? -0.345 -13.194 -13.022 1.00 113.42 ? 44 LEU L CB 1 ATOM 4554 C CG . LEU C 3 44 ? 0.879 -12.290 -12.963 1.00 113.88 ? 44 LEU L CG 1 ATOM 4555 C CD1 . LEU C 3 44 ? 2.141 -13.146 -12.970 1.00 109.79 ? 44 LEU L CD1 1 ATOM 4556 C CD2 . LEU C 3 44 ? 0.879 -11.345 -14.134 1.00 114.92 ? 44 LEU L CD2 1 ATOM 4557 N N . VAL C 3 45 ? 0.362 -13.295 -9.748 1.00 122.19 ? 45 VAL L N 1 ATOM 4558 C CA . VAL C 3 45 ? 0.483 -12.602 -8.474 1.00 128.11 ? 45 VAL L CA 1 ATOM 4559 C C . VAL C 3 45 ? 1.603 -11.573 -8.491 1.00 131.87 ? 45 VAL L C 1 ATOM 4560 O O . VAL C 3 45 ? 1.455 -10.496 -7.904 1.00 133.38 ? 45 VAL L O 1 ATOM 4561 C CB . VAL C 3 45 ? 0.767 -13.602 -7.300 1.00 140.75 ? 45 VAL L CB 1 ATOM 4562 C CG1 . VAL C 3 45 ? 1.546 -12.933 -6.190 1.00 101.52 ? 45 VAL L CG1 1 ATOM 4563 C CG2 . VAL C 3 45 ? -0.517 -14.221 -6.778 1.00 96.68 ? 45 VAL L CG2 1 ATOM 4564 N N . ILE C 3 46 ? 2.723 -11.904 -9.144 1.00 132.13 ? 46 ILE L N 1 ATOM 4565 C CA . ILE C 3 46 ? 3.864 -10.977 -9.170 1.00 134.36 ? 46 ILE L CA 1 ATOM 4566 C C . ILE C 3 46 ? 4.732 -11.141 -10.409 1.00 135.51 ? 46 ILE L C 1 ATOM 4567 O O . ILE C 3 46 ? 4.896 -12.229 -10.905 1.00 133.97 ? 46 ILE L O 1 ATOM 4568 C CB . ILE C 3 46 ? 4.781 -11.119 -7.908 1.00 158.30 ? 46 ILE L CB 1 ATOM 4569 C CG1 . ILE C 3 46 ? 4.172 -10.398 -6.714 1.00 160.27 ? 46 ILE L CG1 1 ATOM 4570 C CG2 . ILE C 3 46 ? 6.198 -10.551 -8.133 1.00 161.60 ? 46 ILE L CG2 1 ATOM 4571 C CD1 . ILE C 3 46 ? 5.126 -10.253 -5.559 1.00 164.05 ? 46 ILE L CD1 1 ATOM 4572 N N . TYR C 3 47 ? 5.258 -10.035 -10.923 1.00 140.31 ? 47 TYR L N 1 ATOM 4573 C CA . TYR C 3 47 ? 6.217 -10.067 -12.024 1.00 140.29 ? 47 TYR L CA 1 ATOM 4574 C C . TYR C 3 47 ? 7.379 -9.112 -11.773 1.00 145.02 ? 47 TYR L C 1 ATOM 4575 O O . TYR C 3 47 ? 7.342 -8.297 -10.842 1.00 141.84 ? 47 TYR L O 1 ATOM 4576 C CB . TYR C 3 47 ? 5.528 -9.781 -13.367 1.00 141.79 ? 47 TYR L CB 1 ATOM 4577 C CG . TYR C 3 47 ? 4.895 -8.394 -13.473 1.00 149.30 ? 47 TYR L CG 1 ATOM 4578 C CD1 . TYR C 3 47 ? 3.616 -8.156 -12.958 1.00 147.68 ? 47 TYR L CD1 1 ATOM 4579 C CD2 . TYR C 3 47 ? 5.600 -7.305 -13.996 1.00 151.97 ? 47 TYR L CD2 1 ATOM 4580 C CE1 . TYR C 3 47 ? 3.028 -6.890 -13.027 1.00 145.80 ? 47 TYR L CE1 1 ATOM 4581 C CE2 . TYR C 3 47 ? 5.022 -6.029 -14.057 1.00 149.01 ? 47 TYR L CE2 1 ATOM 4582 C CZ . TYR C 3 47 ? 3.737 -5.832 -13.568 1.00 144.62 ? 47 TYR L CZ 1 ATOM 4583 O OH . TYR C 3 47 ? 3.151 -4.589 -13.630 1.00 141.70 ? 47 TYR L OH 1 ATOM 4584 N N . SER C 3 48 ? 8.441 -9.295 -12.559 1.00 150.10 ? 48 SER L N 1 ATOM 4585 C CA . SER C 3 48 ? 9.690 -8.558 -12.401 1.00 158.12 ? 48 SER L CA 1 ATOM 4586 C C . SER C 3 48 ? 10.309 -8.869 -11.061 1.00 169.65 ? 48 SER L C 1 ATOM 4587 O O . SER C 3 48 ? 11.235 -8.185 -10.625 1.00 175.66 ? 48 SER L O 1 ATOM 4588 C CB . SER C 3 48 ? 9.475 -7.048 -12.585 1.00 157.57 ? 48 SER L CB 1 ATOM 4589 O OG . SER C 3 48 ? 8.851 -6.745 -13.820 1.00 153.49 ? 48 SER L OG 1 ATOM 4590 N N . GLY C 3 49 ? 9.805 -9.912 -10.410 1.00 174.14 ? 49 GLY L N 1 ATOM 4591 C CA . GLY C 3 49 ? 10.343 -10.322 -9.130 1.00 181.45 ? 49 GLY L CA 1 ATOM 4592 C C . GLY C 3 49 ? 9.678 -9.502 -8.034 1.00 186.58 ? 49 GLY L C 1 ATOM 4593 O O . GLY C 3 49 ? 9.365 -10.041 -6.972 1.00 185.83 ? 49 GLY L O 1 ATOM 4594 N N . SER C 3 50 ? 9.442 -8.212 -8.276 1.00 190.49 ? 50 SER L N 1 ATOM 4595 C CA . SER C 3 50 ? 8.980 -7.337 -7.202 1.00 197.63 ? 50 SER L CA 1 ATOM 4596 C C . SER C 3 50 ? 7.681 -6.566 -7.411 1.00 194.65 ? 50 SER L C 1 ATOM 4597 O O . SER C 3 50 ? 7.292 -5.789 -6.546 1.00 200.26 ? 50 SER L O 1 ATOM 4598 C CB . SER C 3 50 ? 10.110 -6.319 -7.005 1.00 209.54 ? 50 SER L CB 1 ATOM 4599 O OG . SER C 3 50 ? 11.370 -6.948 -6.876 1.00 215.99 ? 50 SER L OG 1 ATOM 4600 N N . THR C 3 51 ? 7.005 -6.753 -8.540 1.00 186.19 ? 51 THR L N 1 ATOM 4601 C CA . THR C 3 51 ? 5.857 -5.896 -8.825 1.00 180.10 ? 51 THR L CA 1 ATOM 4602 C C . THR C 3 51 ? 4.514 -6.611 -8.731 1.00 172.08 ? 51 THR L C 1 ATOM 4603 O O . THR C 3 51 ? 4.294 -7.624 -9.394 1.00 163.18 ? 51 THR L O 1 ATOM 4604 C CB . THR C 3 51 ? 5.983 -5.276 -10.215 1.00 177.25 ? 51 THR L CB 1 ATOM 4605 O OG1 . THR C 3 51 ? 7.262 -4.641 -10.328 1.00 181.78 ? 51 THR L OG1 1 ATOM 4606 C CG2 . THR C 3 51 ? 4.887 -4.245 -10.431 1.00 175.78 ? 51 THR L CG2 1 ATOM 4607 N N . ARG C 3 52 ? 3.608 -6.060 -7.928 1.00 172.14 ? 52 ARG L N 1 ATOM 4608 C CA . ARG C 3 52 ? 2.281 -6.647 -7.781 1.00 164.31 ? 52 ARG L CA 1 ATOM 4609 C C . ARG C 3 52 ? 1.365 -6.390 -8.951 1.00 151.88 ? 52 ARG L C 1 ATOM 4610 O O . ARG C 3 52 ? 1.441 -5.351 -9.604 1.00 153.16 ? 52 ARG L O 1 ATOM 4611 C CB . ARG C 3 52 ? 1.619 -6.171 -6.488 1.00 174.67 ? 52 ARG L CB 1 ATOM 4612 C CG . ARG C 3 52 ? 2.321 -6.720 -5.277 1.00 189.04 ? 52 ARG L CG 1 ATOM 4613 C CD . ARG C 3 52 ? 1.705 -6.309 -3.950 1.00 205.21 ? 52 ARG L CD 1 ATOM 4614 N NE . ARG C 3 52 ? 1.749 -4.893 -3.614 1.00 217.23 ? 52 ARG L NE 1 ATOM 4615 C CZ . ARG C 3 52 ? 0.687 -4.098 -3.725 1.00 223.65 ? 52 ARG L CZ 1 ATOM 4616 N NH1 . ARG C 3 52 ? -0.473 -4.587 -4.141 1.00 222.03 ? 52 ARG L NH1 1 ATOM 4617 N NH2 . ARG C 3 52 ? 0.769 -2.818 -3.414 1.00 230.02 ? 52 ARG L NH2 1 ATOM 4618 N N . ALA C 3 53 ? 0.499 -7.364 -9.203 1.00 146.60 ? 53 ALA L N 1 ATOM 4619 C CA . ALA C 3 53 ? -0.518 -7.253 -10.239 1.00 149.86 ? 53 ALA L CA 1 ATOM 4620 C C . ALA C 3 53 ? -1.817 -6.634 -9.734 1.00 153.87 ? 53 ALA L C 1 ATOM 4621 O O . ALA C 3 53 ? -1.950 -6.264 -8.559 1.00 157.45 ? 53 ALA L O 1 ATOM 4622 C CB . ALA C 3 53 ? -0.801 -8.624 -10.843 1.00 148.94 ? 53 ALA L CB 1 ATOM 4623 N N . ALA C 3 54 ? -2.760 -6.512 -10.662 1.00 157.24 ? 54 ALA L N 1 ATOM 4624 C CA . ALA C 3 54 ? -4.063 -5.924 -10.395 1.00 164.68 ? 54 ALA L CA 1 ATOM 4625 C C . ALA C 3 54 ? -4.913 -6.796 -9.483 1.00 165.70 ? 54 ALA L C 1 ATOM 4626 O O . ALA C 3 54 ? -5.063 -7.998 -9.724 1.00 155.85 ? 54 ALA L O 1 ATOM 4627 C CB . ALA C 3 54 ? -4.796 -5.668 -11.700 1.00 164.94 ? 54 ALA L CB 1 ATOM 4628 N N . GLY C 3 55 ? -5.474 -6.184 -8.446 1.00 174.50 ? 55 GLY L N 1 ATOM 4629 C CA . GLY C 3 55 ? -6.351 -6.889 -7.530 1.00 173.74 ? 55 GLY L CA 1 ATOM 4630 C C . GLY C 3 55 ? -5.560 -7.613 -6.470 1.00 172.63 ? 55 GLY L C 1 ATOM 4631 O O . GLY C 3 55 ? -6.122 -8.222 -5.563 1.00 175.65 ? 55 GLY L O 1 ATOM 4632 N N . ILE C 3 56 ? -4.241 -7.550 -6.587 1.00 167.47 ? 56 ILE L N 1 ATOM 4633 C CA . ILE C 3 56 ? -3.388 -8.117 -5.569 1.00 163.21 ? 56 ILE L CA 1 ATOM 4634 C C . ILE C 3 56 ? -3.194 -7.101 -4.443 1.00 162.83 ? 56 ILE L C 1 ATOM 4635 O O . ILE C 3 56 ? -2.722 -5.987 -4.690 1.00 163.90 ? 56 ILE L O 1 ATOM 4636 C CB . ILE C 3 56 ? -2.023 -8.500 -6.167 1.00 159.30 ? 56 ILE L CB 1 ATOM 4637 C CG1 . ILE C 3 56 ? -2.202 -9.323 -7.441 1.00 147.47 ? 56 ILE L CG1 1 ATOM 4638 C CG2 . ILE C 3 56 ? -1.141 -9.159 -5.128 1.00 164.10 ? 56 ILE L CG2 1 ATOM 4639 C CD1 . ILE C 3 56 ? -2.753 -10.679 -7.202 1.00 144.85 ? 56 ILE L CD1 1 ATOM 4640 N N . PRO C 3 57 ? -3.581 -7.475 -3.209 1.00 157.92 ? 57 PRO L N 1 ATOM 4641 C CA . PRO C 3 57 ? -3.535 -6.562 -2.059 1.00 169.84 ? 57 PRO L CA 1 ATOM 4642 C C . PRO C 3 57 ? -2.133 -6.406 -1.452 1.00 175.20 ? 57 PRO L C 1 ATOM 4643 O O . PRO C 3 57 ? -1.245 -7.190 -1.809 1.00 169.04 ? 57 PRO L O 1 ATOM 4644 C CB . PRO C 3 57 ? -4.492 -7.223 -1.058 1.00 170.65 ? 57 PRO L CB 1 ATOM 4645 C CG . PRO C 3 57 ? -5.318 -8.196 -1.881 1.00 157.33 ? 57 PRO L CG 1 ATOM 4646 C CD . PRO C 3 57 ? -4.373 -8.678 -2.916 1.00 149.33 ? 57 PRO L CD 1 ATOM 4647 N N . ASP C 3 58 ? -1.943 -5.425 -0.562 1.00 183.15 ? 58 ASP L N 1 ATOM 4648 C CA . ASP C 3 58 ? -0.633 -5.185 0.065 1.00 188.88 ? 58 ASP L CA 1 ATOM 4649 C C . ASP C 3 58 ? -0.054 -6.393 0.816 1.00 194.67 ? 58 ASP L C 1 ATOM 4650 O O . ASP C 3 58 ? 1.162 -6.476 1.018 1.00 195.01 ? 58 ASP L O 1 ATOM 4651 C CB . ASP C 3 58 ? -0.682 -3.986 1.030 1.00 196.42 ? 58 ASP L CB 1 ATOM 4652 C CG . ASP C 3 58 ? -0.931 -2.662 0.325 1.00 190.28 ? 58 ASP L CG 1 ATOM 4653 O OD1 . ASP C 3 58 ? -0.806 -2.610 -0.919 1.00 189.52 ? 58 ASP L OD1 1 ATOM 4654 O OD2 . ASP C 3 58 ? -1.227 -1.667 1.022 1.00 208.38 ? 58 ASP L OD2 1 ATOM 4655 N N . ARG C 3 59 ? -0.928 -7.299 1.264 1.00 214.54 ? 59 ARG L N 1 ATOM 4656 C CA . ARG C 3 59 ? -0.521 -8.467 2.060 1.00 109.99 ? 59 ARG L CA 1 ATOM 4657 C C . ARG C 3 59 ? 0.543 -9.312 1.337 1.00 108.97 ? 59 ARG L C 1 ATOM 4658 O O . ARG C 3 59 ? 1.436 -9.888 1.978 1.00 121.45 ? 59 ARG L O 1 ATOM 4659 C CB . ARG C 3 59 ? -1.728 -9.332 2.453 1.00 125.42 ? 59 ARG L CB 1 ATOM 4660 C CG . ARG C 3 59 ? -2.389 -10.096 1.322 1.00 132.97 ? 59 ARG L CG 1 ATOM 4661 C CD . ARG C 3 59 ? -3.651 -10.830 1.786 1.00 134.77 ? 59 ARG L CD 1 ATOM 4662 N NE . ARG C 3 59 ? -4.838 -9.981 1.861 1.00 136.54 ? 59 ARG L NE 1 ATOM 4663 C CZ . ARG C 3 59 ? -6.075 -10.445 2.023 1.00 138.56 ? 59 ARG L CZ 1 ATOM 4664 N NH1 . ARG C 3 59 ? -6.289 -11.750 2.131 1.00 135.03 ? 59 ARG L NH1 1 ATOM 4665 N NH2 . ARG C 3 59 ? -7.102 -9.608 2.083 1.00 141.79 ? 59 ARG L NH2 1 ATOM 4666 N N . PHE C 3 60 ? 0.435 -9.363 0.004 1.00 212.32 ? 60 PHE L N 1 ATOM 4667 C CA . PHE C 3 60 ? 1.395 -10.049 -0.869 1.00 180.83 ? 60 PHE L CA 1 ATOM 4668 C C . PHE C 3 60 ? 2.553 -9.162 -1.215 1.00 165.45 ? 60 PHE L C 1 ATOM 4669 O O . PHE C 3 60 ? 2.358 -8.053 -1.671 1.00 161.78 ? 60 PHE L O 1 ATOM 4670 C CB . PHE C 3 60 ? 0.779 -10.487 -2.191 1.00 168.19 ? 60 PHE L CB 1 ATOM 4671 C CG . PHE C 3 60 ? -0.285 -11.509 -2.064 1.00 159.54 ? 60 PHE L CG 1 ATOM 4672 C CD1 . PHE C 3 60 ? -1.599 -11.138 -1.856 1.00 159.46 ? 60 PHE L CD1 1 ATOM 4673 C CD2 . PHE C 3 60 ? 0.033 -12.851 -2.153 1.00 154.94 ? 60 PHE L CD2 1 ATOM 4674 C CE1 . PHE C 3 60 ? -2.582 -12.091 -1.748 1.00 160.34 ? 60 PHE L CE1 1 ATOM 4675 C CE2 . PHE C 3 60 ? -0.938 -13.806 -2.038 1.00 158.07 ? 60 PHE L CE2 1 ATOM 4676 C CZ . PHE C 3 60 ? -2.252 -13.429 -1.835 1.00 160.04 ? 60 PHE L CZ 1 ATOM 4677 N N . SER C 3 61 ? 3.764 -9.666 -1.022 1.00 161.29 ? 61 SER L N 1 ATOM 4678 C CA . SER C 3 61 ? 4.946 -8.896 -1.362 1.00 164.28 ? 61 SER L CA 1 ATOM 4679 C C . SER C 3 61 ? 6.067 -9.802 -1.820 1.00 168.50 ? 61 SER L C 1 ATOM 4680 O O . SER C 3 61 ? 6.168 -10.926 -1.387 1.00 171.87 ? 61 SER L O 1 ATOM 4681 C CB . SER C 3 61 ? 5.399 -8.078 -0.143 1.00 162.40 ? 61 SER L CB 1 ATOM 4682 O OG . SER C 3 61 ? 5.947 -8.916 0.864 1.00 155.61 ? 61 SER L OG 1 ATOM 4683 N N . GLY C 3 62 ? 6.881 -9.323 -2.744 1.00 142.45 ? 62 GLY L N 1 ATOM 4684 C CA . GLY C 3 62 ? 8.008 -10.098 -3.210 1.00 144.53 ? 62 GLY L CA 1 ATOM 4685 C C . GLY C 3 62 ? 9.290 -9.338 -2.978 1.00 192.64 ? 62 GLY L C 1 ATOM 4686 O O . GLY C 3 62 ? 9.277 -8.115 -2.884 1.00 189.38 ? 62 GLY L O 1 ATOM 4687 N N . SER C 3 63 ? 10.401 -10.049 -2.859 1.00 200.11 ? 63 SER L N 1 ATOM 4688 C CA . SER C 3 63 ? 11.672 -9.387 -2.656 1.00 208.86 ? 63 SER L CA 1 ATOM 4689 C C . SER C 3 63 ? 12.687 -10.253 -3.354 1.00 215.93 ? 63 SER L C 1 ATOM 4690 O O . SER C 3 63 ? 12.370 -11.370 -3.767 1.00 209.64 ? 63 SER L O 1 ATOM 4691 C CB . SER C 3 63 ? 11.981 -9.246 -1.169 1.00 210.18 ? 63 SER L CB 1 ATOM 4692 O OG . SER C 3 63 ? 11.913 -10.510 -0.533 1.00 207.15 ? 63 SER L OG 1 ATOM 4693 N N . ARG C 3 64 ? 13.893 -9.745 -3.542 1.00 228.59 ? 64 ARG L N 1 ATOM 4694 C CA . ARG C 3 64 ? 14.799 -10.543 -4.329 1.00 239.17 ? 64 ARG L CA 1 ATOM 4695 C C . ARG C 3 64 ? 16.267 -10.456 -3.883 1.00 241.52 ? 64 ARG L C 1 ATOM 4696 O O . ARG C 3 64 ? 16.707 -9.401 -3.433 1.00 243.21 ? 64 ARG L O 1 ATOM 4697 C CB . ARG C 3 64 ? 14.479 -10.150 -5.758 1.00 252.92 ? 64 ARG L CB 1 ATOM 4698 C CG . ARG C 3 64 ? 13.192 -10.436 -6.358 1.00 264.50 ? 64 ARG L CG 1 ATOM 4699 C CD . ARG C 3 64 ? 13.331 -9.773 -7.712 1.00 281.49 ? 64 ARG L CD 1 ATOM 4700 N NE . ARG C 3 64 ? 14.369 -10.413 -8.480 1.00 299.23 ? 64 ARG L NE 1 ATOM 4701 C CZ . ARG C 3 64 ? 14.796 -9.990 -9.643 1.00 311.30 ? 64 ARG L CZ 1 ATOM 4702 N NH1 . ARG C 3 64 ? 14.170 -8.970 -10.198 1.00 312.97 ? 64 ARG L NH1 1 ATOM 4703 N NH2 . ARG C 3 64 ? 15.763 -10.648 -10.266 1.00 317.70 ? 64 ARG L NH2 1 ATOM 4704 N N . TRP C 3 65 ? 17.025 -11.545 -3.992 1.00 236.98 ? 65 TRP L N 1 ATOM 4705 C CA . TRP C 3 65 ? 18.472 -11.466 -3.777 1.00 240.25 ? 65 TRP L CA 1 ATOM 4706 C C . TRP C 3 65 ? 19.295 -12.434 -4.621 1.00 239.94 ? 65 TRP L C 1 ATOM 4707 O O . TRP C 3 65 ? 19.356 -13.624 -4.313 1.00 237.44 ? 65 TRP L O 1 ATOM 4708 C CB . TRP C 3 65 ? 18.809 -11.700 -2.305 1.00 244.11 ? 65 TRP L CB 1 ATOM 4709 C CG . TRP C 3 65 ? 20.131 -11.099 -1.912 1.00 253.27 ? 65 TRP L CG 1 ATOM 4710 C CD1 . TRP C 3 65 ? 20.317 -9.945 -1.207 1.00 256.67 ? 65 TRP L CD1 1 ATOM 4711 C CD2 . TRP C 3 65 ? 21.446 -11.599 -2.213 1.00 259.30 ? 65 TRP L CD2 1 ATOM 4712 N NE1 . TRP C 3 65 ? 21.659 -9.698 -1.040 1.00 263.01 ? 65 TRP L NE1 1 ATOM 4713 C CE2 . TRP C 3 65 ? 22.374 -10.696 -1.647 1.00 264.47 ? 65 TRP L CE2 1 ATOM 4714 C CE3 . TRP C 3 65 ? 21.928 -12.721 -2.894 1.00 259.10 ? 65 TRP L CE3 1 ATOM 4715 C CZ2 . TRP C 3 65 ? 23.753 -10.879 -1.746 1.00 270.69 ? 65 TRP L CZ2 1 ATOM 4716 C CZ3 . TRP C 3 65 ? 23.299 -12.899 -2.993 1.00 265.28 ? 65 TRP L CZ3 1 ATOM 4717 C CH2 . TRP C 3 65 ? 24.195 -11.982 -2.420 1.00 271.11 ? 65 TRP L CH2 1 ATOM 4718 N N . GLY C 3 66 ? 19.945 -11.930 -5.663 1.00 241.94 ? 66 GLY L N 1 ATOM 4719 C CA . GLY C 3 66 ? 20.701 -12.780 -6.566 1.00 241.36 ? 66 GLY L CA 1 ATOM 4720 C C . GLY C 3 66 ? 19.855 -13.836 -7.244 1.00 232.67 ? 66 GLY L C 1 ATOM 4721 O O . GLY C 3 66 ? 18.899 -13.513 -7.947 1.00 229.89 ? 66 GLY L O 1 ATOM 4722 N N . ALA C 3 67 ? 20.193 -15.104 -7.024 1.00 230.76 ? 67 ALA L N 1 ATOM 4723 C CA . ALA C 3 67 ? 19.465 -16.186 -7.671 1.00 227.32 ? 67 ALA L CA 1 ATOM 4724 C C . ALA C 3 67 ? 18.224 -16.458 -6.843 1.00 218.23 ? 67 ALA L C 1 ATOM 4725 O O . ALA C 3 67 ? 17.286 -17.096 -7.306 1.00 212.52 ? 67 ALA L O 1 ATOM 4726 C CB . ALA C 3 67 ? 20.325 -17.436 -7.796 1.00 235.60 ? 67 ALA L CB 1 ATOM 4727 N N . ASP C 3 68 ? 18.243 -15.976 -5.603 1.00 216.35 ? 68 ASP L N 1 ATOM 4728 C CA . ASP C 3 68 ? 17.190 -16.263 -4.639 1.00 209.95 ? 68 ASP L CA 1 ATOM 4729 C C . ASP C 3 68 ? 16.047 -15.284 -4.825 1.00 199.81 ? 68 ASP L C 1 ATOM 4730 O O . ASP C 3 68 ? 16.267 -14.101 -5.076 1.00 198.24 ? 68 ASP L O 1 ATOM 4731 C CB . ASP C 3 68 ? 17.698 -16.192 -3.202 1.00 214.18 ? 68 ASP L CB 1 ATOM 4732 C CG . ASP C 3 68 ? 18.836 -17.142 -2.945 1.00 219.08 ? 68 ASP L CG 1 ATOM 4733 O OD1 . ASP C 3 68 ? 18.737 -18.313 -3.372 1.00 214.78 ? 68 ASP L OD1 1 ATOM 4734 O OD2 . ASP C 3 68 ? 19.815 -16.719 -2.294 1.00 226.44 ? 68 ASP L OD2 1 ATOM 4735 N N . TYR C 3 69 ? 14.825 -15.786 -4.770 1.00 193.07 ? 69 TYR L N 1 ATOM 4736 C CA . TYR C 3 69 ? 13.673 -14.938 -4.968 1.00 189.18 ? 69 TYR L CA 1 ATOM 4737 C C . TYR C 3 69 ? 12.714 -15.212 -3.846 1.00 187.73 ? 69 TYR L C 1 ATOM 4738 O O . TYR C 3 69 ? 12.434 -16.362 -3.573 1.00 191.38 ? 69 TYR L O 1 ATOM 4739 C CB . TYR C 3 69 ? 13.014 -15.248 -6.296 1.00 189.93 ? 69 TYR L CB 1 ATOM 4740 C CG . TYR C 3 69 ? 13.745 -14.660 -7.462 1.00 193.59 ? 69 TYR L CG 1 ATOM 4741 C CD1 . TYR C 3 69 ? 15.003 -15.126 -7.814 1.00 197.57 ? 69 TYR L CD1 1 ATOM 4742 C CD2 . TYR C 3 69 ? 13.185 -13.657 -8.219 1.00 189.23 ? 69 TYR L CD2 1 ATOM 4743 C CE1 . TYR C 3 69 ? 15.685 -14.604 -8.875 1.00 198.11 ? 69 TYR L CE1 1 ATOM 4744 C CE2 . TYR C 3 69 ? 13.851 -13.144 -9.286 1.00 190.06 ? 69 TYR L CE2 1 ATOM 4745 C CZ . TYR C 3 69 ? 15.107 -13.609 -9.612 1.00 195.37 ? 69 TYR L CZ 1 ATOM 4746 O OH . TYR C 3 69 ? 15.785 -13.080 -10.688 1.00 200.15 ? 69 TYR L OH 1 ATOM 4747 N N . ASN C 3 70 ? 12.165 -14.199 -3.202 1.00 183.26 ? 70 ASN L N 1 ATOM 4748 C CA . ASN C 3 70 ? 11.224 -14.549 -2.159 1.00 178.44 ? 70 ASN L CA 1 ATOM 4749 C C . ASN C 3 70 ? 9.858 -13.963 -2.401 1.00 168.56 ? 70 ASN L C 1 ATOM 4750 O O . ASN C 3 70 ? 9.715 -12.810 -2.775 1.00 168.32 ? 70 ASN L O 1 ATOM 4751 C CB . ASN C 3 70 ? 11.734 -14.116 -0.782 1.00 188.78 ? 70 ASN L CB 1 ATOM 4752 C CG . ASN C 3 70 ? 12.972 -14.876 -0.351 1.00 202.87 ? 70 ASN L CG 1 ATOM 4753 O OD1 . ASN C 3 70 ? 13.061 -16.090 -0.539 1.00 205.82 ? 70 ASN L OD1 1 ATOM 4754 N ND2 . ASN C 3 70 ? 13.917 -14.175 0.267 1.00 209.85 ? 70 ASN L ND2 1 ATOM 4755 N N . LEU C 3 71 ? 8.848 -14.795 -2.201 1.00 164.61 ? 71 LEU L N 1 ATOM 4756 C CA . LEU C 3 71 ? 7.484 -14.327 -2.110 1.00 167.29 ? 71 LEU L CA 1 ATOM 4757 C C . LEU C 3 71 ? 7.067 -14.452 -0.647 1.00 170.28 ? 71 LEU L C 1 ATOM 4758 O O . LEU C 3 71 ? 7.226 -15.504 -0.025 1.00 172.91 ? 71 LEU L O 1 ATOM 4759 C CB . LEU C 3 71 ? 6.551 -15.114 -3.045 1.00 169.38 ? 71 LEU L CB 1 ATOM 4760 C CG . LEU C 3 71 ? 5.045 -14.986 -2.782 1.00 141.62 ? 71 LEU L CG 1 ATOM 4761 C CD1 . LEU C 3 71 ? 4.549 -13.578 -3.056 1.00 139.65 ? 71 LEU L CD1 1 ATOM 4762 C CD2 . LEU C 3 71 ? 4.264 -15.995 -3.599 1.00 141.66 ? 71 LEU L CD2 1 ATOM 4763 N N . SER C 3 72 ? 6.557 -13.362 -0.103 1.00 144.70 ? 72 SER L N 1 ATOM 4764 C CA . SER C 3 72 ? 6.178 -13.267 1.288 1.00 301.39 ? 72 SER L CA 1 ATOM 4765 C C . SER C 3 72 ? 4.700 -12.925 1.335 1.00 304.10 ? 72 SER L C 1 ATOM 4766 O O . SER C 3 72 ? 4.259 -11.929 0.763 1.00 309.03 ? 72 SER L O 1 ATOM 4767 C CB . SER C 3 72 ? 7.004 -12.210 2.028 1.00 306.76 ? 72 SER L CB 1 ATOM 4768 O OG . SER C 3 72 ? 6.334 -11.750 3.195 1.00 319.91 ? 72 SER L OG 1 ATOM 4769 N N . ILE C 3 73 ? 3.927 -13.745 2.024 1.00 290.21 ? 73 ILE L N 1 ATOM 4770 C CA . ILE C 3 73 ? 2.512 -13.455 2.142 1.00 139.25 ? 73 ILE L CA 1 ATOM 4771 C C . ILE C 3 73 ? 2.223 -13.207 3.610 1.00 124.22 ? 73 ILE L C 1 ATOM 4772 O O . ILE C 3 73 ? 2.300 -14.118 4.440 1.00 133.16 ? 73 ILE L O 1 ATOM 4773 C CB . ILE C 3 73 ? 1.662 -14.596 1.606 1.00 135.17 ? 73 ILE L CB 1 ATOM 4774 C CG1 . ILE C 3 73 ? 2.135 -14.957 0.207 1.00 130.43 ? 73 ILE L CG1 1 ATOM 4775 C CG2 . ILE C 3 73 ? 0.185 -14.228 1.620 1.00 137.05 ? 73 ILE L CG2 1 ATOM 4776 C CD1 . ILE C 3 73 ? 1.522 -16.196 -0.302 1.00 120.47 ? 73 ILE L CD1 1 ATOM 4777 N N . SER C 3 74 ? 1.939 -11.954 3.938 1.00 245.88 ? 74 SER L N 1 ATOM 4778 C CA . SER C 3 74 ? 1.718 -11.609 5.325 1.00 227.12 ? 74 SER L CA 1 ATOM 4779 C C . SER C 3 74 ? 0.244 -11.566 5.702 1.00 217.96 ? 74 SER L C 1 ATOM 4780 O O . SER C 3 74 ? -0.618 -11.286 4.866 1.00 207.92 ? 74 SER L O 1 ATOM 4781 C CB . SER C 3 74 ? 2.369 -10.253 5.597 1.00 226.60 ? 74 SER L CB 1 ATOM 4782 O OG . SER C 3 74 ? 1.824 -9.258 4.740 1.00 223.56 ? 74 SER L OG 1 ATOM 4783 N N . ASN C 3 75 ? -0.023 -11.832 6.978 1.00 219.17 ? 75 ASN L N 1 ATOM 4784 C CA . ASN C 3 75 ? -1.372 -11.795 7.533 1.00 216.31 ? 75 ASN L CA 1 ATOM 4785 C C . ASN C 3 75 ? -2.316 -12.711 6.743 1.00 204.88 ? 75 ASN L C 1 ATOM 4786 O O . ASN C 3 75 ? -3.332 -12.244 6.228 1.00 202.10 ? 75 ASN L O 1 ATOM 4787 C CB . ASN C 3 75 ? -1.904 -10.357 7.588 1.00 218.76 ? 75 ASN L CB 1 ATOM 4788 C CG . ASN C 3 75 ? -3.054 -10.189 8.581 1.00 217.03 ? 75 ASN L CG 1 ATOM 4789 O OD1 . ASN C 3 75 ? -4.152 -10.711 8.384 1.00 215.26 ? 75 ASN L OD1 1 ATOM 4790 N ND2 . ASN C 3 75 ? -2.798 -9.445 9.658 1.00 218.56 ? 75 ASN L ND2 1 ATOM 4791 N N . LEU C 3 76 ? -1.958 -13.990 6.613 1.00 197.93 ? 76 LEU L N 1 ATOM 4792 C CA . LEU C 3 76 ? -2.729 -14.964 5.818 1.00 192.78 ? 76 LEU L CA 1 ATOM 4793 C C . LEU C 3 76 ? -4.231 -14.913 6.048 1.00 202.52 ? 76 LEU L C 1 ATOM 4794 O O . LEU C 3 76 ? -4.693 -14.669 7.168 1.00 210.67 ? 76 LEU L O 1 ATOM 4795 C CB . LEU C 3 76 ? -2.249 -16.393 6.085 1.00 179.54 ? 76 LEU L CB 1 ATOM 4796 C CG . LEU C 3 76 ? -1.144 -17.020 5.239 1.00 171.32 ? 76 LEU L CG 1 ATOM 4797 C CD1 . LEU C 3 76 ? 0.113 -16.205 5.221 1.00 176.92 ? 76 LEU L CD1 1 ATOM 4798 C CD2 . LEU C 3 76 ? -0.848 -18.391 5.802 1.00 165.77 ? 76 LEU L CD2 1 ATOM 4799 N N . GLU C 3 77 ? -4.983 -15.127 4.969 1.00 203.24 ? 77 GLU L N 1 ATOM 4800 C CA . GLU C 3 77 ? -6.439 -15.247 5.037 1.00 212.14 ? 77 GLU L CA 1 ATOM 4801 C C . GLU C 3 77 ? -6.936 -16.310 4.061 1.00 219.98 ? 77 GLU L C 1 ATOM 4802 O O . GLU C 3 77 ? -6.220 -16.675 3.138 1.00 217.62 ? 77 GLU L O 1 ATOM 4803 C CB . GLU C 3 77 ? -7.110 -13.904 4.710 1.00 210.18 ? 77 GLU L CB 1 ATOM 4804 C CG . GLU C 3 77 ? -6.776 -12.751 5.658 1.00 212.15 ? 77 GLU L CG 1 ATOM 4805 C CD . GLU C 3 77 ? -7.478 -11.456 5.279 1.00 212.14 ? 77 GLU L CD 1 ATOM 4806 O OE1 . GLU C 3 77 ? -7.948 -11.351 4.126 1.00 208.36 ? 77 GLU L OE1 1 ATOM 4807 O OE2 . GLU C 3 77 ? -7.558 -10.544 6.132 1.00 215.22 ? 77 GLU L OE2 1 ATOM 4808 N N . SER C 3 78 ? -8.158 -16.794 4.289 1.00 230.88 ? 78 SER L N 1 ATOM 4809 C CA . SER C 3 78 ? -8.748 -17.947 3.585 1.00 234.09 ? 78 SER L CA 1 ATOM 4810 C C . SER C 3 78 ? -8.544 -18.075 2.066 1.00 234.04 ? 78 SER L C 1 ATOM 4811 O O . SER C 3 78 ? -8.430 -19.184 1.541 1.00 235.15 ? 78 SER L O 1 ATOM 4812 C CB . SER C 3 78 ? -10.266 -17.950 3.792 1.00 241.68 ? 78 SER L CB 1 ATOM 4813 O OG . SER C 3 78 ? -10.854 -16.740 3.350 1.00 247.78 ? 78 SER L OG 1 ATOM 4814 N N . GLY C 3 79 ? -8.502 -16.945 1.366 1.00 232.92 ? 79 GLY L N 1 ATOM 4815 C CA . GLY C 3 79 ? -8.354 -16.923 -0.084 1.00 223.95 ? 79 GLY L CA 1 ATOM 4816 C C . GLY C 3 79 ? -6.945 -17.276 -0.540 1.00 216.49 ? 79 GLY L C 1 ATOM 4817 O O . GLY C 3 79 ? -6.744 -17.733 -1.666 1.00 220.52 ? 79 GLY L O 1 ATOM 4818 N N . ASP C 3 80 ? -5.975 -17.048 0.339 1.00 205.99 ? 80 ASP L N 1 ATOM 4819 C CA . ASP C 3 80 ? -4.543 -17.185 0.053 1.00 193.24 ? 80 ASP L CA 1 ATOM 4820 C C . ASP C 3 80 ? -4.000 -18.630 -0.074 1.00 182.34 ? 80 ASP L C 1 ATOM 4821 O O . ASP C 3 80 ? -2.970 -18.836 -0.713 1.00 183.18 ? 80 ASP L O 1 ATOM 4822 C CB . ASP C 3 80 ? -3.734 -16.435 1.127 1.00 194.89 ? 80 ASP L CB 1 ATOM 4823 C CG . ASP C 3 80 ? -4.146 -14.967 1.270 1.00 196.77 ? 80 ASP L CG 1 ATOM 4824 O OD1 . ASP C 3 80 ? -4.724 -14.401 0.316 1.00 193.09 ? 80 ASP L OD1 1 ATOM 4825 O OD2 . ASP C 3 80 ? -3.904 -14.383 2.350 1.00 202.50 ? 80 ASP L OD2 1 ATOM 4826 N N . PHE C 3 81 ? -4.655 -19.617 0.536 1.00 171.54 ? 81 PHE L N 1 ATOM 4827 C CA . PHE C 3 81 ? -4.112 -20.983 0.544 1.00 163.54 ? 81 PHE L CA 1 ATOM 4828 C C . PHE C 3 81 ? -4.153 -21.657 -0.831 1.00 160.68 ? 81 PHE L C 1 ATOM 4829 O O . PHE C 3 81 ? -5.113 -21.503 -1.584 1.00 162.82 ? 81 PHE L O 1 ATOM 4830 C CB . PHE C 3 81 ? -4.864 -21.855 1.555 1.00 164.03 ? 81 PHE L CB 1 ATOM 4831 C CG . PHE C 3 81 ? -4.791 -21.339 2.971 1.00 172.86 ? 81 PHE L CG 1 ATOM 4832 C CD1 . PHE C 3 81 ? -3.711 -21.648 3.786 1.00 173.30 ? 81 PHE L CD1 1 ATOM 4833 C CD2 . PHE C 3 81 ? -5.811 -20.554 3.492 1.00 172.57 ? 81 PHE L CD2 1 ATOM 4834 C CE1 . PHE C 3 81 ? -3.638 -21.164 5.072 1.00 169.24 ? 81 PHE L CE1 1 ATOM 4835 C CE2 . PHE C 3 81 ? -5.745 -20.077 4.782 1.00 169.31 ? 81 PHE L CE2 1 ATOM 4836 C CZ . PHE C 3 81 ? -4.659 -20.384 5.572 1.00 169.38 ? 81 PHE L CZ 1 ATOM 4837 N N . GLY C 3 82 ? -3.102 -22.412 -1.144 1.00 150.85 ? 82 GLY L N 1 ATOM 4838 C CA . GLY C 3 82 ? -2.999 -23.110 -2.417 1.00 138.89 ? 82 GLY L CA 1 ATOM 4839 C C . GLY C 3 82 ? -1.574 -23.533 -2.755 1.00 133.36 ? 82 GLY L C 1 ATOM 4840 O O . GLY C 3 82 ? -0.800 -23.874 -1.868 1.00 130.38 ? 82 GLY L O 1 ATOM 4841 N N . VAL C 3 83 ? -1.189 -23.476 -4.025 1.00 129.53 ? 83 VAL L N 1 ATOM 4842 C CA . VAL C 3 83 ? 0.213 -23.760 -4.350 1.00 120.38 ? 83 VAL L CA 1 ATOM 4843 C C . VAL C 3 83 ? 0.806 -22.645 -5.204 1.00 118.50 ? 83 VAL L C 1 ATOM 4844 O O . VAL C 3 83 ? 0.135 -22.066 -6.053 1.00 112.77 ? 83 VAL L O 1 ATOM 4845 C CB . VAL C 3 83 ? 0.392 -25.128 -5.061 1.00 124.03 ? 83 VAL L CB 1 ATOM 4846 C CG1 . VAL C 3 83 ? -0.016 -26.276 -4.137 1.00 131.84 ? 83 VAL L CG1 1 ATOM 4847 C CG2 . VAL C 3 83 ? -0.402 -25.180 -6.359 1.00 127.02 ? 83 VAL L CG2 1 ATOM 4848 N N . TYR C 3 84 ? 2.078 -22.351 -4.975 1.00 121.66 ? 84 TYR L N 1 ATOM 4849 C CA . TYR C 3 84 ? 2.711 -21.209 -5.612 1.00 122.97 ? 84 TYR L CA 1 ATOM 4850 C C . TYR C 3 84 ? 3.846 -21.619 -6.518 1.00 116.23 ? 84 TYR L C 1 ATOM 4851 O O . TYR C 3 84 ? 4.572 -22.568 -6.247 1.00 107.73 ? 84 TYR L O 1 ATOM 4852 C CB . TYR C 3 84 ? 3.210 -20.246 -4.513 1.00 128.44 ? 84 TYR L CB 1 ATOM 4853 C CG . TYR C 3 84 ? 2.061 -19.560 -3.819 1.00 124.38 ? 84 TYR L CG 1 ATOM 4854 C CD1 . TYR C 3 84 ? 1.373 -20.181 -2.791 1.00 118.92 ? 84 TYR L CD1 1 ATOM 4855 C CD2 . TYR C 3 84 ? 1.666 -18.289 -4.193 1.00 124.90 ? 84 TYR L CD2 1 ATOM 4856 C CE1 . TYR C 3 84 ? 0.308 -19.565 -2.180 1.00 120.49 ? 84 TYR L CE1 1 ATOM 4857 C CE2 . TYR C 3 84 ? 0.615 -17.663 -3.582 1.00 127.11 ? 84 TYR L CE2 1 ATOM 4858 C CZ . TYR C 3 84 ? -0.062 -18.302 -2.577 1.00 128.38 ? 84 TYR L CZ 1 ATOM 4859 O OH . TYR C 3 84 ? -1.123 -17.672 -1.973 1.00 135.06 ? 84 TYR L OH 1 ATOM 4860 N N . TYR C 3 85 ? 3.972 -20.892 -7.620 1.00 120.02 ? 85 TYR L N 1 ATOM 4861 C CA . TYR C 3 85 ? 4.994 -21.171 -8.620 1.00 118.82 ? 85 TYR L CA 1 ATOM 4862 C C . TYR C 3 85 ? 5.822 -19.926 -8.931 1.00 127.54 ? 85 TYR L C 1 ATOM 4863 O O . TYR C 3 85 ? 5.295 -18.831 -9.052 1.00 126.20 ? 85 TYR L O 1 ATOM 4864 C CB . TYR C 3 85 ? 4.356 -21.720 -9.893 1.00 106.47 ? 85 TYR L CB 1 ATOM 4865 C CG . TYR C 3 85 ? 3.599 -23.035 -9.754 1.00 105.32 ? 85 TYR L CG 1 ATOM 4866 C CD1 . TYR C 3 85 ? 4.268 -24.242 -9.548 1.00 96.54 ? 85 TYR L CD1 1 ATOM 4867 C CD2 . TYR C 3 85 ? 2.207 -23.071 -9.844 1.00 113.59 ? 85 TYR L CD2 1 ATOM 4868 C CE1 . TYR C 3 85 ? 3.569 -25.448 -9.433 1.00 97.42 ? 85 TYR L CE1 1 ATOM 4869 C CE2 . TYR C 3 85 ? 1.501 -24.266 -9.734 1.00 112.63 ? 85 TYR L CE2 1 ATOM 4870 C CZ . TYR C 3 85 ? 2.184 -25.450 -9.531 1.00 106.95 ? 85 TYR L CZ 1 ATOM 4871 O OH . TYR C 3 85 ? 1.456 -26.615 -9.423 1.00 108.26 ? 85 TYR L OH 1 ATOM 4872 N N . CYS C 3 86 ? 7.126 -20.098 -9.053 1.00 134.72 ? 86 CYS L N 1 ATOM 4873 C CA . CYS C 3 86 ? 7.967 -19.049 -9.605 1.00 142.68 ? 86 CYS L CA 1 ATOM 4874 C C . CYS C 3 86 ? 8.140 -19.305 -11.095 1.00 146.97 ? 86 CYS L C 1 ATOM 4875 O O . CYS C 3 86 ? 8.069 -20.454 -11.528 1.00 155.34 ? 86 CYS L O 1 ATOM 4876 C CB . CYS C 3 86 ? 9.326 -19.032 -8.932 1.00 144.07 ? 86 CYS L CB 1 ATOM 4877 S SG . CYS C 3 86 ? 10.209 -20.557 -9.280 1.00 176.24 ? 86 CYS L SG 1 ATOM 4878 N N . GLN C 3 87 ? 8.357 -18.255 -11.887 1.00 141.33 ? 87 GLN L N 1 ATOM 4879 C CA . GLN C 3 87 ? 8.453 -18.438 -13.333 1.00 130.53 ? 87 GLN L CA 1 ATOM 4880 C C . GLN C 3 87 ? 9.481 -17.515 -13.964 1.00 121.99 ? 87 GLN L C 1 ATOM 4881 O O . GLN C 3 87 ? 9.611 -16.362 -13.572 1.00 117.43 ? 87 GLN L O 1 ATOM 4882 C CB . GLN C 3 87 ? 7.110 -18.162 -13.997 1.00 126.05 ? 87 GLN L CB 1 ATOM 4883 C CG . GLN C 3 87 ? 7.155 -18.305 -15.507 1.00 130.98 ? 87 GLN L CG 1 ATOM 4884 C CD . GLN C 3 87 ? 6.359 -17.240 -16.246 1.00 135.01 ? 87 GLN L CD 1 ATOM 4885 O OE1 . GLN C 3 87 ? 5.815 -16.316 -15.637 1.00 138.18 ? 87 GLN L OE1 1 ATOM 4886 N NE2 . GLN C 3 87 ? 6.235 -17.400 -17.561 1.00 135.63 ? 87 GLN L NE2 1 ATOM 4887 N N . GLN C 3 88 ? 10.243 -18.064 -14.906 1.00 120.30 ? 88 GLN L N 1 ATOM 4888 C CA . GLN C 3 88 ? 11.191 -17.299 -15.698 1.00 121.60 ? 88 GLN L CA 1 ATOM 4889 C C . GLN C 3 88 ? 11.090 -17.670 -17.184 1.00 126.88 ? 88 GLN L C 1 ATOM 4890 O O . GLN C 3 88 ? 11.508 -18.763 -17.569 1.00 125.14 ? 88 GLN L O 1 ATOM 4891 C CB . GLN C 3 88 ? 12.600 -17.511 -15.186 1.00 121.61 ? 88 GLN L CB 1 ATOM 4892 C CG . GLN C 3 88 ? 13.526 -16.437 -15.618 1.00 135.15 ? 88 GLN L CG 1 ATOM 4893 C CD . GLN C 3 88 ? 14.896 -16.591 -15.017 1.00 148.91 ? 88 GLN L CD 1 ATOM 4894 O OE1 . GLN C 3 88 ? 15.301 -15.811 -14.153 1.00 156.66 ? 88 GLN L OE1 1 ATOM 4895 N NE2 . GLN C 3 88 ? 15.639 -17.583 -15.492 1.00 151.00 ? 88 GLN L NE2 1 ATOM 4896 N N . TYR C 3 89 ? 10.545 -16.773 -18.003 1.00 129.13 ? 89 TYR L N 1 ATOM 4897 C CA . TYR C 3 89 ? 10.244 -17.071 -19.402 1.00 125.45 ? 89 TYR L CA 1 ATOM 4898 C C . TYR C 3 89 ? 9.364 -18.323 -19.416 1.00 125.17 ? 89 TYR L C 1 ATOM 4899 O O . TYR C 3 89 ? 8.357 -18.375 -18.711 1.00 125.97 ? 89 TYR L O 1 ATOM 4900 C CB . TYR C 3 89 ? 11.530 -17.311 -20.191 1.00 123.84 ? 89 TYR L CB 1 ATOM 4901 C CG . TYR C 3 89 ? 12.444 -16.112 -20.212 1.00 129.75 ? 89 TYR L CG 1 ATOM 4902 C CD1 . TYR C 3 89 ? 11.997 -14.867 -20.620 1.00 129.63 ? 89 TYR L CD1 1 ATOM 4903 C CD2 . TYR C 3 89 ? 13.755 -16.221 -19.772 1.00 136.67 ? 89 TYR L CD2 1 ATOM 4904 C CE1 . TYR C 3 89 ? 12.853 -13.765 -20.616 1.00 131.31 ? 89 TYR L CE1 1 ATOM 4905 C CE2 . TYR C 3 89 ? 14.612 -15.130 -19.765 1.00 134.88 ? 89 TYR L CE2 1 ATOM 4906 C CZ . TYR C 3 89 ? 14.155 -13.911 -20.183 1.00 131.96 ? 89 TYR L CZ 1 ATOM 4907 O OH . TYR C 3 89 ? 15.011 -12.842 -20.169 1.00 133.14 ? 89 TYR L OH 1 ATOM 4908 N N . GLU C 3 90 ? 9.781 -19.368 -20.130 1.00 124.73 ? 90 GLU L N 1 ATOM 4909 C CA . GLU C 3 90 ? 8.924 -20.553 -20.276 1.00 130.11 ? 90 GLU L CA 1 ATOM 4910 C C . GLU C 3 90 ? 9.037 -21.555 -19.125 1.00 140.77 ? 90 GLU L C 1 ATOM 4911 O O . GLU C 3 90 ? 8.255 -22.513 -19.064 1.00 148.44 ? 90 GLU L O 1 ATOM 4912 C CB . GLU C 3 90 ? 9.116 -21.294 -21.628 1.00 120.35 ? 90 GLU L CB 1 ATOM 4913 C CG . GLU C 3 90 ? 10.155 -20.848 -22.677 1.00 122.77 ? 90 GLU L CG 1 ATOM 4914 C CD . GLU C 3 90 ? 11.587 -20.881 -22.238 1.00 121.35 ? 90 GLU L CD 1 ATOM 4915 O OE1 . GLU C 3 90 ? 11.838 -21.241 -21.085 1.00 123.84 ? 90 GLU L OE1 1 ATOM 4916 O OE2 . GLU C 3 90 ? 12.473 -20.568 -23.070 1.00 120.69 ? 90 GLU L OE2 1 ATOM 4917 N N . PHE C 3 91 ? 9.984 -21.344 -18.213 1.00 142.05 ? 91 PHE L N 1 ATOM 4918 C CA . PHE C 3 91 ? 10.235 -22.276 -17.103 1.00 137.64 ? 91 PHE L CA 1 ATOM 4919 C C . PHE C 3 91 ? 9.492 -21.949 -15.812 1.00 137.38 ? 91 PHE L C 1 ATOM 4920 O O . PHE C 3 91 ? 9.315 -20.788 -15.451 1.00 142.75 ? 91 PHE L O 1 ATOM 4921 C CB . PHE C 3 91 ? 11.720 -22.363 -16.817 1.00 134.86 ? 91 PHE L CB 1 ATOM 4922 C CG . PHE C 3 91 ? 12.533 -22.695 -18.019 1.00 138.34 ? 91 PHE L CG 1 ATOM 4923 C CD1 . PHE C 3 91 ? 12.281 -23.857 -18.731 1.00 137.59 ? 91 PHE L CD1 1 ATOM 4924 C CD2 . PHE C 3 91 ? 13.555 -21.856 -18.436 1.00 145.28 ? 91 PHE L CD2 1 ATOM 4925 C CE1 . PHE C 3 91 ? 13.037 -24.179 -19.840 1.00 144.57 ? 91 PHE L CE1 1 ATOM 4926 C CE2 . PHE C 3 91 ? 14.318 -22.168 -19.547 1.00 148.68 ? 91 PHE L CE2 1 ATOM 4927 C CZ . PHE C 3 91 ? 14.059 -23.333 -20.251 1.00 149.79 ? 91 PHE L CZ 1 ATOM 4928 N N . PHE C 3 92 ? 9.045 -23.000 -15.132 1.00 131.94 ? 92 PHE L N 1 ATOM 4929 C CA . PHE C 3 92 ? 8.373 -22.843 -13.853 1.00 128.84 ? 92 PHE L CA 1 ATOM 4930 C C . PHE C 3 92 ? 9.087 -23.570 -12.725 1.00 131.92 ? 92 PHE L C 1 ATOM 4931 O O . PHE C 3 92 ? 9.903 -24.460 -12.960 1.00 134.87 ? 92 PHE L O 1 ATOM 4932 C CB . PHE C 3 92 ? 6.969 -23.411 -13.934 1.00 120.33 ? 92 PHE L CB 1 ATOM 4933 C CG . PHE C 3 92 ? 6.058 -22.642 -14.812 1.00 115.22 ? 92 PHE L CG 1 ATOM 4934 C CD1 . PHE C 3 92 ? 6.082 -22.838 -16.178 1.00 114.70 ? 92 PHE L CD1 1 ATOM 4935 C CD2 . PHE C 3 92 ? 5.171 -21.730 -14.287 1.00 115.40 ? 92 PHE L CD2 1 ATOM 4936 C CE1 . PHE C 3 92 ? 5.226 -22.146 -17.002 1.00 113.39 ? 92 PHE L CE1 1 ATOM 4937 C CE2 . PHE C 3 92 ? 4.313 -21.026 -15.108 1.00 113.18 ? 92 PHE L CE2 1 ATOM 4938 C CZ . PHE C 3 92 ? 4.341 -21.234 -16.467 1.00 111.82 ? 92 PHE L CZ 1 ATOM 4939 N N . GLY C 3 93 ? 8.831 -23.153 -11.493 1.00 129.95 ? 93 GLY L N 1 ATOM 4940 C CA . GLY C 3 93 ? 9.354 -23.922 -10.394 1.00 134.73 ? 93 GLY L CA 1 ATOM 4941 C C . GLY C 3 93 ? 8.407 -25.089 -10.171 1.00 137.86 ? 93 GLY L C 1 ATOM 4942 O O . GLY C 3 93 ? 7.329 -25.154 -10.779 1.00 135.02 ? 93 GLY L O 1 ATOM 4943 N N . GLN C 3 94 ? 8.822 -26.014 -9.309 1.00 136.97 ? 94 GLN L N 1 ATOM 4944 C CA . GLN C 3 94 ? 8.071 -27.227 -9.034 1.00 132.89 ? 94 GLN L CA 1 ATOM 4945 C C . GLN C 3 94 ? 6.835 -26.921 -8.211 1.00 128.75 ? 94 GLN L C 1 ATOM 4946 O O . GLN C 3 94 ? 5.921 -27.738 -8.113 1.00 125.95 ? 94 GLN L O 1 ATOM 4947 C CB . GLN C 3 94 ? 8.943 -28.265 -8.332 1.00 133.20 ? 94 GLN L CB 1 ATOM 4948 C CG . GLN C 3 94 ? 10.322 -28.439 -8.942 1.00 139.08 ? 94 GLN L CG 1 ATOM 4949 C CD . GLN C 3 94 ? 11.256 -27.292 -8.615 1.00 150.46 ? 94 GLN L CD 1 ATOM 4950 O OE1 . GLN C 3 94 ? 10.960 -26.472 -7.743 1.00 154.44 ? 94 GLN L OE1 1 ATOM 4951 N NE2 . GLN C 3 94 ? 12.389 -27.223 -9.315 1.00 154.71 ? 94 GLN L NE2 1 ATOM 4952 N N . GLY C 3 95 ? 6.781 -25.716 -7.658 1.00 128.50 ? 95 GLY L N 1 ATOM 4953 C CA . GLY C 3 95 ? 5.642 -25.375 -6.842 1.00 131.75 ? 95 GLY L CA 1 ATOM 4954 C C . GLY C 3 95 ? 5.876 -25.593 -5.370 1.00 138.30 ? 95 GLY L C 1 ATOM 4955 O O . GLY C 3 95 ? 6.758 -26.351 -4.972 1.00 143.25 ? 95 GLY L O 1 ATOM 4956 N N . THR C 3 96 ? 5.151 -24.832 -4.564 1.00 138.59 ? 96 THR L N 1 ATOM 4957 C CA . THR C 3 96 ? 5.146 -25.010 -3.121 1.00 133.19 ? 96 THR L CA 1 ATOM 4958 C C . THR C 3 96 ? 3.707 -25.033 -2.653 1.00 133.58 ? 96 THR L C 1 ATOM 4959 O O . THR C 3 96 ? 2.971 -24.056 -2.831 1.00 134.05 ? 96 THR L O 1 ATOM 4960 C CB . THR C 3 96 ? 5.890 -23.880 -2.402 1.00 130.70 ? 96 THR L CB 1 ATOM 4961 O OG1 . THR C 3 96 ? 7.293 -24.009 -2.652 1.00 132.01 ? 96 THR L OG1 1 ATOM 4962 C CG2 . THR C 3 96 ? 5.656 -23.968 -0.915 1.00 132.06 ? 96 THR L CG2 1 ATOM 4963 N N . LYS C 3 97 ? 3.288 -26.149 -2.063 1.00 127.89 ? 97 LYS L N 1 ATOM 4964 C CA . LYS C 3 97 ? 1.930 -26.190 -1.560 1.00 126.46 ? 97 LYS L CA 1 ATOM 4965 C C . LYS C 3 97 ? 1.909 -25.596 -0.163 1.00 139.99 ? 97 LYS L C 1 ATOM 4966 O O . LYS C 3 97 ? 2.599 -26.056 0.755 1.00 142.28 ? 97 LYS L O 1 ATOM 4967 C CB . LYS C 3 97 ? 1.323 -27.599 -1.601 0.00 125.90 ? 97 LYS L CB 1 ATOM 4968 C CG . LYS C 3 97 ? 2.037 -28.713 -0.869 0.00 125.25 ? 97 LYS L CG 1 ATOM 4969 C CD . LYS C 3 97 ? 1.422 -30.061 -1.290 0.00 123.44 ? 97 LYS L CD 1 ATOM 4970 C CE . LYS C 3 97 ? 2.081 -31.265 -0.610 0.00 122.00 ? 97 LYS L CE 1 ATOM 4971 N NZ . LYS C 3 97 ? 1.782 -31.377 0.864 0.00 122.44 ? 97 LYS L NZ 1 ATOM 4972 N N . VAL C 3 98 ? 1.141 -24.524 -0.035 1.00 143.18 ? 98 VAL L N 1 ATOM 4973 C CA . VAL C 3 98 ? 0.922 -23.875 1.239 1.00 138.56 ? 98 VAL L CA 1 ATOM 4974 C C . VAL C 3 98 ? -0.480 -24.181 1.727 1.00 138.68 ? 98 VAL L C 1 ATOM 4975 O O . VAL C 3 98 ? -1.472 -23.758 1.118 1.00 135.73 ? 98 VAL L O 1 ATOM 4976 C CB . VAL C 3 98 ? 1.134 -22.363 1.141 1.00 135.98 ? 98 VAL L CB 1 ATOM 4977 C CG1 . VAL C 3 98 ? 1.113 -21.745 2.510 1.00 138.80 ? 98 VAL L CG1 1 ATOM 4978 C CG2 . VAL C 3 98 ? 2.447 -22.063 0.436 1.00 136.43 ? 98 VAL L CG2 1 ATOM 4979 N N . GLN C 3 99 ? -0.553 -24.945 2.813 1.00 141.79 ? 99 GLN L N 1 ATOM 4980 C CA . GLN C 3 99 ? -1.826 -25.365 3.357 1.00 149.25 ? 99 GLN L CA 1 ATOM 4981 C C . GLN C 3 99 ? -2.052 -24.948 4.806 1.00 147.78 ? 99 GLN L C 1 ATOM 4982 O O . GLN C 3 99 ? -1.116 -24.634 5.559 1.00 140.18 ? 99 GLN L O 1 ATOM 4983 C CB . GLN C 3 99 ? -1.964 -26.876 3.240 1.00 157.29 ? 99 GLN L CB 1 ATOM 4984 C CG . GLN C 3 99 ? -0.781 -27.641 3.785 1.00 165.64 ? 99 GLN L CG 1 ATOM 4985 C CD . GLN C 3 99 ? -0.779 -29.079 3.310 1.00 173.14 ? 99 GLN L CD 1 ATOM 4986 O OE1 . GLN C 3 99 ? -1.484 -29.925 3.856 1.00 177.29 ? 99 GLN L OE1 1 ATOM 4987 N NE2 . GLN C 3 99 ? 0.014 -29.362 2.283 1.00 172.37 ? 99 GLN L NE2 1 ATOM 4988 N N . VAL C 3 100 ? -3.327 -24.979 5.174 1.00 154.64 ? 100 VAL L N 1 ATOM 4989 C CA . VAL C 3 100 ? -3.820 -24.505 6.456 1.00 162.42 ? 100 VAL L CA 1 ATOM 4990 C C . VAL C 3 100 ? -3.844 -25.613 7.512 1.00 164.73 ? 100 VAL L C 1 ATOM 4991 O O . VAL C 3 100 ? -4.350 -26.709 7.285 1.00 166.79 ? 100 VAL L O 1 ATOM 4992 C CB . VAL C 3 100 ? -5.227 -23.874 6.320 1.00 167.00 ? 100 VAL L CB 1 ATOM 4993 C CG1 . VAL C 3 100 ? -6.271 -24.895 5.881 1.00 169.92 ? 100 VAL L CG1 1 ATOM 4994 C CG2 . VAL C 3 100 ? -5.618 -23.163 7.602 1.00 171.74 ? 100 VAL L CG2 1 ATOM 4995 N N . ASP C 3 101 ? -3.292 -25.299 8.673 1.00 165.43 ? 101 ASP L N 1 ATOM 4996 C CA . ASP C 3 101 ? -3.408 -26.171 9.830 1.00 168.71 ? 101 ASP L CA 1 ATOM 4997 C C . ASP C 3 101 ? -3.769 -25.246 10.963 1.00 161.02 ? 101 ASP L C 1 ATOM 4998 O O . ASP C 3 101 ? -2.917 -24.557 11.531 1.00 164.59 ? 101 ASP L O 1 ATOM 4999 C CB . ASP C 3 101 ? -2.129 -26.989 10.109 1.00 180.81 ? 101 ASP L CB 1 ATOM 5000 C CG . ASP C 3 101 ? -0.906 -26.127 10.389 1.00 196.63 ? 101 ASP L CG 1 ATOM 5001 O OD1 . ASP C 3 101 ? -0.716 -25.116 9.682 1.00 210.34 ? 101 ASP L OD1 1 ATOM 5002 O OD2 . ASP C 3 101 ? -0.135 -26.463 11.318 1.00 193.34 ? 101 ASP L OD2 1 ATOM 5003 N N . ILE C 3 102 ? -5.064 -25.190 11.266 1.00 153.93 ? 102 ILE L N 1 ATOM 5004 C CA . ILE C 3 102 ? -5.493 -24.390 12.392 1.00 157.72 ? 102 ILE L CA 1 ATOM 5005 C C . ILE C 3 102 ? -5.097 -25.055 13.683 1.00 156.88 ? 102 ILE L C 1 ATOM 5006 O O . ILE C 3 102 ? -5.442 -26.219 13.937 1.00 145.90 ? 102 ILE L O 1 ATOM 5007 C CB . ILE C 3 102 ? -7.034 -24.240 12.402 1.00 156.11 ? 102 ILE L CB 1 ATOM 5008 C CG1 . ILE C 3 102 ? -7.528 -23.609 11.093 1.00 152.90 ? 102 ILE L CG1 1 ATOM 5009 C CG2 . ILE C 3 102 ? -7.502 -23.472 13.645 1.00 156.09 ? 102 ILE L CG2 1 ATOM 5010 C CD1 . ILE C 3 102 ? -9.041 -23.499 11.020 1.00 135.85 ? 102 ILE L CD1 1 ATOM 5011 N N . LYS C 3 103 ? -4.387 -24.307 14.511 1.00 133.62 ? 103 LYS L N 1 ATOM 5012 C CA . LYS C 3 103 ? -3.886 -24.860 15.744 1.00 134.04 ? 103 LYS L CA 1 ATOM 5013 C C . LYS C 3 103 ? -5.049 -25.113 16.680 1.00 175.64 ? 103 LYS L C 1 ATOM 5014 O O . LYS C 3 103 ? -6.019 -24.341 16.703 1.00 141.43 ? 103 LYS L O 1 ATOM 5015 C CB . LYS C 3 103 ? -2.863 -23.909 16.386 0.00 144.72 ? 103 LYS L CB 1 ATOM 5016 C CG . LYS C 3 103 ? -1.397 -24.060 15.948 0.00 141.14 ? 103 LYS L CG 1 ATOM 5017 C CD . LYS C 3 103 ? -1.229 -24.246 14.450 0.00 135.27 ? 103 LYS L CD 1 ATOM 5018 C CE . LYS C 3 103 ? 0.252 -24.271 14.077 0.00 132.41 ? 103 LYS L CE 1 ATOM 5019 N NZ . LYS C 3 103 ? 0.505 -24.352 12.602 0.00 127.71 ? 103 LYS L NZ 1 ATOM 5020 N N . ARG C 3 104 ? -4.991 -26.198 17.430 1.00 166.92 ? 104 ARG L N 1 ATOM 5021 C CA . ARG C 3 104 ? -6.059 -26.537 18.381 1.00 159.33 ? 104 ARG L CA 1 ATOM 5022 C C . ARG C 3 104 ? -5.442 -27.501 19.370 1.00 149.74 ? 104 ARG L C 1 ATOM 5023 O O . ARG C 3 104 ? -4.338 -27.993 19.180 1.00 145.99 ? 104 ARG L O 1 ATOM 5024 C CB . ARG C 3 104 ? -7.264 -27.190 17.737 1.00 157.85 ? 104 ARG L CB 1 ATOM 5025 C CG . ARG C 3 104 ? -6.973 -28.639 17.397 1.00 155.29 ? 104 ARG L CG 1 ATOM 5026 C CD . ARG C 3 104 ? -8.132 -29.333 16.717 1.00 153.74 ? 104 ARG L CD 1 ATOM 5027 N NE . ARG C 3 104 ? -9.328 -29.419 17.532 1.00 159.93 ? 104 ARG L NE 1 ATOM 5028 C CZ . ARG C 3 104 ? -9.441 -30.179 18.636 1.00 160.18 ? 104 ARG L CZ 1 ATOM 5029 N NH1 . ARG C 3 104 ? -8.465 -30.994 18.961 1.00 157.79 ? 104 ARG L NH1 1 ATOM 5030 N NH2 . ARG C 3 104 ? -10.585 -30.197 19.309 1.00 159.78 ? 104 ARG L NH2 1 ATOM 5031 N N . THR C 3 105 ? -6.198 -27.820 20.400 1.00 148.21 ? 105 THR L N 1 ATOM 5032 C CA . THR C 3 105 ? -5.708 -28.776 21.362 1.00 147.39 ? 105 THR L CA 1 ATOM 5033 C C . THR C 3 105 ? -5.688 -30.145 20.671 1.00 140.81 ? 105 THR L C 1 ATOM 5034 O O . THR C 3 105 ? -6.506 -30.417 19.792 1.00 134.48 ? 105 THR L O 1 ATOM 5035 C CB . THR C 3 105 ? -6.531 -28.789 22.651 1.00 153.89 ? 105 THR L CB 1 ATOM 5036 O OG1 . THR C 3 105 ? -7.887 -29.116 22.360 1.00 159.14 ? 105 THR L OG1 1 ATOM 5037 C CG2 . THR C 3 105 ? -6.467 -27.409 23.305 1.00 161.51 ? 105 THR L CG2 1 ATOM 5038 N N . VAL C 3 106 ? -4.739 -30.991 21.044 1.00 138.93 ? 106 VAL L N 1 ATOM 5039 C CA . VAL C 3 106 ? -4.574 -32.317 20.462 1.00 134.59 ? 106 VAL L CA 1 ATOM 5040 C C . VAL C 3 106 ? -5.811 -33.159 20.730 1.00 128.30 ? 106 VAL L C 1 ATOM 5041 O O . VAL C 3 106 ? -6.308 -33.199 21.849 1.00 123.04 ? 106 VAL L O 1 ATOM 5042 C CB . VAL C 3 106 ? -3.327 -33.018 21.021 1.00 139.02 ? 106 VAL L CB 1 ATOM 5043 C CG1 . VAL C 3 106 ? -3.344 -34.491 20.670 1.00 136.46 ? 106 VAL L CG1 1 ATOM 5044 C CG2 . VAL C 3 106 ? -2.085 -32.376 20.446 1.00 146.95 ? 106 VAL L CG2 1 ATOM 5045 N N . ALA C 3 107 ? -6.311 -33.848 19.713 1.00 128.79 ? 107 ALA L N 1 ATOM 5046 C CA . ALA C 3 107 ? -7.474 -34.722 19.872 1.00 127.41 ? 107 ALA L CA 1 ATOM 5047 C C . ALA C 3 107 ? -7.204 -36.081 19.304 1.00 130.12 ? 107 ALA L C 1 ATOM 5048 O O . ALA C 3 107 ? -6.835 -36.212 18.155 1.00 128.90 ? 107 ALA L O 1 ATOM 5049 C CB . ALA C 3 107 ? -8.693 -34.142 19.190 1.00 127.53 ? 107 ALA L CB 1 ATOM 5050 N N . ALA C 3 108 ? -7.369 -37.089 20.153 1.00 145.10 ? 108 ALA L N 1 ATOM 5051 C CA . ALA C 3 108 ? -7.157 -38.463 19.746 1.00 146.69 ? 108 ALA L CA 1 ATOM 5052 C C . ALA C 3 108 ? -8.279 -38.960 18.824 1.00 144.16 ? 108 ALA L C 1 ATOM 5053 O O . ALA C 3 108 ? -9.429 -38.521 18.928 1.00 135.29 ? 108 ALA L O 1 ATOM 5054 C CB . ALA C 3 108 ? -7.046 -39.353 20.987 1.00 146.58 ? 108 ALA L CB 1 ATOM 5055 N N . PRO C 3 109 ? -7.928 -39.875 17.909 1.00 162.52 ? 109 PRO L N 1 ATOM 5056 C CA . PRO C 3 109 ? -8.800 -40.502 16.910 1.00 81.36 ? 109 PRO L CA 1 ATOM 5057 C C . PRO C 3 109 ? -9.774 -41.528 17.451 1.00 82.98 ? 109 PRO L C 1 ATOM 5058 O O . PRO C 3 109 ? -9.430 -42.298 18.349 1.00 106.64 ? 109 PRO L O 1 ATOM 5059 C CB . PRO C 3 109 ? -7.809 -41.198 15.969 1.00 92.56 ? 109 PRO L CB 1 ATOM 5060 C CG . PRO C 3 109 ? -6.475 -40.614 16.283 1.00 92.75 ? 109 PRO L CG 1 ATOM 5061 C CD . PRO C 3 109 ? -6.519 -40.249 17.710 1.00 81.03 ? 109 PRO L CD 1 ATOM 5062 N N . SER C 3 110 ? -10.994 -41.519 16.934 1.00 149.25 ? 110 SER L N 1 ATOM 5063 C CA . SER C 3 110 ? -11.873 -42.669 17.096 1.00 127.54 ? 110 SER L CA 1 ATOM 5064 C C . SER C 3 110 ? -11.636 -43.718 16.018 1.00 122.42 ? 110 SER L C 1 ATOM 5065 O O . SER C 3 110 ? -11.669 -43.426 14.840 1.00 122.21 ? 110 SER L O 1 ATOM 5066 C CB . SER C 3 110 ? -13.333 -42.250 17.074 1.00 120.62 ? 110 SER L CB 1 ATOM 5067 O OG . SER C 3 110 ? -13.629 -41.421 18.169 1.00 122.91 ? 110 SER L OG 1 ATOM 5068 N N . VAL C 3 111 ? -11.448 -44.960 16.408 1.00 118.50 ? 111 VAL L N 1 ATOM 5069 C CA . VAL C 3 111 ? -11.049 -45.967 15.444 1.00 109.56 ? 111 VAL L CA 1 ATOM 5070 C C . VAL C 3 111 ? -12.173 -46.979 15.247 1.00 101.40 ? 111 VAL L C 1 ATOM 5071 O O . VAL C 3 111 ? -12.776 -47.434 16.207 1.00 104.20 ? 111 VAL L O 1 ATOM 5072 C CB . VAL C 3 111 ? -9.733 -46.613 15.872 1.00 111.17 ? 111 VAL L CB 1 ATOM 5073 C CG1 . VAL C 3 111 ? -9.156 -47.474 14.772 1.00 113.46 ? 111 VAL L CG1 1 ATOM 5074 C CG2 . VAL C 3 111 ? -8.771 -45.511 16.341 1.00 111.22 ? 111 VAL L CG2 1 ATOM 5075 N N . PHE C 3 112 ? -12.521 -47.245 13.989 1.00 101.19 ? 112 PHE L N 1 ATOM 5076 C CA . PHE C 3 112 ? -13.558 -48.219 13.680 1.00 101.01 ? 112 PHE L CA 1 ATOM 5077 C C . PHE C 3 112 ? -12.993 -49.111 12.607 1.00 97.15 ? 112 PHE L C 1 ATOM 5078 O O . PHE C 3 112 ? -12.318 -48.632 11.704 1.00 96.57 ? 112 PHE L O 1 ATOM 5079 C CB . PHE C 3 112 ? -14.823 -47.541 13.178 1.00 85.09 ? 112 PHE L CB 1 ATOM 5080 C CG . PHE C 3 112 ? -15.332 -46.493 14.095 1.00 121.69 ? 112 PHE L CG 1 ATOM 5081 C CD1 . PHE C 3 112 ? -15.257 -45.158 13.734 1.00 117.00 ? 112 PHE L CD1 1 ATOM 5082 C CD2 . PHE C 3 112 ? -15.844 -46.823 15.342 1.00 126.64 ? 112 PHE L CD2 1 ATOM 5083 C CE1 . PHE C 3 112 ? -15.708 -44.163 14.584 1.00 119.25 ? 112 PHE L CE1 1 ATOM 5084 C CE2 . PHE C 3 112 ? -16.298 -45.834 16.206 1.00 126.05 ? 112 PHE L CE2 1 ATOM 5085 C CZ . PHE C 3 112 ? -16.234 -44.499 15.818 1.00 125.28 ? 112 PHE L CZ 1 ATOM 5086 N N . ILE C 3 113 ? -13.254 -50.408 12.693 1.00 97.43 ? 113 ILE L N 1 ATOM 5087 C CA . ILE C 3 113 ? -12.851 -51.290 11.620 1.00 94.80 ? 113 ILE L CA 1 ATOM 5088 C C . ILE C 3 113 ? -14.122 -51.899 11.047 1.00 102.42 ? 113 ILE L C 1 ATOM 5089 O O . ILE C 3 113 ? -15.078 -52.202 11.769 1.00 103.15 ? 113 ILE L O 1 ATOM 5090 C CB . ILE C 3 113 ? -11.853 -52.358 12.109 1.00 94.68 ? 113 ILE L CB 1 ATOM 5091 C CG1 . ILE C 3 113 ? -11.319 -53.213 10.968 1.00 96.28 ? 113 ILE L CG1 1 ATOM 5092 C CG2 . ILE C 3 113 ? -12.435 -53.170 13.232 1.00 93.98 ? 113 ILE L CG2 1 ATOM 5093 C CD1 . ILE C 3 113 ? -10.010 -53.915 11.337 1.00 95.49 ? 113 ILE L CD1 1 ATOM 5094 N N . PHE C 3 114 ? -14.134 -52.025 9.731 1.00 104.20 ? 114 PHE L N 1 ATOM 5095 C CA . PHE C 3 114 ? -15.246 -52.566 8.981 1.00 102.48 ? 114 PHE L CA 1 ATOM 5096 C C . PHE C 3 114 ? -14.766 -53.746 8.190 1.00 104.05 ? 114 PHE L C 1 ATOM 5097 O O . PHE C 3 114 ? -13.846 -53.616 7.362 1.00 105.76 ? 114 PHE L O 1 ATOM 5098 C CB . PHE C 3 114 ? -15.807 -51.539 8.023 1.00 97.92 ? 114 PHE L CB 1 ATOM 5099 C CG . PHE C 3 114 ? -16.315 -50.298 8.673 1.00 99.03 ? 114 PHE L CG 1 ATOM 5100 C CD1 . PHE C 3 114 ? -17.598 -50.255 9.191 1.00 100.92 ? 114 PHE L CD1 1 ATOM 5101 C CD2 . PHE C 3 114 ? -15.497 -49.194 8.820 1.00 100.11 ? 114 PHE L CD2 1 ATOM 5102 C CE1 . PHE C 3 114 ? -18.089 -49.103 9.765 1.00 102.69 ? 114 PHE L CE1 1 ATOM 5103 C CE2 . PHE C 3 114 ? -15.975 -48.045 9.413 1.00 102.88 ? 114 PHE L CE2 1 ATOM 5104 C CZ . PHE C 3 114 ? -17.278 -48.002 9.888 1.00 103.19 ? 114 PHE L CZ 1 ATOM 5105 N N . PRO C 3 115 ? -15.407 -54.898 8.410 1.00 103.40 ? 115 PRO L N 1 ATOM 5106 C CA . PRO C 3 115 ? -15.171 -56.101 7.621 1.00 103.82 ? 115 PRO L CA 1 ATOM 5107 C C . PRO C 3 115 ? -15.824 -55.912 6.261 1.00 107.97 ? 115 PRO L C 1 ATOM 5108 O O . PRO C 3 115 ? -16.750 -55.102 6.137 1.00 109.29 ? 115 PRO L O 1 ATOM 5109 C CB . PRO C 3 115 ? -15.851 -57.204 8.434 1.00 100.67 ? 115 PRO L CB 1 ATOM 5110 C CG . PRO C 3 115 ? -16.149 -56.598 9.753 1.00 103.33 ? 115 PRO L CG 1 ATOM 5111 C CD . PRO C 3 115 ? -16.346 -55.149 9.510 1.00 105.11 ? 115 PRO L CD 1 ATOM 5112 N N . PRO C 3 116 ? -15.416 -56.717 5.277 1.00 104.68 ? 116 PRO L N 1 ATOM 5113 C CA . PRO C 3 116 ? -15.997 -56.685 3.928 1.00 105.03 ? 116 PRO L CA 1 ATOM 5114 C C . PRO C 3 116 ? -17.497 -57.038 3.893 1.00 106.94 ? 116 PRO L C 1 ATOM 5115 O O . PRO C 3 116 ? -17.970 -57.825 4.706 1.00 99.19 ? 116 PRO L O 1 ATOM 5116 C CB . PRO C 3 116 ? -15.189 -57.761 3.187 1.00 106.04 ? 116 PRO L CB 1 ATOM 5117 C CG . PRO C 3 116 ? -13.911 -57.900 3.987 1.00 103.80 ? 116 PRO L CG 1 ATOM 5118 C CD . PRO C 3 116 ? -14.305 -57.682 5.387 1.00 101.27 ? 116 PRO L CD 1 ATOM 5119 N N . SER C 3 117 ? -18.260 -56.378 3.025 1.00 114.60 ? 117 SER L N 1 ATOM 5120 C CA . SER C 3 117 ? -19.676 -56.705 2.895 1.00 118.77 ? 117 SER L CA 1 ATOM 5121 C C . SER C 3 117 ? -19.786 -58.085 2.239 1.00 130.45 ? 117 SER L C 1 ATOM 5122 O O . SER C 3 117 ? -18.849 -58.516 1.567 1.00 139.45 ? 117 SER L O 1 ATOM 5123 C CB . SER C 3 117 ? -20.399 -55.630 2.085 1.00 108.51 ? 117 SER L CB 1 ATOM 5124 O OG . SER C 3 117 ? -19.862 -55.528 0.782 1.00 103.12 ? 117 SER L OG 1 ATOM 5125 N N . ASP C 3 118 ? -20.889 -58.798 2.446 1.00 129.22 ? 118 ASP L N 1 ATOM 5126 C CA . ASP C 3 118 ? -21.049 -60.089 1.783 1.00 138.06 ? 118 ASP L CA 1 ATOM 5127 C C . ASP C 3 118 ? -21.083 -59.987 0.271 1.00 135.11 ? 118 ASP L C 1 ATOM 5128 O O . ASP C 3 118 ? -20.565 -60.840 -0.448 1.00 133.27 ? 118 ASP L O 1 ATOM 5129 C CB . ASP C 3 118 ? -22.331 -60.737 2.261 1.00 154.31 ? 118 ASP L CB 1 ATOM 5130 C CG . ASP C 3 118 ? -22.284 -61.068 3.723 1.00 167.83 ? 118 ASP L CG 1 ATOM 5131 O OD1 . ASP C 3 118 ? -21.516 -61.981 4.099 1.00 171.92 ? 118 ASP L OD1 1 ATOM 5132 O OD2 . ASP C 3 118 ? -22.992 -60.390 4.500 1.00 173.63 ? 118 ASP L OD2 1 ATOM 5133 N N . GLU C 3 119 ? -21.711 -58.921 -0.194 1.00 134.19 ? 119 GLU L N 1 ATOM 5134 C CA . GLU C 3 119 ? -21.872 -58.644 -1.604 1.00 131.56 ? 119 GLU L CA 1 ATOM 5135 C C . GLU C 3 119 ? -20.489 -58.504 -2.253 1.00 125.79 ? 119 GLU L C 1 ATOM 5136 O O . GLU C 3 119 ? -20.217 -59.031 -3.358 1.00 137.10 ? 119 GLU L O 1 ATOM 5137 C CB . GLU C 3 119 ? -22.769 -57.422 -1.804 1.00 134.86 ? 119 GLU L CB 1 ATOM 5138 C CG . GLU C 3 119 ? -23.107 -57.124 -3.256 1.00 145.43 ? 119 GLU L CG 1 ATOM 5139 C CD . GLU C 3 119 ? -24.047 -55.937 -3.407 1.00 154.02 ? 119 GLU L CD 1 ATOM 5140 O OE1 . GLU C 3 119 ? -24.963 -55.809 -2.563 1.00 160.41 ? 119 GLU L OE1 1 ATOM 5141 O OE2 . GLU C 3 119 ? -23.902 -55.163 -4.379 1.00 153.35 ? 119 GLU L OE2 1 ATOM 5142 N N . GLN C 3 120 ? -19.574 -57.878 -1.517 1.00 109.47 ? 120 GLN L N 1 ATOM 5143 C CA . GLN C 3 120 ? -18.227 -57.722 -2.053 1.00 106.02 ? 120 GLN L CA 1 ATOM 5144 C C . GLN C 3 120 ? -17.515 -59.054 -2.097 1.00 105.78 ? 120 GLN L C 1 ATOM 5145 O O . GLN C 3 120 ? -16.803 -59.327 -3.070 1.00 105.53 ? 120 GLN L O 1 ATOM 5146 C CB . GLN C 3 120 ? -17.402 -56.723 -1.240 1.00 105.73 ? 120 GLN L CB 1 ATOM 5147 C CG . GLN C 3 120 ? -15.992 -56.556 -1.816 1.00 107.49 ? 120 GLN L CG 1 ATOM 5148 C CD . GLN C 3 120 ? -15.111 -55.608 -1.027 1.00 110.73 ? 120 GLN L CD 1 ATOM 5149 O OE1 . GLN C 3 120 ? -14.080 -55.155 -1.540 1.00 111.29 ? 120 GLN L OE1 1 ATOM 5150 N NE2 . GLN C 3 120 ? -15.494 -55.314 0.229 1.00 110.80 ? 120 GLN L NE2 1 ATOM 5151 N N . LEU C 3 121 ? -17.632 -59.857 -1.046 1.00 109.19 ? 121 LEU L N 1 ATOM 5152 C CA . LEU C 3 121 ? -16.987 -61.161 -1.076 1.00 122.53 ? 121 LEU L CA 1 ATOM 5153 C C . LEU C 3 121 ? -17.523 -61.942 -2.279 1.00 131.40 ? 121 LEU L C 1 ATOM 5154 O O . LEU C 3 121 ? -16.793 -62.692 -2.937 1.00 137.84 ? 121 LEU L O 1 ATOM 5155 C CB . LEU C 3 121 ? -17.237 -61.909 0.217 1.00 129.57 ? 121 LEU L CB 1 ATOM 5156 C CG . LEU C 3 121 ? -16.459 -61.252 1.345 1.00 134.43 ? 121 LEU L CG 1 ATOM 5157 C CD1 . LEU C 3 121 ? -17.347 -61.025 2.564 1.00 138.39 ? 121 LEU L CD1 1 ATOM 5158 C CD2 . LEU C 3 121 ? -15.291 -62.151 1.678 1.00 139.15 ? 121 LEU L CD2 1 ATOM 5159 N N . LYS C 3 122 ? -18.803 -61.728 -2.579 1.00 127.16 ? 122 LYS L N 1 ATOM 5160 C CA . LYS C 3 122 ? -19.420 -62.355 -3.732 1.00 129.93 ? 122 LYS L CA 1 ATOM 5161 C C . LYS C 3 122 ? -18.722 -61.865 -5.000 1.00 139.85 ? 122 LYS L C 1 ATOM 5162 O O . LYS C 3 122 ? -18.747 -62.540 -6.027 1.00 148.68 ? 122 LYS L O 1 ATOM 5163 C CB . LYS C 3 122 ? -20.919 -62.076 -3.794 0.00 129.01 ? 122 LYS L CB 1 ATOM 5164 C CG . LYS C 3 122 ? -21.754 -63.015 -2.956 0.00 128.78 ? 122 LYS L CG 1 ATOM 5165 C CD . LYS C 3 122 ? -23.236 -62.741 -3.147 0.00 128.87 ? 122 LYS L CD 1 ATOM 5166 C CE . LYS C 3 122 ? -24.014 -62.979 -1.854 0.00 128.56 ? 122 LYS L CE 1 ATOM 5167 N NZ . LYS C 3 122 ? -23.945 -64.393 -1.372 0.00 130.90 ? 122 LYS L NZ 1 ATOM 5168 N N . SER C 3 123 ? -18.121 -60.678 -4.956 1.00 135.38 ? 123 SER L N 1 ATOM 5169 C CA . SER C 3 123 ? -17.444 -60.196 -6.166 1.00 138.41 ? 123 SER L CA 1 ATOM 5170 C C . SER C 3 123 ? -15.990 -60.718 -6.290 1.00 137.23 ? 123 SER L C 1 ATOM 5171 O O . SER C 3 123 ? -15.328 -60.518 -7.310 1.00 138.99 ? 123 SER L O 1 ATOM 5172 C CB . SER C 3 123 ? -17.450 -58.662 -6.203 1.00 142.77 ? 123 SER L CB 1 ATOM 5173 O OG . SER C 3 123 ? -16.727 -58.108 -5.114 1.00 142.20 ? 123 SER L OG 1 ATOM 5174 N N . GLY C 3 124 ? -15.525 -61.436 -5.273 1.00 135.68 ? 124 GLY L N 1 ATOM 5175 C CA . GLY C 3 124 ? -14.213 -62.069 -5.293 1.00 139.46 ? 124 GLY L CA 1 ATOM 5176 C C . GLY C 3 124 ? -13.080 -61.158 -4.852 1.00 139.15 ? 124 GLY L C 1 ATOM 5177 O O . GLY C 3 124 ? -11.909 -61.386 -5.164 1.00 142.83 ? 124 GLY L O 1 ATOM 5178 N N . THR C 3 125 ? -13.442 -60.128 -4.100 1.00 134.26 ? 125 THR L N 1 ATOM 5179 C CA . THR C 3 125 ? -12.491 -59.191 -3.524 1.00 135.06 ? 125 THR L CA 1 ATOM 5180 C C . THR C 3 125 ? -12.959 -58.845 -2.125 1.00 133.31 ? 125 THR L C 1 ATOM 5181 O O . THR C 3 125 ? -14.121 -59.049 -1.773 1.00 126.66 ? 125 THR L O 1 ATOM 5182 C CB . THR C 3 125 ? -12.332 -57.883 -4.335 1.00 135.57 ? 125 THR L CB 1 ATOM 5183 O OG1 . THR C 3 125 ? -13.613 -57.428 -4.797 1.00 128.36 ? 125 THR L OG1 1 ATOM 5184 C CG2 . THR C 3 125 ? -11.374 -58.078 -5.516 1.00 144.05 ? 125 THR L CG2 1 ATOM 5185 N N . ALA C 3 126 ? -12.046 -58.348 -1.313 1.00 134.11 ? 126 ALA L N 1 ATOM 5186 C CA . ALA C 3 126 ? -12.376 -58.059 0.061 1.00 124.70 ? 126 ALA L CA 1 ATOM 5187 C C . ALA C 3 126 ? -11.660 -56.773 0.424 1.00 118.73 ? 126 ALA L C 1 ATOM 5188 O O . ALA C 3 126 ? -10.461 -56.619 0.176 1.00 119.96 ? 126 ALA L O 1 ATOM 5189 C CB . ALA C 3 126 ? -11.975 -59.198 0.972 1.00 124.12 ? 126 ALA L CB 1 ATOM 5190 N N . SER C 3 127 ? -12.431 -55.819 0.929 1.00 109.61 ? 127 SER L N 1 ATOM 5191 C CA . SER C 3 127 ? -11.884 -54.570 1.399 1.00 102.19 ? 127 SER L CA 1 ATOM 5192 C C . SER C 3 127 ? -12.206 -54.414 2.869 1.00 98.35 ? 127 SER L C 1 ATOM 5193 O O . SER C 3 127 ? -13.382 -54.363 3.265 1.00 101.82 ? 127 SER L O 1 ATOM 5194 C CB . SER C 3 127 ? -12.461 -53.388 0.595 1.00 102.40 ? 127 SER L CB 1 ATOM 5195 O OG . SER C 3 127 ? -12.042 -53.396 -0.765 1.00 100.30 ? 127 SER L OG 1 ATOM 5196 N N . VAL C 3 128 ? -11.166 -54.248 3.671 1.00 94.07 ? 128 VAL L N 1 ATOM 5197 C CA . VAL C 3 128 ? -11.341 -53.976 5.087 1.00 97.72 ? 128 VAL L CA 1 ATOM 5198 C C . VAL C 3 128 ? -11.131 -52.480 5.257 1.00 91.31 ? 128 VAL L C 1 ATOM 5199 O O . VAL C 3 128 ? -10.076 -51.955 4.889 1.00 83.49 ? 128 VAL L O 1 ATOM 5200 C CB . VAL C 3 128 ? -10.332 -54.790 5.946 1.00 98.52 ? 128 VAL L CB 1 ATOM 5201 C CG1 . VAL C 3 128 ? -10.667 -54.678 7.418 1.00 96.31 ? 128 VAL L CG1 1 ATOM 5202 C CG2 . VAL C 3 128 ? -10.353 -56.247 5.540 1.00 97.07 ? 128 VAL L CG2 1 ATOM 5203 N N . VAL C 3 129 ? -12.085 -51.789 5.861 1.00 99.50 ? 129 VAL L N 1 ATOM 5204 C CA . VAL C 3 129 ? -11.921 -50.350 5.929 1.00 113.55 ? 129 VAL L CA 1 ATOM 5205 C C . VAL C 3 129 ? -11.733 -49.964 7.361 1.00 123.24 ? 129 VAL L C 1 ATOM 5206 O O . VAL C 3 129 ? -12.540 -50.281 8.213 1.00 127.03 ? 129 VAL L O 1 ATOM 5207 C CB . VAL C 3 129 ? -13.122 -49.604 5.338 1.00 110.46 ? 129 VAL L CB 1 ATOM 5208 C CG1 . VAL C 3 129 ? -12.959 -48.103 5.509 1.00 105.79 ? 129 VAL L CG1 1 ATOM 5209 C CG2 . VAL C 3 129 ? -13.303 -49.991 3.874 1.00 108.04 ? 129 VAL L CG2 1 ATOM 5210 N N . CYS C 3 130 ? -10.727 -49.140 7.586 1.00 124.20 ? 130 CYS L N 1 ATOM 5211 C CA . CYS C 3 130 ? -10.442 -48.653 8.905 1.00 122.32 ? 130 CYS L CA 1 ATOM 5212 C C . CYS C 3 130 ? -10.539 -47.141 8.937 1.00 120.46 ? 130 CYS L C 1 ATOM 5213 O O . CYS C 3 130 ? -9.834 -46.439 8.213 1.00 129.23 ? 130 CYS L O 1 ATOM 5214 C CB . CYS C 3 130 ? -9.062 -49.142 9.322 1.00 119.70 ? 130 CYS L CB 1 ATOM 5215 S SG . CYS C 3 130 ? -8.601 -48.742 10.989 1.00 227.28 ? 130 CYS L SG 1 ATOM 5216 N N . LEU C 3 131 ? -11.460 -46.659 9.767 1.00 109.00 ? 131 LEU L N 1 ATOM 5217 C CA . LEU C 3 131 ? -11.734 -45.236 9.954 1.00 98.23 ? 131 LEU L CA 1 ATOM 5218 C C . LEU C 3 131 ? -11.128 -44.646 11.232 1.00 95.51 ? 131 LEU L C 1 ATOM 5219 O O . LEU C 3 131 ? -11.305 -45.193 12.315 1.00 97.31 ? 131 LEU L O 1 ATOM 5220 C CB . LEU C 3 131 ? -13.245 -45.018 9.926 1.00 95.43 ? 131 LEU L CB 1 ATOM 5221 C CG . LEU C 3 131 ? -13.768 -43.635 10.279 1.00 97.89 ? 131 LEU L CG 1 ATOM 5222 C CD1 . LEU C 3 131 ? -13.381 -42.624 9.190 1.00 94.67 ? 131 LEU L CD1 1 ATOM 5223 C CD2 . LEU C 3 131 ? -15.288 -43.712 10.420 1.00 86.76 ? 131 LEU L CD2 1 ATOM 5224 N N . LEU C 3 132 ? -10.462 -43.495 11.088 1.00 97.07 ? 132 LEU L N 1 ATOM 5225 C CA . LEU C 3 132 ? -9.932 -42.670 12.192 1.00 95.56 ? 132 LEU L CA 1 ATOM 5226 C C . LEU C 3 132 ? -10.644 -41.321 12.272 1.00 94.81 ? 132 LEU L C 1 ATOM 5227 O O . LEU C 3 132 ? -10.417 -40.454 11.450 1.00 95.12 ? 132 LEU L O 1 ATOM 5228 C CB . LEU C 3 132 ? -8.442 -42.423 12.000 1.00 96.35 ? 132 LEU L CB 1 ATOM 5229 C CG . LEU C 3 132 ? -7.431 -43.541 12.237 1.00 104.86 ? 132 LEU L CG 1 ATOM 5230 C CD1 . LEU C 3 132 ? -7.653 -44.771 11.369 1.00 99.55 ? 132 LEU L CD1 1 ATOM 5231 C CD2 . LEU C 3 132 ? -6.039 -42.992 12.029 1.00 115.29 ? 132 LEU L CD2 1 ATOM 5232 N N . ASN C 3 133 ? -11.476 -41.135 13.280 1.00 101.24 ? 133 ASN L N 1 ATOM 5233 C CA . ASN C 3 133 ? -12.361 -39.997 13.315 1.00 112.02 ? 133 ASN L CA 1 ATOM 5234 C C . ASN C 3 133 ? -11.981 -38.849 14.230 1.00 123.27 ? 133 ASN L C 1 ATOM 5235 O O . ASN C 3 133 ? -11.601 -39.074 15.373 1.00 129.04 ? 133 ASN L O 1 ATOM 5236 C CB . ASN C 3 133 ? -13.729 -40.487 13.721 1.00 121.79 ? 133 ASN L CB 1 ATOM 5237 C CG . ASN C 3 133 ? -14.705 -40.349 12.612 1.00 137.16 ? 133 ASN L CG 1 ATOM 5238 O OD1 . ASN C 3 133 ? -14.493 -39.547 11.705 1.00 142.65 ? 133 ASN L OD1 1 ATOM 5239 N ND2 . ASN C 3 133 ? -15.763 -41.143 12.637 1.00 145.91 ? 133 ASN L ND2 1 ATOM 5240 N N . ASN C 3 134 ? -12.145 -37.633 13.697 1.00 126.71 ? 134 ASN L N 1 ATOM 5241 C CA . ASN C 3 134 ? -11.999 -36.407 14.467 1.00 130.75 ? 134 ASN L CA 1 ATOM 5242 C C . ASN C 3 134 ? -10.773 -36.105 15.296 1.00 134.04 ? 134 ASN L C 1 ATOM 5243 O O . ASN C 3 134 ? -10.866 -35.806 16.482 1.00 154.29 ? 134 ASN L O 1 ATOM 5244 C CB . ASN C 3 134 ? -13.235 -36.221 15.359 1.00 139.59 ? 134 ASN L CB 1 ATOM 5245 C CG . ASN C 3 134 ? -14.534 -36.147 14.565 1.00 146.74 ? 134 ASN L CG 1 ATOM 5246 O OD1 . ASN C 3 134 ? -14.565 -36.436 13.364 1.00 142.81 ? 134 ASN L OD1 1 ATOM 5247 N ND2 . ASN C 3 134 ? -15.644 -35.946 15.279 1.00 155.53 ? 134 ASN L ND2 1 ATOM 5248 N N . PHE C 3 135 ? -9.615 -36.144 14.665 1.00 118.42 ? 135 PHE L N 1 ATOM 5249 C CA . PHE C 3 135 ? -8.343 -36.111 15.358 1.00 110.94 ? 135 PHE L CA 1 ATOM 5250 C C . PHE C 3 135 ? -7.501 -34.898 14.953 1.00 109.81 ? 135 PHE L C 1 ATOM 5251 O O . PHE C 3 135 ? -7.722 -34.289 13.900 1.00 110.41 ? 135 PHE L O 1 ATOM 5252 C CB . PHE C 3 135 ? -7.564 -37.394 15.098 1.00 103.38 ? 135 PHE L CB 1 ATOM 5253 C CG . PHE C 3 135 ? -7.187 -37.587 13.662 1.00 116.16 ? 135 PHE L CG 1 ATOM 5254 C CD1 . PHE C 3 135 ? -5.976 -37.106 13.189 1.00 122.43 ? 135 PHE L CD1 1 ATOM 5255 C CD2 . PHE C 3 135 ? -8.043 -38.227 12.777 1.00 116.48 ? 135 PHE L CD2 1 ATOM 5256 C CE1 . PHE C 3 135 ? -5.618 -37.272 11.869 1.00 119.26 ? 135 PHE L CE1 1 ATOM 5257 C CE2 . PHE C 3 135 ? -7.684 -38.390 11.454 1.00 113.60 ? 135 PHE L CE2 1 ATOM 5258 C CZ . PHE C 3 135 ? -6.470 -37.913 11.004 1.00 116.42 ? 135 PHE L CZ 1 ATOM 5259 N N . TYR C 3 136 ? -6.521 -34.589 15.789 1.00 110.63 ? 136 TYR L N 1 ATOM 5260 C CA . TYR C 3 136 ? -5.552 -33.532 15.569 1.00 117.44 ? 136 TYR L CA 1 ATOM 5261 C C . TYR C 3 136 ? -4.262 -33.755 16.323 1.00 127.45 ? 136 TYR L C 1 ATOM 5262 O O . TYR C 3 136 ? -4.291 -34.146 17.490 1.00 135.32 ? 136 TYR L O 1 ATOM 5263 C CB . TYR C 3 136 ? -6.142 -32.179 15.991 1.00 121.69 ? 136 TYR L CB 1 ATOM 5264 C CG . TYR C 3 136 ? -5.263 -31.027 15.576 1.00 124.88 ? 136 TYR L CG 1 ATOM 5265 C CD1 . TYR C 3 136 ? -4.255 -30.606 16.433 1.00 129.91 ? 136 TYR L CD1 1 ATOM 5266 C CD2 . TYR C 3 136 ? -5.384 -30.391 14.351 1.00 123.88 ? 136 TYR L CD2 1 ATOM 5267 C CE1 . TYR C 3 136 ? -3.403 -29.590 16.109 1.00 133.41 ? 136 TYR L CE1 1 ATOM 5268 C CE2 . TYR C 3 136 ? -4.515 -29.348 14.014 1.00 134.44 ? 136 TYR L CE2 1 ATOM 5269 C CZ . TYR C 3 136 ? -3.528 -28.960 14.916 1.00 135.05 ? 136 TYR L CZ 1 ATOM 5270 O OH . TYR C 3 136 ? -2.632 -27.950 14.661 1.00 135.35 ? 136 TYR L OH 1 ATOM 5271 N N . PRO C 3 137 ? -3.117 -33.426 15.694 1.00 130.14 ? 137 PRO L N 1 ATOM 5272 C CA . PRO C 3 137 ? -2.975 -32.862 14.345 1.00 137.09 ? 137 PRO L CA 1 ATOM 5273 C C . PRO C 3 137 ? -3.110 -33.895 13.235 1.00 137.71 ? 137 PRO L C 1 ATOM 5274 O O . PRO C 3 137 ? -3.297 -35.081 13.531 1.00 127.65 ? 137 PRO L O 1 ATOM 5275 C CB . PRO C 3 137 ? -1.532 -32.360 14.333 1.00 140.21 ? 137 PRO L CB 1 ATOM 5276 C CG . PRO C 3 137 ? -0.831 -33.261 15.274 1.00 132.80 ? 137 PRO L CG 1 ATOM 5277 C CD . PRO C 3 137 ? -1.810 -33.597 16.348 1.00 131.88 ? 137 PRO L CD 1 ATOM 5278 N N . ARG C 3 138 ? -2.944 -33.454 11.988 1.00 148.60 ? 138 ARG L N 1 ATOM 5279 C CA . ARG C 3 138 ? -3.238 -34.279 10.821 1.00 149.83 ? 138 ARG L CA 1 ATOM 5280 C C . ARG C 3 138 ? -2.347 -35.497 10.706 1.00 150.17 ? 138 ARG L C 1 ATOM 5281 O O . ARG C 3 138 ? -2.757 -36.530 10.182 1.00 146.15 ? 138 ARG L O 1 ATOM 5282 C CB . ARG C 3 138 ? -3.139 -33.418 9.550 0.00 153.35 ? 138 ARG L CB 1 ATOM 5283 C CG . ARG C 3 138 ? -3.449 -34.156 8.241 0.00 150.98 ? 138 ARG L CG 1 ATOM 5284 C CD . ARG C 3 138 ? -3.413 -33.254 6.996 0.00 154.93 ? 138 ARG L CD 1 ATOM 5285 N NE . ARG C 3 138 ? -2.089 -32.704 6.697 0.00 159.18 ? 138 ARG L NE 1 ATOM 5286 C CZ . ARG C 3 138 ? -1.138 -33.354 6.026 0.00 159.36 ? 138 ARG L CZ 1 ATOM 5287 N NH1 . ARG C 3 138 ? -1.364 -34.580 5.572 0.00 155.48 ? 138 ARG L NH1 1 ATOM 5288 N NH2 . ARG C 3 138 ? 0.038 -32.777 5.793 0.00 163.89 ? 138 ARG L NH2 1 ATOM 5289 N N . GLU C 3 139 ? -1.113 -35.365 11.172 1.00 153.53 ? 139 GLU L N 1 ATOM 5290 C CA . GLU C 3 139 ? -0.187 -36.481 11.133 1.00 148.02 ? 139 GLU L CA 1 ATOM 5291 C C . GLU C 3 139 ? -0.762 -37.606 11.974 1.00 137.67 ? 139 GLU L C 1 ATOM 5292 O O . GLU C 3 139 ? -1.230 -37.382 13.088 1.00 139.77 ? 139 GLU L O 1 ATOM 5293 C CB . GLU C 3 139 ? 1.204 -36.057 11.616 1.00 159.80 ? 139 GLU L CB 1 ATOM 5294 C CG . GLU C 3 139 ? 1.918 -35.076 10.671 1.00 174.64 ? 139 GLU L CG 1 ATOM 5295 C CD . GLU C 3 139 ? 1.213 -33.726 10.536 1.00 185.80 ? 139 GLU L CD 1 ATOM 5296 O OE1 . GLU C 3 139 ? 0.447 -33.356 11.456 1.00 188.80 ? 139 GLU L OE1 1 ATOM 5297 O OE2 . GLU C 3 139 ? 1.384 -33.065 9.481 1.00 188.13 ? 139 GLU L OE2 1 ATOM 5298 N N . ALA C 3 140 ? -0.709 -38.813 11.428 1.00 129.28 ? 140 ALA L N 1 ATOM 5299 C CA . ALA C 3 140 ? -1.219 -40.012 12.083 1.00 118.22 ? 140 ALA L CA 1 ATOM 5300 C C . ALA C 3 140 ? -0.665 -41.229 11.356 1.00 115.30 ? 140 ALA L C 1 ATOM 5301 O O . ALA C 3 140 ? -0.266 -41.121 10.199 1.00 127.35 ? 140 ALA L O 1 ATOM 5302 C CB . ALA C 3 140 ? -2.756 -40.028 12.080 1.00 107.01 ? 140 ALA L CB 1 ATOM 5303 N N . LYS C 3 141 ? -0.574 -42.367 12.029 1.00 102.85 ? 141 LYS L N 1 ATOM 5304 C CA . LYS C 3 141 ? -0.047 -43.559 11.376 1.00 101.72 ? 141 LYS L CA 1 ATOM 5305 C C . LYS C 3 141 ? -1.017 -44.727 11.474 1.00 112.36 ? 141 LYS L C 1 ATOM 5306 O O . LYS C 3 141 ? -1.538 -45.016 12.550 1.00 125.51 ? 141 LYS L O 1 ATOM 5307 C CB . LYS C 3 141 ? 1.253 -43.974 12.037 1.00 108.64 ? 141 LYS L CB 1 ATOM 5308 C CG . LYS C 3 141 ? 1.978 -45.169 11.454 1.00 117.69 ? 141 LYS L CG 1 ATOM 5309 C CD . LYS C 3 141 ? 3.301 -45.314 12.207 1.00 131.03 ? 141 LYS L CD 1 ATOM 5310 C CE . LYS C 3 141 ? 4.137 -46.501 11.764 1.00 138.90 ? 141 LYS L CE 1 ATOM 5311 N NZ . LYS C 3 141 ? 5.451 -46.523 12.484 1.00 143.38 ? 141 LYS L NZ 1 ATOM 5312 N N . VAL C 3 142 ? -1.220 -45.429 10.366 1.00 107.10 ? 142 VAL L N 1 ATOM 5313 C CA . VAL C 3 142 ? -2.072 -46.626 10.315 1.00 102.96 ? 142 VAL L CA 1 ATOM 5314 C C . VAL C 3 142 ? -1.221 -47.847 10.000 1.00 97.99 ? 142 VAL L C 1 ATOM 5315 O O . VAL C 3 142 ? -0.206 -47.747 9.320 1.00 96.82 ? 142 VAL L O 1 ATOM 5316 C CB . VAL C 3 142 ? -3.256 -46.473 9.370 1.00 98.55 ? 142 VAL L CB 1 ATOM 5317 C CG1 . VAL C 3 142 ? -4.104 -47.747 9.350 1.00 83.49 ? 142 VAL L CG1 1 ATOM 5318 C CG2 . VAL C 3 142 ? -4.086 -45.286 9.848 1.00 103.82 ? 142 VAL L CG2 1 ATOM 5319 N N . GLN C 3 143 ? -1.514 -48.953 10.653 1.00 104.81 ? 143 GLN L N 1 ATOM 5320 C CA . GLN C 3 143 ? -0.686 -50.118 10.520 1.00 115.86 ? 143 GLN L CA 1 ATOM 5321 C C . GLN C 3 143 ? -1.597 -51.318 10.304 1.00 112.45 ? 143 GLN L C 1 ATOM 5322 O O . GLN C 3 143 ? -2.269 -51.758 11.223 1.00 117.77 ? 143 GLN L O 1 ATOM 5323 C CB . GLN C 3 143 ? 0.183 -50.287 11.767 1.00 128.50 ? 143 GLN L CB 1 ATOM 5324 C CG . GLN C 3 143 ? 1.373 -51.202 11.601 1.00 135.96 ? 143 GLN L CG 1 ATOM 5325 C CD . GLN C 3 143 ? 2.430 -50.622 10.666 1.00 142.41 ? 143 GLN L CD 1 ATOM 5326 O OE1 . GLN C 3 143 ? 2.149 -50.287 9.509 1.00 146.65 ? 143 GLN L OE1 1 ATOM 5327 N NE2 . GLN C 3 143 ? 3.664 -50.522 11.163 1.00 144.52 ? 143 GLN L NE2 1 ATOM 5328 N N . TRP C 3 144 ? -1.692 -51.822 9.088 1.00 110.35 ? 144 TRP L N 1 ATOM 5329 C CA . TRP C 3 144 ? -2.540 -52.983 8.898 1.00 108.95 ? 144 TRP L CA 1 ATOM 5330 C C . TRP C 3 144 ? -1.780 -54.225 9.262 1.00 116.93 ? 144 TRP L C 1 ATOM 5331 O O . TRP C 3 144 ? -0.615 -54.397 8.897 1.00 122.95 ? 144 TRP L O 1 ATOM 5332 C CB . TRP C 3 144 ? -3.015 -53.114 7.469 1.00 104.63 ? 144 TRP L CB 1 ATOM 5333 C CG . TRP C 3 144 ? -4.093 -52.213 7.112 1.00 100.20 ? 144 TRP L CG 1 ATOM 5334 C CD1 . TRP C 3 144 ? -3.992 -51.077 6.372 1.00 104.21 ? 144 TRP L CD1 1 ATOM 5335 C CD2 . TRP C 3 144 ? -5.482 -52.392 7.393 1.00 93.64 ? 144 TRP L CD2 1 ATOM 5336 N NE1 . TRP C 3 144 ? -5.236 -50.510 6.207 1.00 103.51 ? 144 TRP L NE1 1 ATOM 5337 C CE2 . TRP C 3 144 ? -6.168 -51.302 6.822 1.00 96.22 ? 144 TRP L CE2 1 ATOM 5338 C CE3 . TRP C 3 144 ? -6.212 -53.359 8.080 1.00 94.69 ? 144 TRP L CE3 1 ATOM 5339 C CZ2 . TRP C 3 144 ? -7.551 -51.151 6.918 1.00 95.69 ? 144 TRP L CZ2 1 ATOM 5340 C CZ3 . TRP C 3 144 ? -7.586 -53.206 8.182 1.00 97.02 ? 144 TRP L CZ3 1 ATOM 5341 C CH2 . TRP C 3 144 ? -8.241 -52.110 7.601 1.00 99.17 ? 144 TRP L CH2 1 ATOM 5342 N N . LYS C 3 145 ? -2.464 -55.100 9.980 1.00 114.85 ? 145 LYS L N 1 ATOM 5343 C CA . LYS C 3 145 ? -1.916 -56.384 10.346 1.00 118.29 ? 145 LYS L CA 1 ATOM 5344 C C . LYS C 3 145 ? -3.001 -57.392 10.144 1.00 120.98 ? 145 LYS L C 1 ATOM 5345 O O . LYS C 3 145 ? -4.114 -57.208 10.576 1.00 108.43 ? 145 LYS L O 1 ATOM 5346 C CB . LYS C 3 145 ? -1.403 -56.418 11.777 1.00 121.44 ? 145 LYS L CB 1 ATOM 5347 C CG . LYS C 3 145 ? -0.427 -55.327 12.127 1.00 128.72 ? 145 LYS L CG 1 ATOM 5348 C CD . LYS C 3 145 ? -0.020 -55.464 13.575 1.00 139.88 ? 145 LYS L CD 1 ATOM 5349 C CE . LYS C 3 145 ? 1.387 -54.942 13.823 1.00 150.99 ? 145 LYS L CE 1 ATOM 5350 N NZ . LYS C 3 145 ? 1.810 -55.249 15.244 1.00 161.65 ? 145 LYS L NZ 1 ATOM 5351 N N . VAL C 3 146 ? -2.661 -58.440 9.421 1.00 132.80 ? 146 VAL L N 1 ATOM 5352 C CA . VAL C 3 146 ? -3.575 -59.524 9.130 1.00 130.65 ? 146 VAL L CA 1 ATOM 5353 C C . VAL C 3 146 ? -3.019 -60.790 9.701 1.00 133.42 ? 146 VAL L C 1 ATOM 5354 O O . VAL C 3 146 ? -2.057 -61.352 9.166 1.00 129.94 ? 146 VAL L O 1 ATOM 5355 C CB . VAL C 3 146 ? -3.823 -59.716 7.625 1.00 125.96 ? 146 VAL L CB 1 ATOM 5356 C CG1 . VAL C 3 146 ? -4.785 -60.872 7.399 1.00 126.30 ? 146 VAL L CG1 1 ATOM 5357 C CG2 . VAL C 3 146 ? -4.315 -58.421 6.986 1.00 115.64 ? 146 VAL L CG2 1 ATOM 5358 N N . ASP C 3 147 ? -3.603 -61.209 10.816 1.00 142.50 ? 147 ASP L N 1 ATOM 5359 C CA . ASP C 3 147 ? -3.050 -62.288 11.597 1.00 154.48 ? 147 ASP L CA 1 ATOM 5360 C C . ASP C 3 147 ? -1.603 -61.985 11.995 1.00 157.17 ? 147 ASP L C 1 ATOM 5361 O O . ASP C 3 147 ? -0.702 -62.763 11.714 1.00 162.59 ? 147 ASP L O 1 ATOM 5362 C CB . ASP C 3 147 ? -3.121 -63.559 10.749 1.00 162.02 ? 147 ASP L CB 1 ATOM 5363 C CG . ASP C 3 147 ? -2.932 -64.794 11.548 1.00 179.35 ? 147 ASP L CG 1 ATOM 5364 O OD1 . ASP C 3 147 ? -3.857 -65.116 12.319 1.00 184.58 ? 147 ASP L OD1 1 ATOM 5365 O OD2 . ASP C 3 147 ? -1.865 -65.438 11.405 1.00 190.41 ? 147 ASP L OD2 1 ATOM 5366 N N . ASN C 3 148 ? -1.404 -60.821 12.615 1.00 155.49 ? 148 ASN L N 1 ATOM 5367 C CA . ASN C 3 148 ? -0.102 -60.367 13.130 1.00 160.34 ? 148 ASN L CA 1 ATOM 5368 C C . ASN C 3 148 ? 0.961 -60.187 12.069 1.00 158.61 ? 148 ASN L C 1 ATOM 5369 O O . ASN C 3 148 ? 2.137 -60.002 12.385 1.00 164.64 ? 148 ASN L O 1 ATOM 5370 C CB . ASN C 3 148 ? 0.444 -61.369 14.154 1.00 174.13 ? 148 ASN L CB 1 ATOM 5371 C CG . ASN C 3 148 ? -0.115 -61.156 15.542 1.00 182.49 ? 148 ASN L CG 1 ATOM 5372 O OD1 . ASN C 3 148 ? -0.679 -60.104 15.840 1.00 184.16 ? 148 ASN L OD1 1 ATOM 5373 N ND2 . ASN C 3 148 ? 0.052 -62.153 16.408 1.00 188.14 ? 148 ASN L ND2 1 ATOM 5374 N N . ALA C 3 149 ? 0.540 -60.226 10.811 1.00 151.28 ? 149 ALA L N 1 ATOM 5375 C CA . ALA C 3 149 ? 1.451 -59.987 9.706 1.00 148.31 ? 149 ALA L CA 1 ATOM 5376 C C . ALA C 3 149 ? 1.318 -58.540 9.275 1.00 147.66 ? 149 ALA L C 1 ATOM 5377 O O . ALA C 3 149 ? 0.233 -58.083 8.905 1.00 143.48 ? 149 ALA L O 1 ATOM 5378 C CB . ALA C 3 149 ? 1.165 -60.915 8.549 1.00 146.36 ? 149 ALA L CB 1 ATOM 5379 N N . LEU C 3 150 ? 2.433 -57.824 9.303 1.00 151.24 ? 150 LEU L N 1 ATOM 5380 C CA . LEU C 3 150 ? 2.440 -56.436 8.899 1.00 149.22 ? 150 LEU L CA 1 ATOM 5381 C C . LEU C 3 150 ? 2.155 -56.271 7.416 1.00 147.66 ? 150 LEU L C 1 ATOM 5382 O O . LEU C 3 150 ? 2.791 -56.905 6.576 1.00 146.13 ? 150 LEU L O 1 ATOM 5383 C CB . LEU C 3 150 ? 3.779 -55.810 9.261 1.00 154.02 ? 150 LEU L CB 1 ATOM 5384 C CG . LEU C 3 150 ? 3.980 -54.394 8.747 1.00 154.86 ? 150 LEU L CG 1 ATOM 5385 C CD1 . LEU C 3 150 ? 2.919 -53.509 9.333 1.00 146.63 ? 150 LEU L CD1 1 ATOM 5386 C CD2 . LEU C 3 150 ? 5.364 -53.900 9.136 1.00 163.73 ? 150 LEU L CD2 1 ATOM 5387 N N . GLN C 3 151 ? 1.169 -55.435 7.102 1.00 145.80 ? 151 GLN L N 1 ATOM 5388 C CA . GLN C 3 151 ? 0.797 -55.206 5.718 1.00 142.71 ? 151 GLN L CA 1 ATOM 5389 C C . GLN C 3 151 ? 1.424 -53.938 5.157 1.00 140.89 ? 151 GLN L C 1 ATOM 5390 O O . GLN C 3 151 ? 0.923 -52.843 5.415 1.00 140.81 ? 151 GLN L O 1 ATOM 5391 C CB . GLN C 3 151 ? -0.722 -55.126 5.601 1.00 136.41 ? 151 GLN L CB 1 ATOM 5392 C CG . GLN C 3 151 ? -1.421 -56.378 6.081 1.00 137.59 ? 151 GLN L CG 1 ATOM 5393 C CD . GLN C 3 151 ? -0.983 -57.610 5.318 1.00 140.21 ? 151 GLN L CD 1 ATOM 5394 O OE1 . GLN C 3 151 ? -1.419 -57.838 4.189 1.00 142.54 ? 151 GLN L OE1 1 ATOM 5395 N NE2 . GLN C 3 151 ? -0.107 -58.404 5.924 1.00 140.41 ? 151 GLN L NE2 1 ATOM 5396 N N . SER C 3 152 ? 2.498 -54.078 4.384 1.00 139.81 ? 152 SER L N 1 ATOM 5397 C CA . SER C 3 152 ? 3.168 -52.914 3.807 1.00 139.24 ? 152 SER L CA 1 ATOM 5398 C C . SER C 3 152 ? 2.851 -52.816 2.290 1.00 158.67 ? 152 SER L C 1 ATOM 5399 O O . SER C 3 152 ? 3.310 -53.636 1.485 1.00 156.86 ? 152 SER L O 1 ATOM 5400 C CB . SER C 3 152 ? 4.680 -52.961 4.077 1.00 144.20 ? 152 SER L CB 1 ATOM 5401 O OG . SER C 3 152 ? 5.315 -51.743 3.712 1.00 144.80 ? 152 SER L OG 1 ATOM 5402 N N . GLY C 3 153 ? 2.037 -51.835 1.912 1.00 157.24 ? 153 GLY L N 1 ATOM 5403 C CA . GLY C 3 153 ? 1.723 -51.585 0.513 1.00 154.44 ? 153 GLY L CA 1 ATOM 5404 C C . GLY C 3 153 ? 0.510 -52.289 -0.082 1.00 147.74 ? 153 GLY L C 1 ATOM 5405 O O . GLY C 3 153 ? 0.378 -52.404 -1.300 1.00 148.76 ? 153 GLY L O 1 ATOM 5406 N N . ASN C 3 154 ? -0.370 -52.775 0.782 1.00 141.37 ? 154 ASN L N 1 ATOM 5407 C CA . ASN C 3 154 ? -1.577 -53.476 0.362 1.00 141.65 ? 154 ASN L CA 1 ATOM 5408 C C . ASN C 3 154 ? -2.794 -52.613 0.618 1.00 138.27 ? 154 ASN L C 1 ATOM 5409 O O . ASN C 3 154 ? -3.928 -53.079 0.514 1.00 143.08 ? 154 ASN L O 1 ATOM 5410 C CB . ASN C 3 154 ? -1.726 -54.809 1.072 1.00 151.12 ? 154 ASN L CB 1 ATOM 5411 C CG . ASN C 3 154 ? -0.663 -55.790 0.675 1.00 166.24 ? 154 ASN L CG 1 ATOM 5412 O OD1 . ASN C 3 154 ? 0.424 -55.402 0.239 1.00 175.29 ? 154 ASN L OD1 1 ATOM 5413 N ND2 . ASN C 3 154 ? -0.964 -57.076 0.822 1.00 170.01 ? 154 ASN L ND2 1 ATOM 5414 N N . SER C 3 155 ? -2.554 -51.349 0.950 1.00 130.99 ? 155 SER L N 1 ATOM 5415 C CA . SER C 3 155 ? -3.640 -50.456 1.307 1.00 122.78 ? 155 SER L CA 1 ATOM 5416 C C . SER C 3 155 ? -3.541 -49.054 0.738 1.00 120.78 ? 155 SER L C 1 ATOM 5417 O O . SER C 3 155 ? -2.494 -48.616 0.264 1.00 122.92 ? 155 SER L O 1 ATOM 5418 C CB . SER C 3 155 ? -3.673 -50.302 2.817 1.00 118.65 ? 155 SER L CB 1 ATOM 5419 O OG . SER C 3 155 ? -2.419 -49.774 3.231 1.00 116.43 ? 155 SER L OG 1 ATOM 5420 N N . GLN C 3 156 ? -4.659 -48.346 0.823 1.00 118.38 ? 156 GLN L N 1 ATOM 5421 C CA . GLN C 3 156 ? -4.730 -46.962 0.383 1.00 117.64 ? 156 GLN L CA 1 ATOM 5422 C C . GLN C 3 156 ? -5.336 -46.021 1.425 1.00 115.58 ? 156 GLN L C 1 ATOM 5423 O O . GLN C 3 156 ? -6.344 -46.334 2.050 1.00 109.85 ? 156 GLN L O 1 ATOM 5424 C CB . GLN C 3 156 ? -5.474 -46.924 -0.943 1.00 127.20 ? 156 GLN L CB 1 ATOM 5425 C CG . GLN C 3 156 ? -4.588 -47.497 -2.063 1.00 135.90 ? 156 GLN L CG 1 ATOM 5426 C CD . GLN C 3 156 ? -5.343 -47.860 -3.333 1.00 138.82 ? 156 GLN L CD 1 ATOM 5427 O OE1 . GLN C 3 156 ? -5.187 -47.205 -4.362 1.00 139.18 ? 156 GLN L OE1 1 ATOM 5428 N NE2 . GLN C 3 156 ? -6.133 -48.937 -3.277 1.00 139.59 ? 156 GLN L NE2 1 ATOM 5429 N N . GLU C 3 157 ? -4.752 -44.836 1.552 1.00 126.72 ? 157 GLU L N 1 ATOM 5430 C CA . GLU C 3 157 ? -5.222 -43.842 2.508 1.00 132.48 ? 157 GLU L CA 1 ATOM 5431 C C . GLU C 3 157 ? -5.904 -42.656 1.863 1.00 126.88 ? 157 GLU L C 1 ATOM 5432 O O . GLU C 3 157 ? -5.641 -42.312 0.714 1.00 137.12 ? 157 GLU L O 1 ATOM 5433 C CB . GLU C 3 157 ? -4.052 -43.336 3.335 1.00 149.79 ? 157 GLU L CB 1 ATOM 5434 C CG . GLU C 3 157 ? -3.475 -44.354 4.272 1.00 164.29 ? 157 GLU L CG 1 ATOM 5435 C CD . GLU C 3 157 ? -2.296 -43.800 5.033 1.00 181.40 ? 157 GLU L CD 1 ATOM 5436 O OE1 . GLU C 3 157 ? -1.729 -42.780 4.579 1.00 190.76 ? 157 GLU L OE1 1 ATOM 5437 O OE2 . GLU C 3 157 ? -1.956 -44.362 6.096 1.00 185.39 ? 157 GLU L OE2 1 ATOM 5438 N N . SER C 3 158 ? -6.768 -42.013 2.634 1.00 116.63 ? 158 SER L N 1 ATOM 5439 C CA . SER C 3 158 ? -7.421 -40.789 2.191 1.00 115.18 ? 158 SER L CA 1 ATOM 5440 C C . SER C 3 158 ? -7.722 -39.904 3.399 1.00 115.96 ? 158 SER L C 1 ATOM 5441 O O . SER C 3 158 ? -8.251 -40.382 4.405 1.00 118.98 ? 158 SER L O 1 ATOM 5442 C CB . SER C 3 158 ? -8.687 -41.088 1.404 1.00 113.54 ? 158 SER L CB 1 ATOM 5443 O OG . SER C 3 158 ? -9.350 -39.878 1.114 1.00 125.25 ? 158 SER L OG 1 ATOM 5444 N N . VAL C 3 159 ? -7.400 -38.618 3.302 1.00 105.30 ? 159 VAL L N 1 ATOM 5445 C CA . VAL C 3 159 ? -7.620 -37.727 4.425 1.00 100.53 ? 159 VAL L CA 1 ATOM 5446 C C . VAL C 3 159 ? -8.526 -36.585 4.059 1.00 114.86 ? 159 VAL L C 1 ATOM 5447 O O . VAL C 3 159 ? -8.392 -36.001 2.986 1.00 135.55 ? 159 VAL L O 1 ATOM 5448 C CB . VAL C 3 159 ? -6.310 -37.135 4.910 1.00 103.48 ? 159 VAL L CB 1 ATOM 5449 C CG1 . VAL C 3 159 ? -6.536 -36.350 6.184 1.00 106.93 ? 159 VAL L CG1 1 ATOM 5450 C CG2 . VAL C 3 159 ? -5.299 -38.230 5.139 1.00 105.70 ? 159 VAL L CG2 1 ATOM 5451 N N . THR C 3 160 ? -9.440 -36.252 4.965 1.00 113.39 ? 160 THR L N 1 ATOM 5452 C CA . THR C 3 160 ? -10.320 -35.104 4.767 1.00 124.59 ? 160 THR L CA 1 ATOM 5453 C C . THR C 3 160 ? -9.513 -33.818 4.889 1.00 129.97 ? 160 THR L C 1 ATOM 5454 O O . THR C 3 160 ? -8.411 -33.831 5.439 1.00 122.41 ? 160 THR L O 1 ATOM 5455 C CB . THR C 3 160 ? -11.453 -35.079 5.810 1.00 124.06 ? 160 THR L CB 1 ATOM 5456 O OG1 . THR C 3 160 ? -10.891 -35.053 7.129 1.00 125.82 ? 160 THR L OG1 1 ATOM 5457 C CG2 . THR C 3 160 ? -12.347 -36.296 5.663 1.00 118.43 ? 160 THR L CG2 1 ATOM 5458 N N . GLU C 3 161 ? -10.015 -32.703 4.376 1.00 141.86 ? 161 GLU L N 1 ATOM 5459 C CA . GLU C 3 161 ? -9.317 -31.482 4.722 1.00 156.79 ? 161 GLU L CA 1 ATOM 5460 C C . GLU C 3 161 ? -9.658 -31.193 6.152 1.00 160.80 ? 161 GLU L C 1 ATOM 5461 O O . GLU C 3 161 ? -10.652 -31.715 6.659 1.00 159.44 ? 161 GLU L O 1 ATOM 5462 C CB . GLU C 3 161 ? -9.692 -30.333 3.799 1.00 171.80 ? 161 GLU L CB 1 ATOM 5463 C CG . GLU C 3 161 ? -9.234 -30.610 2.401 1.00 181.63 ? 161 GLU L CG 1 ATOM 5464 C CD . GLU C 3 161 ? -7.721 -30.709 2.354 1.00 189.13 ? 161 GLU L CD 1 ATOM 5465 O OE1 . GLU C 3 161 ? -7.054 -29.655 2.406 1.00 193.15 ? 161 GLU L OE1 1 ATOM 5466 O OE2 . GLU C 3 161 ? -7.199 -31.851 2.331 1.00 191.41 ? 161 GLU L OE2 1 ATOM 5467 N N . GLN C 3 162 ? -8.845 -30.365 6.802 1.00 166.94 ? 162 GLN L N 1 ATOM 5468 C CA . GLN C 3 162 ? -9.081 -30.075 8.206 1.00 168.77 ? 162 GLN L CA 1 ATOM 5469 C C . GLN C 3 162 ? -10.483 -29.567 8.362 1.00 175.68 ? 162 GLN L C 1 ATOM 5470 O O . GLN C 3 162 ? -10.883 -28.681 7.608 1.00 183.45 ? 162 GLN L O 1 ATOM 5471 C CB . GLN C 3 162 ? -8.089 -29.022 8.723 1.00 167.01 ? 162 GLN L CB 1 ATOM 5472 C CG . GLN C 3 162 ? -8.224 -28.682 10.208 1.00 158.13 ? 162 GLN L CG 1 ATOM 5473 C CD . GLN C 3 162 ? -7.184 -27.681 10.682 1.00 155.71 ? 162 GLN L CD 1 ATOM 5474 O OE1 . GLN C 3 162 ? -6.802 -26.769 9.947 1.00 164.64 ? 162 GLN L OE1 1 ATOM 5475 N NE2 . GLN C 3 162 ? -6.694 -27.871 11.902 1.00 150.19 ? 162 GLN L NE2 1 ATOM 5476 N N . ASP C 3 163 ? -11.269 -30.175 9.245 1.00 175.81 ? 163 ASP L N 1 ATOM 5477 C CA . ASP C 3 163 ? -12.629 -29.701 9.371 1.00 187.20 ? 163 ASP L CA 1 ATOM 5478 C C . ASP C 3 163 ? -12.440 -28.265 9.846 1.00 209.98 ? 163 ASP L C 1 ATOM 5479 O O . ASP C 3 163 ? -11.628 -28.022 10.721 1.00 215.77 ? 163 ASP L O 1 ATOM 5480 C CB . ASP C 3 163 ? -13.464 -30.536 10.343 1.00 176.99 ? 163 ASP L CB 1 ATOM 5481 C CG . ASP C 3 163 ? -14.931 -30.128 10.354 1.00 176.65 ? 163 ASP L CG 1 ATOM 5482 O OD1 . ASP C 3 163 ? -15.365 -29.404 9.431 1.00 180.98 ? 163 ASP L OD1 1 ATOM 5483 O OD2 . ASP C 3 163 ? -15.654 -30.539 11.283 1.00 173.16 ? 163 ASP L OD2 1 ATOM 5484 N N . SER C 3 164 ? -13.132 -27.312 9.254 1.00 222.20 ? 164 SER L N 1 ATOM 5485 C CA . SER C 3 164 ? -12.955 -25.899 9.595 1.00 233.43 ? 164 SER L CA 1 ATOM 5486 C C . SER C 3 164 ? -13.501 -25.573 11.021 1.00 232.75 ? 164 SER L C 1 ATOM 5487 O O . SER C 3 164 ? -13.034 -24.633 11.670 1.00 240.02 ? 164 SER L O 1 ATOM 5488 C CB . SER C 3 164 ? -13.490 -24.989 8.475 1.00 240.63 ? 164 SER L CB 1 ATOM 5489 O OG . SER C 3 164 ? -14.853 -25.180 8.191 1.00 243.18 ? 164 SER L OG 1 ATOM 5490 N N . LYS C 3 165 ? -14.486 -26.358 11.481 1.00 221.26 ? 165 LYS L N 1 ATOM 5491 C CA . LYS C 3 165 ? -15.220 -26.170 12.756 1.00 218.10 ? 165 LYS L CA 1 ATOM 5492 C C . LYS C 3 165 ? -14.538 -26.707 14.008 1.00 203.40 ? 165 LYS L C 1 ATOM 5493 O O . LYS C 3 165 ? -14.407 -25.964 14.985 1.00 213.70 ? 165 LYS L O 1 ATOM 5494 C CB . LYS C 3 165 ? -16.645 -26.766 12.637 1.00 219.40 ? 165 LYS L CB 1 ATOM 5495 C CG . LYS C 3 165 ? -16.862 -28.223 13.019 1.00 211.44 ? 165 LYS L CG 1 ATOM 5496 C CD . LYS C 3 165 ? -18.306 -28.624 12.795 1.00 214.13 ? 165 LYS L CD 1 ATOM 5497 C CE . LYS C 3 165 ? -18.638 -28.582 11.308 1.00 215.01 ? 165 LYS L CE 1 ATOM 5498 N NZ . LYS C 3 165 ? -20.045 -28.972 11.024 1.00 218.74 ? 165 LYS L NZ 1 ATOM 5499 N N . ASP C 3 166 ? -14.127 -27.965 14.029 1.00 178.21 ? 166 ASP L N 1 ATOM 5500 C CA . ASP C 3 166 ? -13.553 -28.477 15.250 1.00 171.06 ? 166 ASP L CA 1 ATOM 5501 C C . ASP C 3 166 ? -12.069 -28.659 14.981 1.00 159.27 ? 166 ASP L C 1 ATOM 5502 O O . ASP C 3 166 ? -11.316 -29.122 15.839 1.00 159.37 ? 166 ASP L O 1 ATOM 5503 C CB . ASP C 3 166 ? -14.256 -29.767 15.719 1.00 172.06 ? 166 ASP L CB 1 ATOM 5504 C CG . ASP C 3 166 ? -14.155 -30.932 14.719 1.00 171.57 ? 166 ASP L CG 1 ATOM 5505 O OD1 . ASP C 3 166 ? -13.210 -31.000 13.902 1.00 172.99 ? 166 ASP L OD1 1 ATOM 5506 O OD2 . ASP C 3 166 ? -15.037 -31.822 14.774 1.00 167.78 ? 166 ASP L OD2 1 ATOM 5507 N N . SER C 3 167 ? -11.682 -28.330 13.749 1.00 149.69 ? 167 SER L N 1 ATOM 5508 C CA . SER C 3 167 ? -10.285 -28.335 13.312 1.00 148.96 ? 167 SER L CA 1 ATOM 5509 C C . SER C 3 167 ? -9.676 -29.709 13.293 1.00 134.97 ? 167 SER L C 1 ATOM 5510 O O . SER C 3 167 ? -8.454 -29.838 13.231 1.00 127.30 ? 167 SER L O 1 ATOM 5511 C CB . SER C 3 167 ? -9.437 -27.375 14.150 1.00 165.29 ? 167 SER L CB 1 ATOM 5512 O OG . SER C 3 167 ? -10.051 -26.095 14.239 1.00 181.03 ? 167 SER L OG 1 ATOM 5513 N N . THR C 3 168 ? -10.517 -30.733 13.267 1.00 134.74 ? 168 THR L N 1 ATOM 5514 C CA . THR C 3 168 ? -9.989 -32.078 13.220 1.00 137.44 ? 168 THR L CA 1 ATOM 5515 C C . THR C 3 168 ? -9.887 -32.628 11.820 1.00 138.50 ? 168 THR L C 1 ATOM 5516 O O . THR C 3 168 ? -10.335 -32.038 10.832 1.00 149.98 ? 168 THR L O 1 ATOM 5517 C CB . THR C 3 168 ? -10.841 -33.054 14.051 1.00 136.33 ? 168 THR L CB 1 ATOM 5518 O OG1 . THR C 3 168 ? -12.160 -33.132 13.500 1.00 135.41 ? 168 THR L OG1 1 ATOM 5519 C CG2 . THR C 3 168 ? -10.923 -32.600 15.497 1.00 141.81 ? 168 THR L CG2 1 ATOM 5520 N N . TYR C 3 169 ? -9.284 -33.797 11.764 1.00 126.62 ? 169 TYR L N 1 ATOM 5521 C CA . TYR C 3 169 ? -9.129 -34.522 10.536 1.00 122.60 ? 169 TYR L CA 1 ATOM 5522 C C . TYR C 3 169 ? -9.824 -35.838 10.726 1.00 120.90 ? 169 TYR L C 1 ATOM 5523 O O . TYR C 3 169 ? -10.064 -36.269 11.851 1.00 126.53 ? 169 TYR L O 1 ATOM 5524 C CB . TYR C 3 169 ? -7.648 -34.704 10.201 1.00 119.48 ? 169 TYR L CB 1 ATOM 5525 C CG . TYR C 3 169 ? -6.933 -33.405 9.927 1.00 117.30 ? 169 TYR L CG 1 ATOM 5526 C CD1 . TYR C 3 169 ? -6.393 -32.666 10.961 1.00 120.05 ? 169 TYR L CD1 1 ATOM 5527 C CD2 . TYR C 3 169 ? -6.811 -32.917 8.652 1.00 118.38 ? 169 TYR L CD2 1 ATOM 5528 C CE1 . TYR C 3 169 ? -5.747 -31.476 10.735 1.00 127.91 ? 169 TYR L CE1 1 ATOM 5529 C CE2 . TYR C 3 169 ? -6.158 -31.736 8.413 1.00 126.77 ? 169 TYR L CE2 1 ATOM 5530 C CZ . TYR C 3 169 ? -5.630 -31.012 9.455 1.00 130.84 ? 169 TYR L CZ 1 ATOM 5531 O OH . TYR C 3 169 ? -4.982 -29.817 9.199 1.00 135.51 ? 169 TYR L OH 1 ATOM 5532 N N . SER C 3 170 ? -10.196 -36.454 9.622 1.00 116.61 ? 170 SER L N 1 ATOM 5533 C CA . SER C 3 170 ? -10.753 -37.782 9.671 1.00 108.69 ? 170 SER L CA 1 ATOM 5534 C C . SER C 3 170 ? -10.034 -38.494 8.559 1.00 102.48 ? 170 SER L C 1 ATOM 5535 O O . SER C 3 170 ? -9.697 -37.886 7.547 1.00 111.02 ? 170 SER L O 1 ATOM 5536 C CB . SER C 3 170 ? -12.270 -37.759 9.477 1.00 109.00 ? 170 SER L CB 1 ATOM 5537 O OG . SER C 3 170 ? -12.914 -37.144 10.576 1.00 117.60 ? 170 SER L OG 1 ATOM 5538 N N . LEU C 3 171 ? -9.717 -39.759 8.780 1.00 96.99 ? 171 LEU L N 1 ATOM 5539 C CA . LEU C 3 171 ? -8.912 -40.535 7.842 1.00 100.15 ? 171 LEU L CA 1 ATOM 5540 C C . LEU C 3 171 ? -9.504 -41.918 7.483 1.00 102.91 ? 171 LEU L C 1 ATOM 5541 O O . LEU C 3 171 ? -10.189 -42.550 8.316 1.00 103.41 ? 171 LEU L O 1 ATOM 5542 C CB . LEU C 3 171 ? -7.489 -40.700 8.402 1.00 99.34 ? 171 LEU L CB 1 ATOM 5543 C CG . LEU C 3 171 ? -6.460 -41.525 7.617 1.00 93.89 ? 171 LEU L CG 1 ATOM 5544 C CD1 . LEU C 3 171 ? -5.051 -41.019 7.895 1.00 97.14 ? 171 LEU L CD1 1 ATOM 5545 C CD2 . LEU C 3 171 ? -6.542 -43.022 7.909 1.00 81.96 ? 171 LEU L CD2 1 ATOM 5546 N N . SER C 3 172 ? -9.343 -42.339 6.227 1.00 102.24 ? 172 SER L N 1 ATOM 5547 C CA . SER C 3 172 ? -9.831 -43.652 5.840 1.00 102.87 ? 172 SER L CA 1 ATOM 5548 C C . SER C 3 172 ? -8.734 -44.473 5.197 1.00 101.62 ? 172 SER L C 1 ATOM 5549 O O . SER C 3 172 ? -8.088 -44.043 4.247 1.00 104.42 ? 172 SER L O 1 ATOM 5550 C CB . SER C 3 172 ? -10.987 -43.515 4.850 1.00 114.87 ? 172 SER L CB 1 ATOM 5551 O OG . SER C 3 172 ? -11.590 -44.764 4.600 1.00 120.45 ? 172 SER L OG 1 ATOM 5552 N N . SER C 3 173 ? -8.547 -45.680 5.701 1.00 101.29 ? 173 SER L N 1 ATOM 5553 C CA . SER C 3 173 ? -7.524 -46.576 5.178 1.00 101.44 ? 173 SER L CA 1 ATOM 5554 C C . SER C 3 173 ? -8.178 -47.864 4.707 1.00 103.05 ? 173 SER L C 1 ATOM 5555 O O . SER C 3 173 ? -8.979 -48.448 5.428 1.00 104.50 ? 173 SER L O 1 ATOM 5556 C CB . SER C 3 173 ? -6.432 -46.876 6.194 1.00 105.17 ? 173 SER L CB 1 ATOM 5557 O OG . SER C 3 173 ? -5.399 -47.604 5.559 1.00 106.74 ? 173 SER L OG 1 ATOM 5558 N N . THR C 3 174 ? -7.897 -48.283 3.486 1.00 103.74 ? 174 THR L N 1 ATOM 5559 C CA . THR C 3 174 ? -8.559 -49.460 2.963 1.00 98.81 ? 174 THR L CA 1 ATOM 5560 C C . THR C 3 174 ? -7.564 -50.531 2.566 1.00 97.67 ? 174 THR L C 1 ATOM 5561 O O . THR C 3 174 ? -6.690 -50.286 1.740 1.00 97.27 ? 174 THR L O 1 ATOM 5562 C CB . THR C 3 174 ? -9.436 -49.149 1.816 1.00 105.33 ? 174 THR L CB 1 ATOM 5563 O OG1 . THR C 3 174 ? -10.373 -48.143 2.225 1.00 118.43 ? 174 THR L OG1 1 ATOM 5564 C CG2 . THR C 3 174 ? -10.136 -50.444 1.384 1.00 94.50 ? 174 THR L CG2 1 ATOM 5565 N N . LEU C 3 175 ? -7.655 -51.692 3.205 1.00 106.03 ? 175 LEU L N 1 ATOM 5566 C CA . LEU C 3 175 ? -6.809 -52.823 2.841 1.00 109.37 ? 175 LEU L CA 1 ATOM 5567 C C . LEU C 3 175 ? -7.583 -53.814 1.980 1.00 109.73 ? 175 LEU L C 1 ATOM 5568 O O . LEU C 3 175 ? -8.616 -54.330 2.383 1.00 103.74 ? 175 LEU L O 1 ATOM 5569 C CB . LEU C 3 175 ? -6.280 -53.515 4.088 1.00 109.20 ? 175 LEU L CB 1 ATOM 5570 C CG . LEU C 3 175 ? -5.467 -54.777 3.848 1.00 111.63 ? 175 LEU L CG 1 ATOM 5571 C CD1 . LEU C 3 175 ? -4.001 -54.438 3.780 1.00 117.86 ? 175 LEU L CD1 1 ATOM 5572 C CD2 . LEU C 3 175 ? -5.731 -55.746 4.977 1.00 108.15 ? 175 LEU L CD2 1 ATOM 5573 N N . THR C 3 176 ? -7.093 -54.027 0.763 1.00 118.12 ? 176 THR L N 1 ATOM 5574 C CA . THR C 3 176 ? -7.755 -54.884 -0.215 1.00 127.85 ? 176 THR L CA 1 ATOM 5575 C C . THR C 3 176 ? -7.015 -56.187 -0.525 1.00 132.56 ? 176 THR L C 1 ATOM 5576 O O . THR C 3 176 ? -5.789 -56.191 -0.655 1.00 137.01 ? 176 THR L O 1 ATOM 5577 C CB . THR C 3 176 ? -7.971 -54.126 -1.534 1.00 134.09 ? 176 THR L CB 1 ATOM 5578 O OG1 . THR C 3 176 ? -8.756 -52.958 -1.280 1.00 132.32 ? 176 THR L OG1 1 ATOM 5579 C CG2 . THR C 3 176 ? -8.694 -54.995 -2.548 1.00 138.02 ? 176 THR L CG2 1 ATOM 5580 N N . LEU C 3 177 ? -7.767 -57.283 -0.664 1.00 127.94 ? 177 LEU L N 1 ATOM 5581 C CA . LEU C 3 177 ? -7.178 -58.587 -0.933 1.00 126.79 ? 177 LEU L CA 1 ATOM 5582 C C . LEU C 3 177 ? -8.114 -59.398 -1.793 1.00 120.44 ? 177 LEU L C 1 ATOM 5583 O O . LEU C 3 177 ? -9.321 -59.146 -1.826 1.00 113.84 ? 177 LEU L O 1 ATOM 5584 C CB . LEU C 3 177 ? -6.945 -59.375 0.352 1.00 134.12 ? 177 LEU L CB 1 ATOM 5585 C CG . LEU C 3 177 ? -6.008 -58.912 1.457 1.00 136.65 ? 177 LEU L CG 1 ATOM 5586 C CD1 . LEU C 3 177 ? -6.034 -59.920 2.613 1.00 129.69 ? 177 LEU L CD1 1 ATOM 5587 C CD2 . LEU C 3 177 ? -4.595 -58.723 0.903 1.00 144.69 ? 177 LEU L CD2 1 ATOM 5588 N N . SER C 3 178 ? -7.541 -60.372 -2.496 1.00 123.23 ? 178 SER L N 1 ATOM 5589 C CA . SER C 3 178 ? -8.321 -61.350 -3.234 1.00 122.02 ? 178 SER L CA 1 ATOM 5590 C C . SER C 3 178 ? -9.132 -62.134 -2.237 1.00 124.93 ? 178 SER L C 1 ATOM 5591 O O . SER C 3 178 ? -8.674 -62.337 -1.116 1.00 131.13 ? 178 SER L O 1 ATOM 5592 C CB . SER C 3 178 ? -7.426 -62.264 -4.066 1.00 122.55 ? 178 SER L CB 1 ATOM 5593 O OG . SER C 3 178 ? -6.537 -62.988 -3.247 1.00 125.07 ? 178 SER L OG 1 ATOM 5594 N N . LYS C 3 179 ? -10.336 -62.545 -2.617 1.00 122.26 ? 179 LYS L N 1 ATOM 5595 C CA . LYS C 3 179 ? -11.159 -63.371 -1.734 1.00 121.02 ? 179 LYS L CA 1 ATOM 5596 C C . LYS C 3 179 ? -10.390 -64.616 -1.280 1.00 125.20 ? 179 LYS L C 1 ATOM 5597 O O . LYS C 3 179 ? -10.494 -65.042 -0.126 1.00 116.65 ? 179 LYS L O 1 ATOM 5598 C CB . LYS C 3 179 ? -12.464 -63.777 -2.402 1.00 120.88 ? 179 LYS L CB 1 ATOM 5599 C CG . LYS C 3 179 ? -13.323 -64.646 -1.509 1.00 118.56 ? 179 LYS L CG 1 ATOM 5600 C CD . LYS C 3 179 ? -14.528 -65.188 -2.243 1.00 126.29 ? 179 LYS L CD 1 ATOM 5601 C CE . LYS C 3 179 ? -15.348 -66.081 -1.328 1.00 134.81 ? 179 LYS L CE 1 ATOM 5602 N NZ . LYS C 3 179 ? -16.587 -66.601 -1.973 1.00 141.09 ? 179 LYS L NZ 1 ATOM 5603 N N . ALA C 3 180 ? -9.609 -65.187 -2.196 1.00 136.87 ? 180 ALA L N 1 ATOM 5604 C CA . ALA C 3 180 ? -8.819 -66.367 -1.871 1.00 147.80 ? 180 ALA L CA 1 ATOM 5605 C C . ALA C 3 180 ? -7.766 -66.055 -0.801 1.00 151.82 ? 180 ALA L C 1 ATOM 5606 O O . ALA C 3 180 ? -7.590 -66.830 0.133 1.00 158.37 ? 180 ALA L O 1 ATOM 5607 C CB . ALA C 3 180 ? -8.149 -66.915 -3.129 1.00 150.48 ? 180 ALA L CB 1 ATOM 5608 N N . ASP C 3 181 ? -7.078 -64.924 -0.925 1.00 149.44 ? 181 ASP L N 1 ATOM 5609 C CA . ASP C 3 181 ? -6.101 -64.525 0.088 1.00 151.54 ? 181 ASP L CA 1 ATOM 5610 C C . ASP C 3 181 ? -6.833 -64.221 1.390 1.00 143.74 ? 181 ASP L C 1 ATOM 5611 O O . ASP C 3 181 ? -6.376 -64.571 2.475 1.00 142.62 ? 181 ASP L O 1 ATOM 5612 C CB . ASP C 3 181 ? -5.245 -63.328 -0.347 1.00 155.82 ? 181 ASP L CB 1 ATOM 5613 C CG . ASP C 3 181 ? -4.295 -63.668 -1.487 1.00 165.10 ? 181 ASP L CG 1 ATOM 5614 O OD1 . ASP C 3 181 ? -3.917 -64.852 -1.615 1.00 166.24 ? 181 ASP L OD1 1 ATOM 5615 O OD2 . ASP C 3 181 ? -3.931 -62.747 -2.255 1.00 170.06 ? 181 ASP L OD2 1 ATOM 5616 N N . TYR C 3 182 ? -7.970 -63.543 1.267 1.00 139.16 ? 182 TYR L N 1 ATOM 5617 C CA . TYR C 3 182 ? -8.781 -63.149 2.414 1.00 138.59 ? 182 TYR L CA 1 ATOM 5618 C C . TYR C 3 182 ? -9.280 -64.317 3.281 1.00 143.93 ? 182 TYR L C 1 ATOM 5619 O O . TYR C 3 182 ? -9.362 -64.187 4.506 1.00 145.14 ? 182 TYR L O 1 ATOM 5620 C CB . TYR C 3 182 ? -9.992 -62.335 1.945 1.00 132.94 ? 182 TYR L CB 1 ATOM 5621 C CG . TYR C 3 182 ? -10.944 -61.965 3.060 1.00 131.19 ? 182 TYR L CG 1 ATOM 5622 C CD1 . TYR C 3 182 ? -10.581 -61.038 4.032 1.00 130.02 ? 182 TYR L CD1 1 ATOM 5623 C CD2 . TYR C 3 182 ? -12.178 -62.579 3.181 1.00 131.48 ? 182 TYR L CD2 1 ATOM 5624 C CE1 . TYR C 3 182 ? -11.439 -60.699 5.073 1.00 124.90 ? 182 TYR L CE1 1 ATOM 5625 C CE2 . TYR C 3 182 ? -13.039 -62.254 4.221 1.00 130.35 ? 182 TYR L CE2 1 ATOM 5626 C CZ . TYR C 3 182 ? -12.670 -61.313 5.162 1.00 125.70 ? 182 TYR L CZ 1 ATOM 5627 O OH . TYR C 3 182 ? -13.531 -60.988 6.194 1.00 122.89 ? 182 TYR L OH 1 ATOM 5628 N N . GLU C 3 183 ? -9.610 -65.451 2.654 1.00 149.81 ? 183 GLU L N 1 ATOM 5629 C CA . GLU C 3 183 ? -10.145 -66.603 3.391 1.00 156.37 ? 183 GLU L CA 1 ATOM 5630 C C . GLU C 3 183 ? -9.060 -67.521 3.974 1.00 156.04 ? 183 GLU L C 1 ATOM 5631 O O . GLU C 3 183 ? -9.343 -68.521 4.642 1.00 157.84 ? 183 GLU L O 1 ATOM 5632 C CB . GLU C 3 183 ? -11.075 -67.419 2.486 1.00 169.38 ? 183 GLU L CB 1 ATOM 5633 C CG . GLU C 3 183 ? -12.406 -66.708 2.199 1.00 174.85 ? 183 GLU L CG 1 ATOM 5634 C CD . GLU C 3 183 ? -13.419 -67.562 1.459 1.00 185.22 ? 183 GLU L CD 1 ATOM 5635 O OE1 . GLU C 3 183 ? -13.005 -68.364 0.580 1.00 190.72 ? 183 GLU L OE1 1 ATOM 5636 O OE2 . GLU C 3 183 ? -14.612 -67.486 1.835 1.00 186.30 ? 183 GLU L OE2 1 ATOM 5637 N N . LYS C 3 184 ? -7.820 -67.124 3.748 1.00 153.82 ? 184 LYS L N 1 ATOM 5638 C CA . LYS C 3 184 ? -6.631 -67.774 4.273 1.00 151.24 ? 184 LYS L CA 1 ATOM 5639 C C . LYS C 3 184 ? -6.286 -67.426 5.717 1.00 144.88 ? 184 LYS L C 1 ATOM 5640 O O . LYS C 3 184 ? -5.699 -68.240 6.412 1.00 151.11 ? 184 LYS L O 1 ATOM 5641 C CB . LYS C 3 184 ? -5.420 -67.455 3.389 0.00 153.51 ? 184 LYS L CB 1 ATOM 5642 C CG . LYS C 3 184 ? -4.792 -68.672 2.712 0.00 161.34 ? 184 LYS L CG 1 ATOM 5643 C CD . LYS C 3 184 ? -5.697 -69.251 1.636 0.00 162.12 ? 184 LYS L CD 1 ATOM 5644 C CE . LYS C 3 184 ? -4.911 -70.185 0.734 0.00 169.27 ? 184 LYS L CE 1 ATOM 5645 N NZ . LYS C 3 184 ? -3.817 -69.486 -0.004 0.00 169.44 ? 184 LYS L NZ 1 ATOM 5646 N N . HIS C 3 185 ? -6.635 -66.222 6.161 1.00 136.70 ? 185 HIS L N 1 ATOM 5647 C CA . HIS C 3 185 ? -6.204 -65.710 7.465 1.00 136.41 ? 185 HIS L CA 1 ATOM 5648 C C . HIS C 3 185 ? -7.286 -65.253 8.452 1.00 133.24 ? 185 HIS L C 1 ATOM 5649 O O . HIS C 3 185 ? -8.359 -64.858 8.038 1.00 139.31 ? 185 HIS L O 1 ATOM 5650 C CB . HIS C 3 185 ? -5.419 -64.433 7.205 1.00 133.86 ? 185 HIS L CB 1 ATOM 5651 C CG . HIS C 3 185 ? -4.241 -64.638 6.302 1.00 134.96 ? 185 HIS L CG 1 ATOM 5652 N ND1 . HIS C 3 185 ? -3.013 -65.076 6.752 1.00 138.09 ? 185 HIS L ND1 1 ATOM 5653 C CD2 . HIS C 3 185 ? -4.123 -64.502 4.959 1.00 132.78 ? 185 HIS L CD2 1 ATOM 5654 C CE1 . HIS C 3 185 ? -2.183 -65.174 5.729 1.00 139.99 ? 185 HIS L CE1 1 ATOM 5655 N NE2 . HIS C 3 185 ? -2.832 -64.834 4.629 1.00 135.45 ? 185 HIS L NE2 1 ATOM 5656 N N . LYS C 3 186 ? -7.040 -65.327 9.755 1.00 122.81 ? 186 LYS L N 1 ATOM 5657 C CA . LYS C 3 186 ? -8.134 -65.098 10.699 1.00 120.21 ? 186 LYS L CA 1 ATOM 5658 C C . LYS C 3 186 ? -8.246 -63.713 11.352 1.00 129.49 ? 186 LYS L C 1 ATOM 5659 O O . LYS C 3 186 ? -9.310 -63.097 11.283 1.00 129.64 ? 186 LYS L O 1 ATOM 5660 C CB . LYS C 3 186 ? -7.952 -66.194 11.763 0.00 125.42 ? 186 LYS L CB 1 ATOM 5661 C CG . LYS C 3 186 ? -6.611 -66.204 12.470 0.00 127.11 ? 186 LYS L CG 1 ATOM 5662 C CD . LYS C 3 186 ? -6.557 -67.229 13.592 0.00 131.20 ? 186 LYS L CD 1 ATOM 5663 C CE . LYS C 3 186 ? -5.632 -68.381 13.240 0.00 135.44 ? 186 LYS L CE 1 ATOM 5664 N NZ . LYS C 3 186 ? -4.218 -67.938 13.065 0.00 135.09 ? 186 LYS L NZ 1 ATOM 5665 N N . VAL C 3 187 ? -7.168 -63.193 11.928 1.00 134.96 ? 187 VAL L N 1 ATOM 5666 C CA . VAL C 3 187 ? -7.224 -61.931 12.671 1.00 131.77 ? 187 VAL L CA 1 ATOM 5667 C C . VAL C 3 187 ? -6.866 -60.702 11.812 1.00 130.93 ? 187 VAL L C 1 ATOM 5668 O O . VAL C 3 187 ? -5.719 -60.557 11.383 1.00 132.25 ? 187 VAL L O 1 ATOM 5669 C CB . VAL C 3 187 ? -6.287 -61.957 13.895 0.00 134.83 ? 187 VAL L CB 1 ATOM 5670 C CG1 . VAL C 3 187 ? -6.477 -60.704 14.735 0.00 131.95 ? 187 VAL L CG1 1 ATOM 5671 C CG2 . VAL C 3 187 ? -6.530 -63.207 14.727 0.00 140.01 ? 187 VAL L CG2 1 ATOM 5672 N N . TYR C 3 188 ? -7.855 -59.845 11.525 1.00 127.51 ? 188 TYR L N 1 ATOM 5673 C CA . TYR C 3 188 ? -7.610 -58.613 10.750 1.00 117.54 ? 188 TYR L CA 1 ATOM 5674 C C . TYR C 3 188 ? -7.646 -57.454 11.714 1.00 116.57 ? 188 TYR L C 1 ATOM 5675 O O . TYR C 3 188 ? -8.681 -57.102 12.278 1.00 118.93 ? 188 TYR L O 1 ATOM 5676 C CB . TYR C 3 188 ? -8.676 -58.412 9.672 1.00 112.51 ? 188 TYR L CB 1 ATOM 5677 C CG . TYR C 3 188 ? -8.628 -59.463 8.604 1.00 119.70 ? 188 TYR L CG 1 ATOM 5678 C CD1 . TYR C 3 188 ? -9.267 -60.675 8.795 1.00 126.16 ? 188 TYR L CD1 1 ATOM 5679 C CD2 . TYR C 3 188 ? -7.981 -59.243 7.396 1.00 118.27 ? 188 TYR L CD2 1 ATOM 5680 C CE1 . TYR C 3 188 ? -9.234 -61.655 7.845 1.00 128.46 ? 188 TYR L CE1 1 ATOM 5681 C CE2 . TYR C 3 188 ? -7.957 -60.221 6.424 1.00 121.37 ? 188 TYR L CE2 1 ATOM 5682 C CZ . TYR C 3 188 ? -8.585 -61.430 6.662 1.00 123.48 ? 188 TYR L CZ 1 ATOM 5683 O OH . TYR C 3 188 ? -8.578 -62.441 5.733 1.00 126.25 ? 188 TYR L OH 1 ATOM 5684 N N . ALA C 3 189 ? -6.475 -56.867 11.872 1.00 122.84 ? 189 ALA L N 1 ATOM 5685 C CA . ALA C 3 189 ? -6.203 -55.806 12.817 1.00 125.63 ? 189 ALA L CA 1 ATOM 5686 C C . ALA C 3 189 ? -5.771 -54.527 12.151 1.00 123.14 ? 189 ALA L C 1 ATOM 5687 O O . ALA C 3 189 ? -5.046 -54.523 11.159 1.00 122.59 ? 189 ALA L O 1 ATOM 5688 C CB . ALA C 3 189 ? -5.157 -56.252 13.829 1.00 128.62 ? 189 ALA L CB 1 ATOM 5689 N N . CYS C 3 190 ? -6.203 -53.445 12.764 1.00 120.45 ? 190 CYS L N 1 ATOM 5690 C CA . CYS C 3 190 ? -5.854 -52.111 12.386 1.00 115.52 ? 190 CYS L CA 1 ATOM 5691 C C . CYS C 3 190 ? -5.209 -51.368 13.559 1.00 112.41 ? 190 CYS L C 1 ATOM 5692 O O . CYS C 3 190 ? -5.858 -51.160 14.588 1.00 115.51 ? 190 CYS L O 1 ATOM 5693 C CB . CYS C 3 190 ? -7.125 -51.433 11.935 1.00 112.29 ? 190 CYS L CB 1 ATOM 5694 S SG . CYS C 3 190 ? -6.937 -49.745 11.585 1.00 135.92 ? 190 CYS L SG 1 ATOM 5695 N N . GLU C 3 191 ? -3.936 -50.992 13.417 1.00 106.85 ? 191 GLU L N 1 ATOM 5696 C CA . GLU C 3 191 ? -3.188 -50.336 14.499 1.00 107.25 ? 191 GLU L CA 1 ATOM 5697 C C . GLU C 3 191 ? -2.866 -48.851 14.244 1.00 108.67 ? 191 GLU L C 1 ATOM 5698 O O . GLU C 3 191 ? -2.054 -48.534 13.399 1.00 101.50 ? 191 GLU L O 1 ATOM 5699 C CB . GLU C 3 191 ? -1.900 -51.103 14.749 1.00 109.18 ? 191 GLU L CB 1 ATOM 5700 C CG . GLU C 3 191 ? -1.024 -50.515 15.820 1.00 122.64 ? 191 GLU L CG 1 ATOM 5701 C CD . GLU C 3 191 ? 0.363 -51.109 15.792 1.00 137.43 ? 191 GLU L CD 1 ATOM 5702 O OE1 . GLU C 3 191 ? 0.549 -52.085 15.032 1.00 141.45 ? 191 GLU L OE1 1 ATOM 5703 O OE2 . GLU C 3 191 ? 1.230 -50.676 16.592 1.00 144.01 ? 191 GLU L OE2 1 ATOM 5704 N N . VAL C 3 192 ? -3.336 -47.967 15.112 1.00 116.04 ? 192 VAL L N 1 ATOM 5705 C CA . VAL C 3 192 ? -3.213 -46.514 14.928 1.00 111.12 ? 192 VAL L CA 1 ATOM 5706 C C . VAL C 3 192 ? -2.247 -45.877 15.918 1.00 108.04 ? 192 VAL L C 1 ATOM 5707 O O . VAL C 3 192 ? -2.391 -46.070 17.137 1.00 113.77 ? 192 VAL L O 1 ATOM 5708 C CB . VAL C 3 192 ? -4.582 -45.826 15.106 1.00 107.41 ? 192 VAL L CB 1 ATOM 5709 C CG1 . VAL C 3 192 ? -4.434 -44.304 15.072 1.00 105.64 ? 192 VAL L CG1 1 ATOM 5710 C CG2 . VAL C 3 192 ? -5.584 -46.333 14.080 1.00 105.76 ? 192 VAL L CG2 1 ATOM 5711 N N . THR C 3 193 ? -1.279 -45.104 15.428 1.00 99.28 ? 193 THR L N 1 ATOM 5712 C CA . THR C 3 193 ? -0.415 -44.387 16.369 1.00 107.23 ? 193 THR L CA 1 ATOM 5713 C C . THR C 3 193 ? -0.648 -42.895 16.146 1.00 107.13 ? 193 THR L C 1 ATOM 5714 O O . THR C 3 193 ? -0.791 -42.462 15.012 1.00 106.26 ? 193 THR L O 1 ATOM 5715 C CB . THR C 3 193 ? 1.105 -44.669 16.167 1.00 119.95 ? 193 THR L CB 1 ATOM 5716 O OG1 . THR C 3 193 ? 1.560 -44.133 14.935 1.00 124.17 ? 193 THR L OG1 1 ATOM 5717 C CG2 . THR C 3 193 ? 1.454 -46.135 16.250 1.00 119.74 ? 193 THR L CG2 1 ATOM 5718 N N . HIS C 3 194 ? -0.727 -42.117 17.225 1.00 115.16 ? 194 HIS L N 1 ATOM 5719 C CA . HIS C 3 194 ? -0.997 -40.689 17.094 1.00 111.86 ? 194 HIS L CA 1 ATOM 5720 C C . HIS C 3 194 ? -0.546 -39.936 18.360 1.00 118.59 ? 194 HIS L C 1 ATOM 5721 O O . HIS C 3 194 ? -0.378 -40.532 19.435 1.00 127.17 ? 194 HIS L O 1 ATOM 5722 C CB . HIS C 3 194 ? -2.499 -40.515 16.836 1.00 104.24 ? 194 HIS L CB 1 ATOM 5723 C CG . HIS C 3 194 ? -2.941 -39.102 16.625 1.00 110.08 ? 194 HIS L CG 1 ATOM 5724 N ND1 . HIS C 3 194 ? -3.940 -38.518 17.370 1.00 110.69 ? 194 HIS L ND1 1 ATOM 5725 C CD2 . HIS C 3 194 ? -2.550 -38.169 15.720 1.00 113.34 ? 194 HIS L CD2 1 ATOM 5726 C CE1 . HIS C 3 194 ? -4.138 -37.282 16.942 1.00 116.23 ? 194 HIS L CE1 1 ATOM 5727 N NE2 . HIS C 3 194 ? -3.308 -37.045 15.941 1.00 113.44 ? 194 HIS L NE2 1 ATOM 5728 N N . GLN C 3 195 ? -0.434 -38.617 18.253 1.00 121.89 ? 195 GLN L N 1 ATOM 5729 C CA . GLN C 3 195 ? 0.054 -37.797 19.359 1.00 130.34 ? 195 GLN L CA 1 ATOM 5730 C C . GLN C 3 195 ? -0.828 -37.801 20.603 1.00 130.80 ? 195 GLN L C 1 ATOM 5731 O O . GLN C 3 195 ? -0.332 -37.673 21.723 1.00 132.73 ? 195 GLN L O 1 ATOM 5732 C CB . GLN C 3 195 ? 0.264 -36.369 18.859 1.00 135.41 ? 195 GLN L CB 1 ATOM 5733 C CG . GLN C 3 195 ? 0.744 -35.392 19.904 1.00 146.30 ? 195 GLN L CG 1 ATOM 5734 C CD . GLN C 3 195 ? 0.950 -34.007 19.331 1.00 158.85 ? 195 GLN L CD 1 ATOM 5735 O OE1 . GLN C 3 195 ? 1.062 -33.843 18.115 1.00 161.43 ? 195 GLN L OE1 1 ATOM 5736 N NE2 . GLN C 3 195 ? 1.011 -33.002 20.201 1.00 169.68 ? 195 GLN L NE2 1 ATOM 5737 N N . GLY C 3 196 ? -2.126 -37.997 20.404 1.00 128.69 ? 196 GLY L N 1 ATOM 5738 C CA . GLY C 3 196 ? -3.078 -37.984 21.500 1.00 128.04 ? 196 GLY L CA 1 ATOM 5739 C C . GLY C 3 196 ? -3.153 -39.324 22.195 1.00 129.80 ? 196 GLY L C 1 ATOM 5740 O O . GLY C 3 196 ? -3.776 -39.456 23.251 1.00 138.56 ? 196 GLY L O 1 ATOM 5741 N N . LEU C 3 197 ? -2.521 -40.319 21.578 1.00 125.87 ? 197 LEU L N 1 ATOM 5742 C CA . LEU C 3 197 ? -2.482 -41.683 22.099 1.00 124.45 ? 197 LEU L CA 1 ATOM 5743 C C . LEU C 3 197 ? -1.163 -41.994 22.818 1.00 124.50 ? 197 LEU L C 1 ATOM 5744 O O . LEU C 3 197 ? -0.092 -41.909 22.209 1.00 118.87 ? 197 LEU L O 1 ATOM 5745 C CB . LEU C 3 197 ? -2.692 -42.691 20.969 1.00 117.67 ? 197 LEU L CB 1 ATOM 5746 C CG . LEU C 3 197 ? -4.011 -42.602 20.209 1.00 105.81 ? 197 LEU L CG 1 ATOM 5747 C CD1 . LEU C 3 197 ? -3.939 -43.504 18.997 1.00 104.07 ? 197 LEU L CD1 1 ATOM 5748 C CD2 . LEU C 3 197 ? -5.210 -42.911 21.073 1.00 102.31 ? 197 LEU L CD2 1 ATOM 5749 N N . SER C 3 198 ? -1.226 -42.314 24.107 1.00 134.06 ? 198 SER L N 1 ATOM 5750 C CA . SER C 3 198 ? -0.018 -42.677 24.844 1.00 147.63 ? 198 SER L CA 1 ATOM 5751 C C . SER C 3 198 ? 0.664 -43.926 24.293 1.00 144.31 ? 198 SER L C 1 ATOM 5752 O O . SER C 3 198 ? 1.867 -44.114 24.456 1.00 151.27 ? 198 SER L O 1 ATOM 5753 C CB . SER C 3 198 ? -0.349 -42.906 26.319 1.00 158.14 ? 198 SER L CB 1 ATOM 5754 O OG . SER C 3 198 ? -1.406 -43.840 26.452 1.00 160.51 ? 198 SER L OG 1 ATOM 5755 N N . SER C 3 199 ? -0.108 -44.765 23.618 1.00 133.98 ? 199 SER L N 1 ATOM 5756 C CA . SER C 3 199 ? 0.439 -45.932 22.938 1.00 136.29 ? 199 SER L CA 1 ATOM 5757 C C . SER C 3 199 ? -0.461 -46.327 21.779 1.00 137.50 ? 199 SER L C 1 ATOM 5758 O O . SER C 3 199 ? -1.671 -46.092 21.836 1.00 139.41 ? 199 SER L O 1 ATOM 5759 C CB . SER C 3 199 ? 0.588 -47.103 23.907 1.00 137.95 ? 199 SER L CB 1 ATOM 5760 O OG . SER C 3 199 ? -0.688 -47.548 24.325 1.00 137.62 ? 199 SER L OG 1 ATOM 5761 N N . PRO C 3 200 ? 0.116 -46.947 20.737 1.00 131.26 ? 200 PRO L N 1 ATOM 5762 C CA . PRO C 3 200 ? -0.675 -47.306 19.557 1.00 120.30 ? 200 PRO L CA 1 ATOM 5763 C C . PRO C 3 200 ? -1.900 -48.131 19.954 1.00 116.13 ? 200 PRO L C 1 ATOM 5764 O O . PRO C 3 200 ? -1.812 -48.984 20.840 1.00 116.13 ? 200 PRO L O 1 ATOM 5765 C CB . PRO C 3 200 ? 0.302 -48.135 18.727 1.00 121.26 ? 200 PRO L CB 1 ATOM 5766 C CG . PRO C 3 200 ? 1.652 -47.637 19.145 1.00 126.89 ? 200 PRO L CG 1 ATOM 5767 C CD . PRO C 3 200 ? 1.533 -47.324 20.592 1.00 133.39 ? 200 PRO L CD 1 ATOM 5768 N N . VAL C 3 201 ? -3.020 -47.862 19.291 1.00 116.80 ? 201 VAL L N 1 ATOM 5769 C CA . VAL C 3 201 ? -4.307 -48.509 19.551 1.00 119.01 ? 201 VAL L CA 1 ATOM 5770 C C . VAL C 3 201 ? -4.731 -49.482 18.455 1.00 122.83 ? 201 VAL L C 1 ATOM 5771 O O . VAL C 3 201 ? -4.680 -49.133 17.279 1.00 128.09 ? 201 VAL L O 1 ATOM 5772 C CB . VAL C 3 201 ? -5.436 -47.472 19.776 1.00 115.80 ? 201 VAL L CB 1 ATOM 5773 C CG1 . VAL C 3 201 ? -5.124 -46.620 21.002 1.00 127.04 ? 201 VAL L CG1 1 ATOM 5774 C CG2 . VAL C 3 201 ? -5.642 -46.602 18.574 1.00 108.23 ? 201 VAL L CG2 1 ATOM 5775 N N . THR C 3 202 ? -5.069 -50.719 18.818 1.00 119.46 ? 202 THR L N 1 ATOM 5776 C CA . THR C 3 202 ? -5.426 -51.737 17.817 1.00 112.41 ? 202 THR L CA 1 ATOM 5777 C C . THR C 3 202 ? -6.912 -52.131 17.872 1.00 107.78 ? 202 THR L C 1 ATOM 5778 O O . THR C 3 202 ? -7.353 -52.752 18.835 1.00 112.32 ? 202 THR L O 1 ATOM 5779 C CB . THR C 3 202 ? -4.559 -53.029 17.950 1.00 118.09 ? 202 THR L CB 1 ATOM 5780 O OG1 . THR C 3 202 ? -3.167 -52.693 17.900 1.00 120.03 ? 202 THR L OG1 1 ATOM 5781 C CG2 . THR C 3 202 ? -4.831 -53.972 16.799 1.00 114.50 ? 202 THR L CG2 1 ATOM 5782 N N . LYS C 3 203 ? -7.684 -51.730 16.855 1.00 107.25 ? 203 LYS L N 1 ATOM 5783 C CA . LYS C 3 203 ? -9.071 -52.203 16.711 1.00 110.96 ? 203 LYS L CA 1 ATOM 5784 C C . LYS C 3 203 ? -8.969 -53.344 15.737 1.00 108.92 ? 203 LYS L C 1 ATOM 5785 O O . LYS C 3 203 ? -8.317 -53.231 14.714 1.00 107.14 ? 203 LYS L O 1 ATOM 5786 C CB . LYS C 3 203 ? -10.052 -51.121 16.201 1.00 107.42 ? 203 LYS L CB 1 ATOM 5787 C CG . LYS C 3 203 ? -10.313 -49.933 17.161 1.00 116.03 ? 203 LYS L CG 1 ATOM 5788 C CD . LYS C 3 203 ? -11.130 -50.364 18.413 1.00 209.24 ? 203 LYS L CD 1 ATOM 5789 C CE . LYS C 3 203 ? -11.598 -49.215 19.366 1.00 117.51 ? 203 LYS L CE 1 ATOM 5790 N NZ . LYS C 3 203 ? -11.484 -47.780 18.914 1.00 114.35 ? 203 LYS L NZ 1 ATOM 5791 N N . SER C 3 204 ? -9.666 -54.429 16.021 1.00 111.62 ? 204 SER L N 1 ATOM 5792 C CA . SER C 3 204 ? -9.513 -55.618 15.211 1.00 113.75 ? 204 SER L CA 1 ATOM 5793 C C . SER C 3 204 ? -10.772 -56.467 15.158 1.00 118.11 ? 204 SER L C 1 ATOM 5794 O O . SER C 3 204 ? -11.774 -56.142 15.819 1.00 119.73 ? 204 SER L O 1 ATOM 5795 C CB . SER C 3 204 ? -8.357 -56.473 15.765 1.00 118.58 ? 204 SER L CB 1 ATOM 5796 O OG . SER C 3 204 ? -8.580 -56.885 17.121 1.00 124.05 ? 204 SER L OG 1 ATOM 5797 N N . PHE C 3 205 ? -10.678 -57.589 14.425 1.00 119.52 ? 205 PHE L N 1 ATOM 5798 C CA . PHE C 3 205 ? -11.782 -58.552 14.313 1.00 120.55 ? 205 PHE L CA 1 ATOM 5799 C C . PHE C 3 205 ? -11.365 -59.873 13.656 1.00 130.44 ? 205 PHE L C 1 ATOM 5800 O O . PHE C 3 205 ? -10.372 -59.963 12.939 1.00 134.60 ? 205 PHE L O 1 ATOM 5801 C CB . PHE C 3 205 ? -12.947 -57.991 13.483 1.00 108.92 ? 205 PHE L CB 1 ATOM 5802 C CG . PHE C 3 205 ? -12.661 -57.917 12.008 1.00 116.58 ? 205 PHE L CG 1 ATOM 5803 C CD1 . PHE C 3 205 ? -12.021 -56.820 11.456 1.00 127.59 ? 205 PHE L CD1 1 ATOM 5804 C CD2 . PHE C 3 205 ? -13.041 -58.956 11.165 1.00 121.68 ? 205 PHE L CD2 1 ATOM 5805 C CE1 . PHE C 3 205 ? -11.755 -56.762 10.087 1.00 127.75 ? 205 PHE L CE1 1 ATOM 5806 C CE2 . PHE C 3 205 ? -12.776 -58.907 9.800 1.00 124.08 ? 205 PHE L CE2 1 ATOM 5807 C CZ . PHE C 3 205 ? -12.131 -57.806 9.262 1.00 124.23 ? 205 PHE L CZ 1 ATOM 5808 N N . ASN C 3 206 ? -12.160 -60.895 13.969 1.00 135.10 ? 206 ASN L N 1 ATOM 5809 C CA . ASN C 3 206 ? -12.098 -62.262 13.456 1.00 133.41 ? 206 ASN L CA 1 ATOM 5810 C C . ASN C 3 206 ? -13.120 -62.553 12.374 1.00 132.79 ? 206 ASN L C 1 ATOM 5811 O O . ASN C 3 206 ? -14.287 -62.187 12.520 1.00 127.75 ? 206 ASN L O 1 ATOM 5812 C CB . ASN C 3 206 ? -12.269 -63.231 14.611 1.00 139.62 ? 206 ASN L CB 1 ATOM 5813 C CG . ASN C 3 206 ? -11.168 -63.097 15.623 1.00 144.57 ? 206 ASN L CG 1 ATOM 5814 O OD1 . ASN C 3 206 ? -10.205 -62.363 15.402 1.00 142.80 ? 206 ASN L OD1 1 ATOM 5815 N ND2 . ASN C 3 206 ? -11.320 -63.760 16.764 1.00 151.27 ? 206 ASN L ND2 1 ATOM 5816 N N . ARG C 3 207 ? -12.691 -63.196 11.292 1.00 142.77 ? 207 ARG L N 1 ATOM 5817 C CA . ARG C 3 207 ? -13.606 -63.521 10.207 1.00 158.45 ? 207 ARG L CA 1 ATOM 5818 C C . ARG C 3 207 ? -14.867 -64.234 10.732 1.00 180.18 ? 207 ARG L C 1 ATOM 5819 O O . ARG C 3 207 ? -15.968 -64.009 10.233 1.00 185.54 ? 207 ARG L O 1 ATOM 5820 C CB . ARG C 3 207 ? -12.920 -64.409 9.165 1.00 162.50 ? 207 ARG L CB 1 ATOM 5821 C CG . ARG C 3 207 ? -13.775 -64.612 7.923 1.00 166.58 ? 207 ARG L CG 1 ATOM 5822 C CD . ARG C 3 207 ? -13.305 -65.756 7.030 1.00 172.13 ? 207 ARG L CD 1 ATOM 5823 N NE . ARG C 3 207 ? -11.921 -65.640 6.590 1.00 171.99 ? 207 ARG L NE 1 ATOM 5824 C CZ . ARG C 3 207 ? -10.935 -66.414 7.028 1.00 172.33 ? 207 ARG L CZ 1 ATOM 5825 N NH1 . ARG C 3 207 ? -11.165 -67.355 7.935 1.00 169.99 ? 207 ARG L NH1 1 ATOM 5826 N NH2 . ARG C 3 207 ? -9.707 -66.236 6.570 1.00 173.86 ? 207 ARG L NH2 1 ATOM 5827 N N . GLY C 3 208 ? -14.717 -65.062 11.761 1.00 202.81 ? 208 GLY L N 1 ATOM 5828 C CA . GLY C 3 208 ? -15.863 -65.698 12.392 1.00 117.88 ? 208 GLY L CA 1 ATOM 5829 C C . GLY C 3 208 ? -16.678 -64.777 13.290 1.00 133.98 ? 208 GLY L C 1 ATOM 5830 O O . GLY C 3 208 ? -17.062 -65.155 14.400 1.00 141.33 ? 208 GLY L O 1 HETATM 5831 S S . SO4 D 4 . ? 5.740 -5.311 -33.664 1.00 160.34 ? 601 SO4 G S 1 HETATM 5832 O O1 . SO4 D 4 . ? 5.238 -6.231 -34.681 1.00 165.24 ? 601 SO4 G O1 1 HETATM 5833 O O2 . SO4 D 4 . ? 4.611 -4.863 -32.851 1.00 157.40 ? 601 SO4 G O2 1 HETATM 5834 O O3 . SO4 D 4 . ? 6.734 -5.988 -32.826 1.00 157.38 ? 601 SO4 G O3 1 HETATM 5835 O O4 . SO4 D 4 . ? 6.357 -4.168 -34.336 1.00 157.97 ? 601 SO4 G O4 1 HETATM 5836 C C1 . NAG E 5 . ? 16.108 -7.968 -55.864 1.00 115.00 ? 602 NAG G C1 1 HETATM 5837 C C2 . NAG E 5 . ? 14.764 -8.205 -56.565 1.00 120.93 ? 602 NAG G C2 1 HETATM 5838 C C3 . NAG E 5 . ? 14.940 -8.599 -58.044 1.00 130.10 ? 602 NAG G C3 1 HETATM 5839 C C4 . NAG E 5 . ? 15.862 -7.612 -58.742 1.00 133.34 ? 602 NAG G C4 1 HETATM 5840 C C5 . NAG E 5 . ? 17.188 -7.605 -57.989 1.00 135.87 ? 602 NAG G C5 1 HETATM 5841 C C6 . NAG E 5 . ? 18.252 -6.775 -58.720 1.00 132.33 ? 602 NAG G C6 1 HETATM 5842 C C7 . NAG E 5 . ? 12.733 -8.987 -55.432 1.00 115.35 ? 602 NAG G C7 1 HETATM 5843 C C8 . NAG E 5 . ? 11.876 -10.212 -55.319 1.00 116.61 ? 602 NAG G C8 1 HETATM 5844 N N2 . NAG E 5 . ? 13.991 -9.192 -55.827 1.00 118.73 ? 602 NAG G N2 1 HETATM 5845 O O3 . NAG E 5 . ? 13.719 -8.630 -58.754 1.00 136.58 ? 602 NAG G O3 1 HETATM 5846 O O4 . NAG E 5 . ? 16.044 -7.974 -60.095 1.00 132.23 ? 602 NAG G O4 1 HETATM 5847 O O5 . NAG E 5 . ? 16.974 -7.160 -56.651 1.00 134.98 ? 602 NAG G O5 1 HETATM 5848 O O6 . NAG E 5 . ? 18.500 -5.544 -58.075 1.00 128.74 ? 602 NAG G O6 1 HETATM 5849 O O7 . NAG E 5 . ? 12.269 -7.880 -55.163 1.00 109.29 ? 602 NAG G O7 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . VAL A 1 ? 2.2562 2.3219 1.9750 -0.5123 -0.4902 0.1881 44 VAL G N 2 C CA . VAL A 1 ? 2.1667 2.2128 1.9198 -0.5202 -0.4843 0.1982 44 VAL G CA 3 C C . VAL A 1 ? 2.1325 2.1023 1.8546 -0.4867 -0.4591 0.1882 44 VAL G C 4 O O . VAL A 1 ? 2.1304 2.0491 1.8651 -0.4976 -0.4590 0.1772 44 VAL G O 5 C CB . VAL A 1 ? 2.0762 2.2129 1.8723 -0.5159 -0.4820 0.2464 44 VAL G CB 6 C CG1 . VAL A 1 ? 2.0179 2.1344 1.8458 -0.5397 -0.4812 0.2569 44 VAL G CG1 7 C CG2 . VAL A 1 ? 2.1100 2.3368 1.9361 -0.5448 -0.5073 0.2577 44 VAL G CG2 8 N N . TRP A 2 ? 2.0882 2.0470 1.7668 -0.4469 -0.4404 0.1929 45 TRP G N 9 C CA . TRP A 2 ? 1.9973 1.8829 1.6407 -0.4191 -0.4181 0.1807 45 TRP G CA 10 C C . TRP A 2 ? 1.9235 1.7722 1.5090 -0.4040 -0.4091 0.1612 45 TRP G C 11 O O . TRP A 2 ? 2.0564 1.9390 1.6248 -0.4070 -0.4187 0.1654 45 TRP G O 12 C CB . TRP A 2 ? 1.9927 1.8943 1.6354 -0.3810 -0.3982 0.2172 45 TRP G CB 13 C CG . TRP A 2 ? 1.9216 1.8766 1.5464 -0.3447 -0.3912 0.2470 45 TRP G CG 14 C CD1 . TRP A 2 ? 1.9050 1.8236 1.4721 -0.3105 -0.3798 0.2456 45 TRP G CD1 15 C CD2 . TRP A 2 ? 1.8960 1.9491 1.5601 -0.3371 -0.3964 0.2827 45 TRP G CD2 16 N NE1 . TRP A 2 ? 1.9676 1.9487 1.5335 -0.2768 -0.3801 0.2777 45 TRP G NE1 17 C CE2 . TRP A 2 ? 1.9804 2.0528 1.6099 -0.2910 -0.3894 0.2999 45 TRP G CE2 18 C CE3 . TRP A 2 ? 1.8523 1.9803 1.5773 -0.3665 -0.4072 0.3019 45 TRP G CE3 19 C CZ2 . TRP A 2 ? 2.0225 2.1946 1.6826 -0.2674 -0.3933 0.3331 45 TRP G CZ2 20 C CZ3 . TRP A 2 ? 1.9209 2.1545 1.6780 -0.3500 -0.4087 0.3355 45 TRP G CZ3 21 C CH2 . TRP A 2 ? 1.9874 2.2466 1.7152 -0.2977 -0.4018 0.3498 45 TRP G CH2 22 N N . LYS A 3 ? 1.7446 1.5251 1.2965 -0.3903 -0.3921 0.1417 46 LYS G N 23 C CA . LYS A 3 ? 1.8515 1.5956 1.3444 -0.3838 -0.3825 0.1252 46 LYS G CA 24 C C . LYS A 3 ? 2.1130 1.8013 1.5658 -0.3520 -0.3599 0.1313 46 LYS G C 25 O O . LYS A 3 ? 2.1547 1.8229 1.6281 -0.3441 -0.3536 0.1319 46 LYS G O 26 C CB . LYS A 3 ? 1.8465 1.5647 1.3359 -0.4193 -0.3883 0.0769 46 LYS G CB 27 C CG . LYS A 3 ? 1.8896 1.5693 1.3138 -0.4197 -0.3739 0.0587 46 LYS G CG 28 C CD . LYS A 3 ? 1.9212 1.6286 1.3034 -0.4127 -0.3806 0.0850 46 LYS G CD 29 C CE . LYS A 3 ? 1.9666 1.6235 1.2695 -0.4085 -0.3655 0.0815 46 LYS G CE 30 N NZ . LYS A 3 ? 1.9779 1.6123 1.2610 -0.4453 -0.3580 0.0351 46 LYS G NZ 31 N N . ASP A 4 ? 2.2355 1.8925 1.6259 -0.3354 -0.3497 0.1364 47 ASP G N 32 C CA . ASP A 4 ? 2.2131 1.8067 1.5593 -0.3107 -0.3302 0.1383 47 ASP G CA 33 C C . ASP A 4 ? 2.1504 1.7025 1.5040 -0.3362 -0.3243 0.0977 47 ASP G C 34 O O . ASP A 4 ? 2.1152 1.6728 1.4776 -0.3688 -0.3298 0.0648 47 ASP G O 35 C CB . ASP A 4 ? 2.2924 1.8476 1.5625 -0.2944 -0.3236 0.1502 47 ASP G CB 36 C CG . ASP A 4 ? 2.3803 1.9711 1.6418 -0.2547 -0.3295 0.1916 47 ASP G CG 37 O OD1 . ASP A 4 ? 2.3986 2.0669 1.7149 -0.2568 -0.3437 0.2060 47 ASP G OD1 38 O OD2 . ASP A 4 ? 2.4246 1.9659 1.6239 -0.2215 -0.3213 0.2088 47 ASP G OD2 39 N N . ALA A 5 ? 2.1779 1.6919 1.5265 -0.3189 -0.3133 0.0988 48 ALA G N 40 C CA . ALA A 5 ? 2.2288 1.7119 1.5930 -0.3374 -0.3109 0.0626 48 ALA G CA 41 C C . ALA A 5 ? 2.3029 1.7352 1.6369 -0.3148 -0.2979 0.0687 48 ALA G C 42 O O . ALA A 5 ? 2.3208 1.7494 1.6394 -0.2829 -0.2924 0.1013 48 ALA G O 43 C CB . ALA A 5 ? 2.1897 1.7045 1.6233 -0.3526 -0.3276 0.0506 48 ALA G CB 44 N N . ASP A 6 ? 2.3128 1.7111 1.6387 -0.3315 -0.2932 0.0351 49 ASP G N 45 C CA . ASP A 6 ? 2.2918 1.6448 1.5978 -0.3167 -0.2859 0.0341 49 ASP G CA 46 C C . ASP A 6 ? 2.2579 1.6237 1.6226 -0.3209 -0.2993 0.0180 49 ASP G C 47 O O . ASP A 6 ? 2.3005 1.6980 1.7152 -0.3400 -0.3126 -0.0031 49 ASP G O 48 C CB . ASP A 6 ? 2.2723 1.5811 1.5310 -0.3351 -0.2742 0.0077 49 ASP G CB 49 C CG . ASP A 6 ? 2.2332 1.5080 1.4187 -0.3324 -0.2628 0.0256 49 ASP G CG 50 O OD1 . ASP A 6 ? 2.2578 1.5446 1.4304 -0.3084 -0.2648 0.0585 49 ASP G OD1 51 O OD2 . ASP A 6 ? 2.1956 1.4321 1.3361 -0.3553 -0.2530 0.0069 49 ASP G OD2 52 N N . THR A 7 ? 2.2202 1.5546 1.5725 -0.3023 -0.2974 0.0269 50 THR G N 53 C CA . THR A 7 ? 2.1888 1.5242 1.5854 -0.3028 -0.3128 0.0165 50 THR G CA 54 C C . THR A 7 ? 2.1761 1.4686 1.5392 -0.2841 -0.3088 0.0237 50 THR G C 55 O O . THR A 7 ? 2.2642 1.5230 1.5691 -0.2702 -0.2931 0.0354 50 THR G O 56 C CB . THR A 7 ? 1.9494 1.3203 1.3898 -0.2993 -0.3255 0.0426 50 THR G CB 57 O OG1 . THR A 7 ? 1.9265 1.2897 1.4085 -0.3055 -0.3456 0.0284 50 THR G OG1 58 C CG2 . THR A 7 ? 1.8972 1.2709 1.3106 -0.2724 -0.3142 0.0863 50 THR G CG2 59 N N . THR A 8 ? 2.1510 1.4393 1.5467 -0.2834 -0.3254 0.0160 51 THR G N 60 C CA . THR A 8 ? 2.1403 1.3904 1.5041 -0.2670 -0.3255 0.0232 51 THR G CA 61 C C . THR A 8 ? 2.1138 1.3664 1.4657 -0.2450 -0.3223 0.0653 51 THR G C 62 O O . THR A 8 ? 2.0982 1.3726 1.4902 -0.2495 -0.3365 0.0789 51 THR G O 63 C CB . THR A 8 ? 2.1042 1.3477 1.5048 -0.2759 -0.3483 -0.0076 51 THR G CB 64 O OG1 . THR A 8 ? 2.1003 1.3527 1.5125 -0.2960 -0.3470 -0.0494 51 THR G OG1 65 C CG2 . THR A 8 ? 2.1301 1.3351 1.4949 -0.2603 -0.3524 0.0008 51 THR G CG2 66 N N . LEU A 9 ? 2.0703 1.2990 1.3636 -0.2223 -0.3031 0.0849 52 LEU G N 67 C CA . LEU A 9 ? 1.9953 1.2339 1.2712 -0.1982 -0.2938 0.1227 52 LEU G CA 68 C C . LEU A 9 ? 1.9006 1.1020 1.1480 -0.1885 -0.2994 0.1240 52 LEU G C 69 O O . LEU A 9 ? 1.7339 0.8954 0.9612 -0.1947 -0.3071 0.0966 52 LEU G O 70 C CB . LEU A 9 ? 2.0362 1.2705 1.2619 -0.1710 -0.2697 0.1411 52 LEU G CB 71 C CG . LEU A 9 ? 1.9545 1.2138 1.1921 -0.1784 -0.2659 0.1384 52 LEU G CG 72 C CD1 . LEU A 9 ? 1.9317 1.1573 1.1035 -0.1500 -0.2475 0.1475 52 LEU G CD1 73 C CD2 . LEU A 9 ? 1.9516 1.2808 1.2426 -0.1818 -0.2698 0.1633 52 LEU G CD2 74 N N . PHE A 10 ? 1.9410 1.1598 1.1854 -0.1761 -0.2959 0.1560 53 PHE G N 75 C CA . PHE A 10 ? 1.9950 1.1781 1.1981 -0.1641 -0.2983 0.1625 53 PHE G CA 76 C C . PHE A 10 ? 2.0695 1.2539 1.2158 -0.1314 -0.2704 0.1890 53 PHE G C 77 O O . PHE A 10 ? 2.0986 1.3297 1.2553 -0.1184 -0.2525 0.2111 53 PHE G O 78 C CB . PHE A 10 ? 1.9248 1.1165 1.1654 -0.1811 -0.3223 0.1738 53 PHE G CB 79 C CG . PHE A 10 ? 1.9734 1.2158 1.2426 -0.1867 -0.3160 0.2100 53 PHE G CG 80 C CD1 . PHE A 10 ? 1.9450 1.2258 1.2715 -0.2068 -0.3237 0.2089 53 PHE G CD1 81 C CD2 . PHE A 10 ? 2.1269 1.3839 1.3637 -0.1740 -0.3004 0.2442 53 PHE G CD2 82 C CE1 . PHE A 10 ? 2.0207 1.3525 1.3746 -0.2175 -0.3190 0.2423 53 PHE G CE1 83 C CE2 . PHE A 10 ? 1.7847 1.0991 1.0506 -0.1845 -0.2926 0.2782 53 PHE G CE2 84 C CZ . PHE A 10 ? 2.0480 1.3996 1.3738 -0.2078 -0.3031 0.2779 53 PHE G CZ 85 N N . CYS A 11 ? 2.0477 1.1851 1.1349 -0.1168 -0.2677 0.1848 54 CYS G N 86 C CA . CYS A 11 ? 2.1129 1.2442 1.1383 -0.0815 -0.2404 0.2024 54 CYS G CA 87 C C . CYS A 11 ? 2.1307 1.2910 1.1486 -0.0767 -0.2350 0.2332 54 CYS G C 88 O O . CYS A 11 ? 2.0987 1.2546 1.1378 -0.1002 -0.2575 0.2376 54 CYS G O 89 C CB . CYS A 11 ? 2.1468 1.2023 1.0972 -0.0671 -0.2373 0.1775 54 CYS G CB 90 S SG . CYS A 11 ? 3.5307 2.5387 2.4658 -0.0892 -0.2672 0.1572 54 CYS G SG 91 N N . ALA A 12 ? 2.1972 1.3905 1.1862 -0.0460 -0.2054 0.2551 55 ALA G N 92 C CA . ALA A 12 ? 2.2345 1.4620 1.2069 -0.0414 -0.1932 0.2850 55 ALA G CA 93 C C . ALA A 12 ? 2.2953 1.5080 1.1893 0.0030 -0.1624 0.2858 55 ALA G C 94 O O . ALA A 12 ? 2.3500 1.5576 1.2239 0.0358 -0.1446 0.2756 55 ALA G O 95 C CB . ALA A 12 ? 1.9551 1.2731 0.9925 -0.0553 -0.1851 0.3167 55 ALA G CB 96 N N . SER A 13 ? 2.3265 1.5247 1.1699 0.0058 -0.1578 0.2959 56 SER G N 97 C CA . SER A 13 ? 2.4157 1.5964 1.1780 0.0496 -0.1279 0.2921 56 SER G CA 98 C C . SER A 13 ? 2.4181 1.6302 1.1442 0.0488 -0.1132 0.3179 56 SER G C 99 O O . SER A 13 ? 2.4319 1.6772 1.1955 0.0118 -0.1270 0.3432 56 SER G O 100 C CB . SER A 13 ? 2.4702 1.5472 1.1622 0.0600 -0.1405 0.2554 56 SER G CB 101 O OG . SER A 13 ? 2.4284 1.4628 1.0922 0.0343 -0.1650 0.2518 56 SER G OG 102 N N . ASP A 14 ? 2.4003 1.5976 1.0482 0.0893 -0.0850 0.3112 57 ASP G N 103 C CA . ASP A 14 ? 2.4285 1.6532 1.0268 0.0907 -0.0666 0.3326 57 ASP G CA 104 C C . ASP A 14 ? 2.4762 1.6055 0.9827 0.0948 -0.0805 0.3096 57 ASP G C 105 O O . ASP A 14 ? 2.5879 1.7171 1.0203 0.1159 -0.0575 0.3130 57 ASP G O 106 C CB . ASP A 14 ? 2.5358 1.8365 1.1138 0.1362 -0.0184 0.3433 57 ASP G CB 107 C CG . ASP A 14 ? 2.5801 1.9902 1.2489 0.1342 -0.0035 0.3670 57 ASP G CG 108 O OD1 . ASP A 14 ? 2.5474 1.9580 1.2863 0.1082 -0.0287 0.3666 57 ASP G OD1 109 O OD2 . ASP A 14 ? 2.6235 2.1256 1.2936 0.1571 0.0338 0.3856 57 ASP G OD2 110 N N . ALA A 15 ? 2.4435 1.4971 0.9550 0.0738 -0.1177 0.2849 58 ALA G N 111 C CA . ALA A 15 ? 2.5258 1.4897 0.9590 0.0710 -0.1388 0.2601 58 ALA G CA 112 C C . ALA A 15 ? 2.6427 1.6084 1.0446 0.0455 -0.1535 0.2836 58 ALA G C 113 O O . ALA A 15 ? 2.4803 1.4855 0.9409 0.0117 -0.1705 0.3120 58 ALA G O 114 C CB . ALA A 15 ? 2.5227 1.4275 0.9857 0.0480 -0.1758 0.2309 58 ALA G CB 115 N N . LYS A 16 ? 2.7397 1.6582 1.0433 0.0611 -0.1481 0.2730 59 LYS G N 116 C CA . LYS A 16 ? 2.7814 1.7000 1.0450 0.0378 -0.1616 0.2983 59 LYS G CA 117 C C . LYS A 16 ? 2.7414 1.5756 0.9638 0.0196 -0.2080 0.2751 59 LYS G C 118 O O . LYS A 16 ? 2.7237 1.4953 0.9033 0.0342 -0.2149 0.2368 59 LYS G O 119 C CB . LYS A 16 ? 2.9807 1.9253 1.1589 0.0666 -0.1184 0.3093 59 LYS G CB 120 C CG . LYS A 16 ? 3.0479 2.0939 1.2681 0.0873 -0.0700 0.3323 59 LYS G CG 121 C CD . LYS A 16 ? 3.0506 2.1698 1.3559 0.0439 -0.0787 0.3764 59 LYS G CD 122 C CE . LYS A 16 ? 3.0490 2.2820 1.4044 0.0583 -0.0329 0.3999 59 LYS G CE 123 N NZ . LYS A 16 ? 2.9559 2.2444 1.4152 0.0169 -0.0494 0.4290 59 LYS G NZ 124 N N . ALA A 17 ? 2.7093 1.5427 0.9497 -0.0144 -0.2431 0.2991 60 ALA G N 125 C CA . ALA A 17 ? 2.7495 1.5159 0.9594 -0.0316 -0.2927 0.2817 60 ALA G CA 126 C C . ALA A 17 ? 2.8451 1.5557 0.9364 -0.0132 -0.2877 0.2609 60 ALA G C 127 O O . ALA A 17 ? 2.8527 1.5033 0.9160 -0.0169 -0.3192 0.2269 60 ALA G O 128 C CB . ALA A 17 ? 2.7295 1.5036 0.9622 -0.0636 -0.3278 0.3185 60 ALA G CB 129 N N . HIS A 18 ? 2.8961 1.6305 0.9172 0.0062 -0.2464 0.2788 61 HIS G N 130 C CA . HIS A 18 ? 3.0879 1.7684 0.9876 0.0241 -0.2406 0.2588 61 HIS G CA 131 C C . HIS A 18 ? 3.0529 1.6872 0.9197 0.0545 -0.2241 0.2128 61 HIS G C 132 O O . HIS A 18 ? 3.1125 1.6755 0.8969 0.0588 -0.2407 0.1818 61 HIS G O 133 C CB . HIS A 18 ? 3.1845 1.9095 1.0136 0.0385 -0.1959 0.2881 61 HIS G CB 134 C CG . HIS A 18 ? 3.1674 1.9488 1.0080 0.0767 -0.1368 0.2843 61 HIS G CG 135 N ND1 . HIS A 18 ? 3.1079 1.9777 1.0406 0.0728 -0.1121 0.3140 61 HIS G ND1 136 C CD2 . HIS A 18 ? 3.1815 1.9439 0.9516 0.1222 -0.0994 0.2536 61 HIS G CD2 137 C CE1 . HIS A 18 ? 3.0011 1.9116 0.9250 0.1157 -0.0629 0.3023 61 HIS G CE1 138 N NE2 . HIS A 18 ? 3.1771 2.0203 1.0021 0.1487 -0.0541 0.2653 61 HIS G NE2 139 N N . GLU A 19 ? 2.9561 1.6250 0.8893 0.0720 -0.1971 0.2081 62 GLU G N 140 C CA . GLU A 19 ? 2.9822 1.5989 0.8804 0.1024 -0.1811 0.1678 62 GLU G CA 141 C C . GLU A 19 ? 2.9544 1.5063 0.8762 0.0762 -0.2257 0.1350 62 GLU G C 142 O O . GLU A 19 ? 2.8638 1.4426 0.8804 0.0479 -0.2516 0.1417 62 GLU G O 143 C CB . GLU A 19 ? 2.9263 1.5996 0.8844 0.1310 -0.1414 0.1755 62 GLU G CB 144 C CG . GLU A 19 ? 3.3462 1.9523 1.2602 0.1634 -0.1291 0.1364 62 GLU G CG 145 C CD . GLU A 19 ? 3.4170 1.9560 1.1982 0.1913 -0.1162 0.1119 62 GLU G CD 146 O OE1 . GLU A 19 ? 3.4655 2.0459 1.2040 0.2292 -0.0741 0.1220 62 GLU G OE1 147 O OE2 . GLU A 19 ? 3.4431 1.8948 1.1625 0.1742 -0.1476 0.0819 62 GLU G OE2 148 N N . THR A 20 ? 3.2422 1.7103 1.0758 0.0859 -0.2321 0.0970 63 THR G N 149 C CA . THR A 20 ? 3.2147 1.6213 1.0545 0.0556 -0.2746 0.0634 63 THR G CA 150 C C . THR A 20 ? 3.2678 1.6185 1.0982 0.0668 -0.2625 0.0304 63 THR G C 151 O O . THR A 20 ? 3.2699 1.5688 1.0995 0.0379 -0.2934 0.0007 63 THR G O 152 C CB . THR A 20 ? 3.2769 1.6227 1.0188 0.0439 -0.3033 0.0446 63 THR G CB 153 O OG1 . THR A 20 ? 3.3552 1.6362 0.9808 0.0781 -0.2741 0.0204 63 THR G OG1 154 C CG2 . THR A 20 ? 3.3534 1.7460 1.0892 0.0348 -0.3145 0.0815 63 THR G CG2 155 N N . GLU A 21 ? 3.2938 1.6554 1.1144 0.1081 -0.2187 0.0362 64 GLU G N 156 C CA . GLU A 21 ? 3.0558 1.3669 0.8748 0.1216 -0.2072 0.0133 64 GLU G CA 157 C C . GLU A 21 ? 3.0602 1.4069 0.9904 0.0811 -0.2323 0.0174 64 GLU G C 158 O O . GLU A 21 ? 3.0160 1.4465 1.0360 0.0661 -0.2379 0.0461 64 GLU G O 159 C CB . GLU A 21 ? 3.0684 1.4092 0.8804 0.1769 -0.1592 0.0265 64 GLU G CB 160 C CG . GLU A 21 ? 3.2036 1.4909 1.0132 0.1967 -0.1485 0.0087 64 GLU G CG 161 C CD . GLU A 21 ? 3.1363 1.4862 1.0639 0.1735 -0.1553 0.0274 64 GLU G CD 162 O OE1 . GLU A 21 ? 3.0648 1.5175 1.0720 0.1736 -0.1450 0.0604 64 GLU G OE1 163 O OE2 . GLU A 21 ? 3.2140 1.5097 1.1509 0.1523 -0.1709 0.0091 64 GLU G OE2 164 N N . CYS A 22 ? 2.9562 1.2380 0.8775 0.0624 -0.2458 -0.0114 65 CYS G N 165 C CA . CYS A 22 ? 2.9964 1.3077 1.0112 0.0167 -0.2735 -0.0156 65 CYS G CA 166 C C . CYS A 22 ? 2.8923 1.2878 1.0153 0.0190 -0.2597 0.0114 65 CYS G C 167 O O . CYS A 22 ? 2.7918 1.2490 1.0047 -0.0118 -0.2818 0.0208 65 CYS G O 168 C CB . CYS A 22 ? 3.0028 1.2260 0.9740 -0.0055 -0.2845 -0.0508 65 CYS G CB 169 S SG . CYS A 22 ? 4.0141 2.2745 2.0847 -0.0688 -0.3207 -0.0653 65 CYS G SG 170 N N . HIS A 23 ? 2.9534 1.3512 1.0685 0.0565 -0.2260 0.0222 66 HIS G N 171 C CA . HIS A 23 ? 2.9657 1.4453 1.1796 0.0573 -0.2151 0.0473 66 HIS G CA 172 C C . HIS A 23 ? 2.8244 1.3956 1.0993 0.0553 -0.2145 0.0797 66 HIS G C 173 O O . HIS A 23 ? 2.5457 1.1774 0.9124 0.0291 -0.2285 0.0929 66 HIS G O 174 C CB . HIS A 23 ? 3.0843 1.5598 1.2778 0.1040 -0.1806 0.0561 66 HIS G CB 175 C CG . HIS A 23 ? 3.2782 1.6641 1.4243 0.1041 -0.1821 0.0317 66 HIS G CG 176 N ND1 . HIS A 23 ? 3.3755 1.7441 1.5033 0.1449 -0.1588 0.0377 66 HIS G ND1 177 C CD2 . HIS A 23 ? 3.4130 1.7183 1.5210 0.0670 -0.2053 0.0021 66 HIS G CD2 178 C CE1 . HIS A 23 ? 3.4768 1.7488 1.5529 0.1320 -0.1683 0.0150 66 HIS G CE1 179 N NE2 . HIS A 23 ? 3.5109 1.7448 1.5743 0.0818 -0.1951 -0.0071 66 HIS G NE2 180 N N . ASN A 24 ? 2.9251 1.5029 1.1421 0.0841 -0.1960 0.0924 67 ASN G N 181 C CA . ASN A 24 ? 2.9428 1.5979 1.1975 0.0796 -0.1932 0.1262 67 ASN G CA 182 C C . ASN A 24 ? 2.9170 1.5821 1.2210 0.0335 -0.2360 0.1281 67 ASN G C 183 O O . ASN A 24 ? 2.8537 1.5836 1.2336 0.0160 -0.2441 0.1548 67 ASN G O 184 C CB . ASN A 24 ? 3.0216 1.6656 1.1833 0.1124 -0.1686 0.1318 67 ASN G CB 185 C CG . ASN A 24 ? 3.0005 1.7341 1.1952 0.1144 -0.1510 0.1720 67 ASN G CG 186 O OD1 . ASN A 24 ? 3.0420 1.7907 1.2442 0.0854 -0.1729 0.1891 67 ASN G OD1 187 N ND2 . ASN A 24 ? 2.6803 1.4758 0.8947 0.1480 -0.1120 0.1887 67 ASN G ND2 188 N N . VAL A 25 ? 2.6172 1.2173 0.8781 0.0146 -0.2654 0.0987 68 VAL G N 189 C CA . VAL A 25 ? 2.5951 1.2073 0.9003 -0.0215 -0.3087 0.0980 68 VAL G CA 190 C C . VAL A 25 ? 2.4851 1.1346 0.8966 -0.0464 -0.3237 0.0919 68 VAL G C 191 O O . VAL A 25 ? 2.4236 1.1230 0.9110 -0.0637 -0.3435 0.1093 68 VAL G O 192 C CB . VAL A 25 ? 2.6592 1.2033 0.8930 -0.0353 -0.3386 0.0672 68 VAL G CB 193 C CG1 . VAL A 25 ? 2.6770 1.1647 0.8916 -0.0465 -0.3420 0.0282 68 VAL G CG1 194 C CG2 . VAL A 25 ? 3.0532 1.6216 1.3392 -0.0650 -0.3851 0.0701 68 VAL G CG2 195 N N . TRP A 26 ? 2.4781 1.0997 0.8896 -0.0472 -0.3127 0.0679 69 TRP G N 196 C CA . TRP A 26 ? 2.6044 1.2620 1.1073 -0.0703 -0.3215 0.0603 69 TRP G CA 197 C C . TRP A 26 ? 2.5074 1.2388 1.0862 -0.0642 -0.3086 0.0929 69 TRP G C 198 O O . TRP A 26 ? 2.2503 1.0222 0.9109 -0.0872 -0.3283 0.0924 69 TRP G O 199 C CB . TRP A 26 ? 2.6054 1.2180 1.0823 -0.0708 -0.3059 0.0370 69 TRP G CB 200 C CG . TRP A 26 ? 2.5544 1.2079 1.1173 -0.0938 -0.3093 0.0316 69 TRP G CG 201 C CD1 . TRP A 26 ? 2.5211 1.1773 1.1262 -0.1314 -0.3323 0.0034 69 TRP G CD1 202 C CD2 . TRP A 26 ? 2.4386 1.1387 1.0505 -0.0806 -0.2871 0.0527 69 TRP G CD2 203 N NE1 . TRP A 26 ? 2.4457 1.1455 1.1201 -0.1422 -0.3244 0.0058 69 TRP G NE1 204 C CE2 . TRP A 26 ? 2.3961 1.1204 1.0745 -0.1120 -0.2988 0.0363 69 TRP G CE2 205 C CE3 . TRP A 26 ? 2.4176 1.1493 1.0260 -0.0462 -0.2591 0.0832 69 TRP G CE3 206 C CZ2 . TRP A 26 ? 2.1550 0.9255 0.8893 -0.1105 -0.2854 0.0496 69 TRP G CZ2 207 C CZ3 . TRP A 26 ? 2.2841 1.0665 0.9540 -0.0450 -0.2475 0.0970 69 TRP G CZ3 208 C CH2 . TRP A 26 ? 2.2111 1.0083 0.9399 -0.0771 -0.2615 0.0805 69 TRP G CH2 209 N N . ALA A 27 ? 2.4878 1.2380 1.0382 -0.0332 -0.2755 0.1186 70 ALA G N 210 C CA . ALA A 27 ? 2.2802 1.1048 0.8971 -0.0297 -0.2617 0.1511 70 ALA G CA 211 C C . ALA A 27 ? 2.2657 1.1228 0.9141 -0.0485 -0.2837 0.1748 70 ALA G C 212 O O . ALA A 27 ? 2.2509 1.1546 0.9774 -0.0667 -0.2943 0.1888 70 ALA G O 213 C CB . ALA A 27 ? 2.3137 1.1597 0.8921 0.0095 -0.2205 0.1706 70 ALA G CB 214 N N . THR A 28 ? 2.3320 1.1608 0.9156 -0.0445 -0.2915 0.1811 71 THR G N 215 C CA . THR A 28 ? 2.5808 1.4295 1.1892 -0.0646 -0.3177 0.2064 71 THR G CA 216 C C . THR A 28 ? 2.4905 1.3358 1.1713 -0.0921 -0.3611 0.1887 71 THR G C 217 O O . THR A 28 ? 2.2515 1.1204 0.9828 -0.1083 -0.3824 0.2095 71 THR G O 218 C CB . THR A 28 ? 2.4170 1.2267 0.9382 -0.0607 -0.3288 0.2138 71 THR G CB 219 O OG1 . THR A 28 ? 2.4453 1.1993 0.9372 -0.0683 -0.3605 0.1784 71 THR G OG1 220 C CG2 . THR A 28 ? 3.1341 1.9478 1.5740 -0.0311 -0.2853 0.2277 71 THR G CG2 221 N N . HIS A 29 ? 2.4546 1.2725 1.1423 -0.0975 -0.3726 0.1495 72 HIS G N 222 C CA . HIS A 29 ? 2.3809 1.2071 1.1410 -0.1205 -0.4105 0.1269 72 HIS G CA 223 C C . HIS A 29 ? 2.3169 1.1852 1.1607 -0.1304 -0.4023 0.1206 72 HIS G C 224 O O . HIS A 29 ? 2.3505 1.2449 1.2643 -0.1439 -0.4265 0.1214 72 HIS G O 225 C CB . HIS A 29 ? 2.5315 1.3180 1.2611 -0.1284 -0.4295 0.0866 72 HIS G CB 226 C CG . HIS A 29 ? 2.7338 1.4831 1.3971 -0.1256 -0.4541 0.0880 72 HIS G CG 227 N ND1 . HIS A 29 ? 2.8225 1.5224 1.4049 -0.1226 -0.4516 0.0660 72 HIS G ND1 228 C CD2 . HIS A 29 ? 2.8250 1.5742 1.4854 -0.1265 -0.4840 0.1095 72 HIS G CD2 229 C CE1 . HIS A 29 ? 2.9361 1.6132 1.4702 -0.1216 -0.4786 0.0726 72 HIS G CE1 230 N NE2 . HIS A 29 ? 2.9159 1.6218 1.4953 -0.1234 -0.4990 0.1003 72 HIS G NE2 231 N N . ALA A 30 ? 2.3868 1.2565 1.2183 -0.1222 -0.3703 0.1130 73 ALA G N 232 C CA . ALA A 30 ? 2.0565 0.9608 0.9544 -0.1326 -0.3620 0.1037 73 ALA G CA 233 C C . ALA A 30 ? 2.3647 1.3175 1.2983 -0.1264 -0.3448 0.1395 73 ALA G C 234 O O . ALA A 30 ? 2.3564 1.3452 1.3606 -0.1413 -0.3530 0.1383 73 ALA G O 235 C CB . ALA A 30 ? 2.0699 0.9471 0.9314 -0.1280 -0.3393 0.0832 73 ALA G CB 236 N N . CYS A 31 ? 2.3794 1.3380 1.2649 -0.1054 -0.3196 0.1691 74 CYS G N 237 C CA . CYS A 31 ? 2.3589 1.3758 1.2791 -0.1007 -0.2977 0.2016 74 CYS G CA 238 C C . CYS A 31 ? 2.0435 1.0887 0.9780 -0.1118 -0.3056 0.2376 74 CYS G C 239 O O . CYS A 31 ? 2.4713 1.4857 1.3845 -0.1206 -0.3301 0.2408 74 CYS G O 240 C CB . CYS A 31 ? 2.3616 1.3859 1.2312 -0.0678 -0.2584 0.2109 74 CYS G CB 241 S SG . CYS A 31 ? 2.5974 1.5701 1.4326 -0.0551 -0.2494 0.1744 74 CYS G SG 242 N N . VAL A 32 ? 2.1266 1.2312 1.0978 -0.1140 -0.2866 0.2655 75 VAL G N 243 C CA . VAL A 32 ? 2.2596 1.3980 1.2382 -0.1288 -0.2861 0.3054 75 VAL G CA 244 C C . VAL A 32 ? 2.2143 1.4044 1.1589 -0.1076 -0.2442 0.3333 75 VAL G C 245 O O . VAL A 32 ? 2.2347 1.4369 1.1605 -0.0772 -0.2172 0.3210 75 VAL G O 246 C CB . VAL A 32 ? 2.3023 1.4762 1.3623 -0.1591 -0.3035 0.3164 75 VAL G CB 247 C CG1 . VAL A 32 ? 2.3640 1.4916 1.4591 -0.1764 -0.3456 0.2887 75 VAL G CG1 248 C CG2 . VAL A 32 ? 2.1955 1.4254 1.2969 -0.1518 -0.2800 0.3138 75 VAL G CG2 249 N N . PRO A 33 ? 2.2313 1.4505 1.1633 -0.1226 -0.2386 0.3704 76 PRO G N 250 C CA . PRO A 33 ? 2.2429 1.5287 1.1496 -0.1030 -0.1953 0.3957 76 PRO G CA 251 C C . PRO A 33 ? 2.2773 1.6426 1.2446 -0.0945 -0.1726 0.4011 76 PRO G C 252 O O . PRO A 33 ? 2.2976 1.6846 1.3342 -0.1223 -0.1911 0.4041 76 PRO G O 253 C CB . PRO A 33 ? 2.2373 1.5448 1.1349 -0.1362 -0.1993 0.4370 76 PRO G CB 254 C CG . PRO A 33 ? 2.3259 1.5485 1.2047 -0.1561 -0.2440 0.4280 76 PRO G CG 255 C CD . PRO A 33 ? 2.2341 1.4232 1.1650 -0.1557 -0.2708 0.3909 76 PRO G CD 256 N N . THR A 34 ? 2.2524 1.6570 1.1910 -0.0534 -0.1351 0.3996 77 THR G N 257 C CA . THR A 34 ? 2.1503 1.6373 1.1409 -0.0370 -0.1132 0.4062 77 THR G CA 258 C C . THR A 34 ? 2.2049 1.7831 1.2555 -0.0757 -0.1098 0.4452 77 THR G C 259 O O . THR A 34 ? 2.2772 1.8666 1.3037 -0.0990 -0.1058 0.4716 77 THR G O 260 C CB . THR A 34 ? 2.2377 1.7510 1.1787 0.0198 -0.0739 0.4002 77 THR G CB 261 O OG1 . THR A 34 ? 2.2805 1.6947 1.1564 0.0490 -0.0803 0.3646 77 THR G OG1 262 C CG2 . THR A 34 ? 2.2970 1.8979 1.2937 0.0435 -0.0553 0.4063 77 THR G CG2 263 N N . ASP A 35 ? 2.2614 1.9020 1.3847 -0.0863 -0.1124 0.4501 78 ASP G N 264 C CA . ASP A 35 ? 2.3304 2.0586 1.5122 -0.1288 -0.1110 0.4860 78 ASP G CA 265 C C . ASP A 35 ? 2.3981 2.2149 1.5591 -0.1175 -0.0711 0.5155 78 ASP G C 266 O O . ASP A 35 ? 2.4179 2.2923 1.5710 -0.0684 -0.0390 0.5091 78 ASP G O 267 C CB . ASP A 35 ? 2.3254 2.1199 1.5830 -0.1333 -0.1155 0.4840 78 ASP G CB 268 C CG . ASP A 35 ? 2.3095 2.0472 1.6075 -0.1708 -0.1564 0.4681 78 ASP G CG 269 O OD1 . ASP A 35 ? 2.2882 1.9598 1.5747 -0.2044 -0.1823 0.4698 78 ASP G OD1 270 O OD2 . ASP A 35 ? 2.2991 2.0596 1.6390 -0.1649 -0.1633 0.4537 78 ASP G OD2 271 N N . PRO A 36 ? 2.4472 2.2763 1.5978 -0.1624 -0.0728 0.5479 79 PRO G N 272 C CA . PRO A 36 ? 2.5070 2.4317 1.6370 -0.1566 -0.0306 0.5767 79 PRO G CA 273 C C . PRO A 36 ? 2.5326 2.5981 1.7374 -0.1523 -0.0064 0.5909 79 PRO G C 274 O O . PRO A 36 ? 2.6069 2.7619 1.8022 -0.1129 0.0349 0.5949 79 PRO G O 275 C CB . PRO A 36 ? 2.5157 2.4166 1.6258 -0.2194 -0.0457 0.6121 79 PRO G CB 276 C CG . PRO A 36 ? 2.4548 2.2801 1.6063 -0.2606 -0.0959 0.6059 79 PRO G CG 277 C CD . PRO A 36 ? 2.4082 2.1618 1.5580 -0.2169 -0.1122 0.5594 79 PRO G CD 278 N N . ASN A 37 ? 2.4587 2.5448 1.7370 -0.1898 -0.0331 0.5956 80 ASN G N 279 C CA . ASN A 37 ? 2.3886 2.6100 1.7438 -0.1919 -0.0177 0.6090 80 ASN G CA 280 C C . ASN A 37 ? 2.3040 2.5026 1.7111 -0.1863 -0.0475 0.5847 80 ASN G C 281 O O . ASN A 37 ? 2.2443 2.4243 1.6941 -0.2397 -0.0796 0.5908 80 ASN G O 282 C CB . ASN A 37 ? 2.3775 2.6756 1.7722 -0.2655 -0.0178 0.6521 80 ASN G CB 283 C CG . ASN A 37 ? 2.3463 2.8172 1.7822 -0.2590 0.0252 0.6766 80 ASN G CG 284 O OD1 . ASN A 37 ? 2.3742 2.8962 1.7770 -0.2046 0.0645 0.6708 80 ASN G OD1 285 N ND2 . ASN A 37 ? 2.2960 2.8592 1.8037 -0.3170 0.0176 0.7032 80 ASN G ND2 286 N N . PRO A 38 ? 2.2916 2.4876 1.6895 -0.1220 -0.0372 0.5571 81 PRO G N 287 C CA . PRO A 38 ? 2.2266 2.4028 1.6617 -0.1101 -0.0612 0.5342 81 PRO G CA 288 C C . PRO A 38 ? 2.2728 2.5718 1.7933 -0.1394 -0.0658 0.5542 81 PRO G C 289 O O . PRO A 38 ? 2.2959 2.7169 1.8458 -0.1435 -0.0392 0.5810 81 PRO G O 290 C CB . PRO A 38 ? 2.2068 2.3656 1.5987 -0.0317 -0.0406 0.5099 81 PRO G CB 291 C CG . PRO A 38 ? 2.2450 2.3604 1.5624 -0.0084 -0.0170 0.5086 81 PRO G CG 292 C CD . PRO A 38 ? 2.3242 2.5174 1.6603 -0.0554 -0.0030 0.5445 81 PRO G CD 293 N N . GLN A 39 ? 2.3436 2.6167 1.9027 -0.1624 -0.0983 0.5411 82 GLN G N 294 C CA . GLN A 39 ? 2.4989 2.8848 2.1363 -0.1894 -0.1071 0.5564 82 GLN G CA 295 C C . GLN A 39 ? 2.8278 3.2096 2.4822 -0.1549 -0.1226 0.5329 82 GLN G C 296 O O . GLN A 39 ? 2.8144 3.0974 2.4541 -0.1675 -0.1501 0.5085 82 GLN G O 297 C CB . GLN A 39 ? 2.3475 2.7173 2.0197 -0.2713 -0.1364 0.5706 82 GLN G CB 298 C CG . GLN A 39 ? 2.2455 2.6575 1.9153 -0.3165 -0.1212 0.6063 82 GLN G CG 299 C CD . GLN A 39 ? 2.0876 2.6709 1.8088 -0.3200 -0.0912 0.6365 82 GLN G CD 300 O OE1 . GLN A 39 ? 1.9870 2.6639 1.7535 -0.2876 -0.0857 0.6312 82 GLN G OE1 301 N NE2 . GLN A 39 ? 2.0597 2.6885 1.7731 -0.3596 -0.0721 0.6691 82 GLN G NE2 302 N N . GLU A 40 ? 3.1520 3.6400 2.8335 -0.1088 -0.1049 0.5395 83 GLU G N 311 N N . ILE A 41 ? 3.6414 4.5685 4.2569 -0.3474 -0.0050 0.9327 84 ILE G N 312 C CA . ILE A 41 ? 3.9195 4.9140 4.6336 -0.4133 -0.0562 0.9522 84 ILE G CA 313 C C . ILE A 41 ? 2.4885 3.5130 3.1895 -0.4009 -0.0845 0.9206 84 ILE G C 314 O O . ILE A 41 ? 2.4560 3.3862 3.0645 -0.3931 -0.1047 0.8506 84 ILE G O 315 C CB . ILE A 41 ? 1.8262 2.7276 2.5517 -0.4916 -0.1131 0.9223 84 ILE G CB 316 C CG1 . ILE A 41 ? 1.8409 2.6098 2.4625 -0.4893 -0.1426 0.8272 84 ILE G CG1 317 C CG2 . ILE A 41 ? 1.8449 2.7115 2.5873 -0.5074 -0.0924 0.9622 84 ILE G CG2 318 C CD1 . ILE A 41 ? 1.8812 2.5624 2.5173 -0.5610 -0.1999 0.7892 84 ILE G CD1 319 N N . HIS A 42 ? 2.4471 3.6064 3.2427 -0.3983 -0.0851 0.9755 85 HIS G N 320 C CA . HIS A 42 ? 2.4058 3.6027 3.2036 -0.3944 -0.1228 0.9594 85 HIS G CA 321 C C . HIS A 42 ? 2.3521 3.5948 3.2380 -0.4787 -0.1931 0.9743 85 HIS G C 322 O O . HIS A 42 ? 2.3419 3.6788 3.3474 -0.5159 -0.1954 1.0364 85 HIS G O 323 C CB . HIS A 42 ? 2.4787 3.7927 3.3222 -0.3235 -0.0811 1.0071 85 HIS G CB 324 C CG . HIS A 42 ? 2.6042 3.9646 3.4637 -0.3189 -0.1252 1.0038 85 HIS G CG 325 N ND1 . HIS A 42 ? 2.6872 3.9472 3.4347 -0.3154 -0.1567 0.9412 85 HIS G ND1 326 C CD2 . HIS A 42 ? 2.6529 4.1516 3.6287 -0.3176 -0.1447 1.0590 85 HIS G CD2 327 C CE1 . HIS A 42 ? 2.7310 4.0573 3.5152 -0.3146 -0.1969 0.9599 85 HIS G CE1 328 N NE2 . HIS A 42 ? 2.7104 4.1822 3.6361 -0.3129 -0.1925 1.0303 85 HIS G NE2 329 N N . LEU A 43 ? 2.3437 3.5216 3.1680 -0.5097 -0.2489 0.9186 86 LEU G N 330 C CA . LEU A 43 ? 2.3777 3.5881 3.2675 -0.5900 -0.3228 0.9242 86 LEU G CA 331 C C . LEU A 43 ? 2.3250 3.5823 3.2038 -0.5867 -0.3681 0.9201 86 LEU G C 332 O O . LEU A 43 ? 2.3496 3.5313 3.1118 -0.5572 -0.3688 0.8687 86 LEU G O 333 C CB . LEU A 43 ? 2.4707 3.5456 3.2942 -0.6501 -0.3605 0.8569 86 LEU G CB 334 C CG . LEU A 43 ? 2.4976 3.5254 3.3506 -0.6675 -0.3341 0.8699 86 LEU G CG 335 C CD1 . LEU A 43 ? 2.5531 3.4338 3.3335 -0.7131 -0.3706 0.7929 86 LEU G CD1 336 C CD2 . LEU A 43 ? 2.5004 3.6431 3.5041 -0.7144 -0.3449 0.9530 86 LEU G CD2 337 N N . GLU A 44 ? 2.2501 3.6329 3.2535 -0.6212 -0.4092 0.9774 87 GLU G N 338 C CA . GLU A 44 ? 2.2077 3.6412 3.2130 -0.6274 -0.4669 0.9817 87 GLU G CA 339 C C . GLU A 44 ? 2.1925 3.5137 3.0963 -0.6943 -0.5342 0.9113 87 GLU G C 340 O O . GLU A 44 ? 2.2441 3.4603 3.0969 -0.7316 -0.5330 0.8622 87 GLU G O 341 C CB . GLU A 44 ? 2.2265 3.8353 3.4079 -0.6437 -0.4929 1.0649 87 GLU G CB 342 C CG . GLU A 44 ? 2.2772 3.9471 3.4732 -0.6507 -0.5630 1.0773 87 GLU G CG 343 C CD . GLU A 44 ? 2.2626 4.0639 3.5453 -0.5711 -0.5325 1.1388 87 GLU G CD 344 O OE1 . GLU A 44 ? 2.2290 4.0213 3.4854 -0.4930 -0.4522 1.1425 87 GLU G OE1 345 O OE2 . GLU A 44 ? 2.2982 4.2097 3.6757 -0.5848 -0.5917 1.1814 87 GLU G OE2 346 N N . ASN A 45 ? 2.1170 3.4576 2.9868 -0.7061 -0.5919 0.9056 88 ASN G N 347 C CA . ASN A 45 ? 2.0770 3.3193 2.8383 -0.7692 -0.6566 0.8390 88 ASN G CA 348 C C . ASN A 45 ? 2.0442 3.1346 2.6321 -0.7526 -0.6272 0.7537 88 ASN G C 349 O O . ASN A 45 ? 2.1512 3.1538 2.6501 -0.8070 -0.6688 0.6906 88 ASN G O 350 C CB . ASN A 45 ? 2.0619 3.2990 2.8951 -0.8566 -0.7061 0.8338 88 ASN G CB 351 C CG . ASN A 45 ? 2.0295 3.4018 3.0007 -0.9042 -0.7761 0.8980 88 ASN G CG 352 O OD1 . ASN A 45 ? 2.1119 3.4911 3.0441 -0.9387 -0.8489 0.8860 88 ASN G OD1 353 N ND2 . ASN A 45 ? 1.9341 3.4181 3.0679 -0.9083 -0.7553 0.9684 88 ASN G ND2 354 N N . VAL A 46 ? 1.9018 2.9629 2.4432 -0.6785 -0.5549 0.7495 89 VAL G N 355 C CA . VAL A 46 ? 1.8577 2.7868 2.2494 -0.6623 -0.5243 0.6724 89 VAL G CA 356 C C . VAL A 46 ? 1.7905 2.7097 2.1045 -0.5947 -0.4908 0.6761 89 VAL G C 357 O O . VAL A 46 ? 1.7710 2.7689 2.1502 -0.5375 -0.4644 0.7342 89 VAL G O 358 C CB . VAL A 46 ? 1.7927 2.6503 2.1829 -0.6506 -0.4711 0.6408 89 VAL G CB 359 C CG1 . VAL A 46 ? 1.8099 2.5345 2.0678 -0.6659 -0.4649 0.5491 89 VAL G CG1 360 C CG2 . VAL A 46 ? 1.7846 2.6767 2.2894 -0.7029 -0.4947 0.6684 89 VAL G CG2 361 N N . THR A 47 ? 1.7636 2.5836 1.9383 -0.6027 -0.4911 0.6127 90 THR G N 362 C CA . THR A 47 ? 1.5604 2.3523 1.6470 -0.5508 -0.4658 0.6119 90 THR G CA 363 C C . THR A 47 ? 2.0413 2.7169 2.0152 -0.5416 -0.4192 0.5382 90 THR G C 364 O O . THR A 47 ? 2.0473 2.6586 1.9735 -0.5910 -0.4307 0.4770 90 THR G O 365 C CB . THR A 47 ? 1.8646 2.6680 1.8861 -0.5792 -0.5275 0.6220 90 THR G CB 366 O OG1 . THR A 47 ? 1.8692 2.7917 2.0066 -0.5778 -0.5735 0.6964 90 THR G OG1 367 C CG2 . THR A 47 ? 1.8445 2.5926 1.7563 -0.5340 -0.5006 0.6149 90 THR G CG2 368 N N . GLU A 48 ? 2.0035 2.6516 1.9422 -0.4786 -0.3666 0.5407 91 GLU G N 369 C CA . GLU A 48 ? 1.9597 2.5051 1.8048 -0.4729 -0.3241 0.4708 91 GLU G CA 370 C C . GLU A 48 ? 1.9612 2.4690 1.7207 -0.4313 -0.2997 0.4716 91 GLU G C 371 O O . GLU A 48 ? 1.9848 2.5358 1.7792 -0.3808 -0.2923 0.5254 91 GLU G O 372 C CB . GLU A 48 ? 1.8912 2.4199 1.7921 -0.4448 -0.2785 0.4600 91 GLU G CB 373 C CG . GLU A 48 ? 1.9136 2.3440 1.7374 -0.4434 -0.2428 0.3854 91 GLU G CG 374 C CD . GLU A 48 ? 1.9732 2.3589 1.7954 -0.4987 -0.2616 0.3276 91 GLU G CD 375 O OE1 . GLU A 48 ? 2.0170 2.4355 1.8763 -0.5471 -0.3086 0.3393 91 GLU G OE1 376 O OE2 . GLU A 48 ? 1.9728 2.2891 1.7597 -0.4929 -0.2318 0.2686 91 GLU G OE2 377 N N . ASN A 49 ? 1.9521 2.3781 1.6036 -0.4507 -0.2841 0.4117 92 ASN G N 378 C CA . ASN A 49 ? 1.9296 2.3119 1.5041 -0.4146 -0.2575 0.4139 92 ASN G CA 379 C C . ASN A 49 ? 1.7765 2.1137 1.3548 -0.3653 -0.1999 0.3907 92 ASN G C 380 O O . ASN A 49 ? 1.6063 1.9061 1.1868 -0.3774 -0.1762 0.3385 92 ASN G O 381 C CB . ASN A 49 ? 2.0476 2.3711 1.4980 -0.4641 -0.2677 0.3685 92 ASN G CB 382 C CG . ASN A 49 ? 2.2244 2.5825 1.6405 -0.5033 -0.3283 0.4020 92 ASN G CG 383 O OD1 . ASN A 49 ? 2.2792 2.7071 1.7759 -0.5117 -0.3701 0.4421 92 ASN G OD1 384 N ND2 . ASN A 49 ? 2.3491 2.6601 1.6446 -0.5306 -0.3352 0.3876 92 ASN G ND2 385 N N . PHE A 50 ? 1.7876 2.1255 1.3674 -0.3079 -0.1815 0.4287 93 PHE G N 386 C CA . PHE A 50 ? 1.7691 2.0571 1.3378 -0.2620 -0.1334 0.4061 93 PHE G CA 387 C C . PHE A 50 ? 1.8360 2.0560 1.3136 -0.2498 -0.1190 0.3937 93 PHE G C 388 O O . PHE A 50 ? 1.9626 2.1853 1.4047 -0.2471 -0.1431 0.4312 93 PHE G O 389 C CB . PHE A 50 ? 1.7708 2.1065 1.4161 -0.1973 -0.1168 0.4561 93 PHE G CB 390 C CG . PHE A 50 ? 1.7716 2.1661 1.5087 -0.2035 -0.1164 0.4696 93 PHE G CG 391 C CD1 . PHE A 50 ? 1.7828 2.2550 1.5860 -0.2353 -0.1543 0.5070 93 PHE G CD1 392 C CD2 . PHE A 50 ? 1.7435 2.1139 1.5003 -0.1812 -0.0820 0.4480 93 PHE G CD2 393 C CE1 . PHE A 50 ? 1.7544 2.2778 1.6451 -0.2474 -0.1544 0.5235 93 PHE G CE1 394 C CE2 . PHE A 50 ? 1.7148 2.1330 1.5509 -0.1905 -0.0824 0.4669 93 PHE G CE2 395 C CZ . PHE A 50 ? 1.7218 2.2158 1.6263 -0.2253 -0.1169 0.5051 93 PHE G CZ 396 N N . ASN A 51 ? 1.7897 1.9481 1.2343 -0.2427 -0.0829 0.3449 94 ASN G N 397 C CA . ASN A 51 ? 1.7904 1.8824 1.1623 -0.2279 -0.0654 0.3361 94 ASN G CA 398 C C . ASN A 51 ? 1.7042 1.7533 1.0878 -0.1815 -0.0290 0.3128 94 ASN G C 399 O O . ASN A 51 ? 1.6262 1.6434 1.0014 -0.2008 -0.0085 0.2588 94 ASN G O 400 C CB . ASN A 51 ? 1.8908 1.9462 1.1852 -0.2912 -0.0647 0.2910 94 ASN G CB 401 C CG . ASN A 51 ? 1.9692 1.9583 1.1864 -0.2908 -0.0484 0.2862 94 ASN G CG 402 O OD1 . ASN A 51 ? 1.9488 1.9078 1.1680 -0.2419 -0.0410 0.3126 94 ASN G OD1 403 N ND2 . ASN A 51 ? 2.0820 2.0454 1.2283 -0.3471 -0.0409 0.2510 94 ASN G ND2 404 N N . MET A 52 ? 1.7254 1.7726 1.1269 -0.1200 -0.0224 0.3500 95 MET G N 405 C CA . MET A 52 ? 1.6898 1.6949 1.0942 -0.0753 0.0072 0.3273 95 MET G CA 406 C C . MET A 52 ? 1.6298 1.5538 0.9695 -0.0897 0.0215 0.2847 95 MET G C 407 O O . MET A 52 ? 1.5989 1.4858 0.9396 -0.0704 0.0406 0.2512 95 MET G O 408 C CB . MET A 52 ? 1.7879 1.8037 1.2131 -0.0045 0.0132 0.3717 95 MET G CB 409 C CG . MET A 52 ? 1.5163 1.4921 0.8960 0.0185 0.0014 0.4003 95 MET G CG 410 S SD . MET A 52 ? 2.1899 2.1801 1.6062 0.1125 0.0199 0.4344 95 MET G SD 411 C CE . MET A 52 ? 2.3763 2.2740 1.7405 0.1314 0.0474 0.3779 95 MET G CE 412 N N . TRP A 53 ? 1.7286 1.6257 1.0113 -0.1252 0.0100 0.2899 96 TRP G N 413 C CA . TRP A 53 ? 1.8934 1.7191 1.1179 -0.1466 0.0245 0.2568 96 TRP G CA 414 C C . TRP A 53 ? 1.9833 1.8167 1.2114 -0.1998 0.0404 0.1982 96 TRP G C 415 O O . TRP A 53 ? 2.0232 1.8128 1.2268 -0.2186 0.0590 0.1606 96 TRP G O 416 C CB . TRP A 53 ? 2.0062 1.7971 1.1653 -0.1626 0.0070 0.2935 96 TRP G CB 417 C CG . TRP A 53 ? 2.1053 1.8939 1.2807 -0.0990 -0.0083 0.3459 96 TRP G CG 418 C CD1 . TRP A 53 ? 2.1800 2.0194 1.3785 -0.0825 -0.0355 0.3985 96 TRP G CD1 419 C CD2 . TRP A 53 ? 2.1660 1.8935 1.3335 -0.0418 0.0016 0.3486 96 TRP G CD2 420 N NE1 . TRP A 53 ? 2.1891 2.0114 1.4057 -0.0122 -0.0382 0.4332 96 TRP G NE1 421 C CE2 . TRP A 53 ? 2.1987 1.9461 1.3890 0.0139 -0.0151 0.4012 96 TRP G CE2 422 C CE3 . TRP A 53 ? 2.2529 1.9118 1.3990 -0.0315 0.0210 0.3088 96 TRP G CE3 423 C CZ2 . TRP A 53 ? 2.3148 2.0103 1.5005 0.0825 -0.0088 0.4113 96 TRP G CZ2 424 C CZ3 . TRP A 53 ? 2.3572 1.9602 1.4930 0.0319 0.0221 0.3195 96 TRP G CZ3 425 C CH2 . TRP A 53 ? 2.3917 2.0103 1.5437 0.0899 0.0094 0.3685 96 TRP G CH2 426 N N . LYS A 54 ? 2.0007 1.8907 1.2679 -0.2217 0.0330 0.1886 97 LYS G N 427 C CA . LYS A 54 ? 2.0274 1.9244 1.3083 -0.2632 0.0482 0.1280 97 LYS G CA 428 C C . LYS A 54 ? 1.9912 1.9260 1.3477 -0.2479 0.0441 0.1153 97 LYS G C 429 O O . LYS A 54 ? 2.0352 2.0007 1.4111 -0.2823 0.0349 0.0961 97 LYS G O 430 C CB . LYS A 54 ? 2.1013 2.0110 1.3285 -0.3249 0.0426 0.1167 97 LYS G CB 431 C CG . LYS A 54 ? 2.1957 2.0618 1.3417 -0.3507 0.0520 0.1245 97 LYS G CG 432 C CD . LYS A 54 ? 2.2919 2.1725 1.3707 -0.4132 0.0474 0.1154 97 LYS G CD 433 C CE . LYS A 54 ? 2.4024 2.2371 1.3933 -0.4443 0.0590 0.1295 97 LYS G CE 434 N NZ . LYS A 54 ? 2.4978 2.3455 1.4059 -0.5068 0.0558 0.1234 97 LYS G NZ 435 N N . ASN A 55 ? 1.9068 1.8319 1.2992 -0.1966 0.0497 0.1265 98 ASN G N 436 C CA . ASN A 55 ? 1.7859 1.7373 1.2437 -0.1774 0.0468 0.1239 98 ASN G CA 437 C C . ASN A 55 ? 1.8031 1.7201 1.2815 -0.1663 0.0607 0.0750 98 ASN G C 438 O O . ASN A 55 ? 1.8323 1.7151 1.2956 -0.1288 0.0685 0.0779 98 ASN G O 439 C CB . ASN A 55 ? 1.6862 1.6622 1.1654 -0.1258 0.0425 0.1823 98 ASN G CB 440 C CG . ASN A 55 ? 1.6296 1.6432 1.1723 -0.1164 0.0381 0.1952 98 ASN G CG 441 O OD1 . ASN A 55 ? 1.5820 1.5856 1.1529 -0.1372 0.0368 0.1571 98 ASN G OD1 442 N ND2 . ASN A 55 ? 1.6794 1.7395 1.2508 -0.0867 0.0352 0.2514 98 ASN G ND2 443 N N . ASN A 56 ? 1.8372 1.7608 1.3512 -0.1964 0.0604 0.0293 99 ASN G N 444 C CA . ASN A 56 ? 1.8580 1.7551 1.4054 -0.1857 0.0680 -0.0187 99 ASN G CA 445 C C . ASN A 56 ? 1.7153 1.5976 1.2857 -0.1345 0.0621 0.0033 99 ASN G C 446 O O . ASN A 56 ? 1.7839 1.6355 1.3657 -0.1168 0.0636 -0.0278 99 ASN G O 447 C CB . ASN A 56 ? 1.9703 1.8802 1.5645 -0.2177 0.0639 -0.0645 99 ASN G CB 448 C CG . ASN A 56 ? 2.0423 1.9296 1.6794 -0.2083 0.0701 -0.1190 99 ASN G CG 449 O OD1 . ASN A 56 ? 2.0925 1.9732 1.7208 -0.2267 0.0883 -0.1619 99 ASN G OD1 450 N ND2 . ASN A 56 ? 2.0042 1.8820 1.6908 -0.1799 0.0539 -0.1138 99 ASN G ND2 451 N N . MET A 57 ? 1.5029 1.4109 1.0799 -0.1116 0.0549 0.0577 100 MET G N 452 C CA . MET A 57 ? 1.4445 1.3424 1.0305 -0.0644 0.0541 0.0828 100 MET G CA 453 C C . MET A 57 ? 1.5267 1.3814 1.0614 -0.0285 0.0633 0.0781 100 MET G C 454 O O . MET A 57 ? 1.6604 1.4852 1.1898 0.0037 0.0605 0.0701 100 MET G O 455 C CB . MET A 57 ? 1.3543 1.2988 0.9548 -0.0471 0.0533 0.1465 100 MET G CB 456 C CG . MET A 57 ? 1.2872 1.2743 0.9393 -0.0865 0.0389 0.1586 100 MET G CG 457 S SD . MET A 57 ? 1.7260 1.7831 1.4089 -0.0692 0.0395 0.2391 100 MET G SD 458 C CE . MET A 57 ? 2.1108 2.1588 1.8042 -0.0242 0.0514 0.2658 100 MET G CE 459 N N . VAL A 58 ? 1.5248 1.3691 1.0175 -0.0366 0.0701 0.0822 101 VAL G N 460 C CA . VAL A 58 ? 1.5243 1.3168 0.9669 -0.0081 0.0752 0.0761 101 VAL G CA 461 C C . VAL A 58 ? 1.5245 1.2791 0.9758 -0.0215 0.0720 0.0205 101 VAL G C 462 O O . VAL A 58 ? 1.5585 1.2700 0.9872 0.0104 0.0671 0.0098 101 VAL G O 463 C CB . VAL A 58 ? 1.5885 1.3710 0.9882 -0.0227 0.0788 0.0933 101 VAL G CB 464 C CG1 . VAL A 58 ? 2.2398 1.9545 1.5943 -0.0202 0.0810 0.0671 101 VAL G CG1 465 C CG2 . VAL A 58 ? 1.6065 1.4127 0.9953 0.0170 0.0793 0.1507 101 VAL G CG2 466 N N . GLU A 59 ? 1.6042 1.3779 1.0907 -0.0682 0.0740 -0.0172 102 GLU G N 467 C CA . GLU A 59 ? 1.7095 1.4630 1.2224 -0.0834 0.0734 -0.0716 102 GLU G CA 468 C C . GLU A 59 ? 1.6905 1.4362 1.2415 -0.0515 0.0563 -0.0815 102 GLU G C 469 O O . GLU A 59 ? 1.7067 1.4192 1.2580 -0.0345 0.0455 -0.1052 102 GLU G O 470 C CB . GLU A 59 ? 1.7375 1.5232 1.2857 -0.1357 0.0851 -0.1122 102 GLU G CB 471 C CG . GLU A 59 ? 1.8493 1.6543 1.3554 -0.1734 0.0980 -0.0946 102 GLU G CG 472 C CD . GLU A 59 ? 2.0513 1.8250 1.4981 -0.1872 0.1083 -0.0841 102 GLU G CD 473 O OE1 . GLU A 59 ? 2.1129 1.8600 1.5657 -0.1930 0.1140 -0.1146 102 GLU G OE1 474 O OE2 . GLU A 59 ? 2.1211 1.8963 1.5190 -0.1946 0.1072 -0.0435 102 GLU G OE2 475 N N . GLN A 60 ? 1.7188 1.4921 1.2988 -0.0448 0.0498 -0.0588 103 GLN G N 476 C CA . GLN A 60 ? 1.8260 1.5876 1.4389 -0.0183 0.0308 -0.0617 103 GLN G CA 477 C C . GLN A 60 ? 1.7970 1.5254 1.3583 0.0311 0.0238 -0.0327 103 GLN G C 478 O O . GLN A 60 ? 1.7902 1.4864 1.3535 0.0515 0.0048 -0.0534 103 GLN G O 479 C CB . GLN A 60 ? 2.0055 1.7980 1.6585 -0.0277 0.0249 -0.0371 103 GLN G CB 480 C CG . GLN A 60 ? 2.1010 1.8762 1.7893 -0.0061 0.0022 -0.0342 103 GLN G CG 481 C CD . GLN A 60 ? 2.1242 1.9012 1.8870 -0.0321 -0.0115 -0.0787 103 GLN G CD 482 O OE1 . GLN A 60 ? 2.0400 1.8402 1.8270 -0.0683 -0.0019 -0.1001 103 GLN G OE1 483 N NE2 . GLN A 60 ? 2.1947 1.9437 1.9913 -0.0113 -0.0363 -0.0944 103 GLN G NE2 484 N N . MET A 61 ? 1.7235 1.4598 1.2367 0.0519 0.0383 0.0130 104 MET G N 485 C CA . MET A 61 ? 1.6446 1.3488 1.0979 0.1020 0.0387 0.0362 104 MET G CA 486 C C . MET A 61 ? 1.5716 1.2202 0.9899 0.1075 0.0295 -0.0038 104 MET G C 487 O O . MET A 61 ? 1.7092 1.3176 1.0955 0.1376 0.0138 -0.0142 104 MET G O 488 C CB . MET A 61 ? 1.3609 1.0909 0.7810 0.1252 0.0600 0.0870 104 MET G CB 489 C CG . MET A 61 ? 1.4142 1.1167 0.7706 0.1818 0.0677 0.1091 104 MET G CG 490 S SD . MET A 61 ? 2.0825 1.8341 1.4241 0.2139 0.0972 0.1690 104 MET G SD 491 C CE . MET A 61 ? 1.8692 1.5818 1.1285 0.2854 0.1110 0.1800 104 MET G CE 492 N N . GLN A 62 ? 1.5138 1.1592 0.9361 0.0741 0.0371 -0.0251 105 GLN G N 493 C CA . GLN A 62 ? 1.5350 1.1302 0.9353 0.0674 0.0283 -0.0620 105 GLN G CA 494 C C . GLN A 62 ? 1.5166 1.1001 0.9589 0.0642 0.0034 -0.1040 105 GLN G C 495 O O . GLN A 62 ? 1.6261 1.1602 1.0352 0.0853 -0.0161 -0.1210 105 GLN G O 496 C CB . GLN A 62 ? 1.6275 1.2305 1.0385 0.0187 0.0421 -0.0779 105 GLN G CB 497 C CG . GLN A 62 ? 1.6482 1.2022 1.0473 0.0031 0.0331 -0.1138 105 GLN G CG 498 C CD . GLN A 62 ? 1.7094 1.1950 1.0304 0.0384 0.0272 -0.0952 105 GLN G CD 499 O OE1 . GLN A 62 ? 1.7227 1.2001 1.0004 0.0846 0.0308 -0.0604 105 GLN G OE1 500 N NE2 . GLN A 62 ? 1.7445 1.1799 1.0509 0.0173 0.0184 -0.1206 105 GLN G NE2 501 N N . GLU A 63 ? 1.5060 1.1320 1.0233 0.0375 0.0009 -0.1241 106 GLU G N 502 C CA . GLU A 63 ? 1.6021 1.2233 1.1755 0.0374 -0.0261 -0.1638 106 GLU G CA 503 C C . GLU A 63 ? 1.6197 1.2098 1.1600 0.0831 -0.0532 -0.1439 106 GLU G C 504 O O . GLU A 63 ? 1.7128 1.2748 1.2620 0.0945 -0.0844 -0.1709 106 GLU G O 505 C CB . GLU A 63 ? 1.7652 1.4334 1.4273 0.0095 -0.0240 -0.1886 106 GLU G CB 506 C CG . GLU A 63 ? 1.9449 1.6496 1.6421 -0.0393 0.0043 -0.2187 106 GLU G CG 507 C CD . GLU A 63 ? 2.0164 1.7617 1.7855 -0.0591 0.0092 -0.2407 106 GLU G CD 508 O OE1 . GLU A 63 ? 2.0261 1.8026 1.8071 -0.0979 0.0361 -0.2608 106 GLU G OE1 509 O OE2 . GLU A 63 ? 2.0206 1.7601 1.8286 -0.0360 -0.0154 -0.2384 106 GLU G OE2 510 N N . ASP A 64 ? 1.5754 1.1723 1.0748 0.1080 -0.0421 -0.0947 107 ASP G N 511 C CA . ASP A 64 ? 1.5453 1.1132 0.9995 0.1501 -0.0627 -0.0709 107 ASP G CA 512 C C . ASP A 64 ? 1.5906 1.1037 0.9577 0.1826 -0.0703 -0.0751 107 ASP G C 513 O O . ASP A 64 ? 1.5963 1.0716 0.9426 0.2000 -0.1033 -0.0934 107 ASP G O 514 C CB . ASP A 64 ? 1.5182 1.1141 0.9510 0.1667 -0.0428 -0.0136 107 ASP G CB 515 C CG . ASP A 64 ? 1.6414 1.2735 1.1514 0.1410 -0.0482 -0.0063 107 ASP G CG 516 O OD1 . ASP A 64 ? 1.6441 1.2759 1.2215 0.1182 -0.0678 -0.0499 107 ASP G OD1 517 O OD2 . ASP A 64 ? 1.7083 1.3711 1.2178 0.1424 -0.0319 0.0409 107 ASP G OD2 518 N N . VAL A 65 ? 1.5211 1.0256 0.8383 0.1901 -0.0436 -0.0610 108 VAL G N 519 C CA . VAL A 65 ? 1.5961 1.0382 0.8271 0.2228 -0.0500 -0.0693 108 VAL G CA 520 C C . VAL A 65 ? 1.6875 1.0866 0.9341 0.2019 -0.0835 -0.1226 108 VAL G C 521 O O . VAL A 65 ? 1.6934 1.0334 0.8778 0.2283 -0.1109 -0.1397 108 VAL G O 522 C CB . VAL A 65 ? 1.6904 1.1303 0.8811 0.2335 -0.0172 -0.0459 108 VAL G CB 523 C CG1 . VAL A 65 ? 1.8177 1.1805 0.9145 0.2729 -0.0240 -0.0585 108 VAL G CG1 524 C CG2 . VAL A 65 ? 1.5864 1.0806 0.7758 0.2551 0.0120 0.0077 108 VAL G CG2 525 N N . ILE A 66 ? 1.6956 1.1278 1.0272 0.1536 -0.0831 -0.1503 109 ILE G N 526 C CA . ILE A 66 ? 1.7889 1.1975 1.1568 0.1293 -0.1133 -0.1991 109 ILE G CA 527 C C . ILE A 66 ? 1.7765 1.1827 1.1746 0.1440 -0.1562 -0.2167 109 ILE G C 528 O O . ILE A 66 ? 1.7366 1.0973 1.1135 0.1519 -0.1955 -0.2443 109 ILE G O 529 C CB . ILE A 66 ? 1.6313 1.0890 1.0881 0.0736 -0.0945 -0.2239 109 ILE G CB 530 C CG1 . ILE A 66 ? 1.6474 1.0878 1.0608 0.0549 -0.0643 -0.2097 109 ILE G CG1 531 C CG2 . ILE A 66 ? 1.6054 1.0645 1.1307 0.0475 -0.1241 -0.2730 109 ILE G CG2 532 C CD1 . ILE A 66 ? 1.6907 1.1743 1.1702 -0.0024 -0.0423 -0.2308 109 ILE G CD1 533 N N . SER A 67 ? 1.8134 1.2594 1.2475 0.1519 -0.1530 -0.1945 110 SER G N 534 C CA . SER A 67 ? 1.8351 1.2762 1.2955 0.1693 -0.1954 -0.2001 110 SER G CA 535 C C . SER A 67 ? 1.9387 1.3195 1.2841 0.2151 -0.2187 -0.1790 110 SER G C 536 O O . SER A 67 ? 1.8560 1.2032 1.1911 0.2264 -0.2666 -0.2006 110 SER G O 537 C CB . SER A 67 ? 1.7895 1.2766 1.3095 0.1650 -0.1848 -0.1758 110 SER G CB 538 O OG . SER A 67 ? 1.9483 1.4213 1.4864 0.1852 -0.2284 -0.1718 110 SER G OG 539 N N . LEU A 68 ? 2.0212 1.3912 1.2801 0.2414 -0.1844 -0.1392 111 LEU G N 540 C CA . LEU A 68 ? 2.0633 1.3815 1.2011 0.2881 -0.1931 -0.1185 111 LEU G CA 541 C C . LEU A 68 ? 2.1893 1.4386 1.2640 0.2972 -0.2220 -0.1589 111 LEU G C 542 O O . LEU A 68 ? 2.4169 1.6162 1.4209 0.3229 -0.2615 -0.1680 111 LEU G O 543 C CB . LEU A 68 ? 1.9885 1.3232 1.0658 0.3126 -0.1399 -0.0731 111 LEU G CB 544 C CG . LEU A 68 ? 2.0267 1.3277 0.9784 0.3654 -0.1262 -0.0435 111 LEU G CG 545 C CD1 . LEU A 68 ? 2.0112 1.3304 0.9439 0.3801 -0.1324 -0.0029 111 LEU G CD1 546 C CD2 . LEU A 68 ? 1.9812 1.3072 0.9075 0.3831 -0.0713 -0.0149 111 LEU G CD2 547 N N . TRP A 69 ? 2.0847 1.3269 1.1831 0.2723 -0.2065 -0.1830 112 TRP G N 548 C CA . TRP A 69 ? 2.0727 1.2409 1.1129 0.2758 -0.2342 -0.2204 112 TRP G CA 549 C C . TRP A 69 ? 2.0748 1.2379 1.1828 0.2469 -0.2902 -0.2637 112 TRP G C 550 O O . TRP A 69 ? 2.0371 1.1363 1.0976 0.2496 -0.3293 -0.2959 112 TRP G O 551 C CB . TRP A 69 ? 2.0613 1.2161 1.1056 0.2549 -0.2027 -0.2267 112 TRP G CB 552 C CG . TRP A 69 ? 1.9919 1.1162 0.9396 0.2983 -0.1665 -0.1973 112 TRP G CG 553 C CD1 . TRP A 69 ? 1.9838 1.1556 0.9155 0.3263 -0.1265 -0.1507 112 TRP G CD1 554 C CD2 . TRP A 69 ? 2.0602 1.1004 0.9185 0.3224 -0.1677 -0.2130 112 TRP G CD2 555 N NE1 . TRP A 69 ? 2.0947 1.2272 0.9401 0.3688 -0.0992 -0.1366 112 TRP G NE1 556 C CE2 . TRP A 69 ? 2.1723 1.2182 0.9676 0.3698 -0.1243 -0.1759 112 TRP G CE2 557 C CE3 . TRP A 69 ? 2.1358 1.0950 0.9662 0.3079 -0.2027 -0.2553 112 TRP G CE3 558 C CZ2 . TRP A 69 ? 2.2685 1.2398 0.9739 0.4091 -0.1134 -0.1830 112 TRP G CZ2 559 C CZ3 . TRP A 69 ? 2.2810 1.1558 1.0152 0.3426 -0.1953 -0.2617 112 TRP G CZ3 560 C CH2 . TRP A 69 ? 2.3229 1.2030 0.9952 0.3958 -0.1501 -0.2272 112 TRP G CH2 561 N N . ASP A 70 ? 2.2150 1.4455 1.4386 0.2204 -0.2967 -0.2665 113 ASP G N 562 C CA . ASP A 70 ? 2.4636 1.7023 1.7713 0.1953 -0.3488 -0.3084 113 ASP G CA 563 C C . ASP A 70 ? 2.6383 1.8445 1.9071 0.2262 -0.4105 -0.3100 113 ASP G C 564 O O . ASP A 70 ? 2.7131 1.9080 2.0251 0.2128 -0.4652 -0.3460 113 ASP G O 565 C CB . ASP A 70 ? 2.4880 1.8123 1.9415 0.1595 -0.3314 -0.3173 113 ASP G CB 566 C CG . ASP A 70 ? 2.6266 1.9781 2.1922 0.1333 -0.3769 -0.3623 113 ASP G CG 567 O OD1 . ASP A 70 ? 2.5676 1.9905 2.2580 0.1066 -0.3616 -0.3785 113 ASP G OD1 568 O OD2 . ASP A 70 ? 2.7929 2.0956 2.3234 0.1386 -0.4273 -0.3845 113 ASP G OD2 569 N N . GLN A 71 ? 2.7164 1.9103 1.9054 0.2650 -0.4037 -0.2685 114 GLN G N 570 C CA . GLN A 71 ? 2.8959 2.0563 2.0324 0.2943 -0.4608 -0.2601 114 GLN G CA 571 C C . GLN A 71 ? 3.0821 2.1683 2.0413 0.3380 -0.4609 -0.2423 114 GLN G C 572 O O . GLN A 71 ? 3.2910 2.3376 2.1756 0.3631 -0.5089 -0.2350 114 GLN G O 573 C CB . GLN A 71 ? 2.9268 2.1365 2.1365 0.2968 -0.4649 -0.2281 114 GLN G CB 574 C CG . GLN A 71 ? 2.9329 2.2042 2.3127 0.2630 -0.4810 -0.2582 114 GLN G CG 575 C CD . GLN A 71 ? 2.9638 2.2685 2.4058 0.2703 -0.4840 -0.2262 114 GLN G CD 576 O OE1 . GLN A 71 ? 3.0080 2.3066 2.3839 0.2874 -0.4533 -0.1767 114 GLN G OE1 577 N NE2 . GLN A 71 ? 2.9290 2.2688 2.5038 0.2579 -0.5223 -0.2540 114 GLN G NE2 578 N N . CYS A 72 ? 3.1359 2.2019 2.0261 0.3484 -0.4086 -0.2370 115 CYS G N 584 N N . LEU A 73 ? 3.4374 2.1986 1.8118 0.3817 -0.2561 0.1437 116 LEU G N 585 C CA . LEU A 73 ? 3.1343 1.9317 1.5175 0.3720 -0.2952 0.1436 116 LEU G CA 586 C C . LEU A 73 ? 2.9758 1.8125 1.4079 0.3784 -0.3171 0.1462 116 LEU G C 587 O O . LEU A 73 ? 2.8507 1.7347 1.3153 0.3589 -0.3359 0.1414 116 LEU G O 588 C CB . LEU A 73 ? 2.9897 1.8151 1.3834 0.3356 -0.2891 0.1342 116 LEU G CB 589 C CG . LEU A 73 ? 2.9748 1.7681 1.3332 0.3252 -0.2730 0.1303 116 LEU G CG 590 C CD1 . LEU A 73 ? 3.0709 1.8287 1.3921 0.3461 -0.2918 0.1313 116 LEU G CD1 591 C CD2 . LEU A 73 ? 3.0332 1.7928 1.3652 0.3234 -0.2266 0.1238 116 LEU G CD2 592 N N . GLN A 74 ? 3.0263 1.8426 1.4699 0.4054 -0.3141 0.1568 117 GLN G N 593 C CA . GLN A 74 ? 3.0949 1.9423 1.5900 0.4165 -0.3351 0.1603 117 GLN G CA 594 C C . GLN A 74 ? 3.1396 2.0093 1.6199 0.4199 -0.3830 0.1666 117 GLN G C 595 O O . GLN A 74 ? 3.2254 2.0713 1.6593 0.4338 -0.4028 0.1779 117 GLN G O 596 C CB . GLN A 74 ? 3.2030 2.0191 1.7178 0.4486 -0.3325 0.1810 117 GLN G CB 597 C CG . GLN A 74 ? 3.2334 2.0761 1.8223 0.4602 -0.3423 0.1825 117 GLN G CG 598 C CD . GLN A 74 ? 3.2297 2.0873 1.8865 0.4438 -0.2964 0.1555 117 GLN G CD 599 O OE1 . GLN A 74 ? 3.2295 2.1057 1.8759 0.4107 -0.2666 0.1289 117 GLN G OE1 600 N NE2 . GLN A 74 ? 3.2068 2.0615 1.9410 0.4628 -0.2891 0.1607 117 GLN G NE2 601 N N . PRO A 75 ? 3.0774 1.9970 1.5990 0.4033 -0.3999 0.1570 118 PRO G N 602 C CA . PRO A 75 ? 3.1109 2.0570 1.6357 0.4040 -0.4424 0.1594 118 PRO G CA 603 C C . PRO A 75 ? 3.2040 2.1584 1.7429 0.4310 -0.4750 0.1704 118 PRO G C 604 O O . PRO A 75 ? 3.2749 2.2239 1.8414 0.4463 -0.4660 0.1775 118 PRO G O 605 C CB . PRO A 75 ? 3.0876 2.0870 1.6580 0.3707 -0.4439 0.1498 118 PRO G CB 606 C CG . PRO A 75 ? 3.0612 2.0736 1.6599 0.3596 -0.4101 0.1396 118 PRO G CG 607 C CD . PRO A 75 ? 3.0584 2.0178 1.6258 0.3743 -0.3753 0.1403 118 PRO G CD 608 N N . CYS A 76 ? 3.2111 2.1820 1.7422 0.4345 -0.5109 0.1703 119 CYS G N 609 C CA . CYS A 76 ? 3.2189 2.2050 1.7613 0.4564 -0.5446 0.1809 119 CYS G CA 610 C C . CYS A 76 ? 3.1247 2.1499 1.7318 0.4543 -0.5519 0.1765 119 CYS G C 611 O O . CYS A 76 ? 3.1292 2.1586 1.7636 0.4744 -0.5631 0.1875 119 CYS G O 612 C CB . CYS A 76 ? 3.2316 2.2318 1.7516 0.4546 -0.5760 0.1736 119 CYS G CB 613 S SG . CYS A 76 ? 4.5035 3.4649 2.9467 0.4505 -0.5647 0.1705 119 CYS G SG 614 N N . VAL A 77 ? 3.0459 2.1042 1.6826 0.4270 -0.5478 0.1626 120 VAL G N 615 C CA . VAL A 77 ? 2.9970 2.0979 1.6911 0.4169 -0.5501 0.1554 120 VAL G CA 616 C C . VAL A 77 ? 2.9222 2.0530 1.6358 0.3760 -0.5230 0.1443 120 VAL G C 617 O O . VAL A 77 ? 2.8179 1.9499 1.5142 0.3543 -0.5198 0.1472 120 VAL G O 618 C CB . VAL A 77 ? 2.6503 1.7872 1.3701 0.4213 -0.5927 0.1554 120 VAL G CB 619 C CG1 . VAL A 77 ? 2.5880 1.7729 1.3652 0.4058 -0.5952 0.1469 120 VAL G CG1 620 C CG2 . VAL A 77 ? 2.7770 1.8964 1.4759 0.4545 -0.6196 0.1660 120 VAL G CG2 621 N N . LYS A 78 ? 2.9459 2.1067 1.7007 0.3612 -0.5035 0.1312 121 LYS G N 622 C CA . LYS A 78 ? 2.9528 2.1579 1.7230 0.3124 -0.4784 0.1194 121 LYS G CA 623 C C . LYS A 78 ? 3.0382 2.3086 1.8551 0.2858 -0.4947 0.1125 121 LYS G C 624 O O . LYS A 78 ? 3.0059 2.2860 1.8596 0.2998 -0.4948 0.0995 121 LYS G O 625 C CB . LYS A 78 ? 2.9316 2.1261 1.7084 0.3007 -0.4263 0.0990 121 LYS G CB 626 C CG . LYS A 78 ? 2.9305 2.0663 1.6639 0.3170 -0.4011 0.1042 121 LYS G CG 627 C CD . LYS A 78 ? 2.9320 2.0589 1.6965 0.3113 -0.3490 0.0799 121 LYS G CD 628 C CE . LYS A 78 ? 2.9485 2.0150 1.6765 0.3292 -0.3216 0.0862 121 LYS G CE 629 N NZ . LYS A 78 ? 2.9673 2.0157 1.7457 0.3355 -0.2745 0.0657 121 LYS G NZ 630 N N . LEU A 79 ? 3.1554 2.4728 1.9776 0.2455 -0.5093 0.1239 122 LEU G N 631 C CA . LEU A 79 ? 3.2524 2.6400 2.1168 0.2107 -0.5238 0.1213 122 LEU G CA 632 C C . LEU A 79 ? 3.4096 2.8517 2.2740 0.1482 -0.4889 0.1109 122 LEU G C 633 O O . LEU A 79 ? 3.4094 2.8811 2.2642 0.1102 -0.4968 0.1336 122 LEU G O 634 C CB . LEU A 79 ? 3.1840 2.5963 2.0684 0.2055 -0.5714 0.1486 122 LEU G CB 635 C CG . LEU A 79 ? 3.1216 2.4979 2.0113 0.2549 -0.6075 0.1542 122 LEU G CG 636 C CD1 . LEU A 79 ? 3.0700 2.4238 1.9546 0.2587 -0.6253 0.1724 122 LEU G CD1 637 C CD2 . LEU A 79 ? 3.0961 2.5194 2.0329 0.2507 -0.6385 0.1548 122 LEU G CD2 638 N N . THR A 80 ? 3.5607 3.0217 2.4436 0.1333 -0.4502 0.0760 123 THR G N 639 C CA . THR A 80 ? 3.6451 3.1651 2.5258 0.0670 -0.4093 0.0557 123 THR G CA 640 C C . THR A 80 ? 3.6688 3.2815 2.5800 0.0096 -0.4190 0.0498 123 THR G C 641 O O . THR A 80 ? 3.6885 3.3643 2.6066 -0.0508 -0.3802 0.0196 123 THR G O 642 C CB . THR A 80 ? 3.6817 3.1756 2.5757 0.0737 -0.3507 0.0116 123 THR G CB 643 O OG1 . THR A 80 ? 3.6938 3.1846 2.6427 0.0988 -0.3454 -0.0151 123 THR G OG1 644 C CG2 . THR A 80 ? 3.7061 3.1125 2.5679 0.1253 -0.3420 0.0232 123 THR G CG2 645 N N . GLY A 81 ? 3.6509 3.2756 2.5810 0.0246 -0.4690 0.0766 124 GLY G N 646 C CA . GLY A 81 ? 3.5877 3.2983 2.5478 -0.0264 -0.4859 0.0784 124 GLY G CA 647 C C . GLY A 81 ? 3.5328 3.2636 2.5310 -0.0273 -0.4591 0.0300 124 GLY G C 648 O O . GLY A 81 ? 3.5271 3.2885 2.5569 -0.0270 -0.4866 0.0319 124 GLY G O 649 N N . GLY A 82 ? 3.4524 3.1667 2.4579 -0.0294 -0.4038 -0.0150 198 GLY G N 650 C CA . GLY A 82 ? 3.3154 3.0429 2.3777 -0.0282 -0.3711 -0.0665 198 GLY G CA 651 C C . GLY A 82 ? 3.1960 2.8393 2.2897 0.0572 -0.3864 -0.0647 198 GLY G C 652 O O . GLY A 82 ? 3.2051 2.8552 2.3577 0.0716 -0.3817 -0.0916 198 GLY G O 653 N N . SER A 83 ? 3.0838 2.6524 2.1399 0.1099 -0.4050 -0.0320 199 SER G N 654 C CA . SER A 83 ? 2.9686 2.4629 2.0429 0.1852 -0.4245 -0.0205 199 SER G CA 655 C C . SER A 83 ? 2.8244 2.2640 1.8396 0.2258 -0.4647 0.0246 199 SER G C 656 O O . SER A 83 ? 2.7816 2.2300 1.7516 0.2005 -0.4696 0.0433 199 SER G O 657 C CB . SER A 83 ? 3.0076 2.4611 2.1241 0.2051 -0.3754 -0.0495 199 SER G CB 658 O OG . SER A 83 ? 3.0280 2.4572 2.1019 0.1927 -0.3449 -0.0478 199 SER G OG 659 N N . VAL A 84 ? 2.7630 2.1524 1.7837 0.2845 -0.4936 0.0412 200 VAL G N 660 C CA . VAL A 84 ? 2.7319 2.0723 1.6983 0.3201 -0.5262 0.0750 200 VAL G CA 661 C C . VAL A 84 ? 2.7108 1.9881 1.6762 0.3709 -0.5231 0.0846 200 VAL G C 662 O O . VAL A 84 ? 2.6646 1.9342 1.6613 0.4038 -0.5475 0.0917 200 VAL G O 663 C CB . VAL A 84 ? 2.9586 2.3185 1.9247 0.3314 -0.5788 0.0928 200 VAL G CB 664 C CG1 . VAL A 84 ? 2.9630 2.2775 1.8802 0.3624 -0.6053 0.1166 200 VAL G CG1 665 C CG2 . VAL A 84 ? 2.9018 2.3275 1.8807 0.2800 -0.5875 0.0934 200 VAL G CG2 666 N N . ILE A 85 ? 2.7710 2.0065 1.7031 0.3754 -0.4958 0.0893 201 ILE G N 667 C CA . ILE A 85 ? 2.8761 2.0570 1.8164 0.4180 -0.4911 0.1041 201 ILE G CA 668 C C . ILE A 85 ? 2.8927 2.0296 1.7622 0.4458 -0.5200 0.1362 201 ILE G C 669 O O . ILE A 85 ? 2.8337 1.9595 1.6472 0.4309 -0.5151 0.1387 201 ILE G O 670 C CB . ILE A 85 ? 2.7419 1.9040 1.7125 0.4066 -0.4339 0.0845 201 ILE G CB 671 C CG1 . ILE A 85 ? 2.7874 1.8966 1.7883 0.4503 -0.4322 0.1075 201 ILE G CG1 672 C CG2 . ILE A 85 ? 2.4590 1.6144 1.3684 0.3774 -0.4087 0.0801 201 ILE G CG2 673 C CD1 . ILE A 85 ? 2.7400 1.8597 1.8508 0.4643 -0.4222 0.0961 201 ILE G CD1 674 N N . LYS A 86 ? 2.9556 2.0706 1.8316 0.4826 -0.5481 0.1604 202 LYS G N 675 C CA . LYS A 86 ? 3.0183 2.1000 1.8252 0.5014 -0.5719 0.1875 202 LYS G CA 676 C C . LYS A 86 ? 3.0728 2.1085 1.8776 0.5152 -0.5438 0.2039 202 LYS G C 677 O O . LYS A 86 ? 3.0598 2.0904 1.9364 0.5222 -0.5196 0.2012 202 LYS G O 678 C CB . LYS A 86 ? 3.0347 2.1294 1.8415 0.5250 -0.6209 0.2083 202 LYS G CB 679 C CG . LYS A 86 ? 3.0540 2.1358 1.7823 0.5292 -0.6470 0.2234 202 LYS G CG 680 C CD . LYS A 86 ? 3.0084 2.1235 1.7218 0.5138 -0.6697 0.2031 202 LYS G CD 681 C CE . LYS A 86 ? 3.0538 2.1541 1.6970 0.5076 -0.6774 0.2029 202 LYS G CE 682 N NZ . LYS A 86 ? 3.1399 2.2296 1.7453 0.5239 -0.6979 0.2308 202 LYS G NZ 683 N N . GLN A 87 ? 3.1032 2.1069 1.8349 0.5165 -0.5439 0.2180 203 GLN G N 684 C CA . GLN A 87 ? 3.1380 2.0968 1.8600 0.5281 -0.5192 0.2377 203 GLN G CA 685 C C . GLN A 87 ? 3.1903 2.1234 1.8207 0.5280 -0.5319 0.2541 203 GLN G C 686 O O . GLN A 87 ? 3.1048 2.0533 1.6875 0.5144 -0.5487 0.2397 203 GLN G O 687 C CB . GLN A 87 ? 3.0966 2.0458 1.8480 0.5089 -0.4645 0.2102 203 GLN G CB 688 C CG . GLN A 87 ? 3.0542 2.0150 1.7541 0.4775 -0.4500 0.1849 203 GLN G CG 689 C CD . GLN A 87 ? 3.0248 1.9839 1.7454 0.4524 -0.3969 0.1592 203 GLN G CD 690 O OE1 . GLN A 87 ? 3.0893 2.0440 1.8745 0.4558 -0.3654 0.1495 203 GLN G OE1 691 N NE2 . GLN A 87 ? 2.9189 1.8854 1.5932 0.4242 -0.3856 0.1465 203 GLN G NE2 692 N N . ALA A 88 ? 3.3548 2.2516 1.9700 0.5414 -0.5239 0.2842 204 ALA G N 693 C CA . ALA A 88 ? 3.5132 2.3879 2.0395 0.5372 -0.5331 0.2998 204 ALA G CA 694 C C . ALA A 88 ? 3.5646 2.4331 2.0414 0.5134 -0.5100 0.2635 204 ALA G C 695 O O . ALA A 88 ? 3.4309 2.2984 1.9371 0.5009 -0.4766 0.2389 204 ALA G O 696 C CB . ALA A 88 ? 3.5507 2.3865 2.0782 0.5498 -0.5183 0.3368 204 ALA G CB 697 N N . CYS A 89 ? 3.6968 2.5669 2.1046 0.5032 -0.5278 0.2598 205 CYS G N 698 C CA . CYS A 89 ? 3.7204 2.5857 2.0952 0.4810 -0.5104 0.2276 205 CYS G CA 699 C C . CYS A 89 ? 3.8211 2.6520 2.1231 0.4758 -0.4986 0.2356 205 CYS G C 700 O O . CYS A 89 ? 3.8920 2.7338 2.1459 0.4642 -0.5160 0.2268 205 CYS G O 701 C CB . CYS A 89 ? 3.6944 2.5979 2.0741 0.4692 -0.5387 0.2052 205 CYS G CB 702 S SG . CYS A 89 ? 4.9080 3.8583 3.3507 0.4819 -0.5747 0.2106 205 CYS G SG 703 N N . PRO A 90 ? 3.7874 2.5799 2.0841 0.4814 -0.4666 0.2493 206 PRO G N 704 C CA . PRO A 90 ? 3.7283 2.4885 1.9546 0.4760 -0.4561 0.2616 206 PRO G CA 705 C C . PRO A 90 ? 3.5638 2.3177 1.7493 0.4527 -0.4405 0.2241 206 PRO G C 706 O O . PRO A 90 ? 3.6476 2.4054 1.8690 0.4437 -0.4234 0.1989 206 PRO G O 707 C CB . PRO A 90 ? 3.8010 2.5227 2.0519 0.4869 -0.4195 0.2774 206 PRO G CB 708 C CG . PRO A 90 ? 3.8082 2.5474 2.1460 0.5026 -0.4213 0.2848 206 PRO G CG 709 C CD . PRO A 90 ? 3.7771 2.5578 2.1372 0.4925 -0.4394 0.2557 206 PRO G CD 710 N N . LYS A 91 ? 3.3634 2.1129 1.4818 0.4389 -0.4466 0.2206 207 LYS G N 711 C CA . LYS A 91 ? 3.2393 1.9778 1.3314 0.4162 -0.4256 0.1819 207 LYS G CA 712 C C . LYS A 91 ? 3.2592 1.9548 1.3503 0.4162 -0.3843 0.1794 207 LYS G C 713 O O . LYS A 91 ? 3.1494 1.8152 1.2197 0.4271 -0.3686 0.2062 207 LYS G O 714 C CB . LYS A 91 ? 3.2855 2.0304 1.3045 0.3958 -0.4333 0.1733 207 LYS G CB 715 C CG . LYS A 91 ? 3.3032 2.0385 1.3109 0.3703 -0.4086 0.1253 207 LYS G CG 716 C CD . LYS A 91 ? 3.2423 1.9937 1.3305 0.3673 -0.4082 0.0950 207 LYS G CD 717 C CE . LYS A 91 ? 3.2492 1.9901 1.3440 0.3418 -0.3840 0.0507 207 LYS G CE 718 N NZ . LYS A 91 ? 3.2739 1.9676 1.3211 0.3383 -0.3487 0.0539 207 LYS G NZ 719 N N . ILE A 92 ? 3.5173 2.2130 1.6380 0.4020 -0.3676 0.1488 208 ILE G N 720 C CA . ILE A 92 ? 3.7223 2.3880 1.8509 0.3979 -0.3306 0.1445 208 ILE G CA 721 C C . ILE A 92 ? 3.7771 2.4139 1.8673 0.3798 -0.3060 0.1208 208 ILE G C 722 O O . ILE A 92 ? 3.7425 2.3931 1.8530 0.3623 -0.3106 0.0922 208 ILE G O 723 C CB . ILE A 92 ? 3.7104 2.4054 1.9096 0.3909 -0.3309 0.1371 208 ILE G CB 724 C CG1 . ILE A 92 ? 3.7160 2.4467 1.9534 0.3773 -0.3577 0.1179 208 ILE G CG1 725 C CG2 . ILE A 92 ? 3.7126 2.4303 1.9476 0.4073 -0.3448 0.1565 208 ILE G CG2 726 C CD1 . ILE A 92 ? 3.6622 2.4327 1.9708 0.3674 -0.3682 0.1202 208 ILE G CD1 727 N N . SER A 93 ? 3.8063 2.4028 1.8511 0.3836 -0.2781 0.1318 209 SER G N 728 C CA . SER A 93 ? 2.8522 1.4187 0.8669 0.3667 -0.2494 0.1084 209 SER G CA 729 C C . SER A 93 ? 3.1469 1.6907 1.1815 0.3686 -0.2163 0.1128 209 SER G C 730 O O . SER A 93 ? 3.1604 1.6836 1.1823 0.3834 -0.2013 0.1353 209 SER G O 731 C CB . SER A 93 ? 2.9279 1.4684 0.8631 0.3647 -0.2427 0.1176 209 SER G CB 732 O OG . SER A 93 ? 3.0738 1.6023 0.9975 0.3856 -0.2451 0.1597 209 SER G OG 733 N N . PHE A 94 ? 3.1305 1.6811 1.2034 0.3510 -0.2043 0.0925 210 PHE G N 734 C CA . PHE A 94 ? 3.2395 1.7716 1.3195 0.3452 -0.1695 0.0934 210 PHE G CA 735 C C . PHE A 94 ? 3.2536 1.7787 1.3509 0.3222 -0.1530 0.0723 210 PHE G C 736 O O . PHE A 94 ? 2.7009 1.2520 0.8464 0.3078 -0.1723 0.0606 210 PHE G O 737 C CB . PHE A 94 ? 3.3020 1.8662 1.4305 0.3464 -0.1691 0.1060 210 PHE G CB 738 C CG . PHE A 94 ? 3.3433 1.9588 1.5340 0.3265 -0.1913 0.1021 210 PHE G CG 739 C CD1 . PHE A 94 ? 3.3684 1.9936 1.5876 0.3012 -0.1864 0.0930 210 PHE G CD1 740 C CD2 . PHE A 94 ? 3.4034 2.0599 1.6312 0.3314 -0.2181 0.1119 210 PHE G CD2 741 C CE1 . PHE A 94 ? 3.3720 2.0493 1.6578 0.2798 -0.2111 0.0996 210 PHE G CE1 742 C CE2 . PHE A 94 ? 3.4079 2.1149 1.6938 0.3102 -0.2401 0.1133 210 PHE G CE2 743 C CZ . PHE A 94 ? 3.3793 2.0981 1.6955 0.2835 -0.2379 0.1102 210 PHE G CZ 744 N N . ASP A 95 ? 3.2945 1.7848 1.3624 0.3192 -0.1165 0.0694 211 ASP G N 745 C CA . ASP A 95 ? 3.2722 1.7578 1.3635 0.2971 -0.0972 0.0553 211 ASP G CA 746 C C . ASP A 95 ? 3.2256 1.7149 1.3209 0.2920 -0.0691 0.0646 211 ASP G C 747 O O . ASP A 95 ? 3.3167 1.7775 1.3745 0.3085 -0.0462 0.0704 211 ASP G O 748 C CB . ASP A 95 ? 3.4095 1.8470 1.4515 0.2952 -0.0742 0.0356 211 ASP G CB 749 C CG . ASP A 95 ? 3.4917 1.9236 1.5689 0.2727 -0.0562 0.0202 211 ASP G CG 750 O OD1 . ASP A 95 ? 3.4184 1.8885 1.5579 0.2565 -0.0657 0.0310 211 ASP G OD1 751 O OD2 . ASP A 95 ? 3.6063 1.9997 1.6514 0.2680 -0.0336 -0.0006 211 ASP G OD2 752 N N . PRO A 96 ? 3.1143 1.6462 1.2644 0.2640 -0.0714 0.0671 212 PRO G N 753 C CA . PRO A 96 ? 3.1105 1.6526 1.2575 0.2519 -0.0384 0.0683 212 PRO G CA 754 C C . PRO A 96 ? 3.0277 1.5175 1.1303 0.2540 0.0019 0.0557 212 PRO G C 755 O O . PRO A 96 ? 3.0998 1.5656 1.1960 0.2487 0.0016 0.0469 212 PRO G O 756 C CB . PRO A 96 ? 3.1153 1.7204 1.3204 0.2130 -0.0519 0.0771 212 PRO G CB 757 C CG . PRO A 96 ? 3.0820 1.7163 1.3332 0.2131 -0.0984 0.0879 212 PRO G CG 758 C CD . PRO A 96 ? 3.1057 1.6850 1.3280 0.2359 -0.0990 0.0730 212 PRO G CD 759 N N . ILE A 97 ? 2.8333 1.3058 0.9144 0.2606 0.0381 0.0522 213 ILE G N 760 C CA . ILE A 97 ? 2.8325 1.2597 0.8775 0.2596 0.0802 0.0401 213 ILE G CA 761 C C . ILE A 97 ? 2.9013 1.3643 0.9710 0.2284 0.1126 0.0301 213 ILE G C 762 O O . ILE A 97 ? 2.9518 1.4646 1.0557 0.2148 0.1124 0.0300 213 ILE G O 763 C CB . ILE A 97 ? 3.0646 1.4379 1.0688 0.2924 0.1001 0.0451 213 ILE G CB 764 C CG1 . ILE A 97 ? 2.7751 1.1694 0.8160 0.2982 0.1171 0.0479 213 ILE G CG1 765 C CG2 . ILE A 97 ? 2.8080 1.1641 0.7849 0.3147 0.0641 0.0587 213 ILE G CG2 766 C CD1 . ILE A 97 ? 2.8247 1.1708 0.8536 0.3241 0.1453 0.0559 213 ILE G CD1 767 N N . PRO A 98 ? 3.0103 1.4518 1.0616 0.2134 0.1437 0.0182 214 PRO G N 768 C CA . PRO A 98 ? 3.0055 1.4907 1.0770 0.1764 0.1748 0.0069 214 PRO G CA 769 C C . PRO A 98 ? 3.1233 1.6118 1.2025 0.1817 0.2135 -0.0084 214 PRO G C 770 O O . PRO A 98 ? 3.0850 1.5152 1.1437 0.2152 0.2354 -0.0109 214 PRO G O 771 C CB . PRO A 98 ? 2.6843 1.1325 0.7294 0.1677 0.2008 -0.0030 214 PRO G CB 772 C CG . PRO A 98 ? 2.8309 1.2390 0.8628 0.1873 0.1717 0.0041 214 PRO G CG 773 C CD . PRO A 98 ? 2.9264 1.3134 0.9424 0.2221 0.1500 0.0122 214 PRO G CD 774 N N . ILE A 99 ? 3.1636 1.7232 1.2802 0.1465 0.2211 -0.0177 215 ILE G N 782 N N . HIS A 100 ? 2.4768 1.6539 1.6557 -0.0221 -0.0726 0.2609 216 HIS G N 783 C CA . HIS A 100 ? 2.2625 1.4447 1.4549 -0.0561 -0.0936 0.2704 216 HIS G CA 784 C C . HIS A 100 ? 2.2014 1.3355 1.3390 -0.0408 -0.1261 0.2478 216 HIS G C 785 O O . HIS A 100 ? 2.2219 1.2915 1.2934 -0.0118 -0.1327 0.2316 216 HIS G O 786 C CB . HIS A 100 ? 2.3589 1.4979 1.5225 -0.0991 -0.0858 0.2896 216 HIS G CB 787 C CG . HIS A 100 ? 2.3556 1.5478 1.5795 -0.1168 -0.0481 0.3127 216 HIS G CG 788 N ND1 . HIS A 100 ? 2.3610 1.5298 1.5594 -0.1000 -0.0165 0.3110 216 HIS G ND1 789 C CD2 . HIS A 100 ? 2.3443 1.6141 1.6542 -0.1497 -0.0352 0.3387 216 HIS G CD2 790 C CE1 . HIS A 100 ? 2.3591 1.5830 1.6224 -0.1203 0.0198 0.3321 216 HIS G CE1 791 N NE2 . HIS A 100 ? 2.3113 1.6021 1.6498 -0.1483 0.0090 0.3507 216 HIS G NE2 792 N N . TYR A 101 ? 2.1822 1.3544 1.3517 -0.0564 -0.1448 0.2471 217 TYR G N 793 C CA . TYR A 101 ? 2.1469 1.2671 1.2590 -0.0488 -0.1702 0.2245 217 TYR G CA 794 C C . TYR A 101 ? 2.1224 1.1877 1.1890 -0.0966 -0.1867 0.2301 217 TYR G C 795 O O . TYR A 101 ? 2.0145 1.1261 1.1239 -0.1428 -0.1919 0.2515 217 TYR G O 796 C CB . TYR A 101 ? 2.0656 1.2486 1.2199 -0.0337 -0.1800 0.2133 217 TYR G CB 797 C CG . TYR A 101 ? 2.0666 1.2661 1.2264 0.0163 -0.1707 0.1949 217 TYR G CG 798 C CD1 . TYR A 101 ? 2.2140 1.3684 1.3217 0.0486 -0.1810 0.1684 217 TYR G CD1 799 C CD2 . TYR A 101 ? 1.9981 1.2592 1.2159 0.0303 -0.1503 0.2035 217 TYR G CD2 800 C CE1 . TYR A 101 ? 2.2366 1.4167 1.3546 0.0904 -0.1753 0.1532 217 TYR G CE1 801 C CE2 . TYR A 101 ? 2.0325 1.3071 1.2488 0.0686 -0.1439 0.1856 217 TYR G CE2 802 C CZ . TYR A 101 ? 2.1236 1.3636 1.2930 0.0967 -0.1587 0.1615 217 TYR G CZ 803 O OH . TYR A 101 ? 2.0674 1.3318 1.2413 0.1302 -0.1552 0.1457 217 TYR G OH 804 N N . CYS A 102 ? 2.1978 1.1612 1.1754 -0.0837 -0.1949 0.2108 218 CYS G N 805 C CA . CYS A 102 ? 2.3720 1.2474 1.2780 -0.1257 -0.2062 0.2110 218 CYS G CA 806 C C . CYS A 102 ? 2.3556 1.1575 1.1911 -0.1124 -0.2201 0.1813 218 CYS G C 807 O O . CYS A 102 ? 2.3804 1.1826 1.2120 -0.0586 -0.2175 0.1603 218 CYS G O 808 C CB . CYS A 102 ? 2.5504 1.3422 1.3988 -0.1251 -0.1941 0.2202 218 CYS G CB 809 S SG . CYS A 102 ? 2.2390 1.0995 1.1523 -0.1367 -0.1676 0.2504 218 CYS G SG 810 N N . THR A 103 ? 2.3143 1.0542 1.0938 -0.1640 -0.2325 0.1792 219 THR G N 811 C CA . THR A 103 ? 2.4087 1.0602 1.1058 -0.1610 -0.2402 0.1491 219 THR G CA 812 C C . THR A 103 ? 2.6118 1.1107 1.2009 -0.1476 -0.2329 0.1356 219 THR G C 813 O O . THR A 103 ? 2.6623 1.1082 1.2210 -0.1733 -0.2294 0.1534 219 THR G O 814 C CB . THR A 103 ? 2.5623 1.2213 1.2426 -0.2324 -0.2598 0.1503 219 THR G CB 815 O OG1 . THR A 103 ? 2.5863 1.2478 1.2717 -0.2980 -0.2671 0.1779 219 THR G OG1 816 C CG2 . THR A 103 ? 2.2925 1.0733 1.0522 -0.2324 -0.2701 0.1545 219 THR G CG2 817 N N . PRO A 104 ? 2.5504 0.9774 1.0820 -0.1058 -0.2279 0.1048 220 PRO G N 818 C CA . PRO A 104 ? 2.6933 0.9660 1.1200 -0.0881 -0.2191 0.0912 220 PRO G CA 819 C C . PRO A 104 ? 3.0471 1.2300 1.3924 -0.1630 -0.2257 0.0856 220 PRO G C 820 O O . PRO A 104 ? 2.7706 1.0270 1.1502 -0.2236 -0.2405 0.0935 220 PRO G O 821 C CB . PRO A 104 ? 2.9046 1.1563 1.3167 -0.0216 -0.2086 0.0597 220 PRO G CB 822 C CG . PRO A 104 ? 2.7068 1.0678 1.1773 -0.0413 -0.2152 0.0505 220 PRO G CG 823 C CD . PRO A 104 ? 2.5505 1.0371 1.1144 -0.0710 -0.2267 0.0819 220 PRO G CD 824 N N . ALA A 105 ? 3.1982 1.2236 1.4365 -0.1599 -0.2160 0.0743 221 ALA G N 825 C CA . ALA A 105 ? 3.1030 1.0155 1.2420 -0.2331 -0.2196 0.0647 221 ALA G CA 826 C C . ALA A 105 ? 3.2269 1.1606 1.3507 -0.2608 -0.2254 0.0383 221 ALA G C 827 O O . ALA A 105 ? 3.1744 1.1533 1.3299 -0.2048 -0.2169 0.0184 221 ALA G O 828 C CB . ALA A 105 ? 3.2719 0.9981 1.2930 -0.2067 -0.2020 0.0509 221 ALA G CB 829 N N . GLY A 106 ? 3.3033 1.2057 1.3755 -0.3508 -0.2405 0.0390 222 GLY G N 830 C CA . GLY A 106 ? 3.3803 1.2838 1.4144 -0.3887 -0.2485 0.0142 222 GLY G CA 831 C C . GLY A 106 ? 3.2066 1.2857 1.3496 -0.3959 -0.2679 0.0269 222 GLY G C 832 O O . GLY A 106 ? 3.2492 1.3353 1.3615 -0.4190 -0.2741 0.0069 222 GLY G O 833 N N . TYR A 107 ? 2.9768 1.1908 1.2409 -0.3751 -0.2750 0.0599 223 TYR G N 834 C CA . TYR A 107 ? 2.8587 1.2337 1.2280 -0.3826 -0.2925 0.0769 223 TYR G CA 835 C C . TYR A 107 ? 2.8065 1.2775 1.2600 -0.4279 -0.3084 0.1208 223 TYR G C 836 O O . TYR A 107 ? 2.9169 1.3226 1.3355 -0.4544 -0.3042 0.1319 223 TYR G O 837 C CB . TYR A 107 ? 2.8176 1.2683 1.2606 -0.2966 -0.2768 0.0690 223 TYR G CB 838 C CG . TYR A 107 ? 2.9457 1.3260 1.3226 -0.2539 -0.2591 0.0275 223 TYR G CG 839 C CD1 . TYR A 107 ? 3.0890 1.3415 1.3917 -0.2038 -0.2345 0.0031 223 TYR G CD1 840 C CD2 . TYR A 107 ? 2.8386 1.2787 1.2278 -0.2613 -0.2647 0.0145 223 TYR G CD2 841 C CE1 . TYR A 107 ? 3.1443 1.3363 1.3949 -0.1599 -0.2125 -0.0344 223 TYR G CE1 842 C CE2 . TYR A 107 ? 2.8983 1.2752 1.2276 -0.2226 -0.2421 -0.0248 223 TYR G CE2 843 C CZ . TYR A 107 ? 3.0960 1.3520 1.3604 -0.1705 -0.2145 -0.0496 223 TYR G CZ 844 O OH . TYR A 107 ? 3.2335 1.4315 1.4473 -0.1272 -0.1868 -0.0879 223 TYR G OH 845 N N . VAL A 108 ? 2.6147 1.2375 1.1800 -0.4329 -0.3228 0.1465 224 VAL G N 846 C CA . VAL A 108 ? 2.5091 1.2390 1.1732 -0.4658 -0.3316 0.1899 224 VAL G CA 847 C C . VAL A 108 ? 2.3741 1.2588 1.1572 -0.4521 -0.3421 0.2130 224 VAL G C 848 O O . VAL A 108 ? 2.5593 1.4675 1.3361 -0.4427 -0.3524 0.1993 224 VAL G O 849 C CB . VAL A 108 ? 2.5950 1.3144 1.2317 -0.5625 -0.3555 0.2104 224 VAL G CB 850 C CG1 . VAL A 108 ? 2.9669 1.7212 1.5849 -0.6186 -0.3888 0.2095 224 VAL G CG1 851 C CG2 . VAL A 108 ? 2.5272 1.3507 1.2692 -0.5859 -0.3545 0.2537 224 VAL G CG2 852 N N . ILE A 109 ? 2.4518 1.4374 1.3405 -0.4500 -0.3364 0.2483 225 ILE G N 853 C CA . ILE A 109 ? 2.1655 1.2926 1.1721 -0.4309 -0.3416 0.2734 225 ILE G CA 854 C C . ILE A 109 ? 2.2665 1.4891 1.3377 -0.4993 -0.3706 0.3131 225 ILE G C 855 O O . ILE A 109 ? 2.2120 1.4296 1.2834 -0.5515 -0.3753 0.3319 225 ILE G O 856 C CB . ILE A 109 ? 2.0684 1.2509 1.1584 -0.3718 -0.3099 0.2853 225 ILE G CB 857 C CG1 . ILE A 109 ? 2.1396 1.2534 1.1795 -0.3023 -0.2888 0.2495 225 ILE G CG1 858 C CG2 . ILE A 109 ? 2.0539 1.3704 1.2619 -0.3538 -0.3116 0.3122 225 ILE G CG2 859 C CD1 . ILE A 109 ? 2.3243 1.3538 1.3159 -0.2825 -0.2670 0.2417 225 ILE G CD1 860 N N . LEU A 110 ? 2.2437 1.5559 1.3701 -0.4998 -0.3916 0.3276 226 LEU G N 861 C CA . LEU A 110 ? 2.2963 1.7191 1.5012 -0.5567 -0.4233 0.3721 226 LEU G CA 862 C C . LEU A 110 ? 2.1598 1.7051 1.5035 -0.5056 -0.4052 0.4035 226 LEU G C 863 O O . LEU A 110 ? 2.0202 1.5688 1.3787 -0.4418 -0.3857 0.3878 226 LEU G O 864 C CB . LEU A 110 ? 2.3345 1.7615 1.4899 -0.5988 -0.4641 0.3695 226 LEU G CB 865 C CG . LEU A 110 ? 2.2790 1.5779 1.2848 -0.6562 -0.4817 0.3357 226 LEU G CG 866 C CD1 . LEU A 110 ? 2.3203 1.6412 1.2874 -0.6974 -0.5205 0.3380 226 LEU G CD1 867 C CD2 . LEU A 110 ? 2.4781 1.7474 1.4584 -0.7275 -0.4924 0.3493 226 LEU G CD2 868 N N . LYS A 111 ? 2.1906 1.8357 1.6348 -0.5374 -0.4107 0.4482 227 LYS G N 869 C CA . LYS A 111 ? 2.0831 1.8420 1.6658 -0.4944 -0.3866 0.4826 227 LYS G CA 870 C C . LYS A 111 ? 2.0273 1.9199 1.7131 -0.5316 -0.4231 0.5346 227 LYS G C 871 O O . LYS A 111 ? 1.9372 1.8592 1.6217 -0.6040 -0.4570 0.5567 227 LYS G O 872 C CB . LYS A 111 ? 2.0114 1.7683 1.6303 -0.4887 -0.3473 0.4900 227 LYS G CB 873 C CG . LYS A 111 ? 1.9640 1.8269 1.7187 -0.4414 -0.3133 0.5211 227 LYS G CG 874 C CD . LYS A 111 ? 2.0514 1.9104 1.8339 -0.4428 -0.2716 0.5280 227 LYS G CD 875 C CE . LYS A 111 ? 2.0672 2.0224 1.9785 -0.3940 -0.2299 0.5552 227 LYS G CE 876 N NZ . LYS A 111 ? 2.1204 2.0736 2.0560 -0.4009 -0.1850 0.5625 227 LYS G NZ 877 N N . CYS A 112 ? 2.0242 1.9961 1.7960 -0.4840 -0.4188 0.5555 228 CYS G N 878 C CA . CYS A 112 ? 2.0489 2.1516 1.9262 -0.5106 -0.4549 0.6106 228 CYS G CA 879 C C . CYS A 112 ? 2.0368 2.2543 2.0680 -0.4888 -0.4248 0.6559 228 CYS G C 880 O O . CYS A 112 ? 2.0359 2.2607 2.1210 -0.4211 -0.3776 0.6522 228 CYS G O 881 C CB . CYS A 112 ? 1.9478 2.0694 1.8267 -0.4777 -0.4730 0.6140 228 CYS G CB 882 S SG . CYS A 112 ? 1.8553 2.1388 1.8673 -0.5040 -0.5207 0.6894 228 CYS G SG 883 N N . ASN A 113 ? 1.9819 2.2819 2.0769 -0.5487 -0.4477 0.6951 229 ASN G N 884 C CA . ASN A 113 ? 1.9108 2.3239 2.1549 -0.5325 -0.4150 0.7380 229 ASN G CA 885 C C . ASN A 113 ? 1.8743 2.4469 2.2685 -0.5300 -0.4439 0.8038 229 ASN G C 886 O O . ASN A 113 ? 1.9048 2.5933 2.4312 -0.5382 -0.4306 0.8488 229 ASN G O 887 C CB . ASN A 113 ? 2.0110 2.4223 2.2466 -0.5959 -0.4102 0.7415 229 ASN G CB 888 C CG . ASN A 113 ? 2.1207 2.3717 2.2089 -0.5983 -0.3838 0.6830 229 ASN G CG 889 O OD1 . ASN A 113 ? 1.7199 1.8950 1.7682 -0.5335 -0.3414 0.6486 229 ASN G OD1 890 N ND2 . ASN A 113 ? 2.2082 2.4066 2.2155 -0.6743 -0.4083 0.6736 229 ASN G ND2 891 N N . ASP A 114 ? 1.8479 2.4277 2.2242 -0.5165 -0.4814 0.8114 230 ASP G N 892 C CA . ASP A 114 ? 1.5649 2.2861 2.0814 -0.4984 -0.5071 0.8761 230 ASP G CA 893 C C . ASP A 114 ? 2.1522 2.9034 2.7730 -0.4078 -0.4437 0.8866 230 ASP G C 894 O O . ASP A 114 ? 1.4655 2.1225 2.0211 -0.3529 -0.4095 0.8458 230 ASP G O 895 C CB . ASP A 114 ? 1.7468 2.4530 2.2000 -0.5087 -0.5628 0.8807 230 ASP G CB 896 C CG . ASP A 114 ? 1.8325 2.5365 2.2014 -0.6053 -0.6346 0.8855 230 ASP G CG 897 O OD1 . ASP A 114 ? 1.7255 2.3855 2.0308 -0.6649 -0.6386 0.8631 230 ASP G OD1 898 O OD2 . ASP A 114 ? 1.8451 2.5835 2.2015 -0.6237 -0.6876 0.9116 230 ASP G OD2 899 N N . LYS A 115 ? 2.1297 3.0114 2.9121 -0.3943 -0.4254 0.9405 231 LYS G N 900 C CA . LYS A 115 ? 2.1444 3.0466 3.0242 -0.3125 -0.3537 0.9476 231 LYS G CA 901 C C . LYS A 115 ? 2.2591 3.1534 3.1592 -0.2462 -0.3512 0.9583 231 LYS G C 902 O O . LYS A 115 ? 2.1892 3.0458 3.1143 -0.1773 -0.2887 0.9433 231 LYS G O 903 C CB . LYS A 115 ? 2.0546 3.1097 3.1129 -0.3141 -0.3354 1.0080 231 LYS G CB 904 C CG . LYS A 115 ? 2.0392 3.1132 3.0875 -0.3860 -0.3369 1.0033 231 LYS G CG 905 C CD . LYS A 115 ? 2.0295 2.9582 2.9512 -0.3819 -0.2837 0.9357 231 LYS G CD 906 C CE . LYS A 115 ? 2.0664 2.9905 2.9468 -0.4642 -0.2968 0.9289 231 LYS G CE 907 N NZ . LYS A 115 ? 2.0550 3.1407 3.1030 -0.4888 -0.2870 0.9881 231 LYS G NZ 908 N N . ASN A 116 ? 2.4325 3.3480 3.3044 -0.2722 -0.4183 0.9801 232 ASN G N 909 C CA . ASN A 116 ? 2.4855 3.3875 3.3625 -0.2192 -0.4235 0.9929 232 ASN G CA 910 C C . ASN A 116 ? 2.4645 3.2655 3.1832 -0.2471 -0.4670 0.9538 232 ASN G C 911 O O . ASN A 116 ? 2.5383 3.3573 3.2577 -0.2375 -0.5024 0.9807 232 ASN G O 912 C CB . ASN A 116 ? 2.6071 3.6607 3.6399 -0.2101 -0.4602 1.0778 232 ASN G CB 913 C CG . ASN A 116 ? 2.7302 3.7718 3.7929 -0.1416 -0.4498 1.0989 232 ASN G CG 914 O OD1 . ASN A 116 ? 2.7735 3.7142 3.7838 -0.0879 -0.3938 1.0554 232 ASN G OD1 915 N ND2 . ASN A 116 ? 2.7720 3.9132 3.9127 -0.1471 -0.5065 1.1669 232 ASN G ND2 916 N N . PHE A 117 ? 2.2537 2.9467 2.8361 -0.2808 -0.4619 0.8912 233 PHE G N 917 C CA . PHE A 117 ? 2.1392 2.7268 2.5673 -0.3030 -0.4904 0.8456 233 PHE G CA 918 C C . PHE A 117 ? 2.1185 2.6352 2.5163 -0.2335 -0.4488 0.8170 233 PHE G C 919 O O . PHE A 117 ? 2.0903 2.5539 2.4850 -0.1892 -0.3893 0.7830 233 PHE G O 920 C CB . PHE A 117 ? 2.0772 2.5679 2.3813 -0.3481 -0.4869 0.7884 233 PHE G CB 921 C CG . PHE A 117 ? 2.0617 2.4371 2.2073 -0.3656 -0.5056 0.7358 233 PHE G CG 922 C CD1 . PHE A 117 ? 2.1247 2.5078 2.2103 -0.4201 -0.5668 0.7489 233 PHE G CD1 923 C CD2 . PHE A 117 ? 2.0174 2.2796 2.0731 -0.3300 -0.4619 0.6741 233 PHE G CD2 924 C CE1 . PHE A 117 ? 2.1565 2.4323 2.0954 -0.4363 -0.5774 0.6989 233 PHE G CE1 925 C CE2 . PHE A 117 ? 2.0420 2.2070 1.9628 -0.3429 -0.4752 0.6272 233 PHE G CE2 926 C CZ . PHE A 117 ? 2.1205 2.2904 1.9829 -0.3949 -0.5298 0.6383 233 PHE G CZ 927 N N . ASN A 118 ? 2.1319 2.6485 2.5058 -0.2275 -0.4800 0.8326 234 ASN G N 928 C CA . ASN A 118 ? 2.0388 2.4990 2.3961 -0.1655 -0.4417 0.8136 234 ASN G CA 929 C C . ASN A 118 ? 1.9563 2.2921 2.1666 -0.1655 -0.4258 0.7414 234 ASN G C 930 O O . ASN A 118 ? 1.9160 2.2023 2.1048 -0.1205 -0.3930 0.7203 234 ASN G O 931 C CB . ASN A 118 ? 2.0177 2.5335 2.4222 -0.1546 -0.4775 0.8683 234 ASN G CB 932 C CG . ASN A 118 ? 1.9595 2.4689 2.2706 -0.2182 -0.5467 0.8732 234 ASN G CG 933 O OD1 . ASN A 118 ? 1.9790 2.4160 2.1687 -0.2614 -0.5587 0.8232 234 ASN G OD1 934 N ND2 . ASN A 118 ? 1.9260 2.5060 2.2898 -0.2224 -0.5908 0.9347 234 ASN G ND2 935 N N . GLY A 119 ? 1.9466 2.2330 2.0585 -0.2160 -0.4481 0.7052 235 GLY G N 936 C CA . GLY A 119 ? 1.9441 2.1188 1.9270 -0.2129 -0.4301 0.6378 235 GLY G CA 937 C C . GLY A 119 ? 2.0083 2.1296 1.8692 -0.2582 -0.4698 0.6127 235 GLY G C 938 O O . GLY A 119 ? 2.0074 2.0399 1.7661 -0.2591 -0.4540 0.5566 235 GLY G O 939 N N . THR A 120 ? 2.0404 2.2158 1.9107 -0.2965 -0.5210 0.6551 236 THR G N 940 C CA . THR A 120 ? 2.0315 2.1577 1.7798 -0.3489 -0.5606 0.6351 236 THR G CA 941 C C . THR A 120 ? 1.9890 2.1790 1.7453 -0.4190 -0.6239 0.6808 236 THR G C 942 O O . THR A 120 ? 2.0565 2.3513 1.9283 -0.4173 -0.6473 0.7442 236 THR G O 943 C CB . THR A 120 ? 1.9764 2.0810 1.6869 -0.3261 -0.5593 0.6326 236 THR G CB 944 O OG1 . THR A 120 ? 1.9095 2.1005 1.7318 -0.3010 -0.5710 0.6962 236 THR G OG1 945 C CG2 . THR A 120 ? 1.9637 1.9984 1.6429 -0.2707 -0.5023 0.5801 236 THR G CG2 946 N N . GLY A 121 ? 1.8927 2.0208 1.5285 -0.4811 -0.6512 0.6502 237 GLY G N 947 C CA . GLY A 121 ? 1.8481 2.0330 1.4790 -0.5575 -0.7150 0.6920 237 GLY G CA 948 C C . GLY A 121 ? 2.0367 2.2060 1.6385 -0.6152 -0.7283 0.6801 237 GLY G C 949 O O . GLY A 121 ? 2.0877 2.1855 1.6568 -0.5964 -0.6863 0.6343 237 GLY G O 950 N N . PRO A 122 ? 2.1060 2.3400 1.7142 -0.6900 -0.7891 0.7229 238 PRO G N 951 C CA . PRO A 122 ? 2.1488 2.3603 1.7250 -0.7490 -0.7977 0.7090 238 PRO G CA 952 C C . PRO A 122 ? 2.0246 2.3270 1.7517 -0.7220 -0.7747 0.7422 238 PRO G C 953 O O . PRO A 122 ? 1.9318 2.3492 1.8028 -0.6811 -0.7748 0.7961 238 PRO G O 954 C CB . PRO A 122 ? 2.3189 2.5756 1.8510 -0.8442 -0.8733 0.7456 238 PRO G CB 955 C CG . PRO A 122 ? 2.2923 2.6609 1.9195 -0.8203 -0.9065 0.8092 238 PRO G CG 956 C CD . PRO A 122 ? 2.1991 2.5134 1.8225 -0.7319 -0.8535 0.7797 238 PRO G CD 957 N N . CYS A 123 ? 1.9632 2.2073 1.6538 -0.7426 -0.7506 0.7095 239 CYS G N 958 C CA . CYS A 123 ? 2.1695 2.4912 1.9869 -0.7281 -0.7267 0.7375 239 CYS G CA 959 C C . CYS A 123 ? 2.1587 2.5063 1.9556 -0.8250 -0.7693 0.7548 239 CYS G C 960 O O . CYS A 123 ? 2.2343 2.4720 1.8803 -0.8869 -0.7874 0.7139 239 CYS G O 961 C CB . CYS A 123 ? 2.2005 2.4306 1.9958 -0.6647 -0.6564 0.6864 239 CYS G CB 962 S SG . CYS A 123 ? 2.9240 3.2345 2.8704 -0.6272 -0.6073 0.7136 239 CYS G SG 963 N N . LYS A 124 ? 2.1154 2.6076 2.0660 -0.8362 -0.7818 0.8155 240 LYS G N 964 C CA . LYS A 124 ? 2.0197 2.5836 1.9994 -0.9272 -0.8240 0.8490 240 LYS G CA 965 C C . LYS A 124 ? 2.6943 3.2109 2.6716 -0.9360 -0.7775 0.8226 240 LYS G C 966 O O . LYS A 124 ? 2.1214 2.5668 1.9967 -1.0144 -0.7946 0.7992 240 LYS G O 967 C CB . LYS A 124 ? 1.9703 2.7325 2.1369 -0.9263 -0.8593 0.9341 240 LYS G CB 968 C CG . LYS A 124 ? 1.9745 2.7851 2.1443 -0.9184 -0.9095 0.9682 240 LYS G CG 969 C CD . LYS A 124 ? 1.9925 2.9831 2.2894 -0.9696 -0.9790 1.0532 240 LYS G CD 970 C CE . LYS A 124 ? 2.1259 3.0870 2.3090 -1.0841 -1.0333 1.0481 240 LYS G CE 971 N NZ . LYS A 124 ? 2.1744 3.2663 2.4558 -1.1132 -1.0682 1.1168 240 LYS G NZ 972 N N . ASN A 125 ? 2.5404 3.0979 2.6306 -0.8587 -0.7188 0.8300 241 ASN G N 973 C CA . ASN A 125 ? 2.4349 2.9528 2.5336 -0.8544 -0.6666 0.8089 241 ASN G CA 974 C C . ASN A 125 ? 2.3964 2.7359 2.3532 -0.8100 -0.6202 0.7361 241 ASN G C 975 O O . ASN A 125 ? 2.3185 2.6369 2.3069 -0.7257 -0.5706 0.7198 241 ASN G O 976 C CB . ASN A 125 ? 2.2610 2.9093 2.5462 -0.7916 -0.6234 0.8529 241 ASN G CB 977 C CG . ASN A 125 ? 2.1779 2.8127 2.4899 -0.7978 -0.5723 0.8431 241 ASN G CG 978 O OD1 . ASN A 125 ? 2.2327 2.7277 2.4157 -0.8114 -0.5492 0.7914 241 ASN G OD1 979 N ND2 . ASN A 125 ? 2.0720 2.8511 2.5538 -0.7828 -0.5506 0.8943 241 ASN G ND2 980 N N . VAL A 126 ? 2.4549 2.6672 2.2608 -0.8683 -0.6327 0.6941 242 VAL G N 981 C CA . VAL A 126 ? 2.4685 2.5124 2.1383 -0.8272 -0.5940 0.6281 242 VAL G CA 982 C C . VAL A 126 ? 2.5337 2.4917 2.1522 -0.8462 -0.5593 0.6041 242 VAL G C 983 O O . VAL A 126 ? 2.6552 2.6320 2.2704 -0.9248 -0.5802 0.6222 242 VAL G O 984 C CB . VAL A 126 ? 2.8807 2.8125 2.3913 -0.8645 -0.6288 0.5896 242 VAL G CB 985 C CG1 . VAL A 126 ? 2.8946 2.6721 2.2882 -0.8048 -0.5864 0.5258 242 VAL G CG1 986 C CG2 . VAL A 126 ? 2.8549 2.8737 2.4047 -0.8648 -0.6717 0.6194 242 VAL G CG2 987 N N . SER A 127 ? 2.4390 2.3066 2.0193 -0.7773 -0.5075 0.5667 243 SER G N 988 C CA . SER A 127 ? 2.3814 2.1533 1.8973 -0.7954 -0.4770 0.5448 243 SER G CA 989 C C . SER A 127 ? 2.3960 2.0007 1.7721 -0.7493 -0.4519 0.4858 243 SER G C 990 O O . SER A 127 ? 2.3799 1.9612 1.7302 -0.6972 -0.4514 0.4633 243 SER G O 991 C CB . SER A 127 ? 2.2433 2.0976 1.8822 -0.7617 -0.4324 0.5727 243 SER G CB 992 O OG . SER A 127 ? 2.1243 1.9926 1.8118 -0.6697 -0.3955 0.5633 243 SER G OG 993 N N . SER A 128 ? 2.4779 1.9696 1.7684 -0.7670 -0.4302 0.4633 244 SER G N 994 C CA . SER A 128 ? 2.5698 1.9023 1.7306 -0.7230 -0.4081 0.4119 244 SER G CA 995 C C . SER A 128 ? 2.5896 1.8837 1.7616 -0.6705 -0.3604 0.4057 244 SER G C 996 O O . SER A 128 ? 2.6667 1.9637 1.8550 -0.7071 -0.3463 0.4244 244 SER G O 997 C CB . SER A 128 ? 2.7086 1.9037 1.7215 -0.7897 -0.4286 0.3850 244 SER G CB 998 O OG . SER A 128 ? 2.7938 1.8454 1.6888 -0.7403 -0.4114 0.3364 244 SER G OG 999 N N . VAL A 129 ? 2.4967 1.7518 1.6526 -0.5899 -0.3362 0.3794 245 VAL G N 1000 C CA . VAL A 129 ? 2.4880 1.6991 1.6394 -0.5413 -0.2953 0.3721 245 VAL G CA 1001 C C . VAL A 129 ? 2.5639 1.6409 1.6031 -0.4895 -0.2851 0.3289 245 VAL G C 1002 O O . VAL A 129 ? 2.5048 1.5489 1.4976 -0.4720 -0.3013 0.3037 245 VAL G O 1003 C CB . VAL A 129 ? 2.2162 1.5450 1.4932 -0.4863 -0.2688 0.3925 245 VAL G CB 1004 C CG1 . VAL A 129 ? 2.1661 1.6380 1.5709 -0.5257 -0.2749 0.4386 245 VAL G CG1 1005 C CG2 . VAL A 129 ? 2.1663 1.5126 1.4530 -0.4254 -0.2727 0.3726 245 VAL G CG2 1006 N N . GLN A 130 ? 2.6502 1.6489 1.6436 -0.4671 -0.2581 0.3222 246 GLN G N 1007 C CA . GLN A 130 ? 2.7378 1.6172 1.6352 -0.4130 -0.2494 0.2874 246 GLN G CA 1008 C C . GLN A 130 ? 2.6507 1.5810 1.6021 -0.3357 -0.2295 0.2810 246 GLN G C 1009 O O . GLN A 130 ? 2.6628 1.5307 1.5611 -0.2833 -0.2271 0.2537 246 GLN G O 1010 C CB . GLN A 130 ? 2.8969 1.6525 1.7031 -0.4309 -0.2361 0.2859 246 GLN G CB 1011 C CG . GLN A 130 ? 3.0469 1.6581 1.7375 -0.3885 -0.2345 0.2533 246 GLN G CG 1012 C CD . GLN A 130 ? 3.2712 1.7433 1.8523 -0.4353 -0.2340 0.2523 246 GLN G CD 1013 O OE1 . GLN A 130 ? 3.3431 1.8099 1.9079 -0.5116 -0.2479 0.2618 246 GLN G OE1 1014 N NE2 . GLN A 130 ? 3.3988 1.7566 1.9025 -0.3923 -0.2197 0.2430 246 GLN G NE2 1015 N N . CYS A 131 ? 2.5488 1.5967 1.6088 -0.3302 -0.2151 0.3063 247 CYS G N 1016 C CA . CYS A 131 ? 2.4371 1.5328 1.5471 -0.2659 -0.1931 0.3015 247 CYS G CA 1017 C C . CYS A 131 ? 2.3289 1.5617 1.5638 -0.2664 -0.1852 0.3272 247 CYS G C 1018 O O . CYS A 131 ? 2.3495 1.6453 1.6463 -0.3097 -0.1823 0.3573 247 CYS G O 1019 C CB . CYS A 131 ? 2.4832 1.5252 1.5594 -0.2436 -0.1644 0.3026 247 CYS G CB 1020 S SG . CYS A 131 ? 2.8322 1.7064 1.7645 -0.2309 -0.1688 0.2813 247 CYS G SG 1021 N N . THR A 132 ? 2.2780 1.5556 1.5515 -0.2165 -0.1791 0.3167 248 THR G N 1022 C CA . THR A 132 ? 2.1927 1.5842 1.5792 -0.2026 -0.1636 0.3394 248 THR G CA 1023 C C . THR A 132 ? 2.1394 1.5573 1.5722 -0.1970 -0.1232 0.3574 248 THR G C 1024 O O . THR A 132 ? 2.0705 1.4162 1.4404 -0.2024 -0.1084 0.3510 248 THR G O 1025 C CB . THR A 132 ? 2.2012 1.6126 1.5998 -0.1506 -0.1618 0.3199 248 THR G CB 1026 O OG1 . THR A 132 ? 1.7243 1.0695 1.0628 -0.1100 -0.1448 0.2941 248 THR G OG1 1027 C CG2 . THR A 132 ? 2.2705 1.6683 1.6326 -0.1591 -0.1965 0.3046 248 THR G CG2 1028 N N . HIS A 133 ? 2.0632 1.5805 1.6030 -0.1884 -0.1036 0.3819 249 HIS G N 1029 C CA . HIS A 133 ? 2.0424 1.5809 1.6239 -0.1723 -0.0554 0.3928 249 HIS G CA 1030 C C . HIS A 133 ? 1.9660 1.4509 1.4950 -0.1221 -0.0345 0.3632 249 HIS G C 1031 O O . HIS A 133 ? 1.8526 1.3102 1.3409 -0.0968 -0.0569 0.3394 249 HIS G O 1032 C CB . HIS A 133 ? 1.9750 1.6303 1.6881 -0.1698 -0.0362 0.4268 249 HIS G CB 1033 C CG . HIS A 133 ? 1.9375 1.6323 1.6930 -0.1277 -0.0380 0.4221 249 HIS G CG 1034 N ND1 . HIS A 133 ? 1.9045 1.6412 1.6860 -0.1351 -0.0782 0.4305 249 HIS G ND1 1035 C CD2 . HIS A 133 ? 1.8824 1.5739 1.6500 -0.0822 -0.0042 0.4096 249 HIS G CD2 1036 C CE1 . HIS A 133 ? 1.7952 1.5538 1.6064 -0.0943 -0.0684 0.4251 249 HIS G CE1 1037 N NE2 . HIS A 133 ? 1.7790 1.5099 1.5827 -0.0623 -0.0236 0.4116 249 HIS G NE2 1038 N N . GLY A 134 ? 2.0244 1.4975 1.5538 -0.1107 0.0089 0.3648 250 GLY G N 1039 C CA . GLY A 134 ? 1.9923 1.4163 1.4666 -0.0712 0.0267 0.3385 250 GLY G CA 1040 C C . GLY A 134 ? 1.9024 1.3794 1.4345 -0.0367 0.0360 0.3332 250 GLY G C 1041 O O . GLY A 134 ? 1.8944 1.4351 1.5123 -0.0315 0.0670 0.3529 250 GLY G O 1042 N N . ILE A 135 ? 1.8729 1.3215 1.3582 -0.0121 0.0116 0.3074 251 ILE G N 1043 C CA . ILE A 135 ? 1.8415 1.3307 1.3691 0.0164 0.0174 0.3002 251 ILE G CA 1044 C C . ILE A 135 ? 1.8041 1.2530 1.2785 0.0443 0.0344 0.2731 251 ILE G C 1045 O O . ILE A 135 ? 1.8918 1.2885 1.2896 0.0516 0.0134 0.2518 251 ILE G O 1046 C CB . ILE A 135 ? 1.9236 1.4315 1.4540 0.0163 -0.0257 0.2944 251 ILE G CB 1047 C CG1 . ILE A 135 ? 1.9493 1.5026 1.5311 -0.0180 -0.0463 0.3232 251 ILE G CG1 1048 C CG2 . ILE A 135 ? 1.9494 1.4954 1.5192 0.0422 -0.0192 0.2888 251 ILE G CG2 1049 C CD1 . ILE A 135 ? 1.9180 1.4798 1.4869 -0.0272 -0.0889 0.3176 251 ILE G CD1 1050 N N . LYS A 136 ? 1.7647 1.2375 1.2795 0.0599 0.0714 0.2745 252 LYS G N 1051 C CA . LYS A 136 ? 1.7811 1.2141 1.2394 0.0780 0.0878 0.2483 252 LYS G CA 1052 C C . LYS A 136 ? 1.7661 1.2208 1.2329 0.0950 0.0646 0.2330 252 LYS G C 1053 O O . LYS A 136 ? 1.7751 1.2771 1.3096 0.0997 0.0673 0.2466 252 LYS G O 1054 C CB . LYS A 136 ? 1.7890 1.2182 1.2680 0.0822 0.1458 0.2526 252 LYS G CB 1055 C CG . LYS A 136 ? 1.9189 1.3235 1.3806 0.0630 0.1743 0.2653 252 LYS G CG 1056 C CD . LYS A 136 ? 1.9878 1.4195 1.5173 0.0658 0.2357 0.2826 252 LYS G CD 1057 C CE . LYS A 136 ? 1.9869 1.3806 1.4829 0.0820 0.2808 0.2611 252 LYS G CE 1058 N NZ . LYS A 136 ? 1.9679 1.2887 1.3607 0.0679 0.3025 0.2426 252 LYS G NZ 1059 N N . PRO A 137 ? 1.6988 1.1218 1.0983 0.1040 0.0416 0.2069 253 PRO G N 1060 C CA . PRO A 137 ? 1.5379 0.9817 0.9381 0.1173 0.0201 0.1893 253 PRO G CA 1061 C C . PRO A 137 ? 1.5155 0.9625 0.9220 0.1251 0.0505 0.1780 253 PRO G C 1062 O O . PRO A 137 ? 1.5270 0.9557 0.8833 0.1292 0.0455 0.1548 253 PRO G O 1063 C CB . PRO A 137 ? 1.5162 0.9272 0.8461 0.1243 -0.0115 0.1691 253 PRO G CB 1064 C CG . PRO A 137 ? 1.6372 1.0008 0.9161 0.1179 0.0049 0.1712 253 PRO G CG 1065 C CD . PRO A 137 ? 1.6675 1.0355 0.9872 0.1014 0.0328 0.1960 253 PRO G CD 1066 N N . VAL A 138 ? 1.4969 0.9664 0.9647 0.1266 0.0819 0.1953 254 VAL G N 1067 C CA . VAL A 138 ? 1.5867 1.0438 1.0523 0.1333 0.1152 0.1836 254 VAL G CA 1068 C C . VAL A 138 ? 1.6746 1.1568 1.1555 0.1388 0.0972 0.1751 254 VAL G C 1069 O O . VAL A 138 ? 1.6421 1.1613 1.1816 0.1423 0.0885 0.1950 254 VAL G O 1070 C CB . VAL A 138 ? 1.5731 1.0346 1.0980 0.1391 0.1650 0.2057 254 VAL G CB 1071 C CG1 . VAL A 138 ? 1.5880 1.0081 1.0834 0.1435 0.2084 0.1874 254 VAL G CG1 1072 C CG2 . VAL A 138 ? 1.5752 1.0303 1.1070 0.1309 0.1826 0.2217 254 VAL G CG2 1073 N N . VAL A 139 ? 1.6667 1.1291 1.0938 0.1363 0.0941 0.1474 255 VAL G N 1074 C CA . VAL A 139 ? 1.5843 1.0690 1.0185 0.1368 0.0799 0.1363 255 VAL G CA 1075 C C . VAL A 139 ? 1.5796 1.0403 1.0265 0.1371 0.1243 0.1377 255 VAL G C 1076 O O . VAL A 139 ? 1.6004 1.0176 1.0012 0.1300 0.1536 0.1216 255 VAL G O 1077 C CB . VAL A 139 ? 1.5693 1.0559 0.9474 0.1318 0.0527 0.1070 255 VAL G CB 1078 C CG1 . VAL A 139 ? 1.4092 0.9222 0.7984 0.1278 0.0453 0.0958 255 VAL G CG1 1079 C CG2 . VAL A 139 ? 1.4227 0.9198 0.7848 0.1380 0.0150 0.1066 255 VAL G CG2 1080 N N . SER A 140 ? 1.5865 1.0696 1.0916 0.1447 0.1297 0.1587 256 SER G N 1081 C CA . SER A 140 ? 1.7419 1.1957 1.2638 0.1503 0.1735 0.1641 256 SER G CA 1082 C C . SER A 140 ? 1.7437 1.2238 1.3125 0.1560 0.1634 0.1830 256 SER G C 1083 O O . SER A 140 ? 1.7484 1.2745 1.3468 0.1555 0.1255 0.1983 256 SER G O 1084 C CB . SER A 140 ? 1.8054 1.2424 1.3625 0.1626 0.2153 0.1846 256 SER G CB 1085 O OG . SER A 140 ? 1.8241 1.3120 1.4585 0.1730 0.2009 0.2211 256 SER G OG 1086 N N . THR A 141 ? 1.7128 1.1565 1.2833 0.1602 0.1992 0.1840 257 THR G N 1087 C CA . THR A 141 ? 1.7097 1.1681 1.3182 0.1656 0.1922 0.2056 257 THR G CA 1088 C C . THR A 141 ? 1.7185 1.1568 1.3870 0.1903 0.2333 0.2397 257 THR G C 1089 O O . THR A 141 ? 1.8214 1.2150 1.4858 0.2010 0.2813 0.2353 257 THR G O 1090 C CB . THR A 141 ? 1.6831 1.1117 1.2353 0.1466 0.1943 0.1775 257 THR G CB 1091 O OG1 . THR A 141 ? 1.8582 1.2192 1.3632 0.1405 0.2398 0.1550 257 THR G OG1 1092 C CG2 . THR A 141 ? 1.5369 1.0032 1.0482 0.1268 0.1502 0.1499 257 THR G CG2 1093 N N . GLN A 142 ? 1.5589 1.0311 1.2832 0.2005 0.2147 0.2754 258 GLN G N 1094 C CA . GLN A 142 ? 1.6207 1.0813 1.4129 0.2298 0.2489 0.3153 258 GLN G CA 1095 C C . GLN A 142 ? 1.6006 1.1002 1.4668 0.2501 0.2620 0.3445 258 GLN G C 1096 O O . GLN A 142 ? 1.4689 1.0270 1.4156 0.2637 0.2424 0.3895 258 GLN G O 1097 C CB . GLN A 142 ? 1.5814 0.9544 1.3395 0.2392 0.3090 0.2999 258 GLN G CB 1098 C CG . GLN A 142 ? 1.6653 0.9921 1.3545 0.2165 0.3052 0.2750 258 GLN G CG 1099 C CD . GLN A 142 ? 1.9589 1.1910 1.6245 0.2277 0.3658 0.2720 258 GLN G CD 1100 O OE1 . GLN A 142 ? 2.0300 1.2008 1.6589 0.2288 0.4137 0.2479 258 GLN G OE1 1101 N NE2 . GLN A 142 ? 2.0576 1.2708 1.7370 0.2343 0.3641 0.2967 258 GLN G NE2 1102 N N . LEU A 143 ? 1.6948 1.1664 1.5293 0.2470 0.2919 0.3185 259 LEU G N 1103 C CA . LEU A 143 ? 1.6986 1.2036 1.5908 0.2595 0.3093 0.3391 259 LEU G CA 1104 C C . LEU A 143 ? 1.6897 1.2316 1.5549 0.2349 0.2680 0.3253 259 LEU G C 1105 O O . LEU A 143 ? 1.6688 1.1786 1.4501 0.2144 0.2552 0.2858 259 LEU G O 1106 C CB . LEU A 143 ? 1.7412 1.1770 1.6084 0.2721 0.3801 0.3204 259 LEU G CB 1107 C CG . LEU A 143 ? 1.8332 1.2250 1.7421 0.3055 0.4364 0.3403 259 LEU G CG 1108 C CD1 . LEU A 143 ? 1.9080 1.2162 1.7679 0.3113 0.5101 0.3115 259 LEU G CD1 1109 C CD2 . LEU A 143 ? 1.8135 1.2771 1.8500 0.3385 0.4352 0.3994 259 LEU G CD2 1110 N N . LEU A 144 ? 1.6830 1.2914 1.6195 0.2363 0.2469 0.3597 260 LEU G N 1111 C CA . LEU A 144 ? 1.6165 1.2471 1.5257 0.2129 0.2156 0.3486 260 LEU G CA 1112 C C . LEU A 144 ? 1.7765 1.3857 1.6868 0.2167 0.2632 0.3439 260 LEU G C 1113 O O . LEU A 144 ? 1.8502 1.4871 1.8413 0.2353 0.2997 0.3751 260 LEU G O 1114 C CB . LEU A 144 ? 1.5136 1.2201 1.4859 0.2021 0.1680 0.3851 260 LEU G CB 1115 C CG . LEU A 144 ? 1.4803 1.2112 1.4394 0.1888 0.1134 0.3897 260 LEU G CG 1116 C CD1 . LEU A 144 ? 1.3117 1.1143 1.3305 0.1725 0.0713 0.4281 260 LEU G CD1 1117 C CD2 . LEU A 144 ? 1.4200 1.1115 1.2808 0.1703 0.0894 0.3435 260 LEU G CD2 1118 N N . LEU A 145 ? 1.8408 1.4027 1.6616 0.1995 0.2632 0.3063 261 LEU G N 1119 C CA . LEU A 145 ? 1.8383 1.3619 1.6344 0.1990 0.3125 0.2954 261 LEU G CA 1120 C C . LEU A 145 ? 1.8091 1.3553 1.5949 0.1777 0.2876 0.3003 261 LEU G C 1121 O O . LEU A 145 ? 1.7010 1.2524 1.4434 0.1608 0.2350 0.2889 261 LEU G O 1122 C CB . LEU A 145 ? 1.8100 1.2547 1.5039 0.1922 0.3341 0.2522 261 LEU G CB 1123 C CG . LEU A 145 ? 1.7493 1.1550 1.4621 0.2134 0.3892 0.2528 261 LEU G CG 1124 C CD1 . LEU A 145 ? 1.8297 1.1497 1.4377 0.2004 0.4190 0.2101 261 LEU G CD1 1125 C CD2 . LEU A 145 ? 1.7523 1.1773 1.5540 0.2382 0.4439 0.2853 261 LEU G CD2 1126 N N . ASN A 146 ? 1.9032 1.4607 1.7296 0.1789 0.3282 0.3179 262 ASN G N 1127 C CA . ASN A 146 ? 2.0285 1.5908 1.8324 0.1547 0.3173 0.3206 262 ASN G CA 1128 C C . ASN A 146 ? 1.9273 1.5456 1.7633 0.1362 0.2561 0.3410 262 ASN G C 1129 O O . ASN A 146 ? 1.9144 1.5113 1.6917 0.1133 0.2280 0.3303 262 ASN G O 1130 C CB . ASN A 146 ? 2.2800 1.7668 1.9601 0.1382 0.3138 0.2823 262 ASN G CB 1131 C CG . ASN A 146 ? 2.5357 1.9577 2.1641 0.1447 0.3758 0.2602 262 ASN G CG 1132 O OD1 . ASN A 146 ? 2.5297 1.9574 2.2157 0.1610 0.4335 0.2739 262 ASN G OD1 1133 N ND2 . ASN A 146 ? 2.8285 2.1874 2.3454 0.1309 0.3646 0.2263 262 ASN G ND2 1134 N N . GLY A 147 ? 1.8917 1.5752 1.8140 0.1444 0.2352 0.3712 263 GLY G N 1135 C CA . GLY A 147 ? 1.8278 1.5619 1.7752 0.1206 0.1785 0.3910 263 GLY G CA 1136 C C . GLY A 147 ? 1.6892 1.4958 1.7328 0.1082 0.1870 0.4328 263 GLY G C 1137 O O . GLY A 147 ? 1.6525 1.4716 1.7465 0.1212 0.2418 0.4458 263 GLY G O 1138 N N . SER A 148 ? 1.6351 1.4891 1.7013 0.0800 0.1348 0.4529 264 SER G N 1139 C CA . SER A 148 ? 1.7315 1.6721 1.8999 0.0618 0.1325 0.4979 264 SER G CA 1140 C C . SER A 148 ? 1.8366 1.8609 2.1278 0.0873 0.1390 0.5411 264 SER G C 1141 O O . SER A 148 ? 1.8914 1.9001 2.1802 0.1159 0.1381 0.5365 264 SER G O 1142 C CB . SER A 148 ? 1.7825 1.7381 1.9211 0.0159 0.0705 0.5032 264 SER G CB 1143 O OG . SER A 148 ? 1.8071 1.7529 1.9086 0.0157 0.0226 0.4937 264 SER G OG 1144 N N . LEU A 149 ? 1.8981 2.0119 2.2988 0.0774 0.1475 0.5851 265 LEU G N 1145 C CA . LEU A 149 ? 1.9682 2.1728 2.5016 0.1060 0.1545 0.6345 265 LEU G CA 1146 C C . LEU A 149 ? 1.9761 2.2871 2.5895 0.0714 0.0936 0.6828 265 LEU G C 1147 O O . LEU A 149 ? 1.9642 2.2892 2.5503 0.0211 0.0610 0.6822 265 LEU G O 1148 C CB . LEU A 149 ? 2.0208 2.2524 2.6420 0.1394 0.2324 0.6515 265 LEU G CB 1149 C CG . LEU A 149 ? 2.0932 2.2274 2.6529 0.1781 0.3008 0.6122 265 LEU G CG 1150 C CD1 . LEU A 149 ? 2.1491 2.1872 2.5758 0.1533 0.3142 0.5608 265 LEU G CD1 1151 C CD2 . LEU A 149 ? 2.1504 2.3288 2.8229 0.2163 0.3756 0.6405 265 LEU G CD2 1152 N N . ALA A 150 ? 1.9957 2.3762 2.7020 0.0963 0.0775 0.7255 266 ALA G N 1153 C CA . ALA A 150 ? 2.0190 2.5161 2.8197 0.0678 0.0211 0.7815 266 ALA G CA 1154 C C . ALA A 150 ? 2.0751 2.6701 2.9875 0.0497 0.0435 0.8179 266 ALA G C 1155 O O . ALA A 150 ? 2.1254 2.7348 3.1087 0.0890 0.1129 0.8253 266 ALA G O 1156 C CB . ALA A 150 ? 1.9940 2.5414 2.8772 0.1088 0.0093 0.8241 266 ALA G CB 1157 N N . GLU A 151 ? 2.0837 2.7437 3.0102 -0.0115 -0.0104 0.8394 267 GLU G N 1158 C CA . GLU A 151 ? 2.0921 2.8452 3.1194 -0.0367 0.0124 0.8711 267 GLU G CA 1159 C C . GLU A 151 ? 2.0990 2.9925 3.3127 0.0014 0.0261 0.9396 267 GLU G C 1160 O O . GLU A 151 ? 2.1264 3.0745 3.4422 0.0272 0.0897 0.9584 267 GLU G O 1161 C CB . GLU A 151 ? 2.0938 2.8516 3.0578 -0.1189 -0.0442 0.8650 267 GLU G CB 1162 C CG . GLU A 151 ? 2.0897 2.7042 2.8843 -0.1434 -0.0377 0.7996 267 GLU G CG 1163 C CD . GLU A 151 ? 2.0846 2.6927 2.8130 -0.2233 -0.0933 0.7955 267 GLU G CD 1164 O OE1 . GLU A 151 ? 2.0698 2.7797 2.8692 -0.2647 -0.1454 0.8395 267 GLU G OE1 1165 O OE2 . GLU A 151 ? 2.0972 2.5948 2.6989 -0.2458 -0.0861 0.7492 267 GLU G OE2 1166 N N . GLU A 152 ? 2.0751 3.0266 3.3323 0.0054 -0.0325 0.9783 268 GLU G N 1167 C CA . GLU A 152 ? 2.0547 3.1420 3.4891 0.0444 -0.0322 1.0506 268 GLU G CA 1168 C C . GLU A 152 ? 2.0056 3.0799 3.5017 0.1290 0.0073 1.0698 268 GLU G C 1169 O O . GLU A 152 ? 2.0294 3.1605 3.6531 0.1825 0.0711 1.0996 268 GLU G O 1170 C CB . GLU A 152 ? 2.0883 3.2700 3.5513 -0.0083 -0.1300 1.0978 268 GLU G CB 1171 C CG . GLU A 152 ? 2.1662 3.4097 3.6225 -0.0954 -0.1773 1.1058 268 GLU G CG 1172 C CD . GLU A 152 ? 2.2422 3.6031 3.8438 -0.0993 -0.1329 1.1410 268 GLU G CD 1173 O OE1 . GLU A 152 ? 2.2477 3.7177 4.0150 -0.0440 -0.1011 1.1950 268 GLU G OE1 1174 O OE2 . GLU A 152 ? 2.2925 3.6344 3.8420 -0.1576 -0.1276 1.1151 268 GLU G OE2 1175 N N . GLU A 153 ? 1.9590 2.9517 3.3597 0.1404 -0.0268 1.0512 269 GLU G N 1176 C CA . GLU A 153 ? 1.9677 2.9261 3.4014 0.2137 0.0051 1.0656 269 GLU G CA 1177 C C . GLU A 153 ? 1.9720 2.7989 3.2436 0.2077 -0.0205 1.0153 269 GLU G C 1178 O O . GLU A 153 ? 2.0177 2.8102 3.1794 0.1497 -0.0766 0.9862 269 GLU G O 1179 C CB . GLU A 153 ? 1.9686 3.0518 3.5540 0.2445 -0.0282 1.1490 269 GLU G CB 1180 C CG . GLU A 153 ? 1.9831 3.2088 3.7589 0.2702 0.0068 1.2080 269 GLU G CG 1181 C CD . GLU A 153 ? 1.9951 3.3502 3.9204 0.3000 -0.0374 1.2955 269 GLU G CD 1182 O OE1 . GLU A 153 ? 1.9993 3.3342 3.8653 0.2857 -0.1059 1.3097 269 GLU G OE1 1183 O OE2 . GLU A 153 ? 2.0021 3.4800 4.1038 0.3379 -0.0038 1.3517 269 GLU G OE2 1184 N N . ILE A 154 ? 1.9062 2.6570 3.1634 0.2677 0.0259 1.0040 270 ILE G N 1185 C CA . ILE A 154 ? 1.8058 2.4277 2.9160 0.2687 0.0187 0.9526 270 ILE G CA 1186 C C . ILE A 154 ? 1.7068 2.3357 2.7444 0.2197 -0.0696 0.9582 270 ILE G C 1187 O O . ILE A 154 ? 1.7268 2.4510 2.8443 0.2111 -0.1225 1.0192 270 ILE G O 1188 C CB . ILE A 154 ? 1.6958 2.2666 2.8371 0.3387 0.0678 0.9655 270 ILE G CB 1189 C CG1 . ILE A 154 ? 1.7135 2.2776 2.9343 0.3914 0.1608 0.9653 270 ILE G CG1 1190 C CG2 . ILE A 154 ? 1.6918 2.1320 2.6839 0.3361 0.0656 0.9114 270 ILE G CG2 1191 C CD1 . ILE A 154 ? 1.6945 2.3928 3.1063 0.4299 0.1729 1.0438 270 ILE G CD1 1192 N N . ILE A 155 ? 1.6405 2.1706 2.5269 0.1868 -0.0847 0.8955 271 ILE G N 1193 C CA . ILE A 155 ? 1.6286 2.1537 2.4297 0.1354 -0.1613 0.8913 271 ILE G CA 1194 C C . ILE A 155 ? 1.6335 2.0530 2.3155 0.1446 -0.1618 0.8497 271 ILE G C 1195 O O . ILE A 155 ? 1.5743 1.9008 2.1763 0.1587 -0.1179 0.7927 271 ILE G O 1196 C CB . ILE A 155 ? 1.6295 2.1500 2.3575 0.0711 -0.1936 0.8584 271 ILE G CB 1197 C CG1 . ILE A 155 ? 1.7066 2.3407 2.5495 0.0484 -0.2024 0.9034 271 ILE G CG1 1198 C CG2 . ILE A 155 ? 1.5700 2.0743 2.2023 0.0194 -0.2658 0.8512 271 ILE G CG2 1199 C CD1 . ILE A 155 ? 1.7466 2.3636 2.5210 -0.0117 -0.2193 0.8700 271 ILE G CD1 1200 N N . ILE A 156 ? 1.6916 2.1299 2.3635 0.1342 -0.2124 0.8811 272 ILE G N 1201 C CA . ILE A 156 ? 1.6507 1.9975 2.2116 0.1362 -0.2153 0.8450 272 ILE G CA 1202 C C . ILE A 156 ? 1.6938 2.0094 2.1344 0.0769 -0.2654 0.8073 272 ILE G C 1203 O O . ILE A 156 ? 1.7037 2.0757 2.1461 0.0337 -0.3256 0.8381 272 ILE G O 1204 C CB . ILE A 156 ? 1.5830 1.9493 2.1863 0.1614 -0.2338 0.8978 272 ILE G CB 1205 C CG1 . ILE A 156 ? 1.5424 1.9462 2.2791 0.2239 -0.1844 0.9432 272 ILE G CG1 1206 C CG2 . ILE A 156 ? 1.3862 1.6518 1.8751 0.1641 -0.2248 0.8567 272 ILE G CG2 1207 C CD1 . ILE A 156 ? 1.5352 1.8525 2.2487 0.2644 -0.1026 0.8938 272 ILE G CD1 1208 N N . ARG A 157 ? 1.7117 1.9362 2.0467 0.0751 -0.2394 0.7409 273 ARG G N 1209 C CA . ARG A 157 ? 1.7604 1.9462 1.9812 0.0265 -0.2758 0.6991 273 ARG G CA 1210 C C . ARG A 157 ? 1.7525 1.8727 1.8808 0.0276 -0.2792 0.6707 273 ARG G C 1211 O O . ARG A 157 ? 1.7383 1.8066 1.8531 0.0634 -0.2346 0.6468 273 ARG G O 1212 C CB . ARG A 157 ? 1.8168 1.9596 1.9942 0.0209 -0.2471 0.6478 273 ARG G CB 1213 C CG . ARG A 157 ? 1.8592 2.0627 2.1268 0.0192 -0.2349 0.6746 273 ARG G CG 1214 C CD . ARG A 157 ? 1.8870 2.0431 2.0985 0.0047 -0.2139 0.6276 273 ARG G CD 1215 N NE . ARG A 157 ? 1.9172 2.1266 2.1592 -0.0380 -0.2426 0.6497 273 ARG G NE 1216 C CZ . ARG A 157 ? 1.9046 2.1763 2.2452 -0.0318 -0.2202 0.6812 273 ARG G CZ 1217 N NH1 . ARG A 157 ? 1.8826 2.1624 2.2944 0.0185 -0.1650 0.6909 273 ARG G NH1 1218 N NH2 . ARG A 157 ? 1.9159 2.2375 2.2799 -0.0783 -0.2489 0.7008 273 ARG G NH2 1219 N N . SER A 158 ? 1.7893 1.9126 1.8560 -0.0128 -0.3292 0.6764 274 SER G N 1220 C CA . SER A 158 ? 1.8155 1.8742 1.7833 -0.0183 -0.3278 0.6406 274 SER G CA 1221 C C . SER A 158 ? 1.8504 1.9015 1.7285 -0.0724 -0.3776 0.6314 274 SER G C 1222 O O . SER A 158 ? 1.9459 2.0500 1.8460 -0.1064 -0.4240 0.6714 274 SER G O 1223 C CB . SER A 158 ? 1.8283 1.8811 1.8282 0.0139 -0.3129 0.6716 274 SER G CB 1224 O OG . SER A 158 ? 1.9085 2.0238 1.9623 0.0026 -0.3571 0.7387 274 SER G OG 1225 N N . GLU A 159 ? 1.7757 1.7629 1.5522 -0.0822 -0.3675 0.5794 275 GLU G N 1226 C CA . GLU A 159 ? 1.8277 1.7969 1.5093 -0.1329 -0.4065 0.5651 275 GLU G CA 1227 C C . GLU A 159 ? 1.9200 1.9196 1.5964 -0.1582 -0.4486 0.6157 275 GLU G C 1228 O O . GLU A 159 ? 1.9848 2.0099 1.6344 -0.2053 -0.4967 0.6381 275 GLU G O 1229 C CB . GLU A 159 ? 1.8707 1.7703 1.4541 -0.1319 -0.3797 0.5001 275 GLU G CB 1230 C CG . GLU A 159 ? 1.9657 1.8314 1.4503 -0.1771 -0.4035 0.4671 275 GLU G CG 1231 C CD . GLU A 159 ? 2.0111 1.8175 1.4088 -0.1717 -0.3748 0.4080 275 GLU G CD 1232 O OE1 . GLU A 159 ? 2.0287 1.8260 1.4458 -0.1360 -0.3390 0.3915 275 GLU G OE1 1233 O OE2 . GLU A 159 ? 2.0036 1.7727 1.3138 -0.2041 -0.3865 0.3779 275 GLU G OE2 1234 N N . ASN A 160 ? 1.9185 1.9115 1.6157 -0.1295 -0.4316 0.6350 276 ASN G N 1235 C CA . ASN A 160 ? 1.9624 1.9855 1.6708 -0.1432 -0.4692 0.6944 276 ASN G CA 1236 C C . ASN A 160 ? 1.8098 1.8447 1.6104 -0.0888 -0.4392 0.7314 276 ASN G C 1237 O O . ASN A 160 ? 1.6811 1.6632 1.4598 -0.0608 -0.3946 0.7005 276 ASN G O 1238 C CB . ASN A 160 ? 2.0952 2.0663 1.6848 -0.1757 -0.4781 0.6704 276 ASN G CB 1239 C CG . ASN A 160 ? 2.1837 2.1586 1.6905 -0.2393 -0.5288 0.6706 276 ASN G CG 1240 O OD1 . ASN A 160 ? 2.0931 2.1126 1.6130 -0.2683 -0.5800 0.7279 276 ASN G OD1 1241 N ND2 . ASN A 160 ? 2.2925 2.2179 1.7106 -0.2617 -0.5147 0.6073 276 ASN G ND2 1242 N N . LEU A 161 ? 1.8394 1.9425 1.7430 -0.0744 -0.4624 0.7982 277 LEU G N 1243 C CA . LEU A 161 ? 1.9164 2.0243 1.9121 -0.0168 -0.4278 0.8342 277 LEU G CA 1244 C C . LEU A 161 ? 2.0144 2.0719 1.9589 -0.0108 -0.4243 0.8477 277 LEU G C 1245 O O . LEU A 161 ? 2.0340 2.0412 1.9897 0.0289 -0.3752 0.8359 277 LEU G O 1246 C CB . LEU A 161 ? 1.9801 2.1810 2.1044 -0.0008 -0.4552 0.9086 277 LEU G CB 1247 C CG . LEU A 161 ? 1.9986 2.2553 2.1673 -0.0194 -0.4647 0.8985 277 LEU G CG 1248 C CD1 . LEU A 161 ? 2.0834 2.3536 2.1666 -0.0904 -0.5236 0.8882 277 LEU G CD1 1249 C CD2 . LEU A 161 ? 1.9743 2.3255 2.2955 0.0120 -0.4691 0.9661 277 LEU G CD2 1250 N N . THR A 162 ? 2.0531 2.1186 1.9324 -0.0554 -0.4765 0.8723 278 THR G N 1251 C CA . THR A 162 ? 2.1208 2.1404 1.9467 -0.0565 -0.4758 0.8859 278 THR G CA 1252 C C . THR A 162 ? 2.1218 2.0572 1.8563 -0.0569 -0.4295 0.8231 278 THR G C 1253 O O . THR A 162 ? 2.2115 2.0970 1.9365 -0.0336 -0.3990 0.8289 278 THR G O 1254 C CB . THR A 162 ? 2.2220 2.2607 1.9803 -0.1128 -0.5278 0.8925 278 THR G CB 1255 O OG1 . THR A 162 ? 2.2752 2.2709 1.9098 -0.1605 -0.5320 0.8370 278 THR G OG1 1256 C CG2 . THR A 162 ? 2.2172 2.3461 2.0550 -0.1289 -0.5707 0.9266 278 THR G CG2 1257 N N . ASN A 163 ? 2.0020 1.9224 1.6712 -0.0844 -0.4216 0.7582 279 ASN G N 1258 C CA . ASN A 163 ? 1.9082 1.7661 1.4917 -0.0921 -0.3834 0.6933 279 ASN G CA 1259 C C . ASN A 163 ? 1.8477 1.6784 1.4857 -0.0426 -0.3245 0.6675 279 ASN G C 1260 O O . ASN A 163 ? 1.8445 1.6908 1.5248 -0.0248 -0.3061 0.6404 279 ASN G O 1261 C CB . ASN A 163 ? 1.8773 1.7314 1.3897 -0.1274 -0.3913 0.6371 279 ASN G CB 1262 C CG . ASN A 163 ? 1.8611 1.6614 1.2902 -0.1345 -0.3523 0.5711 279 ASN G CG 1263 O OD1 . ASN A 163 ? 1.7844 1.5535 1.2190 -0.1111 -0.3134 0.5587 279 ASN G OD1 1264 N ND2 . ASN A 163 ? 1.8887 1.6786 1.2428 -0.1667 -0.3602 0.5267 279 ASN G ND2 1265 N N . ASN A 164 ? 1.8706 1.6546 1.4996 -0.0245 -0.2942 0.6742 280 ASN G N 1266 C CA . ASN A 164 ? 1.8271 1.5780 1.5049 0.0193 -0.2393 0.6573 280 ASN G CA 1267 C C . ASN A 164 ? 1.8386 1.5680 1.4737 0.0142 -0.2054 0.5810 280 ASN G C 1268 O O . ASN A 164 ? 1.9371 1.6483 1.6084 0.0439 -0.1652 0.5585 280 ASN G O 1269 C CB . ASN A 164 ? 1.8323 1.5255 1.4931 0.0315 -0.2155 0.6801 280 ASN G CB 1270 C CG . ASN A 164 ? 1.8251 1.4689 1.3830 -0.0021 -0.1970 0.6312 280 ASN G CG 1271 O OD1 . ASN A 164 ? 1.7384 1.3734 1.2636 -0.0101 -0.1709 0.5690 280 ASN G OD1 1272 N ND2 . ASN A 164 ? 1.7985 1.4136 1.3073 -0.0223 -0.2115 0.6636 280 ASN G ND2 1273 N N . ALA A 165 ? 1.7859 1.5203 1.3465 -0.0227 -0.2232 0.5432 281 ALA G N 1274 C CA . ALA A 165 ? 1.7162 1.4383 1.2394 -0.0260 -0.1969 0.4758 281 ALA G CA 1275 C C . ALA A 165 ? 1.7656 1.5206 1.3192 -0.0205 -0.2101 0.4621 281 ALA G C 1276 O O . ALA A 165 ? 1.7427 1.4909 1.2724 -0.0188 -0.1936 0.4115 281 ALA G O 1277 C CB . ALA A 165 ? 1.6810 1.3890 1.1119 -0.0631 -0.2013 0.4410 281 ALA G CB 1278 N N . LYS A 166 ? 1.8662 1.6587 1.4767 -0.0171 -0.2397 0.5100 282 LYS G N 1279 C CA . LYS A 166 ? 1.8964 1.7166 1.5354 -0.0156 -0.2493 0.4986 282 LYS G CA 1280 C C . LYS A 166 ? 1.9820 1.8060 1.7037 0.0259 -0.2154 0.5104 282 LYS G C 1281 O O . LYS A 166 ? 1.8769 1.7065 1.6569 0.0488 -0.2070 0.5549 282 LYS G O 1282 C CB . LYS A 166 ? 1.9024 1.7679 1.5553 -0.0438 -0.3013 0.5412 282 LYS G CB 1283 C CG . LYS A 166 ? 1.9521 1.8069 1.5111 -0.0912 -0.3352 0.5273 282 LYS G CG 1284 C CD . LYS A 166 ? 1.9767 1.7939 1.4636 -0.0984 -0.3131 0.4580 282 LYS G CD 1285 C CE . LYS A 166 ? 2.1338 1.9346 1.5256 -0.1444 -0.3407 0.4413 282 LYS G CE 1286 N NZ . LYS A 166 ? 2.1742 1.9371 1.5007 -0.1431 -0.3113 0.3752 282 LYS G NZ 1287 N N . THR A 167 ? 2.2983 2.1144 2.0199 0.0359 -0.1944 0.4706 283 THR G N 1294 N N . ILE A 168 ? 2.3955 2.0202 2.2374 -0.0146 -0.3130 0.6622 284 ILE G N 1295 C CA . ILE A 168 ? 2.0909 1.7155 1.9838 -0.0455 -0.3110 0.6866 284 ILE G CA 1296 C C . ILE A 168 ? 2.0815 1.6062 1.8834 -0.0282 -0.2686 0.6710 284 ILE G C 1297 O O . ILE A 168 ? 2.1047 1.6070 1.8975 -0.0013 -0.2416 0.6557 284 ILE G O 1298 C CB . ILE A 168 ? 1.8372 1.5828 1.9345 -0.0717 -0.3226 0.7244 284 ILE G CB 1299 C CG1 . ILE A 168 ? 1.7273 1.5800 1.9247 -0.0957 -0.3599 0.7475 284 ILE G CG1 1300 C CG2 . ILE A 168 ? 1.8268 1.5811 1.9850 -0.1007 -0.3204 0.7531 284 ILE G CG2 1301 C CD1 . ILE A 168 ? 1.6289 1.6133 2.0469 -0.1226 -0.3707 0.7916 284 ILE G CD1 1302 N N . ILE A 169 ? 2.1033 1.5643 1.8315 -0.0465 -0.2607 0.6758 285 ILE G N 1303 C CA . ILE A 169 ? 2.0998 1.4741 1.7553 -0.0391 -0.2133 0.6690 285 ILE G CA 1304 C C . ILE A 169 ? 2.0556 1.4456 1.7909 -0.0800 -0.2057 0.7004 285 ILE G C 1305 O O . ILE A 169 ? 2.0864 1.4937 1.8353 -0.1158 -0.2309 0.7207 285 ILE G O 1306 C CB . ILE A 169 ? 1.8869 1.1805 1.4017 -0.0304 -0.2014 0.6513 285 ILE G CB 1307 C CG1 . ILE A 169 ? 2.0676 1.3394 1.5454 -0.0711 -0.2302 0.6626 285 ILE G CG1 1308 C CG2 . ILE A 169 ? 1.9032 1.2045 1.3685 0.0046 -0.2148 0.6250 285 ILE G CG2 1309 C CD1 . ILE A 169 ? 2.3481 1.5497 1.7642 -0.0975 -0.2036 0.6691 285 ILE G CD1 1310 N N . VAL A 170 ? 2.0068 1.3917 1.7987 -0.0774 -0.1705 0.7051 286 VAL G N 1311 C CA . VAL A 170 ? 2.0411 1.4367 1.9081 -0.1161 -0.1524 0.7338 286 VAL G CA 1312 C C . VAL A 170 ? 2.1658 1.4399 1.8904 -0.1276 -0.0992 0.7228 286 VAL G C 1313 O O . VAL A 170 ? 2.2071 1.4093 1.8384 -0.0994 -0.0607 0.6995 286 VAL G O 1314 C CB . VAL A 170 ? 2.0231 1.4857 2.0516 -0.1125 -0.1371 0.7474 286 VAL G CB 1315 C CG1 . VAL A 170 ? 2.0730 1.5561 2.1946 -0.1536 -0.1125 0.7779 286 VAL G CG1 1316 C CG2 . VAL A 170 ? 1.9609 1.5594 2.1492 -0.0985 -0.1849 0.7629 286 VAL G CG2 1317 N N . HIS A 171 ? 2.2790 1.5463 2.0060 -0.1725 -0.0960 0.7454 287 HIS G N 1318 C CA . HIS A 171 ? 2.4204 1.5973 2.0419 -0.1955 -0.0466 0.7440 287 HIS G CA 1319 C C . HIS A 171 ? 2.4622 1.6426 2.1592 -0.2465 -0.0008 0.7632 287 HIS G C 1320 O O . HIS A 171 ? 2.5395 1.7777 2.3169 -0.2923 -0.0251 0.7944 287 HIS G O 1321 C CB . HIS A 171 ? 2.4894 1.6533 2.0359 -0.2147 -0.0887 0.7486 287 HIS G CB 1322 C CG . HIS A 171 ? 2.6828 1.7741 2.1177 -0.2275 -0.0667 0.7416 287 HIS G CG 1323 N ND1 . HIS A 171 ? 2.8276 1.8871 2.2457 -0.2809 -0.0373 0.7604 287 HIS G ND1 1324 C CD2 . HIS A 171 ? 2.7602 1.8159 2.1024 -0.2043 -0.0828 0.7168 287 HIS G CD2 1325 C CE1 . HIS A 171 ? 2.9139 1.9179 2.2262 -0.2907 -0.0420 0.7477 287 HIS G CE1 1326 N NE2 . HIS A 171 ? 2.8906 1.8874 2.1524 -0.2464 -0.0730 0.7186 287 HIS G NE2 1327 N N . LEU A 172 ? 2.4071 1.5489 2.1058 -0.2521 0.0493 0.7565 288 LEU G N 1328 C CA . LEU A 172 ? 2.3779 1.5597 2.1972 -0.3209 0.0822 0.7917 288 LEU G CA 1329 C C . LEU A 172 ? 2.4980 1.6517 2.2708 -0.3860 0.1146 0.8103 288 LEU G C 1330 O O . LEU A 172 ? 2.4973 1.5774 2.1306 -0.3715 0.1265 0.7965 288 LEU G O 1331 C CB . LEU A 172 ? 2.3617 1.4943 2.1593 -0.3213 0.1323 0.7758 288 LEU G CB 1332 C CG . LEU A 172 ? 1.9593 1.1136 1.7960 -0.2571 0.1005 0.7550 288 LEU G CG 1333 C CD1 . LEU A 172 ? 2.3530 1.4595 2.1706 -0.2663 0.1449 0.7431 288 LEU G CD1 1334 C CD2 . LEU A 172 ? 1.8281 1.1441 1.9255 -0.2398 0.0593 0.7914 288 LEU G CD2 1335 N N . ASN A 173 ? 2.5375 1.7865 2.4741 -0.4507 0.1292 0.8487 289 ASN G N 1336 C CA . ASN A 173 ? 2.6077 1.8457 2.5129 -0.5241 0.1650 0.8645 289 ASN G CA 1337 C C . ASN A 173 ? 2.6026 1.8148 2.4912 -0.5777 0.2550 0.8573 289 ASN G C 1338 O O . ASN A 173 ? 2.6255 1.8206 2.4654 -0.6343 0.2964 0.8646 289 ASN G O 1339 C CB . ASN A 173 ? 2.5826 1.9547 2.6680 -0.5639 0.1269 0.9086 289 ASN G CB 1340 C CG . ASN A 173 ? 2.4987 2.0293 2.8628 -0.5697 0.1475 0.9404 289 ASN G CG 1341 O OD1 . ASN A 173 ? 2.4306 1.9783 2.8718 -0.5247 0.1654 0.9305 289 ASN G OD1 1342 N ND2 . ASN A 173 ? 2.4864 2.1409 3.0218 -0.6178 0.1497 0.9779 289 ASN G ND2 1343 N N . LYS A 174 ? 2.5416 1.7645 2.4802 -0.5591 0.2821 0.8443 290 LYS G N 1344 C CA . LYS A 174 ? 2.3525 1.5726 2.2850 -0.6148 0.3682 0.8337 290 LYS G CA 1345 C C . LYS A 174 ? 2.6946 1.8522 2.5577 -0.5677 0.3677 0.8084 290 LYS G C 1346 O O . LYS A 174 ? 2.4329 1.6764 2.4831 -0.5113 0.3521 0.8156 290 LYS G O 1347 C CB . LYS A 174 ? 2.3852 1.7993 2.6145 -0.6557 0.4148 0.8601 290 LYS G CB 1348 C CG . LYS A 174 ? 2.4435 1.9033 2.7045 -0.7125 0.5225 0.8412 290 LYS G CG 1349 C CD . LYS A 174 ? 2.3816 2.0425 2.9481 -0.7395 0.5968 0.8459 290 LYS G CD 1350 C CE . LYS A 174 ? 2.4527 2.1636 3.0216 -0.7947 0.7207 0.8060 290 LYS G CE 1351 N NZ . LYS A 174 ? 2.4123 2.3278 3.2640 -0.8215 0.7993 0.7914 290 LYS G NZ 1352 N N . SER A 175 ? 2.8826 1.9255 2.5486 -0.5464 0.4037 0.7740 291 SER G N 1353 C CA . SER A 175 ? 2.7700 1.9043 2.4839 -0.5155 0.3032 0.8100 291 SER G CA 1354 C C . SER A 175 ? 2.7622 1.8707 2.5370 -0.5270 0.4246 0.7723 291 SER G C 1355 O O . SER A 175 ? 2.7896 1.9783 2.7039 -0.5703 0.5263 0.7651 291 SER G O 1356 C CB . SER A 175 ? 2.7937 1.8558 2.3563 -0.4729 0.3421 0.8038 291 SER G CB 1357 O OG . SER A 175 ? 2.8476 1.8953 2.3235 -0.5542 0.4094 0.7848 291 SER G OG 1358 N N . VAL A 176 ? 2.6773 1.7450 2.4436 -0.4564 0.4169 0.7461 292 VAL G N 1359 C CA . VAL A 176 ? 2.6519 1.7407 2.5545 -0.4302 0.5358 0.7063 292 VAL G CA 1360 C C . VAL A 176 ? 2.7546 1.7366 2.4498 -0.4059 0.5394 0.6661 292 VAL G C 1361 O O . VAL A 176 ? 2.7495 1.6934 2.3612 -0.3517 0.4421 0.6711 292 VAL G O 1362 C CB . VAL A 176 ? 2.4982 1.6697 2.6769 -0.3606 0.5288 0.7143 292 VAL G CB 1363 C CG1 . VAL A 176 ? 2.4999 1.7094 2.8066 -0.3301 0.6211 0.6426 292 VAL G CG1 1364 C CG2 . VAL A 176 ? 2.4519 1.7549 2.8583 -0.3793 0.5191 0.7508 292 VAL G CG2 1365 N N . GLU A 177 ? 2.8211 1.7778 2.4480 -0.4491 0.6529 0.6178 293 GLU G N 1366 C CA . GLU A 177 ? 2.8207 1.6808 2.2322 -0.4381 0.6615 0.5735 293 GLU G CA 1367 C C . GLU A 177 ? 2.7425 1.5869 2.2306 -0.3630 0.6635 0.5381 293 GLU G C 1368 O O . GLU A 177 ? 2.6761 1.6307 2.4199 -0.3256 0.6938 0.5026 293 GLU G O 1369 C CB . GLU A 177 ? 2.9229 1.7929 2.2457 -0.5157 0.7753 0.5237 293 GLU G CB 1370 C CG . GLU A 177 ? 3.0459 1.9288 2.2438 -0.5752 0.7286 0.5550 293 GLU G CG 1371 C CD . GLU A 177 ? 3.2285 2.1263 2.3086 -0.6511 0.8193 0.5098 293 GLU G CD 1372 O OE1 . GLU A 177 ? 3.2513 2.1546 2.2318 -0.6956 0.7809 0.5347 293 GLU G OE1 1373 O OE2 . GLU A 177 ? 3.3324 2.2475 2.4346 -0.6645 0.9305 0.4462 293 GLU G OE2 1374 N N . ILE A 178 ? 2.7234 1.4722 2.0166 -0.3299 0.6003 0.5373 294 ILE G N 1375 C CA . ILE A 178 ? 2.6905 1.4001 1.9969 -0.2706 0.6032 0.5041 294 ILE G CA 1376 C C . ILE A 178 ? 2.7010 1.3277 1.7759 -0.2880 0.6370 0.4514 294 ILE G C 1377 O O . ILE A 178 ? 2.6974 1.2919 1.5862 -0.2872 0.5600 0.4592 294 ILE G O 1378 C CB . ILE A 178 ? 2.4549 1.1923 1.8043 -0.1984 0.4669 0.5421 294 ILE G CB 1379 C CG1 . ILE A 178 ? 2.4791 1.1745 1.8240 -0.1427 0.4629 0.5126 294 ILE G CG1 1380 C CG2 . ILE A 178 ? 2.3923 1.1640 1.6141 -0.2007 0.3567 0.5613 294 ILE G CG2 1381 C CD1 . ILE A 178 ? 2.3690 1.1421 1.7787 -0.0853 0.3319 0.5359 294 ILE G CD1 1382 N N . ASN A 179 ? 2.8188 1.5096 1.9798 -0.2906 0.7175 0.3656 295 ASN G N 1383 C CA . ASN A 179 ? 3.0072 1.6413 1.9647 -0.3174 0.7621 0.3063 295 ASN G CA 1384 C C . ASN A 179 ? 2.9788 1.5608 1.8897 -0.2580 0.7214 0.2805 295 ASN G C 1385 O O . ASN A 179 ? 2.9210 1.5668 2.0175 -0.2180 0.7455 0.2250 295 ASN G O 1386 C CB . ASN A 179 ? 3.0981 1.8346 2.1579 -0.3575 0.8775 0.2167 295 ASN G CB 1387 C CG . ASN A 179 ? 3.2440 1.9291 2.0612 -0.4093 0.9298 0.1649 295 ASN G CG 1388 O OD1 . ASN A 179 ? 3.2750 1.8495 1.8721 -0.4024 0.8776 0.1868 295 ASN G OD1 1389 N ND2 . ASN A 179 ? 3.3291 2.1034 2.1923 -0.4599 1.0340 0.0936 295 ASN G ND2 1390 N N . CYS A 180 ? 2.9917 1.4590 1.6560 -0.2551 0.6632 0.3159 296 CYS G N 1391 C CA . CYS A 180 ? 2.9503 1.3758 1.5696 -0.2008 0.6182 0.2987 296 CYS G CA 1392 C C . CYS A 180 ? 3.1147 1.4878 1.5207 -0.2344 0.6560 0.2432 296 CYS G C 1393 O O . CYS A 180 ? 3.2427 1.5742 1.4586 -0.2758 0.6409 0.2569 296 CYS G O 1394 C CB . CYS A 180 ? 2.8301 1.2525 1.4285 -0.1453 0.4891 0.3593 296 CYS G CB 1395 S SG . CYS A 180 ? 3.0624 1.5813 1.9409 -0.0966 0.4347 0.4117 296 CYS G SG 1396 N N . THR A 181 ? 3.0557 1.4634 1.5391 -0.2094 0.6836 0.1700 297 THR G N 1397 C CA . THR A 181 ? 3.1432 1.5198 1.4518 -0.2423 0.7257 0.1040 297 THR G CA 1398 C C . THR A 181 ? 3.0875 1.4378 1.3822 -0.1938 0.6814 0.0776 297 THR G C 1399 O O . THR A 181 ? 2.8877 1.2794 1.3855 -0.1392 0.6542 0.0723 297 THR G O 1400 C CB . THR A 181 ? 3.0956 1.5644 1.5195 -0.2823 0.8401 0.0050 297 THR G CB 1401 O OG1 . THR A 181 ? 3.1022 1.6232 1.5904 -0.3252 0.8866 0.0257 297 THR G OG1 1402 C CG2 . THR A 181 ? 3.4360 1.8773 1.6499 -0.3318 0.8906 -0.0623 297 THR G CG2 1403 N N . ARG A 182 ? 3.1935 1.4751 1.2452 -0.2174 0.6694 0.0672 298 ARG G N 1404 C CA . ARG A 182 ? 3.2105 1.4782 1.2310 -0.1895 0.6458 0.0233 298 ARG G CA 1405 C C . ARG A 182 ? 3.3822 1.6432 1.2362 -0.2500 0.7142 -0.0548 298 ARG G C 1406 O O . ARG A 182 ? 3.3788 1.6236 1.0847 -0.2814 0.6700 -0.0251 298 ARG G O 1407 C CB . ARG A 182 ? 3.1605 1.3523 1.0393 -0.1480 0.5395 0.1015 298 ARG G CB 1408 C CG . ARG A 182 ? 3.1385 1.3300 1.0193 -0.1143 0.5042 0.0661 298 ARG G CG 1409 C CD . ARG A 182 ? 3.1438 1.3493 0.9324 -0.1097 0.4107 0.0859 298 ARG G CD 1410 N NE . ARG A 182 ? 3.4216 1.6470 1.1156 -0.1691 0.4479 0.0361 298 ARG G NE 1411 C CZ . ARG A 182 ? 3.5709 1.8368 1.2283 -0.1756 0.3835 0.0468 298 ARG G CZ 1412 N NH1 . ARG A 182 ? 3.5476 1.8481 1.2662 -0.1265 0.2881 0.0908 298 ARG G NH1 1413 N NH2 . ARG A 182 ? 3.7013 1.9898 1.2763 -0.2312 0.4223 0.0087 298 ARG G NH2 1414 N N . PRO A 183 ? 3.4386 1.7675 1.4304 -0.2577 0.7887 -0.1577 299 PRO G N 1415 C CA . PRO A 183 ? 3.6583 1.9986 1.5109 -0.3184 0.8659 -0.2473 299 PRO G CA 1416 C C . PRO A 183 ? 3.7192 2.0197 1.3924 -0.3239 0.7897 -0.2294 299 PRO G C 1417 O O . PRO A 183 ? 3.6970 1.9520 1.3572 -0.2736 0.7045 -0.1779 299 PRO G O 1418 C CB . PRO A 183 ? 3.6441 2.0602 1.7333 -0.2959 0.9276 -0.3554 299 PRO G CB 1419 C CG . PRO A 183 ? 3.4437 1.9055 1.8056 -0.2440 0.9109 -0.3170 299 PRO G CG 1420 C CD . PRO A 183 ? 3.2984 1.6978 1.5947 -0.2086 0.8038 -0.1957 299 PRO G CD 1421 N N . SER A 184 ? 3.7815 2.1352 1.3847 -0.3764 0.8028 -0.2658 300 SER G N 1422 C CA . SER A 184 ? 3.8542 2.2091 1.3662 -0.3728 0.7129 -0.2359 300 SER G CA 1423 C C . SER A 184 ? 3.9575 2.3297 1.4885 -0.3686 0.7427 -0.3282 300 SER G C 1424 O O . SER A 184 ? 3.9696 2.3459 1.6076 -0.3586 0.8226 -0.4131 300 SER G O 1425 C CB . SER A 184 ? 3.9694 2.3677 1.3896 -0.4264 0.7002 -0.2140 300 SER G CB 1426 O OG . SER A 184 ? 4.0457 2.4977 1.4727 -0.4825 0.8054 -0.2854 300 SER G OG 1427 N N . ASN A 185 ? 3.9889 2.3742 1.4441 -0.3694 0.6738 -0.3129 301 ASN G N 1428 C CA . ASN A 185 ? 4.0093 2.4165 1.4642 -0.3729 0.6858 -0.3938 301 ASN G CA 1429 C C . ASN A 185 ? 3.9191 2.2736 1.4342 -0.3157 0.6415 -0.3912 301 ASN G C 1430 O O . ASN A 185 ? 3.6928 2.0425 1.1635 -0.2944 0.5572 -0.3471 301 ASN G O 1431 C CB . ASN A 185 ? 4.0790 2.5365 1.5929 -0.4104 0.7990 -0.5153 301 ASN G CB 1432 C CG . ASN A 185 ? 4.1562 2.6487 1.6496 -0.4255 0.8024 -0.5966 301 ASN G CG 1433 O OD1 . ASN A 185 ? 4.0205 2.5112 1.4247 -0.4234 0.7258 -0.5566 301 ASN G OD1 1434 N ND2 . ASN A 185 ? 4.2101 2.7416 1.8020 -0.4382 0.8908 -0.7132 301 ASN G ND2 1435 N N . ILE A 194 ? 3.4433 1.6691 1.4296 -0.0141 0.3403 -0.0938 326 ILE G N 1436 C CA . ILE A 194 ? 3.5975 1.7801 1.3822 -0.0336 0.3393 -0.0391 326 ILE G CA 1437 C C . ILE A 194 ? 3.5602 1.7482 1.4337 0.0052 0.3034 0.0505 326 ILE G C 1438 O O . ILE A 194 ? 3.6242 1.7940 1.4488 -0.0170 0.3367 0.0723 326 ILE G O 1439 C CB . ILE A 194 ? 3.6024 1.8175 1.2960 -0.0360 0.2585 -0.0019 326 ILE G CB 1440 C CG1 . ILE A 194 ? 3.5568 1.7887 1.3008 0.0130 0.1787 0.0320 326 ILE G CG1 1441 C CG2 . ILE A 194 ? 3.6885 1.9269 1.3021 -0.0920 0.2973 -0.0724 326 ILE G CG2 1442 C CD1 . ILE A 194 ? 3.4974 1.8190 1.2564 0.0101 0.1109 0.0460 326 ILE G CD1 1443 N N . ARG A 195 ? 3.4030 1.6198 1.4060 0.0589 0.2346 0.1020 327 ARG G N 1444 C CA . ARG A 195 ? 3.1631 1.3938 1.2563 0.0974 0.1940 0.1857 327 ARG G CA 1445 C C . ARG A 195 ? 3.0619 1.3392 1.3843 0.0951 0.2463 0.1692 327 ARG G C 1446 O O . ARG A 195 ? 2.9138 1.2078 1.3185 0.1187 0.2201 0.2338 327 ARG G O 1447 C CB . ARG A 195 ? 2.9724 1.2946 1.2364 0.1479 0.1115 0.2193 327 ARG G CB 1448 C CG . ARG A 195 ? 2.8652 1.3027 1.1334 0.1551 0.0399 0.2077 327 ARG G CG 1449 C CD . ARG A 195 ? 2.6561 1.2282 1.1077 0.1876 -0.0243 0.2346 327 ARG G CD 1450 N NE . ARG A 195 ? 2.5601 1.2319 1.0237 0.1874 -0.0697 0.2259 327 ARG G NE 1451 C CZ . ARG A 195 ? 2.4034 1.1982 0.9994 0.2022 -0.1137 0.2448 327 ARG G CZ 1452 N NH1 . ARG A 195 ? 2.3019 1.1470 1.0391 0.2158 -0.1268 0.2736 327 ARG G NH1 1453 N NH2 . ARG A 195 ? 2.3529 1.2339 0.9621 0.1984 -0.1405 0.2409 327 ARG G NH2 1454 N N . LYS A 196 ? 3.1345 1.4366 1.5644 0.0677 0.3192 0.0798 328 LYS G N 1455 C CA . LYS A 196 ? 3.0086 1.3618 1.6700 0.0679 0.3729 0.0559 328 LYS G CA 1456 C C . LYS A 196 ? 2.9633 1.3019 1.5323 0.0364 0.4114 0.0817 328 LYS G C 1457 O O . LYS A 196 ? 3.1077 1.3914 1.4410 0.0072 0.4103 0.0959 328 LYS G O 1458 C CB . LYS A 196 ? 3.1425 1.5159 1.8952 0.0428 0.4503 -0.0590 328 LYS G CB 1459 C CG . LYS A 196 ? 3.1522 1.5845 2.1666 0.0488 0.5098 -0.0963 328 LYS G CG 1460 C CD . LYS A 196 ? 3.0742 1.5433 2.3328 0.1004 0.4504 -0.0465 328 LYS G CD 1461 C CE . LYS A 196 ? 3.1073 1.6284 2.6401 0.1094 0.5096 -0.1085 328 LYS G CE 1462 N NZ . LYS A 196 ? 3.1783 1.7318 2.7239 0.0793 0.5922 -0.1385 328 LYS G NZ 1463 N N . ALA A 197 ? 2.7784 1.1676 1.5421 0.0406 0.4427 0.0897 329 ALA G N 1464 C CA . ALA A 197 ? 2.7991 1.1911 1.5265 0.0077 0.4825 0.1130 329 ALA G CA 1465 C C . ALA A 197 ? 2.7209 1.1900 1.7212 0.0199 0.5128 0.1140 329 ALA G C 1466 O O . ALA A 197 ? 2.6771 1.1882 1.8884 0.0611 0.4855 0.1169 329 ALA G O 1467 C CB . ALA A 197 ? 2.8505 1.1859 1.4054 0.0156 0.4128 0.2074 329 ALA G CB 1468 N N . TYR A 198 ? 2.5832 1.0756 1.5876 -0.0192 0.5711 0.1092 330 TYR G N 1469 C CA . TYR A 198 ? 2.4921 1.0660 1.7577 -0.0083 0.5970 0.1160 330 TYR G CA 1470 C C . TYR A 198 ? 2.7726 1.3570 1.9983 -0.0443 0.6106 0.1687 330 TYR G C 1471 O O . TYR A 198 ? 2.6031 1.1319 1.6012 -0.0888 0.6232 0.1800 330 TYR G O 1472 C CB . TYR A 198 ? 2.5316 1.1667 1.9679 -0.0150 0.6855 0.0082 330 TYR G CB 1473 C CG . TYR A 198 ? 2.9062 1.5389 2.1880 -0.0758 0.7767 -0.0662 330 TYR G CG 1474 C CD1 . TYR A 198 ? 2.9401 1.6289 2.2604 -0.1178 0.8455 -0.0759 330 TYR G CD1 1475 C CD2 . TYR A 198 ? 3.0080 1.5889 2.1003 -0.0956 0.7922 -0.1247 330 TYR G CD2 1476 C CE1 . TYR A 198 ? 3.0811 1.7757 2.2493 -0.1798 0.9297 -0.1408 330 TYR G CE1 1477 C CE2 . TYR A 198 ? 3.1637 1.7466 2.1008 -0.1562 0.8731 -0.1895 330 TYR G CE2 1478 C CZ . TYR A 198 ? 3.2119 1.8528 2.1859 -0.1990 0.9434 -0.1975 330 TYR G CZ 1479 O OH . TYR A 198 ? 3.3820 2.0335 2.1942 -0.2654 1.0258 -0.2604 330 TYR G OH 1480 N N . CYS A 199 ? 2.6502 1.3061 2.1026 -0.0278 0.6055 0.2024 331 CYS G N 1481 C CA . CYS A 199 ? 2.6682 1.3509 2.1275 -0.0638 0.6193 0.2498 331 CYS G CA 1482 C C . CYS A 199 ? 2.6353 1.4287 2.3539 -0.0720 0.6905 0.2071 331 CYS G C 1483 O O . CYS A 199 ? 2.5473 1.3960 2.4912 -0.0310 0.6998 0.1694 331 CYS G O 1484 C CB . CYS A 199 ? 2.5865 1.2527 2.0565 -0.0370 0.5254 0.3544 331 CYS G CB 1485 S SG . CYS A 199 ? 2.7027 1.2485 1.8665 -0.0296 0.4382 0.4205 331 CYS G SG 1486 N N . GLU A 200 ? 2.7477 1.5736 2.4375 -0.1254 0.7394 0.2135 332 GLU G N 1487 C CA . GLU A 200 ? 2.8387 1.7822 2.7709 -0.1360 0.8094 0.1761 332 GLU G CA 1488 C C . GLU A 200 ? 2.8955 1.8846 2.8972 -0.1610 0.7862 0.2548 332 GLU G C 1489 O O . GLU A 200 ? 2.8947 1.8226 2.6904 -0.2060 0.7633 0.3068 332 GLU G O 1490 C CB . GLU A 200 ? 2.9808 1.9519 2.8325 -0.1880 0.9181 0.0825 332 GLU G CB 1491 C CG . GLU A 200 ? 2.9374 2.0405 3.0163 -0.2056 1.0046 0.0343 332 GLU G CG 1492 C CD . GLU A 200 ? 2.9727 2.1087 2.9490 -0.2604 1.1140 -0.0602 332 GLU G CD 1493 O OE1 . GLU A 200 ? 3.0341 2.1294 2.9198 -0.2511 1.1402 -0.1342 332 GLU G OE1 1494 O OE2 . GLU A 200 ? 2.9441 2.1522 2.9282 -0.3166 1.1736 -0.0601 332 GLU G OE2 1495 N N . ILE A 201 ? 2.9463 2.0399 3.2377 -0.1337 0.7896 0.2639 333 ILE G N 1496 C CA . ILE A 201 ? 3.0616 2.2143 3.4400 -0.1611 0.7701 0.3347 333 ILE G CA 1497 C C . ILE A 201 ? 3.2728 2.5687 3.9434 -0.1587 0.8426 0.2879 333 ILE G C 1498 O O . ILE A 201 ? 3.2939 2.6382 4.1803 -0.1042 0.8562 0.2409 333 ILE G O 1499 C CB . ILE A 201 ? 2.2048 1.3379 2.6413 -0.1214 0.6589 0.4334 333 ILE G CB 1500 C CG1 . ILE A 201 ? 2.2295 1.2319 2.4046 -0.1087 0.5846 0.4741 333 ILE G CG1 1501 C CG2 . ILE A 201 ? 2.1726 1.3591 2.6660 -0.1593 0.6369 0.5048 333 ILE G CG2 1502 C CD1 . ILE A 201 ? 2.0604 1.0232 2.2406 -0.0526 0.5595 0.4417 333 ILE G CD1 1503 N N . ASN A 202 ? 3.5952 2.9594 4.2864 -0.2151 0.8805 0.3076 334 ASN G N 1511 N N . GLY A 203 ? 3.6130 2.8918 3.3952 0.4207 1.0868 0.3458 335 GLY G N 1512 C CA . GLY A 203 ? 3.2443 2.5690 3.1307 0.4725 1.0642 0.3878 335 GLY G CA 1513 C C . GLY A 203 ? 2.9227 2.3804 2.9423 0.4989 1.0483 0.4323 335 GLY G C 1514 O O . GLY A 203 ? 2.7894 2.3087 2.8549 0.5142 0.9884 0.4720 335 GLY G O 1515 N N . THR A 204 ? 2.8566 2.3625 2.9353 0.4997 1.1019 0.4236 336 THR G N 1516 C CA . THR A 204 ? 2.6557 2.2995 2.8716 0.5226 1.0932 0.4614 336 THR G CA 1517 C C . THR A 204 ? 2.5261 2.2560 2.7343 0.4873 1.0159 0.4846 336 THR G C 1518 O O . THR A 204 ? 2.4289 2.2490 2.7212 0.5121 0.9670 0.5280 336 THR G O 1519 C CB . THR A 204 ? 2.5951 2.2683 2.8609 0.5177 1.1712 0.4368 336 THR G CB 1520 O OG1 . THR A 204 ? 2.6440 2.2415 2.9291 0.5519 1.2500 0.4128 336 THR G OG1 1521 C CG2 . THR A 204 ? 2.5077 2.3340 2.9266 0.5411 1.1636 0.4736 336 THR G CG2 1522 N N . LYS A 205 ? 2.5295 2.2283 2.6342 0.4290 1.0049 0.4567 337 LYS G N 1523 C CA . LYS A 205 ? 2.4393 2.2021 2.5263 0.3906 0.9381 0.4724 337 LYS G CA 1524 C C . LYS A 205 ? 2.4728 2.2282 2.5371 0.3992 0.8663 0.4951 337 LYS G C 1525 O O . LYS A 205 ? 2.4301 2.2813 2.5601 0.4032 0.8165 0.5282 337 LYS G O 1526 C CB . LYS A 205 ? 2.4184 2.1227 2.3840 0.3296 0.9400 0.4397 337 LYS G CB 1527 C CG . LYS A 205 ? 2.4201 2.1505 2.4094 0.3106 1.0057 0.4213 337 LYS G CG 1528 C CD . LYS A 205 ? 2.4091 2.0642 2.2624 0.2508 1.0108 0.3924 337 LYS G CD 1529 C CE . LYS A 205 ? 2.3114 2.0264 2.1613 0.2099 0.9630 0.4075 337 LYS G CE 1530 N NZ . LYS A 205 ? 2.3489 2.0120 2.1019 0.1562 0.9921 0.3847 337 LYS G NZ 1531 N N . TRP A 206 ? 2.5524 2.1975 2.5257 0.4004 0.8642 0.4757 338 TRP G N 1532 C CA . TRP A 206 ? 2.5160 2.1408 2.4554 0.4034 0.8028 0.4901 338 TRP G CA 1533 C C . TRP A 206 ? 2.3887 2.0885 2.4394 0.4518 0.7851 0.5356 338 TRP G C 1534 O O . TRP A 206 ? 2.2810 2.0577 2.3619 0.4444 0.7274 0.5637 338 TRP G O 1535 C CB . TRP A 206 ? 2.6712 2.1688 2.5110 0.4013 0.8175 0.4587 338 TRP G CB 1536 C CG . TRP A 206 ? 2.7573 2.2302 2.5627 0.4025 0.7618 0.4689 338 TRP G CG 1537 C CD1 . TRP A 206 ? 2.8011 2.2334 2.6214 0.4361 0.7668 0.4793 338 TRP G CD1 1538 C CD2 . TRP A 206 ? 2.7836 2.2655 2.5322 0.3662 0.6970 0.4672 338 TRP G CD2 1539 N NE1 . TRP A 206 ? 2.7763 2.1967 2.5513 0.4206 0.7088 0.4839 338 TRP G NE1 1540 C CE2 . TRP A 206 ? 2.7477 2.1991 2.4807 0.3788 0.6658 0.4750 338 TRP G CE2 1541 C CE3 . TRP A 206 ? 2.8242 2.3326 2.5347 0.3239 0.6658 0.4592 338 TRP G CE3 1542 C CZ2 . TRP A 206 ? 2.7317 2.1857 2.4181 0.3509 0.6059 0.4726 338 TRP G CZ2 1543 C CZ3 . TRP A 206 ? 2.7875 2.2925 2.4528 0.2991 0.6061 0.4579 338 TRP G CZ3 1544 C CH2 . TRP A 206 ? 2.7379 2.2184 2.3931 0.3127 0.5774 0.4629 338 TRP G CH2 1545 N N . ASN A 207 ? 2.4109 2.0857 2.5192 0.5001 0.8346 0.5434 339 ASN G N 1546 C CA . ASN A 207 ? 2.3538 2.0891 2.5662 0.5523 0.8200 0.5924 339 ASN G CA 1547 C C . ASN A 207 ? 2.2963 2.1830 2.6160 0.5570 0.7872 0.6310 339 ASN G C 1548 O O . ASN A 207 ? 2.2420 2.1949 2.6077 0.5739 0.7360 0.6734 339 ASN G O 1549 C CB . ASN A 207 ? 2.3852 2.0746 2.6602 0.6058 0.8917 0.5937 339 ASN G CB 1550 C CG . ASN A 207 ? 2.4089 1.9566 2.5937 0.6082 0.9171 0.5653 339 ASN G CG 1551 O OD1 . ASN A 207 ? 2.4047 1.9202 2.6187 0.6474 0.9175 0.5912 339 ASN G OD1 1552 N ND2 . ASN A 207 ? 2.4899 1.9529 2.5635 0.5646 0.9383 0.5128 339 ASN G ND2 1553 N N . LYS A 208 ? 2.2924 2.2360 2.6506 0.5393 0.8180 0.6159 340 LYS G N 1554 C CA . LYS A 208 ? 2.2092 2.3023 2.6650 0.5330 0.7872 0.6451 340 LYS G CA 1555 C C . LYS A 208 ? 2.1113 2.2408 2.5119 0.4886 0.7093 0.6534 340 LYS G C 1556 O O . LYS A 208 ? 2.0513 2.2865 2.5201 0.4977 0.6596 0.6929 340 LYS G O 1557 C CB . LYS A 208 ? 2.2254 2.3557 2.7064 0.5066 0.8362 0.6170 340 LYS G CB 1558 C CG . LYS A 208 ? 2.1788 2.4669 2.7608 0.4911 0.8104 0.6394 340 LYS G CG 1559 C CD . LYS A 208 ? 2.2110 2.5261 2.8170 0.4641 0.8697 0.6085 340 LYS G CD 1560 C CE . LYS A 208 ? 2.1791 2.6565 2.8935 0.4461 0.8482 0.6276 340 LYS G CE 1561 N NZ . LYS A 208 ? 2.1688 2.7701 3.0382 0.5054 0.8341 0.6755 340 LYS G NZ 1562 N N . VAL A 209 ? 2.1101 2.1491 2.3849 0.4412 0.6985 0.6158 341 VAL G N 1563 C CA . VAL A 209 ? 2.0462 2.1046 2.2644 0.3980 0.6318 0.6166 341 VAL G CA 1564 C C . VAL A 209 ? 2.0033 2.0503 2.2106 0.4189 0.5853 0.6428 341 VAL G C 1565 O O . VAL A 209 ? 1.9089 2.0158 2.1138 0.3952 0.5286 0.6579 341 VAL G O 1566 C CB . VAL A 209 ? 2.2153 2.1734 2.3061 0.3481 0.6328 0.5723 341 VAL G CB 1567 C CG1 . VAL A 209 ? 2.1828 2.1592 2.2251 0.3057 0.5693 0.5708 341 VAL G CG1 1568 C CG2 . VAL A 209 ? 2.2273 2.1937 2.3200 0.3235 0.6793 0.5501 341 VAL G CG2 1569 N N . LEU A 210 ? 2.0819 2.0536 2.2840 0.4612 0.6125 0.6482 342 LEU G N 1570 C CA . LEU A 210 ? 2.0741 2.0310 2.2673 0.4819 0.5748 0.6762 342 LEU G CA 1571 C C . LEU A 210 ? 2.0636 2.1454 2.3719 0.5162 0.5499 0.7325 342 LEU G C 1572 O O . LEU A 210 ? 1.9807 2.1112 2.2831 0.5049 0.4939 0.7580 342 LEU G O 1573 C CB . LEU A 210 ? 2.0846 1.9177 2.2345 0.5126 0.6130 0.6646 342 LEU G CB 1574 C CG . LEU A 210 ? 2.0125 1.7381 2.0342 0.4723 0.5995 0.6208 342 LEU G CG 1575 C CD1 . LEU A 210 ? 1.9976 1.6901 1.9635 0.4351 0.6223 0.5774 342 LEU G CD1 1576 C CD2 . LEU A 210 ? 2.0373 1.6502 2.0138 0.4953 0.6263 0.6103 342 LEU G CD2 1577 N N . LYS A 211 ? 2.1412 2.2721 2.5534 0.5599 0.5921 0.7524 343 LYS G N 1578 C CA . LYS A 211 ? 2.1781 2.4451 2.7134 0.5944 0.5662 0.8083 343 LYS G CA 1579 C C . LYS A 211 ? 2.1254 2.5069 2.6618 0.5436 0.5039 0.8142 343 LYS G C 1580 O O . LYS A 211 ? 2.1006 2.5551 2.6587 0.5461 0.4486 0.8541 343 LYS G O 1581 C CB . LYS A 211 ? 2.2700 2.5895 2.9229 0.6363 0.6241 0.8157 343 LYS G CB 1582 C CG . LYS A 211 ? 2.3986 2.6119 3.0656 0.6924 0.6861 0.8160 343 LYS G CG 1583 C CD . LYS A 211 ? 2.4837 2.7224 3.2454 0.7225 0.7583 0.8032 343 LYS G CD 1584 C CE . LYS A 211 ? 2.5886 2.7348 3.3861 0.7854 0.8192 0.8109 343 LYS G CE 1585 N NZ . LYS A 211 ? 2.6361 2.8408 3.5361 0.8493 0.7934 0.8801 343 LYS G NZ 1586 N N . GLN A 212 ? 2.1366 2.5259 2.6403 0.4935 0.5141 0.7730 344 GLN G N 1587 C CA . GLN A 212 ? 2.0907 2.5871 2.6023 0.4415 0.4646 0.7730 344 GLN G CA 1588 C C . GLN A 212 ? 1.9630 2.4274 2.3797 0.4028 0.4062 0.7680 344 GLN G C 1589 O O . GLN A 212 ? 1.8434 2.4085 2.2861 0.3833 0.3534 0.7926 344 GLN G O 1590 C CB . GLN A 212 ? 2.1537 2.6498 2.6455 0.3949 0.4947 0.7297 344 GLN G CB 1591 C CG . GLN A 212 ? 2.2013 2.7398 2.7859 0.4214 0.5563 0.7275 344 GLN G CG 1592 C CD . GLN A 212 ? 2.2007 2.7324 2.7525 0.3683 0.5866 0.6857 344 GLN G CD 1593 O OE1 . GLN A 212 ? 2.1433 2.6856 2.6397 0.3119 0.5527 0.6687 344 GLN G OE1 1594 N NE2 . GLN A 212 ? 2.2562 2.7667 2.8417 0.3852 0.6537 0.6688 344 GLN G NE2 1595 N N . VAL A 213 ? 1.9861 2.3138 2.2950 0.3913 0.4164 0.7353 345 VAL G N 1596 C CA . VAL A 213 ? 1.9396 2.2308 2.1615 0.3545 0.3685 0.7238 345 VAL G CA 1597 C C . VAL A 213 ? 1.8705 2.1890 2.1108 0.3836 0.3344 0.7680 345 VAL G C 1598 O O . VAL A 213 ? 1.8151 2.1884 2.0361 0.3527 0.2836 0.7784 345 VAL G O 1599 C CB . VAL A 213 ? 2.2861 2.4307 2.3952 0.3369 0.3859 0.6781 345 VAL G CB 1600 C CG1 . VAL A 213 ? 2.3046 2.3540 2.4026 0.3835 0.4283 0.6790 345 VAL G CG1 1601 C CG2 . VAL A 213 ? 2.2703 2.3886 2.3066 0.3034 0.3381 0.6675 345 VAL G CG2 1602 N N . THR A 214 ? 1.9121 2.1900 2.1869 0.4409 0.3642 0.7944 346 THR G N 1603 C CA . THR A 214 ? 1.9248 2.2221 2.2151 0.4704 0.3339 0.8425 346 THR G CA 1604 C C . THR A 214 ? 1.8786 2.3357 2.2613 0.4755 0.2926 0.8914 346 THR G C 1605 O O . THR A 214 ? 1.8090 2.3105 2.1760 0.4663 0.2437 0.9228 346 THR G O 1606 C CB . THR A 214 ? 2.0135 2.2320 2.3317 0.5351 0.3786 0.8658 346 THR G CB 1607 O OG1 . THR A 214 ? 2.0169 2.2993 2.4476 0.5786 0.4140 0.8874 346 THR G OG1 1608 C CG2 . THR A 214 ? 2.0563 2.1219 2.2846 0.5278 0.4210 0.8153 346 THR G CG2 1609 N N . GLU A 215 ? 1.9466 2.4965 2.4227 0.4849 0.3101 0.8965 347 GLU G N 1610 C CA . GLU A 215 ? 1.9998 2.7148 2.5660 0.4850 0.2650 0.9415 347 GLU G CA 1611 C C . GLU A 215 ? 2.1830 2.9623 2.6951 0.4105 0.2119 0.9201 347 GLU G C 1612 O O . GLU A 215 ? 2.1998 3.0849 2.7368 0.4007 0.1588 0.9579 347 GLU G O 1613 C CB . GLU A 215 ? 2.0723 2.8850 2.7674 0.5154 0.2977 0.9536 347 GLU G CB 1614 C CG . GLU A 215 ? 2.1260 2.9436 2.8204 0.4743 0.3326 0.9009 347 GLU G CG 1615 C CD . GLU A 215 ? 2.2058 3.0504 3.0060 0.5195 0.3930 0.9036 347 GLU G CD 1616 O OE1 . GLU A 215 ? 2.2460 3.0806 3.1128 0.5868 0.4145 0.9408 347 GLU G OE1 1617 O OE2 . GLU A 215 ? 2.2274 3.0995 3.0441 0.4868 0.4223 0.8679 347 GLU G OE2 1618 N N . LYS A 216 ? 2.1316 2.8546 2.5767 0.3592 0.2270 0.8623 348 LYS G N 1619 C CA . LYS A 216 ? 2.0461 2.8155 2.4405 0.2895 0.1839 0.8380 348 LYS G CA 1620 C C . LYS A 216 ? 1.9809 2.6964 2.2865 0.2724 0.1468 0.8404 348 LYS G C 1621 O O . LYS A 216 ? 1.9408 2.7378 2.2355 0.2350 0.0986 0.8513 348 LYS G O 1622 C CB . LYS A 216 ? 2.0218 2.7275 2.3631 0.2429 0.2116 0.7785 348 LYS G CB 1623 C CG . LYS A 216 ? 1.9683 2.7458 2.2902 0.1723 0.1767 0.7546 348 LYS G CG 1624 C CD . LYS A 216 ? 1.9521 2.8954 2.3820 0.1638 0.1629 0.7791 348 LYS G CD 1625 C CE . LYS A 216 ? 1.9287 2.9509 2.3387 0.0894 0.1252 0.7564 348 LYS G CE 1626 N NZ . LYS A 216 ? 1.9152 3.1062 2.4338 0.0760 0.1129 0.7759 348 LYS G NZ 1627 N N . LEU A 217 ? 1.9966 2.5747 2.2370 0.2962 0.1721 0.8270 349 LEU G N 1628 C CA . LEU A 217 ? 2.0365 2.5497 2.1904 0.2796 0.1461 0.8230 349 LEU G CA 1629 C C . LEU A 217 ? 2.0044 2.5910 2.1893 0.3040 0.1093 0.8841 349 LEU G C 1630 O O . LEU A 217 ? 1.9134 2.5330 2.0513 0.2671 0.0670 0.8894 349 LEU G O 1631 C CB . LEU A 217 ? 2.0991 2.4589 2.1926 0.3057 0.1858 0.7990 349 LEU G CB 1632 C CG . LEU A 217 ? 2.1400 2.4211 2.1434 0.2865 0.1673 0.7860 349 LEU G CG 1633 C CD1 . LEU A 217 ? 2.1808 2.5260 2.1488 0.2256 0.1218 0.7705 349 LEU G CD1 1634 C CD2 . LEU A 217 ? 2.0540 2.1981 1.9895 0.2840 0.2021 0.7363 349 LEU G CD2 1635 N N . LYS A 218 ? 2.0131 2.6269 2.2795 0.3664 0.1269 0.9314 350 LYS G N 1636 C CA . LYS A 218 ? 1.9793 2.6597 2.2840 0.4001 0.0934 0.9992 350 LYS G CA 1637 C C . LYS A 218 ? 1.9238 2.7612 2.2609 0.3567 0.0396 1.0142 350 LYS G C 1638 O O . LYS A 218 ? 1.9534 2.8432 2.2591 0.3368 -0.0083 1.0445 350 LYS G O 1639 C CB . LYS A 218 ? 1.9983 2.6954 2.4086 0.4759 0.1265 1.0432 350 LYS G CB 1640 C CG . LYS A 218 ? 2.0584 2.8436 2.5336 0.5204 0.0905 1.1237 350 LYS G CG 1641 C CD . LYS A 218 ? 1.7953 2.5966 2.3892 0.5981 0.1297 1.1616 350 LYS G CD 1642 C CE . LYS A 218 ? 1.8169 2.4514 2.3782 0.6320 0.1991 1.1300 350 LYS G CE 1643 N NZ . LYS A 218 ? 1.8845 2.3963 2.3577 0.6422 0.1990 1.1439 350 LYS G NZ 1644 N N . GLU A 219 ? 1.8732 2.7837 2.2674 0.3362 0.0497 0.9889 351 GLU G N 1645 C CA . GLU A 219 ? 1.8203 2.8887 2.2549 0.2902 0.0034 0.9969 351 GLU G CA 1646 C C . GLU A 219 ? 1.7662 2.8200 2.0945 0.2258 -0.0371 0.9750 351 GLU G C 1647 O O . GLU A 219 ? 1.7393 2.9137 2.0762 0.1927 -0.0879 0.9989 351 GLU G O 1648 C CB . GLU A 219 ? 1.7857 2.8993 2.2665 0.2592 0.0290 0.9532 351 GLU G CB 1649 C CG . GLU A 219 ? 1.7763 3.0517 2.2996 0.2036 -0.0135 0.9527 351 GLU G CG 1650 C CD . GLU A 219 ? 1.7701 3.0809 2.3424 0.1752 0.0197 0.9112 351 GLU G CD 1651 O OE1 . GLU A 219 ? 1.7468 3.1182 2.4243 0.2178 0.0455 0.9324 351 GLU G OE1 1652 O OE2 . GLU A 219 ? 1.7966 3.0717 2.3031 0.1102 0.0227 0.8572 351 GLU G OE2 1653 N N . HIS A 220 ? 1.7847 2.6949 2.0146 0.2071 -0.0140 0.9283 352 HIS G N 1654 C CA . HIS A 220 ? 1.8610 2.7479 1.9921 0.1447 -0.0439 0.8983 352 HIS G CA 1655 C C . HIS A 220 ? 1.9489 2.7869 2.0187 0.1603 -0.0634 0.9324 352 HIS G C 1656 O O . HIS A 220 ? 1.8961 2.7178 1.8846 0.1092 -0.0858 0.9093 352 HIS G O 1657 C CB . HIS A 220 ? 1.8907 2.6681 1.9540 0.1051 -0.0139 0.8244 352 HIS G CB 1658 C CG . HIS A 220 ? 1.8622 2.6914 1.9616 0.0679 -0.0038 0.7882 352 HIS G CG 1659 N ND1 . HIS A 220 ? 1.8635 2.7021 2.0330 0.0992 0.0308 0.7901 352 HIS G ND1 1660 C CD2 . HIS A 220 ? 1.8399 2.7054 1.9106 -0.0013 -0.0190 0.7463 352 HIS G CD2 1661 C CE1 . HIS A 220 ? 1.8704 2.7518 2.0519 0.0502 0.0347 0.7541 352 HIS G CE1 1662 N NE2 . HIS A 220 ? 1.8654 2.7615 1.9886 -0.0105 0.0049 0.7272 352 HIS G NE2 1663 N N . PHE A 221 ? 2.0928 2.9063 2.2016 0.2286 -0.0519 0.9864 353 PHE G N 1664 C CA . PHE A 221 ? 2.1423 2.9088 2.1977 0.2472 -0.0679 1.0279 353 PHE G CA 1665 C C . PHE A 221 ? 2.1975 3.0618 2.3150 0.2914 -0.1020 1.1139 353 PHE G C 1666 O O . PHE A 221 ? 2.2673 3.0664 2.3725 0.3384 -0.0944 1.1595 353 PHE G O 1667 C CB . PHE A 221 ? 2.1606 2.7628 2.1755 0.2849 -0.0181 1.0098 353 PHE G CB 1668 C CG . PHE A 221 ? 2.1453 2.6448 2.0731 0.2377 0.0013 0.9355 353 PHE G CG 1669 C CD1 . PHE A 221 ? 2.1510 2.5990 1.9878 0.2017 -0.0132 0.9217 353 PHE G CD1 1670 C CD2 . PHE A 221 ? 2.1090 2.5602 2.0462 0.2316 0.0355 0.8817 353 PHE G CD2 1671 C CE1 . PHE A 221 ? 2.1458 2.5053 1.9138 0.1621 0.0044 0.8537 353 PHE G CE1 1672 C CE2 . PHE A 221 ? 2.0572 2.4161 1.9192 0.1931 0.0496 0.8184 353 PHE G CE2 1673 C CZ . PHE A 221 ? 2.0685 2.3845 1.8515 0.1601 0.0337 0.8039 353 PHE G CZ 1674 N N . ASN A 222 ? 2.2312 3.2531 2.4154 0.2740 -0.1402 1.1354 354 ASN G N 1675 C CA . ASN A 222 ? 2.3588 3.5080 2.6096 0.3073 -0.1857 1.2181 354 ASN G CA 1676 C C . ASN A 222 ? 2.3563 3.4750 2.6978 0.4013 -0.1562 1.2742 354 ASN G C 1677 O O . ASN A 222 ? 2.3855 3.5193 2.7394 0.4443 -0.1801 1.3472 354 ASN G O 1678 C CB . ASN A 222 ? 2.4992 3.6485 2.6568 0.2796 -0.2300 1.2531 354 ASN G CB 1679 C CG . ASN A 222 ? 2.5568 3.7520 2.6308 0.1850 -0.2606 1.2010 354 ASN G CG 1680 O OD1 . ASN A 222 ? 2.5607 3.8594 2.6732 0.1425 -0.2753 1.1702 354 ASN G OD1 1681 N ND2 . ASN A 222 ? 2.5990 3.7108 2.5576 0.1492 -0.2648 1.1864 354 ASN G ND2 1682 N N . ASN A 223 ? 2.2990 3.3690 2.6994 0.4311 -0.1019 1.2389 355 ASN G N 1683 C CA . ASN A 223 ? 2.2716 3.3099 2.7672 0.5172 -0.0619 1.2785 355 ASN G CA 1684 C C . ASN A 223 ? 2.3155 3.2217 2.7549 0.5600 -0.0460 1.3144 355 ASN G C 1685 O O . ASN A 223 ? 2.4744 3.4148 2.9686 0.6171 -0.0629 1.3913 355 ASN G O 1686 C CB . ASN A 223 ? 2.2752 3.4873 2.9068 0.5569 -0.0958 1.3446 355 ASN G CB 1687 C CG . ASN A 223 ? 2.2647 3.4558 3.0158 0.6428 -0.0446 1.3712 355 ASN G CG 1688 O OD1 . ASN A 223 ? 2.2212 3.2670 2.9487 0.6681 0.0185 1.3363 355 ASN G OD1 1689 N ND2 . ASN A 223 ? 2.2880 3.6281 3.1702 0.6868 -0.0713 1.4320 355 ASN G ND2 1690 N N . LYS A 224 ? 2.2218 2.9778 2.5554 0.5332 -0.0132 1.2603 357 LYS G N 1691 C CA . LYS A 224 ? 2.2742 2.8893 2.5557 0.5707 0.0145 1.2827 357 LYS G CA 1692 C C . LYS A 224 ? 2.3054 2.7896 2.5969 0.6016 0.0878 1.2353 357 LYS G C 1693 O O . LYS A 224 ? 1.8958 2.3761 2.1873 0.5722 0.1099 1.1725 357 LYS G O 1694 C CB . LYS A 224 ? 2.2985 2.8577 2.4477 0.5102 -0.0113 1.2624 357 LYS G CB 1695 C CG . LYS A 224 ? 2.4610 3.1280 2.5806 0.4759 -0.0784 1.3065 357 LYS G CG 1696 C CD . LYS A 224 ? 2.5588 3.1427 2.5437 0.4132 -0.0852 1.2664 357 LYS G CD 1697 C CE . LYS A 224 ? 2.6953 3.3726 2.6350 0.3671 -0.1470 1.2929 357 LYS G CE 1698 N NZ . LYS A 224 ? 2.7458 3.3485 2.5557 0.3026 -0.1508 1.2520 357 LYS G NZ 1699 N N . THR A 225 ? 2.4181 2.7962 2.7184 0.6594 0.1267 1.2653 358 THR G N 1700 C CA . THR A 225 ? 2.4566 2.7140 2.7657 0.6858 0.1985 1.2180 358 THR G CA 1701 C C . THR A 225 ? 2.3881 2.5383 2.5872 0.6277 0.2202 1.1340 358 THR G C 1702 O O . THR A 225 ? 2.4287 2.5086 2.5319 0.5953 0.2082 1.1223 358 THR G O 1703 C CB . THR A 225 ? 2.5265 2.6827 2.8551 0.7378 0.2381 1.2367 358 THR G CB 1704 O OG1 . THR A 225 ? 2.5409 2.7962 2.9818 0.7875 0.2223 1.2960 358 THR G OG1 1705 C CG2 . THR A 225 ? 2.5356 2.5679 2.8667 0.7617 0.3145 1.1888 358 THR G CG2 1706 N N . ILE A 226 ? 2.2933 2.4359 2.5112 0.6159 0.2525 1.0780 359 ILE G N 1707 C CA . ILE A 226 ? 2.2674 2.3199 2.3979 0.5672 0.2738 0.9994 359 ILE G CA 1708 C C . ILE A 226 ? 2.3267 2.2361 2.4342 0.5938 0.3399 0.9650 359 ILE G C 1709 O O . ILE A 226 ? 2.3535 2.2558 2.5312 0.6365 0.3837 0.9691 359 ILE G O 1710 C CB . ILE A 226 ? 2.1578 2.2892 2.3067 0.5275 0.2633 0.9580 359 ILE G CB 1711 C CG1 . ILE A 226 ? 2.1343 2.3263 2.2245 0.4632 0.2072 0.9432 359 ILE G CG1 1712 C CG2 . ILE A 226 ? 2.0765 2.1074 2.1794 0.5113 0.3092 0.8902 359 ILE G CG2 1713 C CD1 . ILE A 226 ? 2.1694 2.4777 2.2899 0.4621 0.1531 1.0031 359 ILE G CD1 1714 N N . ILE A 227 ? 2.3343 2.1329 2.3469 0.5675 0.3494 0.9301 360 ILE G N 1715 C CA . ILE A 227 ? 2.3368 2.0032 2.3203 0.5840 0.4100 0.8917 360 ILE G CA 1716 C C . ILE A 227 ? 2.2633 1.8613 2.1553 0.5299 0.4138 0.8170 360 ILE G C 1717 O O . ILE A 227 ? 2.2295 1.8432 2.0630 0.4841 0.3737 0.7999 360 ILE G O 1718 C CB . ILE A 227 ? 2.4572 2.0332 2.4244 0.6175 0.4314 0.9272 360 ILE G CB 1719 C CG1 . ILE A 227 ? 2.5514 2.1801 2.6191 0.6805 0.4365 0.9980 360 ILE G CG1 1720 C CG2 . ILE A 227 ? 2.4832 1.9181 2.4077 0.6226 0.4938 0.8782 360 ILE G CG2 1721 C CD1 . ILE A 227 ? 2.6548 2.2270 2.7085 0.6926 0.4391 1.0161 360 ILE G CD1 1722 N N . PHE A 228 ? 2.2400 1.7681 2.1229 0.5351 0.4618 0.7728 361 PHE G N 1723 C CA . PHE A 228 ? 2.1973 1.6586 1.9972 0.4897 0.4661 0.7054 361 PHE G CA 1724 C C . PHE A 228 ? 2.3499 1.6844 2.0904 0.4906 0.5019 0.6781 361 PHE G C 1725 O O . PHE A 228 ? 2.5330 1.8083 2.3005 0.5306 0.5468 0.6964 361 PHE G O 1726 C CB . PHE A 228 ? 2.1457 1.6143 1.9573 0.4836 0.4909 0.6695 361 PHE G CB 1727 C CG . PHE A 228 ? 2.1175 1.7006 1.9701 0.4665 0.4564 0.6802 361 PHE G CG 1728 C CD1 . PHE A 228 ? 2.0885 1.7023 1.8938 0.4171 0.4127 0.6548 361 PHE G CD1 1729 C CD2 . PHE A 228 ? 2.1474 1.8054 2.0890 0.4984 0.4720 0.7117 361 PHE G CD2 1730 C CE1 . PHE A 228 ? 2.0249 1.7375 1.8656 0.3969 0.3852 0.6613 361 PHE G CE1 1731 C CE2 . PHE A 228 ? 2.0908 1.8562 2.0707 0.4772 0.4427 0.7179 361 PHE G CE2 1732 C CZ . PHE A 228 ? 2.0096 1.7991 1.9359 0.4249 0.3999 0.6924 361 PHE G CZ 1733 N N . GLN A 229 ? 2.2793 1.5728 1.9431 0.4455 0.4842 0.6316 362 GLN G N 1734 C CA . GLN A 229 ? 2.3144 1.4958 1.9169 0.4345 0.5146 0.5937 362 GLN G CA 1735 C C . GLN A 229 ? 2.1810 1.3344 1.7211 0.3911 0.5057 0.5290 362 GLN G C 1736 O O . GLN A 229 ? 2.0667 1.2821 1.6000 0.3639 0.4655 0.5180 362 GLN G O 1737 C CB . GLN A 229 ? 2.4081 1.5655 1.9829 0.4267 0.4984 0.6158 362 GLN G CB 1738 C CG . GLN A 229 ? 2.5001 1.6625 2.1260 0.4728 0.5110 0.6829 362 GLN G CG 1739 C CD . GLN A 229 ? 2.6735 1.7314 2.3061 0.5055 0.5747 0.6779 362 GLN G CD 1740 O OE1 . GLN A 229 ? 2.7671 1.8409 2.4696 0.5505 0.5986 0.7115 362 GLN G OE1 1741 N NE2 . GLN A 229 ? 2.7248 1.6885 2.2920 0.4771 0.6000 0.6251 362 GLN G NE2 1742 N N . PRO A 230 ? 2.1950 1.2541 1.6887 0.3832 0.5418 0.4868 363 PRO G N 1743 C CA . PRO A 230 ? 2.1874 1.2179 1.6197 0.3431 0.5301 0.4272 363 PRO G CA 1744 C C . PRO A 230 ? 2.1889 1.2393 1.5905 0.3088 0.4857 0.4147 363 PRO G C 1745 O O . PRO A 230 ? 2.3264 1.3936 1.7415 0.3138 0.4740 0.4479 363 PRO G O 1746 C CB . PRO A 230 ? 2.2487 1.1775 1.6453 0.3449 0.5820 0.3927 363 PRO G CB 1747 C CG . PRO A 230 ? 2.2901 1.1818 1.7177 0.3773 0.6133 0.4320 363 PRO G CG 1748 C CD . PRO A 230 ? 2.2515 1.2251 1.7505 0.4119 0.5973 0.4931 363 PRO G CD 1749 N N . PRO A 231 ? 2.1773 1.2310 1.5406 0.2750 0.4601 0.3701 364 PRO G N 1750 C CA . PRO A 231 ? 2.1747 1.2494 1.5168 0.2427 0.4217 0.3533 364 PRO G CA 1751 C C . PRO A 231 ? 2.2087 1.2278 1.5280 0.2352 0.4396 0.3467 364 PRO G C 1752 O O . PRO A 231 ? 2.2523 1.1987 1.5533 0.2428 0.4800 0.3310 364 PRO G O 1753 C CB . PRO A 231 ? 2.2554 1.3220 1.5633 0.2160 0.4033 0.3027 364 PRO G CB 1754 C CG . PRO A 231 ? 2.3309 1.3547 1.6255 0.2306 0.4381 0.2906 364 PRO G CG 1755 C CD . PRO A 231 ? 2.2931 1.3367 1.6337 0.2656 0.4634 0.3368 364 PRO G CD 1756 N N . SER A 232 ? 2.2397 1.2906 1.5548 0.2144 0.4114 0.3525 365 SER G N 1757 C CA . SER A 232 ? 2.3549 1.3594 1.6466 0.2026 0.4271 0.3516 365 SER G CA 1758 C C . SER A 232 ? 2.4213 1.3859 1.6751 0.1668 0.4286 0.2904 365 SER G C 1759 O O . SER A 232 ? 2.4897 1.4039 1.7207 0.1533 0.4507 0.2808 365 SER G O 1760 C CB . SER A 232 ? 2.3571 1.4186 1.6573 0.1929 0.3979 0.3880 365 SER G CB 1761 O OG . SER A 232 ? 2.3413 1.4640 1.6407 0.1628 0.3575 0.3613 365 SER G OG 1762 N N . GLY A 233 ? 2.4076 1.3959 1.6569 0.1515 0.4050 0.2507 366 GLY G N 1763 C CA . GLY A 233 ? 2.4023 1.3696 1.6265 0.1196 0.3986 0.1926 366 GLY G CA 1764 C C . GLY A 233 ? 2.3102 1.3246 1.5412 0.1091 0.3595 0.1666 366 GLY G C 1765 O O . GLY A 233 ? 2.2579 1.3115 1.5072 0.1243 0.3431 0.1921 366 GLY G O 1766 N N . GLY A 234 ? 2.2752 1.2865 1.4949 0.0831 0.3450 0.1170 367 GLY G N 1767 C CA . GLY A 234 ? 2.2194 1.2699 1.4481 0.0747 0.3063 0.0924 367 GLY G CA 1768 C C . GLY A 234 ? 2.1880 1.2174 1.3947 0.0762 0.3010 0.0649 367 GLY G C 1769 O O . GLY A 234 ? 2.3085 1.2909 1.4885 0.0828 0.3315 0.0613 367 GLY G O 1770 N N . ASP A 235 ? 2.0671 1.1297 1.2832 0.0693 0.2626 0.0460 368 ASP G N 1771 C CA . ASP A 235 ? 2.0927 1.1408 1.2829 0.0684 0.2491 0.0224 368 ASP G CA 1772 C C . ASP A 235 ? 2.1087 1.1301 1.2692 0.0863 0.2680 0.0469 368 ASP G C 1773 O O . ASP A 235 ? 2.0973 1.1265 1.2704 0.1037 0.2818 0.0857 368 ASP G O 1774 C CB . ASP A 235 ? 2.0406 1.1283 1.2517 0.0636 0.2026 0.0081 368 ASP G CB 1775 C CG . ASP A 235 ? 2.1074 1.2197 1.3496 0.0441 0.1877 -0.0283 368 ASP G CG 1776 O OD1 . ASP A 235 ? 2.1817 1.2747 1.4159 0.0292 0.2101 -0.0529 368 ASP G OD1 1777 O OD2 . ASP A 235 ? 2.0944 1.2430 1.3705 0.0424 0.1569 -0.0353 368 ASP G OD2 1778 N N . LEU A 236 ? 2.1269 1.1211 1.2480 0.0793 0.2690 0.0220 369 LEU G N 1779 C CA . LEU A 236 ? 2.2241 1.1900 1.3096 0.0907 0.2906 0.0380 369 LEU G CA 1780 C C . LEU A 236 ? 2.2865 1.2774 1.3785 0.1048 0.2735 0.0720 369 LEU G C 1781 O O . LEU A 236 ? 2.3475 1.3233 1.4294 0.1182 0.3034 0.0961 369 LEU G O 1782 C CB . LEU A 236 ? 2.2693 1.2089 1.3032 0.0732 0.2864 0.0011 369 LEU G CB 1783 C CG . LEU A 236 ? 2.2810 1.1856 1.2995 0.0551 0.3161 -0.0355 369 LEU G CG 1784 C CD1 . LEU A 236 ? 2.2859 1.1795 1.2538 0.0320 0.3022 -0.0749 369 LEU G CD1 1785 C CD2 . LEU A 236 ? 2.2490 1.1058 1.2629 0.0676 0.3751 -0.0190 369 LEU G CD2 1786 N N . GLU A 237 ? 2.2394 1.2657 1.3499 0.1009 0.2293 0.0719 370 GLU G N 1787 C CA . GLU A 237 ? 2.1275 1.1752 1.2471 0.1100 0.2136 0.1030 370 GLU G CA 1788 C C . GLU A 237 ? 2.0402 1.1125 1.1982 0.1223 0.2350 0.1386 370 GLU G C 1789 O O . GLU A 237 ? 2.0032 1.0868 1.1634 0.1296 0.2395 0.1655 370 GLU G O 1790 C CB . GLU A 237 ? 2.1154 1.1899 1.2550 0.1036 0.1659 0.0934 370 GLU G CB 1791 C CG . GLU A 237 ? 2.1464 1.2062 1.2514 0.0967 0.1354 0.0690 370 GLU G CG 1792 C CD . GLU A 237 ? 2.1470 1.2088 1.2573 0.0845 0.1299 0.0286 370 GLU G CD 1793 O OE1 . GLU A 237 ? 2.2295 1.3027 1.3736 0.0803 0.1464 0.0191 370 GLU G OE1 1794 O OE2 . GLU A 237 ? 2.0800 1.1360 1.1614 0.0770 0.1073 0.0066 370 GLU G OE2 1795 N N . ILE A 238 ? 2.1116 1.1928 1.2974 0.1231 0.2489 0.1395 371 ILE G N 1796 C CA . ILE A 238 ? 2.2092 1.3230 1.4334 0.1336 0.2615 0.1749 371 ILE G CA 1797 C C . ILE A 238 ? 2.2397 1.3309 1.4650 0.1527 0.3054 0.1968 371 ILE G C 1798 O O . ILE A 238 ? 2.2666 1.3841 1.5180 0.1683 0.3180 0.2318 371 ILE G O 1799 C CB . ILE A 238 ? 2.2551 1.3971 1.5083 0.1221 0.2478 0.1703 371 ILE G CB 1800 C CG1 . ILE A 238 ? 2.3391 1.5227 1.6143 0.1088 0.2115 0.1663 371 ILE G CG1 1801 C CG2 . ILE A 238 ? 2.1735 1.3390 1.4534 0.1338 0.2669 0.2088 371 ILE G CG2 1802 C CD1 . ILE A 238 ? 2.3952 1.6113 1.6961 0.0945 0.2039 0.1644 371 ILE G CD1 1803 N N . THR A 239 ? 2.2390 1.2811 1.4389 0.1516 0.3309 0.1748 372 THR G N 1804 C CA . THR A 239 ? 2.2617 1.2732 1.4679 0.1716 0.3770 0.1942 372 THR G CA 1805 C C . THR A 239 ? 2.3177 1.3053 1.5057 0.1842 0.4068 0.1985 372 THR G C 1806 O O . THR A 239 ? 2.4052 1.3705 1.6082 0.2054 0.4493 0.2165 372 THR G O 1807 C CB . THR A 239 ? 2.2671 1.2265 1.4525 0.1621 0.4000 0.1665 372 THR G CB 1808 O OG1 . THR A 239 ? 2.3596 1.2886 1.5003 0.1415 0.3943 0.1214 372 THR G OG1 1809 C CG2 . THR A 239 ? 2.1654 1.1491 1.3696 0.1482 0.3774 0.1646 372 THR G CG2 1810 N N . MET A 240 ? 2.2617 1.2539 1.4193 0.1718 0.3861 0.1842 373 MET G N 1811 C CA . MET A 240 ? 2.3295 1.2978 1.4593 0.1771 0.4150 0.1851 373 MET G CA 1812 C C . MET A 240 ? 2.3936 1.4022 1.5285 0.1743 0.3895 0.2045 373 MET G C 1813 O O . MET A 240 ? 2.4436 1.4826 1.5862 0.1630 0.3458 0.2042 373 MET G O 1814 C CB . MET A 240 ? 2.3620 1.2772 1.4264 0.1578 0.4237 0.1433 373 MET G CB 1815 C CG . MET A 240 ? 2.4173 1.2851 1.4775 0.1595 0.4630 0.1244 373 MET G CG 1816 S SD . MET A 240 ? 2.8071 1.6157 1.7890 0.1306 0.4789 0.0703 373 MET G SD 1817 C CE . MET A 240 ? 3.5006 2.2463 2.4947 0.1414 0.5472 0.0615 373 MET G CE 1818 N N . HIS A 241 ? 2.3565 1.3623 1.4878 0.1830 0.4203 0.2192 374 HIS G N 1819 C CA . HIS A 241 ? 2.2578 1.2909 1.3817 0.1739 0.3995 0.2330 374 HIS G CA 1820 C C . HIS A 241 ? 2.1969 1.1955 1.2513 0.1517 0.3725 0.2064 374 HIS G C 1821 O O . HIS A 241 ? 2.2735 1.2283 1.2710 0.1431 0.3941 0.1865 374 HIS G O 1822 C CB . HIS A 241 ? 2.3430 1.3820 1.4787 0.1848 0.4431 0.2518 374 HIS G CB 1823 C CG . HIS A 241 ? 2.3654 1.4241 1.4856 0.1706 0.4285 0.2643 374 HIS G CG 1824 N ND1 . HIS A 241 ? 2.3228 1.4218 1.4665 0.1613 0.3860 0.2781 374 HIS G ND1 1825 C CD2 . HIS A 241 ? 2.4421 1.4802 1.5212 0.1608 0.4540 0.2635 374 HIS G CD2 1826 C CE1 . HIS A 241 ? 2.4275 1.5266 1.5469 0.1475 0.3859 0.2871 374 HIS G CE1 1827 N NE2 . HIS A 241 ? 2.4935 1.5572 1.5719 0.1465 0.4262 0.2796 374 HIS G NE2 1828 N N . HIS A 242 ? 2.0993 1.1213 1.1595 0.1420 0.3252 0.2092 375 HIS G N 1829 C CA . HIS A 242 ? 2.1252 1.1233 1.1347 0.1261 0.2883 0.1875 375 HIS G CA 1830 C C . HIS A 242 ? 2.1476 1.1528 1.1426 0.1185 0.2638 0.2067 375 HIS G C 1831 O O . HIS A 242 ? 2.0032 1.0441 1.0448 0.1204 0.2504 0.2263 375 HIS G O 1832 C CB . HIS A 242 ? 2.0187 1.0320 1.0564 0.1235 0.2543 0.1681 375 HIS G CB 1833 C CG . HIS A 242 ? 2.0306 1.0363 1.0395 0.1122 0.2081 0.1510 375 HIS G CG 1834 N ND1 . HIS A 242 ? 2.0669 1.0418 1.0178 0.1017 0.2004 0.1271 375 HIS G ND1 1835 C CD2 . HIS A 242 ? 2.0337 1.0602 1.0672 0.1107 0.1667 0.1553 375 HIS G CD2 1836 C CE1 . HIS A 242 ? 2.0500 1.0322 0.9951 0.0973 0.1522 0.1210 375 HIS G CE1 1837 N NE2 . HIS A 242 ? 2.0779 1.0874 1.0746 0.1043 0.1331 0.1375 375 HIS G NE2 1838 N N . PHE A 243 ? 2.2242 1.1931 1.1499 0.1068 0.2549 0.1997 376 PHE G N 1839 C CA . PHE A 243 ? 2.2385 1.2014 1.1398 0.0987 0.2346 0.2212 376 PHE G CA 1840 C C . PHE A 243 ? 2.3377 1.2600 1.1575 0.0860 0.2122 0.2128 376 PHE G C 1841 O O . PHE A 243 ? 2.3051 1.2077 1.0840 0.0803 0.2174 0.1882 376 PHE G O 1842 C CB . PHE A 243 ? 2.2369 1.2092 1.1475 0.0983 0.2767 0.2454 376 PHE G CB 1843 C CG . PHE A 243 ? 2.3520 1.2961 1.2175 0.0954 0.3252 0.2369 376 PHE G CG 1844 C CD1 . PHE A 243 ? 2.4480 1.3512 1.2301 0.0778 0.3325 0.2368 376 PHE G CD1 1845 C CD2 . PHE A 243 ? 2.3096 1.2645 1.2147 0.1099 0.3659 0.2287 376 PHE G CD2 1846 C CE1 . PHE A 243 ? 2.4410 1.3170 1.1802 0.0716 0.3837 0.2232 376 PHE G CE1 1847 C CE2 . PHE A 243 ? 2.2776 1.2020 1.1474 0.1081 0.4169 0.2167 376 PHE G CE2 1848 C CZ . PHE A 243 ? 2.3040 1.1903 1.0911 0.0875 0.4273 0.2111 376 PHE G CZ 1849 N N . ASN A 244 ? 2.4799 1.3898 1.2761 0.0803 0.1843 0.2338 377 ASN G N 1850 C CA . ASN A 244 ? 2.6592 1.5335 1.3779 0.0702 0.1534 0.2334 377 ASN G CA 1851 C C . ASN A 244 ? 2.7779 1.6183 1.4253 0.0547 0.1826 0.2541 377 ASN G C 1852 O O . ASN A 244 ? 2.8592 1.6999 1.5219 0.0522 0.1942 0.2799 377 ASN G O 1853 C CB . ASN A 244 ? 2.7405 1.6188 1.4833 0.0779 0.0962 0.2425 377 ASN G CB 1854 C CG . ASN A 244 ? 2.9067 1.7601 1.5823 0.0733 0.0534 0.2401 377 ASN G CG 1855 O OD1 . ASN A 244 ? 3.0104 1.8633 1.6484 0.0655 0.0549 0.2149 377 ASN G OD1 1856 N ND2 . ASN A 244 ? 2.9554 1.7914 1.6225 0.0786 0.0124 0.2648 377 ASN G ND2 1857 N N . CYS A 245 ? 2.8087 1.6214 1.3790 0.0404 0.2006 0.2388 378 CYS G N 1858 C CA . CYS A 245 ? 2.8040 1.5814 1.2945 0.0204 0.2351 0.2524 378 CYS G CA 1859 C C . CYS A 245 ? 2.8856 1.6246 1.2679 0.0012 0.2021 0.2546 378 CYS G C 1860 O O . CYS A 245 ? 2.9447 1.6807 1.2882 -0.0066 0.1908 0.2266 378 CYS G O 1861 C CB . CYS A 245 ? 2.7701 1.5471 1.2604 0.0162 0.3019 0.2303 378 CYS G CB 1862 S SG . CYS A 245 ? 3.5449 2.2798 1.9366 -0.0126 0.3561 0.2371 378 CYS G SG 1863 N N . ARG A 246 ? 2.9024 1.6121 1.2339 -0.0089 0.1881 0.2892 379 ARG G N 1864 C CA . ARG A 246 ? 2.8989 1.5694 1.1207 -0.0267 0.1515 0.3040 379 ARG G CA 1865 C C . ARG A 246 ? 2.8328 1.5217 1.0612 -0.0155 0.0877 0.2897 379 ARG G C 1866 O O . ARG A 246 ? 2.7689 1.4448 0.9121 -0.0326 0.0644 0.2810 379 ARG G O 1867 C CB . ARG A 246 ? 3.0272 1.6688 1.1489 -0.0575 0.1997 0.2880 379 ARG G CB 1868 C CG . ARG A 246 ? 3.0656 1.6876 1.1705 -0.0724 0.2621 0.3044 379 ARG G CG 1869 C CD . ARG A 246 ? 3.1941 1.7753 1.1737 -0.1092 0.3007 0.2954 379 ARG G CD 1870 N NE . ARG A 246 ? 3.2892 1.8408 1.1735 -0.1302 0.2572 0.3216 379 ARG G NE 1871 C CZ . ARG A 246 ? 3.3905 1.9264 1.1821 -0.1641 0.2726 0.3082 379 ARG G CZ 1872 N NH1 . ARG A 246 ? 3.4104 1.9448 1.1814 -0.1813 0.3352 0.2674 379 ARG G NH1 1873 N NH2 . ARG A 246 ? 3.4797 2.0012 1.2021 -0.1804 0.2269 0.3353 379 ARG G NH2 1874 N N . GLY A 247 ? 2.7158 1.4394 1.0472 0.0109 0.0598 0.2862 380 GLY G N 1875 C CA . GLY A 247 ? 2.6637 1.4124 1.0218 0.0243 -0.0003 0.2730 380 GLY G CA 1876 C C . GLY A 247 ? 2.6364 1.4179 1.0231 0.0215 0.0140 0.2252 380 GLY G C 1877 O O . GLY A 247 ? 2.6013 1.4128 1.0209 0.0297 -0.0290 0.2060 380 GLY G O 1878 N N . GLU A 248 ? 2.6670 1.4425 1.0472 0.0104 0.0770 0.2052 381 GLU G N 1879 C CA . GLU A 248 ? 2.6819 1.4776 1.0887 0.0072 0.0971 0.1610 381 GLU G CA 1880 C C . GLU A 248 ? 2.5079 1.3312 1.0230 0.0288 0.1234 0.1562 381 GLU G C 1881 O O . GLU A 248 ? 2.4867 1.3092 1.0346 0.0376 0.1511 0.1803 381 GLU G O 1882 C CB . GLU A 248 ? 2.8661 1.6302 1.1917 -0.0190 0.1513 0.1402 381 GLU G CB 1883 C CG . GLU A 248 ? 3.0871 1.8237 1.2918 -0.0458 0.1248 0.1489 381 GLU G CG 1884 C CD . GLU A 248 ? 3.2356 1.9900 1.4014 -0.0608 0.0784 0.1204 381 GLU G CD 1885 O OE1 . GLU A 248 ? 3.1445 1.9316 1.3571 -0.0437 0.0158 0.1283 381 GLU G OE1 1886 O OE2 . GLU A 248 ? 3.4430 2.1800 1.5297 -0.0918 0.1047 0.0893 381 GLU G OE2 1887 N N . PHE A 249 ? 2.4197 1.2689 0.9868 0.0341 0.1175 0.1248 382 PHE G N 1888 C CA . PHE A 249 ? 2.3272 1.2013 0.9879 0.0521 0.1416 0.1228 382 PHE G CA 1889 C C . PHE A 249 ? 2.4000 1.2602 1.0632 0.0487 0.2045 0.1025 382 PHE G C 1890 O O . PHE A 249 ? 2.2468 1.1025 0.9023 0.0391 0.2131 0.0678 382 PHE G O 1891 C CB . PHE A 249 ? 2.2905 1.2004 1.0159 0.0610 0.0998 0.1042 382 PHE G CB 1892 C CG . PHE A 249 ? 2.2996 1.2239 1.0459 0.0714 0.0434 0.1247 382 PHE G CG 1893 C CD1 . PHE A 249 ? 2.2524 1.1901 1.0605 0.0861 0.0397 0.1476 382 PHE G CD1 1894 C CD2 . PHE A 249 ? 2.3766 1.3019 1.0826 0.0663 -0.0064 0.1200 382 PHE G CD2 1895 C CE1 . PHE A 249 ? 2.1949 1.1367 1.0237 0.0961 -0.0069 0.1644 382 PHE G CE1 1896 C CE2 . PHE A 249 ? 2.3183 1.2525 1.0499 0.0810 -0.0576 0.1414 382 PHE G CE2 1897 C CZ . PHE A 249 ? 2.2513 1.1890 1.0445 0.0962 -0.0551 0.1626 382 PHE G CZ 1898 N N . PHE A 250 ? 2.4168 1.2725 1.1001 0.0576 0.2486 0.1244 383 PHE G N 1899 C CA . PHE A 250 ? 2.4812 1.3233 1.1797 0.0616 0.3105 0.1118 383 PHE G CA 1900 C C . PHE A 250 ? 2.4493 1.3194 1.2352 0.0809 0.3166 0.1117 383 PHE G C 1901 O O . PHE A 250 ? 2.3944 1.3008 1.2382 0.0929 0.2874 0.1320 383 PHE G O 1902 C CB . PHE A 250 ? 2.4898 1.3228 1.1796 0.0646 0.3549 0.1361 383 PHE G CB 1903 C CG . PHE A 250 ? 2.6172 1.4114 1.2077 0.0402 0.3694 0.1296 383 PHE G CG 1904 C CD1 . PHE A 250 ? 2.6499 1.4367 1.1794 0.0256 0.3206 0.1426 383 PHE G CD1 1905 C CD2 . PHE A 250 ? 2.6184 1.3812 1.1747 0.0315 0.4329 0.1116 383 PHE G CD2 1906 C CE1 . PHE A 250 ? 2.7175 1.4682 1.1457 -0.0001 0.3317 0.1400 383 PHE G CE1 1907 C CE2 . PHE A 250 ? 2.6837 1.4109 1.1409 0.0038 0.4487 0.1033 383 PHE G CE2 1908 C CZ . PHE A 250 ? 2.7745 1.4964 1.1632 -0.0134 0.3965 0.1188 383 PHE G CZ 1909 N N . TYR A 251 ? 2.4526 1.3008 1.2440 0.0825 0.3614 0.0908 384 TYR G N 1910 C CA . TYR A 251 ? 2.3546 1.2175 1.2163 0.0993 0.3760 0.0921 384 TYR G CA 1911 C C . TYR A 251 ? 2.5698 1.4028 1.4409 0.1112 0.4441 0.0930 384 TYR G C 1912 O O . TYR A 251 ? 2.7455 1.5339 1.5746 0.0984 0.4766 0.0609 384 TYR G O 1913 C CB . TYR A 251 ? 2.1854 1.0419 1.0400 0.0853 0.3543 0.0562 384 TYR G CB 1914 C CG . TYR A 251 ? 2.1180 1.0121 0.9919 0.0807 0.2910 0.0540 384 TYR G CG 1915 C CD1 . TYR A 251 ? 2.2019 1.0990 1.0291 0.0689 0.2498 0.0517 384 TYR G CD1 1916 C CD2 . TYR A 251 ? 1.9952 0.9188 0.9308 0.0871 0.2737 0.0525 384 TYR G CD2 1917 C CE1 . TYR A 251 ? 2.2030 1.1316 1.0538 0.0686 0.1939 0.0494 384 TYR G CE1 1918 C CE2 . TYR A 251 ? 1.9578 0.9146 0.9150 0.0826 0.2207 0.0450 384 TYR G CE2 1919 C CZ . TYR A 251 ? 2.1424 1.1014 1.0614 0.0757 0.1812 0.0436 384 TYR G CZ 1920 O OH . TYR A 251 ? 2.0906 1.0805 1.0375 0.0761 0.1293 0.0380 384 TYR G OH 1921 N N . CYS A 252 ? 2.5605 1.4177 1.4858 0.1340 0.4674 0.1274 385 CYS G N 1922 C CA . CYS A 252 ? 2.5746 1.4078 1.5189 0.1508 0.5330 0.1321 385 CYS G CA 1923 C C . CYS A 252 ? 2.6102 1.4550 1.6295 0.1784 0.5527 0.1511 385 CYS G C 1924 O O . CYS A 252 ? 2.6306 1.5264 1.7059 0.1916 0.5236 0.1813 385 CYS G O 1925 C CB . CYS A 252 ? 2.4867 1.3401 1.4373 0.1567 0.5528 0.1567 385 CYS G CB 1926 S SG . CYS A 252 ? 3.3107 2.1421 2.1614 0.1224 0.5305 0.1408 385 CYS G SG 1927 N N . ASN A 253 ? 2.6731 1.4679 1.6909 0.1861 0.6048 0.1346 386 ASN G N 1928 C CA . ASN A 253 ? 2.6885 1.4833 1.7732 0.2152 0.6285 0.1575 386 ASN G CA 1929 C C . ASN A 253 ? 2.7014 1.5400 1.8574 0.2487 0.6499 0.2021 386 ASN G C 1930 O O . ASN A 253 ? 2.8245 1.6488 1.9815 0.2572 0.6956 0.2004 386 ASN G O 1931 C CB . ASN A 253 ? 2.7472 1.4641 1.8067 0.2131 0.6842 0.1254 386 ASN G CB 1932 C CG . ASN A 253 ? 2.7644 1.4647 1.8758 0.2364 0.7010 0.1445 386 ASN G CG 1933 O OD1 . ASN A 253 ? 2.7997 1.5422 1.9787 0.2674 0.6962 0.1907 386 ASN G OD1 1934 N ND2 . ASN A 253 ? 2.7924 1.4321 1.8698 0.2188 0.7197 0.1099 386 ASN G ND2 1935 N N . THR A 254 ? 2.5741 1.4703 1.7914 0.2658 0.6181 0.2402 387 THR G N 1936 C CA . THR A 254 ? 2.4945 1.4505 1.7837 0.2939 0.6278 0.2834 387 THR G CA 1937 C C . THR A 254 ? 2.4739 1.4253 1.8289 0.3319 0.6595 0.3141 387 THR G C 1938 O O . THR A 254 ? 2.3749 1.3868 1.8026 0.3596 0.6613 0.3559 387 THR G O 1939 C CB . THR A 254 ? 2.1467 1.1824 1.4617 0.2845 0.5691 0.3085 387 THR G CB 1940 O OG1 . THR A 254 ? 2.0756 1.1187 1.3890 0.2757 0.5292 0.3090 387 THR G OG1 1941 C CG2 . THR A 254 ? 2.1383 1.1778 1.3998 0.2546 0.5458 0.2884 387 THR G CG2 1942 N N . THR A 255 ? 2.5771 1.4584 1.9068 0.3318 0.6822 0.2944 388 THR G N 1943 C CA . THR A 255 ? 2.6036 1.4593 1.9850 0.3673 0.7159 0.3231 388 THR G CA 1944 C C . THR A 255 ? 2.6075 1.4819 2.0550 0.4055 0.7620 0.3498 388 THR G C 1945 O O . THR A 255 ? 2.5168 1.4329 2.0412 0.4433 0.7639 0.3988 388 THR G O 1946 C CB . THR A 255 ? 2.7039 1.4589 2.0379 0.3570 0.7549 0.2861 388 THR G CB 1947 O OG1 . THR A 255 ? 2.6950 1.4438 1.9847 0.3249 0.7119 0.2663 388 THR G OG1 1948 C CG2 . THR A 255 ? 2.7473 1.4625 2.1363 0.3983 0.8006 0.3188 388 THR G CG2 1949 N N . GLN A 256 ? 2.7397 1.5867 2.1544 0.3930 0.7977 0.3158 389 GLN G N 1950 C CA . GLN A 256 ? 2.8447 1.6955 2.3117 0.4223 0.8553 0.3247 389 GLN G CA 1951 C C . GLN A 256 ? 2.7577 1.7144 2.2974 0.4391 0.8298 0.3669 389 GLN G C 1952 O O . GLN A 256 ? 2.6810 1.6704 2.3058 0.4788 0.8645 0.3970 389 GLN G O 1953 C CB . GLN A 256 ? 2.9776 1.7712 2.3703 0.3917 0.8964 0.2703 389 GLN G CB 1954 C CG . GLN A 256 ? 3.1204 1.8078 2.4685 0.3859 0.9487 0.2304 389 GLN G CG 1955 C CD . GLN A 256 ? 3.1775 1.8282 2.4370 0.3421 0.9077 0.1943 389 GLN G CD 1956 O OE1 . GLN A 256 ? 3.1417 1.8339 2.4070 0.3367 0.8471 0.2147 389 GLN G OE1 1957 N NE2 . GLN A 256 ? 3.2501 1.8194 2.4385 0.3143 0.9469 0.1412 389 GLN G NE2 1958 N N . LEU A 257 ? 2.7627 1.7736 2.2721 0.4082 0.7704 0.3674 390 LEU G N 1959 C CA . LEU A 257 ? 2.7617 1.8726 2.3301 0.4133 0.7437 0.4006 390 LEU G CA 1960 C C . LEU A 257 ? 2.7501 1.9316 2.4144 0.4513 0.7266 0.4557 390 LEU G C 1961 O O . LEU A 257 ? 2.7297 1.9810 2.4752 0.4764 0.7409 0.4852 390 LEU G O 1962 C CB . LEU A 257 ? 2.7493 1.8875 2.2594 0.3703 0.6838 0.3872 390 LEU G CB 1963 C CG . LEU A 257 ? 2.7277 1.9506 2.2682 0.3575 0.6577 0.4054 390 LEU G CG 1964 C CD1 . LEU A 257 ? 2.7539 1.9560 2.2615 0.3418 0.6970 0.3810 390 LEU G CD1 1965 C CD2 . LEU A 257 ? 2.6955 1.9377 2.1926 0.3238 0.5928 0.3999 390 LEU G CD2 1966 N N . PHE A 258 ? 2.7959 1.9639 2.4507 0.4539 0.6951 0.4703 391 PHE G N 1967 C CA . PHE A 258 ? 2.8369 2.0714 2.5697 0.4861 0.6723 0.5262 391 PHE G CA 1968 C C . PHE A 258 ? 2.9933 2.1674 2.7668 0.5323 0.7244 0.5450 391 PHE G C 1969 O O . PHE A 258 ? 3.0242 2.1507 2.7779 0.5383 0.7175 0.5560 391 PHE G O 1970 C CB . PHE A 258 ? 2.7386 1.9956 2.4340 0.4586 0.6092 0.5331 391 PHE G CB 1971 C CG . PHE A 258 ? 2.6635 1.9540 2.3106 0.4123 0.5666 0.5050 391 PHE G CG 1972 C CD1 . PHE A 258 ? 2.5613 1.9506 2.2518 0.4038 0.5346 0.5273 391 PHE G CD1 1973 C CD2 . PHE A 258 ? 2.6378 1.8618 2.2002 0.3777 0.5594 0.4570 391 PHE G CD2 1974 C CE1 . PHE A 258 ? 2.4130 1.8227 2.0607 0.3625 0.5002 0.5026 391 PHE G CE1 1975 C CE2 . PHE A 258 ? 2.5113 1.7616 2.0356 0.3409 0.5211 0.4360 391 PHE G CE2 1976 C CZ . PHE A 258 ? 2.3931 1.7308 1.9590 0.3338 0.4935 0.4590 391 PHE G CZ 1977 N N . ASN A 259 ? 3.0513 2.2255 2.8836 0.5644 0.7796 0.5484 392 ASN G N 1978 C CA . ASN A 259 ? 3.1102 2.2236 2.9925 0.6130 0.8374 0.5655 392 ASN G CA 1979 C C . ASN A 259 ? 3.1005 2.3077 3.1044 0.6652 0.8305 0.6314 392 ASN G C 1980 O O . ASN A 259 ? 3.1054 2.3826 3.1816 0.6826 0.8491 0.6401 392 ASN G O 1981 C CB . ASN A 259 ? 3.1562 2.1933 3.0229 0.6149 0.9142 0.5184 392 ASN G CB 1982 C CG . ASN A 259 ? 3.2210 2.1693 3.1242 0.6587 0.9795 0.5255 392 ASN G CG 1983 O OD1 . ASN A 259 ? 3.2231 2.2042 3.2309 0.7125 1.0092 0.5661 392 ASN G OD1 1984 N ND2 . ASN A 259 ? 3.2624 2.0979 3.0830 0.6356 1.0033 0.4850 392 ASN G ND2 1985 N N . ASN A 260 ? 3.0877 2.2950 3.1117 0.6888 0.8038 0.6779 393 ASN G N 1986 C CA . ASN A 260 ? 3.0787 2.3755 3.2087 0.7381 0.7830 0.7499 393 ASN G CA 1987 C C . ASN A 260 ? 3.1863 2.4939 3.4294 0.7999 0.8432 0.7739 393 ASN G C 1988 O O . ASN A 260 ? 3.1759 2.6006 3.5174 0.8266 0.8265 0.8128 393 ASN G O 1989 C CB . ASN A 260 ? 3.0401 2.2993 3.1444 0.7479 0.7536 0.7894 393 ASN G CB 1990 C CG . ASN A 260 ? 2.8840 2.1771 2.9081 0.6923 0.6841 0.7794 393 ASN G CG 1991 O OD1 . ASN A 260 ? 2.7659 2.1594 2.7982 0.6656 0.6392 0.7786 393 ASN G OD1 1992 N ND2 . ASN A 260 ? 2.8832 2.0895 2.8302 0.6723 0.6798 0.7674 393 ASN G ND2 1993 N N . THR A 261 ? 3.2967 2.4847 3.5295 0.8211 0.9148 0.7481 394 THR G N 1994 C CA . THR A 261 ? 3.4273 2.6135 3.7677 0.8785 0.9783 0.7651 394 THR G CA 1995 C C . THR A 261 ? 3.4625 2.7296 3.8833 0.8920 1.0093 0.7535 394 THR G C 1996 O O . THR A 261 ? 3.4806 2.8145 4.0272 0.9463 1.0290 0.7946 394 THR G O 1997 C CB . THR A 261 ? 4.0084 3.0592 4.2941 0.8644 1.0468 0.7105 394 THR G CB 1998 O OG1 . THR A 261 ? 4.0462 3.0365 4.2658 0.8446 1.0207 0.7147 394 THR G OG1 1999 C CG2 . THR A 261 ? 4.0777 3.1317 4.4661 0.9071 1.1075 0.7197 394 THR G CG2 2000 N N . CYS A 262 ? 3.4494 2.7236 3.7989 0.8358 1.0085 0.6967 395 CYS G N 2001 C CA . CYS A 262 ? 3.4304 2.7792 3.8453 0.8377 1.0414 0.6798 395 CYS G CA 2002 C C . CYS A 262 ? 3.2161 2.7291 3.7152 0.8412 0.9832 0.7241 395 CYS G C 2003 O O . CYS A 262 ? 3.2199 2.8045 3.7694 0.8341 1.0051 0.7086 395 CYS G O 2004 C CB . CYS A 262 ? 3.5422 2.8340 3.8457 0.7755 1.0651 0.6063 395 CYS G CB 2005 S SG . CYS A 262 ? 3.6122 2.8987 3.7772 0.7035 0.9840 0.5840 395 CYS G SG 2006 N N . ILE A 263 ? 2.9925 2.5660 3.5029 0.8472 0.9111 0.7762 396 ILE G N 2007 C CA . ILE A 263 ? 2.7696 2.5026 3.3557 0.8455 0.8527 0.8170 396 ILE G CA 2008 C C . ILE A 263 ? 2.8275 2.6408 3.5558 0.9178 0.8483 0.8897 396 ILE G C 2009 O O . ILE A 263 ? 2.8748 2.7342 3.7179 0.9609 0.8970 0.8979 396 ILE G O 2010 C CB . ILE A 263 ? 2.5513 2.3174 3.0524 0.7947 0.7690 0.8241 396 ILE G CB 2011 C CG1 . ILE A 263 ? 2.4435 2.3261 2.9556 0.7504 0.7331 0.8115 396 ILE G CG1 2012 C CG2 . ILE A 263 ? 2.4903 2.3028 3.0330 0.8282 0.7177 0.8936 396 ILE G CG2 2013 C CD1 . ILE A 263 ? 2.3745 2.2846 2.8037 0.6968 0.6588 0.8100 396 ILE G CD1 2014 N N . ASN A 272 ? 3.6052 2.8826 3.9516 0.7352 1.3172 0.4506 411 ASN G N 2015 C CA . ASN A 272 ? 3.6024 2.9725 3.9668 0.7045 1.3165 0.4408 411 ASN G CA 2016 C C . ASN A 272 ? 3.5842 2.8869 3.8067 0.6351 1.3399 0.3788 411 ASN G C 2017 O O . ASN A 272 ? 3.6044 2.9720 3.8107 0.5975 1.3246 0.3727 411 ASN G O 2018 C CB . ASN A 272 ? 3.7341 3.1759 4.2540 0.7543 1.3832 0.4527 411 ASN G CB 2019 C CG . ASN A 272 ? 3.7763 3.3401 4.3424 0.7275 1.3745 0.4542 411 ASN G CG 2020 O OD1 . ASN A 272 ? 3.7387 3.3684 4.2684 0.6919 1.2999 0.4726 411 ASN G OD1 2021 N ND2 . ASN A 272 ? 3.8420 3.4341 4.4900 0.7424 1.4551 0.4321 411 ASN G ND2 2022 N N . GLY A 273 ? 3.4874 2.6602 3.6041 0.6157 1.3753 0.3340 412 GLY G N 2023 C CA . GLY A 273 ? 3.3363 2.4433 3.3162 0.5516 1.4007 0.2762 412 GLY G CA 2024 C C . GLY A 273 ? 3.1137 2.2129 2.9696 0.4985 1.3168 0.2750 412 GLY G C 2025 O O . GLY A 273 ? 3.0436 2.2123 2.9307 0.5053 1.2417 0.3174 412 GLY G O 2026 N N . THR A 274 ? 3.0324 2.0462 2.7476 0.4456 1.3311 0.2254 413 THR G N 2027 C CA . THR A 274 ? 2.8815 1.8784 2.4734 0.3948 1.2571 0.2196 413 THR G CA 2028 C C . THR A 274 ? 2.8384 1.7592 2.3671 0.3936 1.2254 0.2094 413 THR G C 2029 O O . THR A 274 ? 2.8626 1.6934 2.3473 0.3910 1.2771 0.1712 413 THR G O 2030 C CB . THR A 274 ? 2.8053 1.7602 2.2751 0.3357 1.2821 0.1768 413 THR G CB 2031 O OG1 . THR A 274 ? 2.6165 1.6513 2.1387 0.3289 1.2975 0.1914 413 THR G OG1 2032 C CG2 . THR A 274 ? 2.6022 1.5291 1.9474 0.2903 1.2059 0.1722 413 THR G CG2 2033 N N . ILE A 275 ? 2.7857 1.7440 2.3126 0.3930 1.1433 0.2411 414 ILE G N 2034 C CA . ILE A 275 ? 2.7658 1.6602 2.2288 0.3847 1.1071 0.2301 414 ILE G CA 2035 C C . ILE A 275 ? 2.7388 1.5962 2.0674 0.3285 1.0592 0.2007 414 ILE G C 2036 O O . ILE A 275 ? 2.7370 1.6410 2.0369 0.3028 1.0167 0.2117 414 ILE G O 2037 C CB . ILE A 275 ? 2.6513 1.6008 2.1970 0.4213 1.0530 0.2806 414 ILE G CB 2038 C CG1 . ILE A 275 ? 2.4568 1.5140 2.0471 0.4168 0.9947 0.3190 414 ILE G CG1 2039 C CG2 . ILE A 275 ? 2.7078 1.6626 2.3703 0.4805 1.1049 0.3060 414 ILE G CG2 2040 C CD1 . ILE A 275 ? 2.3844 1.4434 1.8882 0.3741 0.9238 0.3124 414 ILE G CD1 2041 N N . THR A 276 ? 2.7210 1.4923 1.9689 0.3091 1.0710 0.1618 415 THR G N 2042 C CA . THR A 276 ? 2.7723 1.5082 1.8951 0.2580 1.0273 0.1317 415 THR G CA 2043 C C . THR A 276 ? 2.8081 1.5158 1.9038 0.2537 0.9781 0.1264 415 THR G C 2044 O O . THR A 276 ? 2.8174 1.4677 1.9188 0.2649 1.0125 0.1075 415 THR G O 2045 C CB . THR A 276 ? 3.1698 1.8334 2.1929 0.2204 1.0844 0.0784 415 THR G CB 2046 O OG1 . THR A 276 ? 3.1973 1.8890 2.2344 0.2165 1.1276 0.0812 415 THR G OG1 2047 C CG2 . THR A 276 ? 3.2214 1.8543 2.1161 0.1694 1.0319 0.0515 415 THR G CG2 2048 N N . LEU A 277 ? 2.8394 1.5862 1.9068 0.2356 0.9011 0.1414 416 LEU G N 2049 C CA . LEU A 277 ? 2.7758 1.5130 1.8209 0.2270 0.8449 0.1375 416 LEU G CA 2050 C C . LEU A 277 ? 2.8085 1.4865 1.7428 0.1841 0.8352 0.0890 416 LEU G C 2051 O O . LEU A 277 ? 2.9252 1.5961 1.7840 0.1530 0.8287 0.0727 416 LEU G O 2052 C CB . LEU A 277 ? 2.7001 1.5088 1.7714 0.2267 0.7706 0.1723 416 LEU G CB 2053 C CG . LEU A 277 ? 2.7232 1.6017 1.9011 0.2631 0.7541 0.2208 416 LEU G CG 2054 C CD1 . LEU A 277 ? 2.7959 1.6913 2.0545 0.2992 0.8145 0.2411 416 LEU G CD1 2055 C CD2 . LEU A 277 ? 2.6491 1.5954 1.8355 0.2504 0.6959 0.2456 416 LEU G CD2 2056 N N . PRO A 278 ? 2.7041 1.3418 1.6269 0.1804 0.8324 0.0668 417 PRO G N 2057 C CA . PRO A 278 ? 2.7131 1.3123 1.5382 0.1370 0.8100 0.0219 417 PRO G CA 2058 C C . PRO A 278 ? 2.5899 1.2360 1.3965 0.1222 0.7262 0.0336 417 PRO G C 2059 O O . PRO A 278 ? 2.4414 1.1194 1.3049 0.1395 0.6909 0.0552 417 PRO G O 2060 C CB . PRO A 278 ? 2.7303 1.2761 1.5665 0.1397 0.8391 -0.0036 417 PRO G CB 2061 C CG . PRO A 278 ? 2.7320 1.2783 1.6662 0.1876 0.8828 0.0312 417 PRO G CG 2062 C CD . PRO A 278 ? 2.6287 1.2536 1.6240 0.2128 0.8509 0.0819 417 PRO G CD 2063 N N . CYS A 279 ? 2.6620 1.3109 1.3895 0.0907 0.6953 0.0202 418 CYS G N 2064 C CA . CYS A 279 ? 2.6710 1.3596 1.3867 0.0801 0.6172 0.0306 418 CYS G CA 2065 C C . CYS A 279 ? 2.7583 1.4243 1.3917 0.0433 0.5862 -0.0100 418 CYS G C 2066 O O . CYS A 279 ? 2.9470 1.5688 1.5078 0.0168 0.6212 -0.0453 418 CYS G O 2067 C CB . CYS A 279 ? 2.3926 1.1171 1.1011 0.0805 0.5911 0.0637 418 CYS G CB 2068 S SG . CYS A 279 ? 3.8796 2.6583 2.6149 0.0833 0.5038 0.0904 418 CYS G SG 2069 N N . LYS A 280 ? 2.6851 1.3854 1.3319 0.0403 0.5210 -0.0068 419 LYS G N 2070 C CA . LYS A 280 ? 2.4453 1.1435 1.0231 0.0077 0.4772 -0.0385 419 LYS G CA 2071 C C . LYS A 280 ? 2.6051 1.3474 1.1761 0.0070 0.4011 -0.0145 419 LYS G C 2072 O O . LYS A 280 ? 2.4615 1.2395 1.0983 0.0304 0.3742 0.0175 419 LYS G O 2073 C CB . LYS A 280 ? 2.5620 1.2514 1.1579 -0.0025 0.4766 -0.0750 419 LYS G CB 2074 C CG . LYS A 280 ? 2.4558 1.1709 1.1440 0.0229 0.4660 -0.0587 419 LYS G CG 2075 C CD . LYS A 280 ? 2.4522 1.1463 1.1405 0.0035 0.4763 -0.1017 419 LYS G CD 2076 C CE . LYS A 280 ? 2.3597 1.0703 1.1272 0.0233 0.4734 -0.0875 419 LYS G CE 2077 N NZ . LYS A 280 ? 2.3788 1.0633 1.1424 0.0000 0.4895 -0.1304 419 LYS G NZ 2078 N N . ILE A 281 ? 2.7319 1.4697 1.2218 -0.0202 0.3676 -0.0290 420 ILE G N 2079 C CA . ILE A 281 ? 2.8219 1.5947 1.3060 -0.0183 0.2948 -0.0061 420 ILE G CA 2080 C C . ILE A 281 ? 2.8431 1.6456 1.3465 -0.0266 0.2451 -0.0336 420 ILE G C 2081 O O . ILE A 281 ? 2.9141 1.7048 1.3730 -0.0531 0.2524 -0.0739 420 ILE G O 2082 C CB . ILE A 281 ? 2.9503 1.7053 1.3334 -0.0405 0.2776 0.0042 420 ILE G CB 2083 C CG1 . ILE A 281 ? 2.9963 1.7264 1.3619 -0.0354 0.3266 0.0312 420 ILE G CG1 2084 C CG2 . ILE A 281 ? 2.9618 1.7473 1.3457 -0.0335 0.2008 0.0317 420 ILE G CG2 2085 C CD1 . ILE A 281 ? 3.1261 1.8332 1.3849 -0.0607 0.3144 0.0438 420 ILE G CD1 2086 N N . LYS A 282 ? 2.7528 1.5956 1.3256 -0.0065 0.1983 -0.0160 421 LYS G N 2087 C CA . LYS A 282 ? 2.6520 1.5298 1.2567 -0.0130 0.1548 -0.0444 421 LYS G CA 2088 C C . LYS A 282 ? 2.5626 1.4751 1.1630 -0.0101 0.0815 -0.0313 421 LYS G C 2089 O O . LYS A 282 ? 2.5882 1.5026 1.1946 0.0072 0.0576 0.0078 421 LYS G O 2090 C CB . LYS A 282 ? 2.5957 1.4941 1.2937 0.0042 0.1652 -0.0481 421 LYS G CB 2091 C CG . LYS A 282 ? 2.6275 1.4919 1.3335 0.0019 0.2311 -0.0634 421 LYS G CG 2092 C CD . LYS A 282 ? 2.6352 1.5188 1.4259 0.0219 0.2389 -0.0520 421 LYS G CD 2093 C CE . LYS A 282 ? 2.7533 1.5990 1.5541 0.0291 0.3047 -0.0496 421 LYS G CE 2094 N NZ . LYS A 282 ? 2.7401 1.6068 1.6156 0.0466 0.3075 -0.0343 421 LYS G NZ 2095 N N . GLN A 283 ? 2.5569 1.4974 1.1523 -0.0274 0.0478 -0.0658 422 GLN G N 2096 C CA . GLN A 283 ? 2.6128 1.5960 1.2176 -0.0227 -0.0256 -0.0593 422 GLN G CA 2097 C C . GLN A 283 ? 2.3784 1.4085 1.0905 -0.0049 -0.0513 -0.0706 422 GLN G C 2098 O O . GLN A 283 ? 2.4070 1.4710 1.1574 0.0124 -0.1068 -0.0548 422 GLN G O 2099 C CB . GLN A 283 ? 2.8556 1.8491 1.3829 -0.0565 -0.0484 -0.0907 422 GLN G CB 2100 C CG . GLN A 283 ? 2.9539 2.0111 1.5213 -0.0618 -0.1095 -0.1165 422 GLN G CG 2101 C CD . GLN A 283 ? 3.1452 2.2182 1.6211 -0.0920 -0.1486 -0.1289 422 GLN G CD 2102 O OE1 . GLN A 283 ? 3.2204 2.2577 1.6062 -0.1249 -0.1111 -0.1485 422 GLN G OE1 2103 N NE2 . GLN A 283 ? 3.2113 2.3394 1.7110 -0.0810 -0.2243 -0.1170 422 GLN G NE2 2104 N N . ILE A 284 ? 2.2847 1.3143 1.0443 -0.0098 -0.0097 -0.0982 423 ILE G N 2105 C CA . ILE A 284 ? 2.2881 1.3589 1.1457 0.0035 -0.0259 -0.1096 423 ILE G CA 2106 C C . ILE A 284 ? 2.2120 1.2667 1.1183 0.0247 0.0080 -0.0819 423 ILE G C 2107 O O . ILE A 284 ? 2.1478 1.1700 1.0433 0.0212 0.0617 -0.0815 423 ILE G O 2108 C CB . ILE A 284 ? 2.5780 1.6644 1.4609 -0.0208 -0.0047 -0.1612 423 ILE G CB 2109 C CG1 . ILE A 284 ? 2.6732 1.7772 1.5035 -0.0512 -0.0277 -0.1975 423 ILE G CG1 2110 C CG2 . ILE A 284 ? 2.0487 1.1797 1.0286 -0.0104 -0.0212 -0.1738 423 ILE G CG2 2111 C CD1 . ILE A 284 ? 2.6632 1.7815 1.5190 -0.0805 -0.0037 -0.2520 423 ILE G CD1 2112 N N . ILE A 285 ? 2.1639 1.2419 1.1250 0.0463 -0.0228 -0.0587 424 ILE G N 2113 C CA . ILE A 285 ? 2.1019 1.1695 1.1008 0.0615 0.0063 -0.0319 424 ILE G CA 2114 C C . ILE A 285 ? 2.0662 1.1717 1.1506 0.0712 -0.0120 -0.0387 424 ILE G C 2115 O O . ILE A 285 ? 2.1300 1.2679 1.2499 0.0746 -0.0539 -0.0543 424 ILE G O 2116 C CB . ILE A 285 ? 2.1667 1.2086 1.1306 0.0744 0.0048 0.0128 424 ILE G CB 2117 C CG1 . ILE A 285 ? 2.1440 1.2035 1.1335 0.0888 -0.0490 0.0292 424 ILE G CG1 2118 C CG2 . ILE A 285 ? 2.2578 1.2635 1.1308 0.0621 0.0188 0.0185 424 ILE G CG2 2119 C CD1 . ILE A 285 ? 2.1923 1.2208 1.1405 0.0972 -0.0533 0.0720 424 ILE G CD1 2120 N N . ASN A 286 ? 1.9648 1.0692 1.0836 0.0747 0.0203 -0.0286 425 ASN G N 2121 C CA . ASN A 286 ? 1.8791 1.0166 1.0707 0.0802 0.0063 -0.0336 425 ASN G CA 2122 C C . ASN A 286 ? 1.8425 0.9769 1.0457 0.0958 -0.0131 0.0002 425 ASN G C 2123 O O . ASN A 286 ? 1.7675 0.8817 0.9469 0.0994 0.0098 0.0316 425 ASN G O 2124 C CB . ASN A 286 ? 1.8702 1.0123 1.0895 0.0720 0.0455 -0.0389 425 ASN G CB 2125 C CG . ASN A 286 ? 1.8686 1.0080 1.0819 0.0543 0.0665 -0.0741 425 ASN G CG 2126 O OD1 . ASN A 286 ? 1.8416 1.0064 1.0787 0.0443 0.0447 -0.1096 425 ASN G OD1 2127 N ND2 . ASN A 286 ? 1.9244 1.0331 1.1094 0.0504 0.1101 -0.0646 425 ASN G ND2 2128 N N . MET A 287 ? 1.8283 0.9799 1.0664 0.1054 -0.0539 -0.0050 426 MET G N 2129 C CA . MET A 287 ? 1.9105 1.0469 1.1531 0.1181 -0.0668 0.0277 426 MET G CA 2130 C C . MET A 287 ? 1.9271 1.0730 1.2062 0.1127 -0.0373 0.0348 426 MET G C 2131 O O . MET A 287 ? 1.9557 1.1302 1.2846 0.1048 -0.0293 0.0091 426 MET G O 2132 C CB . MET A 287 ? 1.9041 1.0533 1.1883 0.1329 -0.1132 0.0215 426 MET G CB 2133 C CG . MET A 287 ? 1.8600 1.0037 1.0998 0.1383 -0.1485 0.0238 426 MET G CG 2134 S SD . MET A 287 ? 1.9007 1.0670 1.2018 0.1622 -0.2076 0.0202 426 MET G SD 2135 C CE . MET A 287 ? 2.6895 1.8247 2.0256 0.1752 -0.1993 0.0495 426 MET G CE 2136 N N . TRP A 288 ? 1.9692 1.0944 1.2233 0.1145 -0.0235 0.0692 427 TRP G N 2137 C CA . TRP A 288 ? 1.9077 1.0472 1.1905 0.1071 0.0001 0.0809 427 TRP G CA 2138 C C . TRP A 288 ? 1.9937 1.1392 1.3252 0.1092 -0.0218 0.0747 427 TRP G C 2139 O O . TRP A 288 ? 1.8630 1.0325 1.2374 0.0983 -0.0110 0.0631 427 TRP G O 2140 C CB . TRP A 288 ? 1.8872 1.0083 1.1290 0.1065 0.0230 0.1175 427 TRP G CB 2141 C CG . TRP A 288 ? 2.0693 1.1570 1.2793 0.1132 0.0033 0.1394 427 TRP G CG 2142 C CD1 . TRP A 288 ? 2.1133 1.1698 1.2628 0.1180 -0.0051 0.1503 427 TRP G CD1 2143 C CD2 . TRP A 288 ? 2.1371 1.2138 1.3683 0.1130 -0.0093 0.1537 427 TRP G CD2 2144 N NE1 . TRP A 288 ? 2.1662 1.1923 1.2953 0.1222 -0.0244 0.1745 427 TRP G NE1 2145 C CE2 . TRP A 288 ? 2.1703 1.2051 1.3512 0.1201 -0.0258 0.1770 427 TRP G CE2 2146 C CE3 . TRP A 288 ? 2.1665 1.2614 1.4503 0.1044 -0.0060 0.1478 427 TRP G CE3 2147 C CZ2 . TRP A 288 ? 2.3369 1.3422 1.5207 0.1214 -0.0381 0.1974 427 TRP G CZ2 2148 C CZ3 . TRP A 288 ? 2.2173 1.2844 1.5069 0.1041 -0.0164 0.1630 427 TRP G CZ3 2149 C CH2 . TRP A 288 ? 2.3093 1.3293 1.5503 0.1137 -0.0317 0.1891 427 TRP G CH2 2150 N N . GLN A 289 ? 2.2033 1.3247 1.5253 0.1230 -0.0529 0.0818 428 GLN G N 2151 C CA . GLN A 289 ? 2.3989 1.5105 1.7632 0.1311 -0.0745 0.0817 428 GLN G CA 2152 C C . GLN A 289 ? 2.4516 1.5965 1.8904 0.1301 -0.0813 0.0417 428 GLN G C 2153 O O . GLN A 289 ? 2.6072 1.7452 2.0931 0.1357 -0.0915 0.0353 428 GLN G O 2154 C CB . GLN A 289 ? 2.5598 1.6403 1.8953 0.1505 -0.1113 0.0989 428 GLN G CB 2155 C CG . GLN A 289 ? 2.7370 1.7918 2.1081 0.1654 -0.1352 0.1093 428 GLN G CG 2156 C CD . GLN A 289 ? 2.9339 1.9539 2.2610 0.1847 -0.1726 0.1379 428 GLN G CD 2157 O OE1 . GLN A 289 ? 2.9879 1.9803 2.3407 0.2028 -0.1975 0.1521 428 GLN G OE1 2158 N NE2 . GLN A 289 ? 3.0217 2.0402 2.2797 0.1804 -0.1758 0.1473 428 GLN G NE2 2159 N N . GLY A 290 ? 2.2425 1.4199 1.6927 0.1215 -0.0717 0.0131 429 GLY G N 2160 C CA . GLY A 290 ? 2.1820 1.3936 1.7010 0.1167 -0.0736 -0.0285 429 GLY G CA 2161 C C . GLY A 290 ? 2.2440 1.4777 1.7489 0.1087 -0.0671 -0.0507 429 GLY G C 2162 O O . GLY A 290 ? 2.3200 1.5426 1.7710 0.1012 -0.0471 -0.0352 429 GLY G O 2163 N N . THR A 291 ? 2.2468 1.5109 1.8050 0.1105 -0.0823 -0.0887 430 THR G N 2164 C CA . THR A 291 ? 2.2244 1.5125 1.7787 0.0979 -0.0747 -0.1182 430 THR G CA 2165 C C . THR A 291 ? 2.1422 1.4367 1.6822 0.1093 -0.1080 -0.1244 430 THR G C 2166 O O . THR A 291 ? 1.9919 1.2887 1.5544 0.1309 -0.1464 -0.1166 430 THR G O 2167 C CB . THR A 291 ? 2.5099 1.8376 2.1371 0.0833 -0.0622 -0.1636 430 THR G CB 2168 O OG1 . THR A 291 ? 2.4990 1.8227 2.1298 0.0680 -0.0332 -0.1576 430 THR G OG1 2169 C CG2 . THR A 291 ? 2.4601 1.8099 2.0831 0.0625 -0.0448 -0.1963 430 THR G CG2 2170 N N . GLY A 292 ? 2.1738 1.4694 1.6733 0.0936 -0.0929 -0.1367 431 GLY G N 2171 C CA . GLY A 292 ? 2.3040 1.6118 1.7838 0.0953 -0.1209 -0.1491 431 GLY G CA 2172 C C . GLY A 292 ? 2.4033 1.6723 1.7919 0.0921 -0.1144 -0.1230 431 GLY G C 2173 O O . GLY A 292 ? 2.4084 1.6391 1.7528 0.0979 -0.0981 -0.0858 431 GLY G O 2174 N N . GLN A 293 ? 2.4354 1.7170 1.7971 0.0799 -0.1250 -0.1458 432 GLN G N 2175 C CA . GLN A 293 ? 2.5196 1.7642 1.7917 0.0723 -0.1157 -0.1288 432 GLN G CA 2176 C C . GLN A 293 ? 2.5751 1.8234 1.8218 0.0879 -0.1679 -0.1078 432 GLN G C 2177 O O . GLN A 293 ? 2.6226 1.9153 1.9181 0.0960 -0.2115 -0.1246 432 GLN G O 2178 C CB . GLN A 293 ? 2.5785 1.8287 1.8250 0.0442 -0.0939 -0.1677 432 GLN G CB 2179 C CG . GLN A 293 ? 2.5306 1.7694 1.7933 0.0268 -0.0413 -0.1868 432 GLN G CG 2180 C CD . GLN A 293 ? 2.4948 1.7397 1.7419 -0.0034 -0.0233 -0.2314 432 GLN G CD 2181 O OE1 . GLN A 293 ? 2.4808 1.7747 1.7684 -0.0143 -0.0512 -0.2682 432 GLN G OE1 2182 N NE2 . GLN A 293 ? 2.4602 1.6555 1.6525 -0.0172 0.0252 -0.2292 432 GLN G NE2 2183 N N . ALA A 294 ? 2.5504 1.7539 1.7227 0.0926 -0.1637 -0.0696 433 ALA G N 2184 C CA . ALA A 294 ? 2.5372 1.7359 1.6651 0.1026 -0.2104 -0.0457 433 ALA G CA 2185 C C . ALA A 294 ? 2.5279 1.7099 1.5627 0.0790 -0.2029 -0.0534 433 ALA G C 2186 O O . ALA A 294 ? 2.4369 1.5847 1.4255 0.0624 -0.1517 -0.0578 433 ALA G O 2187 C CB . ALA A 294 ? 2.5369 1.6945 1.6450 0.1221 -0.2137 0.0041 433 ALA G CB 2188 N N . MET A 295 ? 2.5680 1.7747 1.5765 0.0776 -0.2539 -0.0546 434 MET G N 2189 C CA . MET A 295 ? 2.5851 1.7807 1.4989 0.0502 -0.2525 -0.0652 434 MET G CA 2190 C C . MET A 295 ? 2.6241 1.7900 1.4613 0.0592 -0.2852 -0.0181 434 MET G C 2191 O O . MET A 295 ? 2.6387 1.8319 1.4962 0.0783 -0.3460 0.0018 434 MET G O 2192 C CB . MET A 295 ? 2.6222 1.8792 1.5572 0.0318 -0.2859 -0.1097 434 MET G CB 2193 C CG . MET A 295 ? 2.5753 1.8450 1.5438 0.0066 -0.2403 -0.1615 434 MET G CG 2194 S SD . MET A 295 ? 3.2452 2.5800 2.2057 -0.0282 -0.2747 -0.2152 434 MET G SD 2195 C CE . MET A 295 ? 3.1376 2.4453 1.9627 -0.0444 -0.3007 -0.1894 434 MET G CE 2196 N N . TYR A 296 ? 2.6366 1.7462 1.3885 0.0459 -0.2431 0.0002 435 TYR G N 2197 C CA . TYR A 296 ? 2.7534 1.8262 1.4130 0.0452 -0.2627 0.0425 435 TYR G CA 2198 C C . TYR A 296 ? 2.8490 1.9238 1.4084 0.0099 -0.2691 0.0213 435 TYR G C 2199 O O . TYR A 296 ? 2.8001 1.8935 1.3622 -0.0146 -0.2444 -0.0267 435 TYR G O 2200 C CB . TYR A 296 ? 2.7597 1.7742 1.3911 0.0494 -0.2097 0.0736 435 TYR G CB 2201 C CG . TYR A 296 ? 2.6444 1.6588 1.3647 0.0797 -0.2104 0.0969 435 TYR G CG 2202 C CD1 . TYR A 296 ? 2.6997 1.6973 1.4213 0.1008 -0.2484 0.1402 435 TYR G CD1 2203 C CD2 . TYR A 296 ? 2.4453 1.4740 1.2441 0.0847 -0.1735 0.0755 435 TYR G CD2 2204 C CE1 . TYR A 296 ? 2.6129 1.6070 1.4126 0.1236 -0.2458 0.1564 435 TYR G CE1 2205 C CE2 . TYR A 296 ? 2.3883 1.4196 1.2610 0.1063 -0.1744 0.0929 435 TYR G CE2 2206 C CZ . TYR A 296 ? 2.4883 1.5020 1.3625 0.1246 -0.2090 0.1307 435 TYR G CZ 2207 O OH . TYR A 296 ? 2.4904 1.5026 1.4367 0.1419 -0.2055 0.1434 435 TYR G OH 2208 N N . ALA A 297 ? 2.9487 2.0022 1.4161 0.0042 -0.3010 0.0560 436 ALA G N 2209 C CA . ALA A 297 ? 3.0012 2.0609 1.3635 -0.0338 -0.3134 0.0364 436 ALA G CA 2210 C C . ALA A 297 ? 2.9771 1.9861 1.2690 -0.0654 -0.2340 0.0122 436 ALA G C 2211 O O . ALA A 297 ? 2.6702 1.6381 0.9845 -0.0525 -0.1801 0.0264 436 ALA G O 2212 C CB . ALA A 297 ? 2.8039 1.8512 1.0808 -0.0317 -0.3693 0.0859 436 ALA G CB 2213 N N . PRO A 298 ? 2.9500 1.9631 1.1582 -0.1075 -0.2256 -0.0251 437 PRO G N 2214 C CA . PRO A 298 ? 2.9331 1.8918 1.0733 -0.1373 -0.1455 -0.0504 437 PRO G CA 2215 C C . PRO A 298 ? 3.0057 1.9037 1.0818 -0.1318 -0.1122 -0.0056 437 PRO G C 2216 O O . PRO A 298 ? 3.0598 1.9525 1.0956 -0.1214 -0.1583 0.0416 437 PRO G O 2217 C CB . PRO A 298 ? 3.0130 1.9892 1.0597 -0.1862 -0.1588 -0.0918 437 PRO G CB 2218 C CG . PRO A 298 ? 2.9876 2.0420 1.1035 -0.1796 -0.2295 -0.1081 437 PRO G CG 2219 C CD . PRO A 298 ? 2.9448 2.0180 1.1307 -0.1308 -0.2843 -0.0530 437 PRO G CD 2220 N N . PRO A 299 ? 3.0523 1.9044 1.1205 -0.1393 -0.0310 -0.0202 438 PRO G N 2221 C CA . PRO A 299 ? 2.8945 1.6937 0.9154 -0.1370 0.0155 0.0130 438 PRO G CA 2222 C C . PRO A 299 ? 3.0508 1.8244 0.9330 -0.1716 0.0039 0.0242 438 PRO G C 2223 O O . PRO A 299 ? 3.2366 2.0074 1.0408 -0.2114 0.0165 -0.0164 438 PRO G O 2224 C CB . PRO A 299 ? 2.8670 1.6362 0.9119 -0.1435 0.1028 -0.0219 438 PRO G CB 2225 C CG . PRO A 299 ? 3.1676 1.9559 1.2104 -0.1687 0.1034 -0.0781 438 PRO G CG 2226 C CD . PRO A 299 ? 3.0776 1.9263 1.1835 -0.1524 0.0246 -0.0734 438 PRO G CD 2227 N N . ILE A 300 ? 3.0893 1.8412 0.9356 -0.1603 -0.0173 0.0778 439 ILE G N 2228 C CA . ILE A 300 ? 3.4246 2.1440 1.1277 -0.1954 -0.0233 0.0950 439 ILE G CA 2229 C C . ILE A 300 ? 3.5508 2.2234 1.1710 -0.2337 0.0633 0.0624 439 ILE G C 2230 O O . ILE A 300 ? 3.5357 2.1917 1.2189 -0.2230 0.1339 0.0422 439 ILE G O 2231 C CB . ILE A 300 ? 3.5793 2.2742 1.2677 -0.1737 -0.0549 0.1634 439 ILE G CB 2232 C CG1 . ILE A 300 ? 3.4462 2.1227 1.2282 -0.1429 -0.0056 0.1825 439 ILE G CG1 2233 C CG2 . ILE A 300 ? 3.5303 2.2643 1.2564 -0.1471 -0.1497 0.1947 439 ILE G CG2 2234 C CD1 . ILE A 300 ? 3.1597 1.7911 0.8933 -0.1639 0.0793 0.1773 439 ILE G CD1 2235 N N . ASP A 301 ? 3.6447 2.2979 1.1239 -0.2785 0.0570 0.0572 440 ASP G N 2236 C CA . ASP A 301 ? 3.7809 2.3915 1.1802 -0.3183 0.1392 0.0252 440 ASP G CA 2237 C C . ASP A 301 ? 3.6622 2.2416 1.0651 -0.3113 0.1838 0.0628 440 ASP G C 2238 O O . ASP A 301 ? 3.6094 2.1881 1.0143 -0.2926 0.1406 0.1183 440 ASP G O 2239 C CB . ASP A 301 ? 4.0646 2.6997 1.3729 -0.3681 0.1157 -0.0020 440 ASP G CB 2240 C CG . ASP A 301 ? 4.2049 2.8799 1.5196 -0.3809 0.0771 -0.0473 440 ASP G CG 2241 O OD1 . ASP A 301 ? 4.2133 2.8804 1.5449 -0.4019 0.1367 -0.1073 440 ASP G OD1 2242 O OD2 . ASP A 301 ? 4.2788 2.9942 1.5919 -0.3686 -0.0115 -0.0233 440 ASP G OD2 2243 N N . GLY A 302 ? 3.6188 2.1741 1.0257 -0.3288 0.2716 0.0292 441 GLY G N 2244 C CA . GLY A 302 ? 3.5562 2.0874 0.9694 -0.3287 0.3246 0.0529 441 GLY G CA 2245 C C . GLY A 302 ? 3.4721 1.9915 0.9870 -0.2943 0.3889 0.0459 441 GLY G C 2246 O O . GLY A 302 ? 3.3941 1.9223 0.9710 -0.2636 0.3740 0.0422 441 GLY G O 2247 N N . LYS A 303 ? 3.4747 1.9774 1.0079 -0.3004 0.4617 0.0420 442 LYS G N 2248 C CA . LYS A 303 ? 3.4304 1.9302 1.0661 -0.2667 0.5249 0.0396 442 LYS G CA 2249 C C . LYS A 303 ? 3.4131 1.9282 1.1078 -0.2291 0.4807 0.0940 442 LYS G C 2250 O O . LYS A 303 ? 3.5079 2.0243 1.1732 -0.2349 0.4422 0.1346 442 LYS G O 2251 C CB . LYS A 303 ? 3.5090 1.9953 1.1550 -0.2818 0.6082 0.0247 442 LYS G CB 2252 C CG . LYS A 303 ? 3.4575 1.9488 1.2177 -0.2450 0.6754 0.0185 442 LYS G CG 2253 C CD . LYS A 303 ? 3.5570 2.0395 1.3347 -0.2586 0.7584 0.0000 442 LYS G CD 2254 C CE . LYS A 303 ? 3.5655 2.0564 1.3228 -0.2703 0.7514 0.0389 442 LYS G CE 2255 N NZ . LYS A 303 ? 3.3833 1.9013 1.2227 -0.2327 0.7288 0.0857 442 LYS G NZ 2256 N N . ILE A 304 ? 3.2800 1.8168 1.0826 -0.1904 0.4836 0.0923 443 ILE G N 2257 C CA . ILE A 304 ? 3.1918 1.7626 1.0957 -0.1522 0.4402 0.1344 443 ILE G CA 2258 C C . ILE A 304 ? 3.2256 1.8169 1.2426 -0.1245 0.4986 0.1384 443 ILE G C 2259 O O . ILE A 304 ? 3.2784 1.8767 1.3543 -0.1116 0.5429 0.1075 443 ILE G O 2260 C CB . ILE A 304 ? 3.1392 1.7447 1.1091 -0.1282 0.3746 0.1279 443 ILE G CB 2261 C CG1 . ILE A 304 ? 3.2778 1.8775 1.1529 -0.1534 0.3164 0.1151 443 ILE G CG1 2262 C CG2 . ILE A 304 ? 2.9649 1.6012 1.0294 -0.0941 0.3327 0.1678 443 ILE G CG2 2263 C CD1 . ILE A 304 ? 2.9575 1.5954 0.9007 -0.1354 0.2664 0.0948 443 ILE G CD1 2264 N N . ASN A 305 ? 3.2368 1.8366 1.2816 -0.1172 0.5005 0.1772 444 ASN G N 2265 C CA . ASN A 305 ? 3.1986 1.8254 1.3432 -0.0966 0.5576 0.1829 444 ASN G CA 2266 C C . ASN A 305 ? 3.0857 1.7489 1.3156 -0.0752 0.5314 0.2236 444 ASN G C 2267 O O . ASN A 305 ? 3.2089 1.8560 1.3920 -0.0917 0.5163 0.2535 444 ASN G O 2268 C CB . ASN A 305 ? 3.3453 1.9422 1.4238 -0.1257 0.6326 0.1713 444 ASN G CB 2269 C CG . ASN A 305 ? 3.3349 1.9659 1.5145 -0.1072 0.6932 0.1799 444 ASN G CG 2270 O OD1 . ASN A 305 ? 3.3041 1.9640 1.5824 -0.0778 0.7238 0.1649 444 ASN G OD1 2271 N ND2 . ASN A 305 ? 3.3633 1.9936 1.5214 -0.1255 0.7108 0.2042 444 ASN G ND2 2272 N N . CYS A 306 ? 2.9469 1.6564 1.2966 -0.0417 0.5259 0.2247 445 CYS G N 2273 C CA . CYS A 306 ? 2.9708 1.7203 1.4038 -0.0262 0.5087 0.2577 445 CYS G CA 2274 C C . CYS A 306 ? 3.0504 1.8442 1.5800 -0.0097 0.5669 0.2584 445 CYS G C 2275 O O . CYS A 306 ? 3.1109 1.9232 1.6996 0.0121 0.5919 0.2398 445 CYS G O 2276 C CB . CYS A 306 ? 2.8919 1.6699 1.3902 -0.0030 0.4457 0.2642 445 CYS G CB 2277 S SG . CYS A 306 ? 3.4383 2.1887 1.8767 -0.0116 0.3649 0.2837 445 CYS G SG 2278 N N . VAL A 307 ? 3.0347 1.8464 1.5830 -0.0200 0.5880 0.2814 446 VAL G N 2279 C CA . VAL A 307 ? 2.9589 1.8285 1.6124 -0.0036 0.6355 0.2868 446 VAL G CA 2280 C C . VAL A 307 ? 2.8728 1.7951 1.6081 0.0054 0.5991 0.3141 446 VAL G C 2281 O O . VAL A 307 ? 2.9881 1.8989 1.6912 -0.0172 0.5831 0.3339 446 VAL G O 2282 C CB . VAL A 307 ? 3.0275 1.8897 1.6527 -0.0258 0.7020 0.2845 446 VAL G CB 2283 C CG1 . VAL A 307 ? 2.9233 1.8606 1.6753 -0.0053 0.7430 0.2930 446 VAL G CG1 2284 C CG2 . VAL A 307 ? 3.1615 1.9729 1.7091 -0.0368 0.7464 0.2513 446 VAL G CG2 2285 N N . SER A 308 ? 2.7005 1.6770 1.5365 0.0351 0.5877 0.3153 447 SER G N 2286 C CA . SER A 308 ? 2.5486 1.5765 1.4561 0.0393 0.5488 0.3369 447 SER G CA 2287 C C . SER A 308 ? 2.4092 1.5198 1.4305 0.0546 0.5790 0.3487 447 SER G C 2288 O O . SER A 308 ? 2.3991 1.5291 1.4604 0.0733 0.6248 0.3411 447 SER G O 2289 C CB . SER A 308 ? 2.5040 1.5288 1.4239 0.0552 0.4924 0.3311 447 SER G CB 2290 O OG . SER A 308 ? 2.6208 1.5804 1.4468 0.0447 0.4633 0.3188 447 SER G OG 2291 N N . ASN A 309 ? 2.3796 1.5406 1.4555 0.0463 0.5544 0.3669 448 ASN G N 2292 C CA . ASN A 309 ? 2.3850 1.6372 1.5722 0.0594 0.5748 0.3796 448 ASN G CA 2293 C C . ASN A 309 ? 2.2401 1.5394 1.4938 0.0808 0.5331 0.3856 448 ASN G C 2294 O O . ASN A 309 ? 2.0896 1.3908 1.3389 0.0677 0.4874 0.3889 448 ASN G O 2295 C CB . ASN A 309 ? 2.5079 1.8003 1.7198 0.0294 0.5824 0.3938 448 ASN G CB 2296 C CG . ASN A 309 ? 2.7265 1.9846 1.8838 0.0051 0.6326 0.3903 448 ASN G CG 2297 O OD1 . ASN A 309 ? 2.8098 2.1022 2.0092 0.0141 0.6856 0.3863 448 ASN G OD1 2298 N ND2 . ASN A 309 ? 2.8213 2.0120 1.8868 -0.0265 0.6179 0.3931 448 ASN G ND2 2299 N N . ILE A 310 ? 2.2334 1.5669 1.5473 0.1133 0.5514 0.3872 449 ILE G N 2300 C CA . ILE A 310 ? 2.1530 1.5373 1.5307 0.1318 0.5161 0.3977 449 ILE G CA 2301 C C . ILE A 310 ? 2.1376 1.6165 1.5954 0.1210 0.5066 0.4183 449 ILE G C 2302 O O . ILE A 310 ? 2.1896 1.7286 1.7108 0.1279 0.5426 0.4303 449 ILE G O 2303 C CB . ILE A 310 ? 2.0676 1.4570 1.4861 0.1701 0.5407 0.3991 449 ILE G CB 2304 C CG1 . ILE A 310 ? 2.0609 1.3564 1.3962 0.1736 0.5526 0.3729 449 ILE G CG1 2305 C CG2 . ILE A 310 ? 1.9767 1.4230 1.4594 0.1873 0.5051 0.4162 449 ILE G CG2 2306 C CD1 . ILE A 310 ? 2.1219 1.4041 1.4882 0.2076 0.5890 0.3696 449 ILE G CD1 2307 N N . THR A 311 ? 2.0777 1.5718 1.5347 0.1027 0.4595 0.4195 450 THR G N 2308 C CA . THR A 311 ? 2.0856 1.6648 1.6054 0.0821 0.4438 0.4330 450 THR G CA 2309 C C . THR A 311 ? 2.0491 1.6821 1.6144 0.0897 0.4037 0.4408 450 THR G C 2310 O O . THR A 311 ? 1.9899 1.7040 1.6099 0.0722 0.3876 0.4514 450 THR G O 2311 C CB . THR A 311 ? 2.1285 1.6735 1.5996 0.0410 0.4303 0.4244 450 THR G CB 2312 O OG1 . THR A 311 ? 2.1436 1.6184 1.5534 0.0373 0.3931 0.4101 450 THR G OG1 2313 C CG2 . THR A 311 ? 2.2090 1.7059 1.6314 0.0280 0.4713 0.4213 450 THR G CG2 2314 N N . GLY A 312 ? 2.0166 1.6017 1.5507 0.1090 0.3861 0.4324 451 GLY G N 2315 C CA . GLY A 312 ? 1.9234 1.5487 1.4872 0.1128 0.3504 0.4378 451 GLY G CA 2316 C C . GLY A 312 ? 1.8788 1.4570 1.4208 0.1412 0.3478 0.4327 451 GLY G C 2317 O O . GLY A 312 ? 1.9534 1.4553 1.4432 0.1514 0.3652 0.4167 451 GLY G O 2318 N N . ILE A 313 ? 1.7663 1.3897 1.3439 0.1499 0.3260 0.4456 452 ILE G N 2319 C CA . ILE A 313 ? 1.8155 1.3934 1.3720 0.1719 0.3236 0.4408 452 ILE G CA 2320 C C . ILE A 313 ? 1.8327 1.4311 1.3864 0.1556 0.2845 0.4365 452 ILE G C 2321 O O . ILE A 313 ? 1.8033 1.4738 1.3909 0.1363 0.2627 0.4482 452 ILE G O 2322 C CB . ILE A 313 ? 1.8620 1.4629 1.4669 0.2104 0.3523 0.4680 452 ILE G CB 2323 C CG1 . ILE A 313 ? 1.8998 1.4815 1.5113 0.2249 0.3978 0.4675 452 ILE G CG1 2324 C CG2 . ILE A 313 ? 1.9208 1.4598 1.4958 0.2290 0.3554 0.4603 452 ILE G CG2 2325 C CD1 . ILE A 313 ? 1.9824 1.4775 1.5146 0.2080 0.4078 0.4340 452 ILE G CD1 2326 N N . LEU A 314 ? 1.8849 1.4219 1.3975 0.1601 0.2779 0.4168 453 LEU G N 2327 C CA . LEU A 314 ? 1.8849 1.4348 1.3913 0.1437 0.2470 0.4084 453 LEU G CA 2328 C C . LEU A 314 ? 1.8252 1.3709 1.3411 0.1674 0.2551 0.4257 453 LEU G C 2329 O O . LEU A 314 ? 1.7631 1.2456 1.2558 0.1877 0.2783 0.4173 453 LEU G O 2330 C CB . LEU A 314 ? 1.9849 1.4710 1.4407 0.1258 0.2313 0.3690 453 LEU G CB 2331 C CG . LEU A 314 ? 1.9836 1.4509 1.4202 0.1074 0.2256 0.3541 453 LEU G CG 2332 C CD1 . LEU A 314 ? 1.9374 1.3479 1.3343 0.0958 0.2054 0.3198 453 LEU G CD1 2333 C CD2 . LEU A 314 ? 1.9767 1.5120 1.4483 0.0826 0.2122 0.3651 453 LEU G CD2 2334 N N . LEU A 315 ? 1.8321 1.4427 1.3776 0.1616 0.2363 0.4497 454 LEU G N 2335 C CA . LEU A 315 ? 1.7913 1.4009 1.3465 0.1845 0.2430 0.4759 454 LEU G CA 2336 C C . LEU A 315 ? 1.8725 1.4991 1.4082 0.1596 0.2153 0.4715 454 LEU G C 2337 O O . LEU A 315 ? 1.8406 1.5163 1.3773 0.1264 0.1888 0.4619 454 LEU G O 2338 C CB . LEU A 315 ? 1.7370 1.4183 1.3539 0.2106 0.2505 0.5246 454 LEU G CB 2339 C CG . LEU A 315 ? 1.8027 1.4693 1.4462 0.2379 0.2864 0.5295 454 LEU G CG 2340 C CD1 . LEU A 315 ? 1.8239 1.5759 1.5431 0.2639 0.2915 0.5768 454 LEU G CD1 2341 C CD2 . LEU A 315 ? 1.8660 1.4362 1.4778 0.2630 0.3217 0.5147 454 LEU G CD2 2342 N N . THR A 316 ? 2.0161 1.5982 1.5316 0.1729 0.2256 0.4767 455 THR G N 2343 C CA . THR A 316 ? 2.1314 1.7273 1.6247 0.1494 0.2052 0.4766 455 THR G CA 2344 C C . THR A 316 ? 2.3561 1.9791 1.8704 0.1750 0.2090 0.5311 455 THR G C 2345 O O . THR A 316 ? 2.4393 2.0128 1.9606 0.2110 0.2382 0.5489 455 THR G O 2346 C CB . THR A 316 ? 2.0962 1.6122 1.5433 0.1385 0.2148 0.4354 455 THR G CB 2347 O OG1 . THR A 316 ? 2.1524 1.6263 1.5865 0.1346 0.2199 0.3949 455 THR G OG1 2348 C CG2 . THR A 316 ? 2.0128 1.5500 1.4359 0.0996 0.1919 0.4168 455 THR G CG2 2349 N N . ARG A 317 ? 2.5556 2.2557 2.0789 0.1562 0.1801 0.5582 456 ARG G N 2360 N N . ASP A 318 ? 2.3651 2.2556 2.8909 0.3330 0.5511 0.8302 457 ASP G N 2361 C CA . ASP A 318 ? 2.1863 1.9924 2.6653 0.3341 0.6027 0.8181 457 ASP G CA 2362 C C . ASP A 318 ? 2.0902 1.8786 2.5232 0.3565 0.5654 0.8628 457 ASP G C 2363 O O . ASP A 318 ? 2.0660 1.8920 2.5204 0.3894 0.5260 0.9150 457 ASP G O 2364 C CB . ASP A 318 ? 2.1800 1.9249 2.6915 0.3576 0.6883 0.8282 457 ASP G CB 2365 C CG . ASP A 318 ? 2.1270 1.8462 2.6455 0.3207 0.7497 0.7621 457 ASP G CG 2366 O OD1 . ASP A 318 ? 2.1488 1.8701 2.6279 0.2802 0.7405 0.7066 457 ASP G OD1 2367 O OD2 . ASP A 318 ? 2.0588 1.7582 2.6227 0.3323 0.8072 0.7644 457 ASP G OD2 2368 N N . GLY A 319 ? 2.0622 1.8010 2.4316 0.3346 0.5762 0.8319 458 GLY G N 2369 C CA . GLY A 319 ? 2.1126 1.8213 2.4259 0.3486 0.5486 0.8657 458 GLY G CA 2370 C C . GLY A 319 ? 2.2699 1.9132 2.5684 0.3791 0.5953 0.8816 458 GLY G C 2371 O O . GLY A 319 ? 2.3299 1.9329 2.6579 0.3911 0.6622 0.8758 458 GLY G O 2372 N N . GLY A 320 ? 2.3565 1.9847 2.6044 0.3902 0.5618 0.8999 459 GLY G N 2373 C CA . GLY A 320 ? 2.5224 2.0825 2.7449 0.4190 0.6035 0.9166 459 GLY G CA 2374 C C . GLY A 320 ? 2.6048 2.1892 2.8889 0.4613 0.6178 0.9509 459 GLY G C 2375 O O . GLY A 320 ? 2.6497 2.1738 2.9443 0.4780 0.6892 0.9472 459 GLY G O 2376 N N . ALA A 321 ? 2.6190 2.2946 2.9443 0.4762 0.5511 0.9814 460 ALA G N 2377 C CA . ALA A 321 ? 2.6239 2.3417 3.0171 0.5148 0.5574 1.0149 460 ALA G CA 2378 C C . ALA A 321 ? 2.7658 2.4292 3.1379 0.5559 0.5880 1.0433 460 ALA G C 2379 O O . ALA A 321 ? 2.8068 2.4561 3.2236 0.5864 0.6375 1.0574 460 ALA G O 2380 C CB . ALA A 321 ? 2.5408 2.3687 2.9720 0.5164 0.4756 1.0377 460 ALA G CB 2381 N N . ASN A 322 ? 2.8734 2.5050 3.1763 0.5574 0.5586 1.0527 461 ASN G N 2382 C CA . ASN A 322 ? 3.0149 2.5890 3.2867 0.5966 0.5829 1.0817 461 ASN G CA 2383 C C . ASN A 322 ? 3.0163 2.6569 3.3504 0.6418 0.5605 1.1251 461 ASN G C 2384 O O . ASN A 322 ? 2.9990 2.7295 3.3572 0.6422 0.4885 1.1432 461 ASN G O 2385 C CB . ASN A 322 ? 3.1570 2.6144 3.3927 0.5985 0.6762 1.0600 461 ASN G CB 2386 C CG . ASN A 322 ? 3.3491 2.7320 3.5291 0.6331 0.6974 1.0868 461 ASN G CG 2387 O OD1 . ASN A 322 ? 3.4113 2.8063 3.5497 0.6415 0.6409 1.1109 461 ASN G OD1 2388 N ND2 . ASN A 322 ? 3.4422 2.7439 3.6173 0.6520 0.7797 1.0814 461 ASN G ND2 2389 N N . ASN A 323 ? 3.0418 2.6385 3.4004 0.6783 0.6236 1.1398 462 ASN G N 2390 C CA . ASN A 323 ? 3.0316 2.6876 3.4506 0.7244 0.6094 1.1810 462 ASN G CA 2391 C C . ASN A 323 ? 2.8952 2.6622 3.4024 0.7143 0.5768 1.1812 462 ASN G C 2392 O O . ASN A 323 ? 2.8070 2.5806 3.3404 0.6823 0.5980 1.1504 462 ASN G O 2393 C CB . ASN A 323 ? 3.0936 2.6738 3.5223 0.7623 0.6931 1.1911 462 ASN G CB 2394 C CG . ASN A 323 ? 3.1594 2.6438 3.5052 0.7864 0.7132 1.2065 462 ASN G CG 2395 O OD1 . ASN A 323 ? 3.1819 2.6756 3.4783 0.7882 0.6542 1.2235 462 ASN G OD1 2396 N ND2 . ASN A 323 ? 3.2012 2.5887 3.5275 0.8032 0.7983 1.1993 462 ASN G ND2 2397 N N . THR A 324 ? 2.8840 2.7371 3.4346 0.7412 0.5254 1.2156 463 THR G N 2398 C CA . THR A 324 ? 2.7906 2.7597 3.4069 0.7246 0.4714 1.2171 463 THR G CA 2399 C C . THR A 324 ? 2.8826 2.8740 3.5749 0.7173 0.5172 1.2032 463 THR G C 2400 O O . THR A 324 ? 2.8522 2.8980 3.5710 0.6814 0.4902 1.1835 463 THR G O 2401 C CB . THR A 324 ? 2.6997 2.7492 3.3538 0.7622 0.4235 1.2577 463 THR G CB 2402 O OG1 . THR A 324 ? 2.7113 2.7461 3.2941 0.7653 0.3732 1.2697 463 THR G OG1 2403 C CG2 . THR A 324 ? 2.6026 2.7728 3.3266 0.7435 0.3732 1.2580 463 THR G CG2 2404 N N . SER A 325 ? 2.9542 2.8987 3.6777 0.7505 0.5877 1.2130 464 SER G N 2405 C CA . SER A 325 ? 2.9164 2.8778 3.7150 0.7469 0.6362 1.2020 464 SER G CA 2406 C C . SER A 325 ? 2.8950 2.7998 3.6722 0.7024 0.6761 1.1568 464 SER G C 2407 O O . SER A 325 ? 2.9670 2.8090 3.6701 0.6782 0.6775 1.1333 464 SER G O 2408 C CB . SER A 325 ? 2.9452 2.8635 3.7774 0.7936 0.7053 1.2221 464 SER G CB 2409 O OG . SER A 325 ? 2.8655 2.7891 3.7654 0.7853 0.7584 1.2066 464 SER G OG 2410 N N . ASN A 326 ? 2.7782 2.7059 3.6212 0.6913 0.7087 1.1437 465 ASN G N 2411 C CA . ASN A 326 ? 2.7009 2.5701 3.5290 0.6516 0.7557 1.0994 465 ASN G CA 2412 C C . ASN A 326 ? 2.6188 2.4934 3.3958 0.6022 0.7100 1.0685 465 ASN G C 2413 O O . ASN A 326 ? 2.6831 2.4793 3.4040 0.5758 0.7461 1.0333 465 ASN G O 2414 C CB . ASN A 326 ? 2.7862 2.5375 3.5733 0.6608 0.8430 1.0811 465 ASN G CB 2415 C CG . ASN A 326 ? 2.8367 2.5706 3.6825 0.6964 0.9096 1.0965 465 ASN G CG 2416 O OD1 . ASN A 326 ? 2.8223 2.6232 3.7465 0.7035 0.9047 1.1086 465 ASN G OD1 2417 N ND2 . ASN A 326 ? 2.8973 2.5383 3.7032 0.7178 0.9745 1.0949 465 ASN G ND2 2418 N N . GLU A 327 ? 2.4757 2.4421 3.2691 0.5877 0.6322 1.0789 466 GLU G N 2419 C CA . GLU A 327 ? 2.2488 2.2232 3.0045 0.5399 0.5960 1.0478 466 GLU G CA 2420 C C . GLU A 327 ? 2.0999 2.0290 2.8780 0.5159 0.6604 1.0153 466 GLU G C 2421 O O . GLU A 327 ? 2.0319 1.9773 2.8784 0.5307 0.6964 1.0249 466 GLU G O 2422 C CB . GLU A 327 ? 2.1240 2.2055 2.9090 0.5278 0.5156 1.0626 466 GLU G CB 2423 C CG . GLU A 327 ? 2.1440 2.2726 2.8974 0.5386 0.4466 1.0855 466 GLU G CG 2424 C CD . GLU A 327 ? 2.1399 2.2140 2.8024 0.5168 0.4263 1.0646 466 GLU G CD 2425 O OE1 . GLU A 327 ? 2.1167 2.1102 2.7437 0.5024 0.4765 1.0366 466 GLU G OE1 2426 O OE2 . GLU A 327 ? 2.1322 2.2430 2.7589 0.5119 0.3629 1.0739 466 GLU G OE2 2427 N N . THR A 328 ? 2.0610 1.9345 2.7822 0.4760 0.6777 0.9743 467 THR G N 2428 C CA . THR A 328 ? 2.0476 1.8967 2.7808 0.4390 0.7335 0.9153 467 THR G CA 2429 C C . THR A 328 ? 1.9655 1.8728 2.6787 0.3877 0.6779 0.8684 467 THR G C 2430 O O . THR A 328 ? 1.9821 1.8879 2.6368 0.3673 0.6356 0.8536 467 THR G O 2431 C CB . THR A 328 ? 2.1574 1.9023 2.8427 0.4274 0.8098 0.8824 467 THR G CB 2432 O OG1 . THR A 328 ? 2.3272 2.0158 3.0300 0.4745 0.8657 0.9169 467 THR G OG1 2433 C CG2 . THR A 328 ? 2.1057 1.8403 2.7988 0.3810 0.8566 0.8144 467 THR G CG2 2434 N N . PHE A 329 ? 1.9086 1.8627 2.6673 0.3686 0.6797 0.8459 468 PHE G N 2435 C CA . PHE A 329 ? 1.8559 1.8589 2.5923 0.3236 0.6288 0.8043 468 PHE G CA 2436 C C . PHE A 329 ? 1.8598 1.8328 2.5859 0.2837 0.6776 0.7387 468 PHE G C 2437 O O . PHE A 329 ? 1.8112 1.7626 2.5787 0.2865 0.7403 0.7294 468 PHE G O 2438 C CB . PHE A 329 ? 1.8071 1.8934 2.5928 0.3276 0.5807 0.8294 468 PHE G CB 2439 C CG . PHE A 329 ? 1.8238 1.9566 2.6153 0.3582 0.5201 0.8870 468 PHE G CG 2440 C CD1 . PHE A 329 ? 1.8261 1.9875 2.6807 0.4033 0.5295 0.9401 468 PHE G CD1 2441 C CD2 . PHE A 329 ? 1.8212 1.9716 2.5552 0.3425 0.4536 0.8871 468 PHE G CD2 2442 C CE1 . PHE A 329 ? 1.7828 1.9950 2.6427 0.4306 0.4710 0.9918 468 PHE G CE1 2443 C CE2 . PHE A 329 ? 1.8004 1.9950 2.5366 0.3670 0.3981 0.9384 468 PHE G CE2 2444 C CZ . PHE A 329 ? 1.7693 1.9973 2.5684 0.4104 0.4056 0.9906 468 PHE G CZ 2445 N N . ARG A 330 ? 1.9399 1.9130 2.6106 0.2467 0.6496 0.6916 469 ARG G N 2446 C CA . ARG A 330 ? 2.0457 2.0006 2.7047 0.2081 0.6889 0.6273 469 ARG G CA 2447 C C . ARG A 330 ? 1.9062 1.9176 2.5493 0.1779 0.6284 0.6007 469 ARG G C 2448 O O . ARG A 330 ? 1.8326 1.8716 2.4371 0.1738 0.5612 0.6062 469 ARG G O 2449 C CB . ARG A 330 ? 2.2413 2.1429 2.8476 0.1901 0.7193 0.5856 469 ARG G CB 2450 C CG . ARG A 330 ? 2.3993 2.3208 2.9484 0.1782 0.6524 0.5741 469 ARG G CG 2451 C CD . ARG A 330 ? 2.5757 2.4493 3.0776 0.1611 0.6849 0.5327 469 ARG G CD 2452 N NE . ARG A 330 ? 2.7067 2.6036 3.1576 0.1503 0.6205 0.5196 469 ARG G NE 2453 C CZ . ARG A 330 ? 2.8472 2.7386 3.2742 0.1713 0.5837 0.5606 469 ARG G CZ 2454 N NH1 . ARG A 330 ? 2.9045 2.7703 3.3530 0.2065 0.6014 0.6192 469 ARG G NH1 2455 N NH2 . ARG A 330 ? 2.8866 2.7976 3.2665 0.1584 0.5287 0.5433 469 ARG G NH2 2456 N N . PRO A 331 ? 1.8915 1.9149 2.5585 0.1564 0.6527 0.5719 470 PRO G N 2457 C CA . PRO A 331 ? 1.9121 1.9798 2.5551 0.1285 0.5965 0.5483 470 PRO G CA 2458 C C . PRO A 331 ? 1.9735 2.0308 2.5498 0.1078 0.5670 0.5060 470 PRO G C 2459 O O . PRO A 331 ? 1.9901 2.0115 2.5518 0.0953 0.6140 0.4666 470 PRO G O 2460 C CB . PRO A 331 ? 1.8760 1.9352 2.5431 0.1049 0.6484 0.5118 470 PRO G CB 2461 C CG . PRO A 331 ? 1.8918 1.8962 2.5596 0.1030 0.7218 0.4854 470 PRO G CG 2462 C CD . PRO A 331 ? 1.9055 1.8831 2.5848 0.1410 0.7338 0.5323 470 PRO G CD 2463 N N . GLY A 332 ? 1.9731 2.0616 2.5095 0.1037 0.4927 0.5119 471 GLY G N 2464 C CA . GLY A 332 ? 1.9978 2.0779 2.4741 0.0908 0.4632 0.4761 471 GLY G CA 2465 C C . GLY A 332 ? 2.0203 2.1256 2.4484 0.0673 0.4080 0.4416 471 GLY G C 2466 O O . GLY A 332 ? 2.0605 2.1931 2.4801 0.0673 0.3574 0.4655 471 GLY G O 2467 N N . GLY A 333 ? 2.0275 2.1232 2.4214 0.0477 0.4181 0.3842 472 GLY G N 2468 C CA . GLY A 333 ? 2.0243 2.1393 2.3659 0.0301 0.3659 0.3485 472 GLY G CA 2469 C C . GLY A 333 ? 2.0413 2.1686 2.3391 0.0408 0.2951 0.3693 472 GLY G C 2470 O O . GLY A 333 ? 2.1031 2.2448 2.3661 0.0348 0.2425 0.3723 472 GLY G O 2471 N N . GLY A 334 ? 1.9991 2.1152 2.2934 0.0549 0.2963 0.3832 473 GLY G N 2472 C CA . GLY A 334 ? 2.0249 2.1490 2.2752 0.0632 0.2335 0.4003 473 GLY G CA 2473 C C . GLY A 334 ? 2.0865 2.2203 2.2792 0.0501 0.1907 0.3521 473 GLY G C 2474 O O . GLY A 334 ? 2.1788 2.3120 2.3624 0.0396 0.2140 0.2992 473 GLY G O 2475 N N . ASN A 335 ? 1.9937 2.1369 2.1460 0.0510 0.1284 0.3697 474 ASN G N 2476 C CA . ASN A 335 ? 1.8797 2.0259 1.9700 0.0442 0.0825 0.3301 474 ASN G CA 2477 C C . ASN A 335 ? 1.7746 1.9220 1.8454 0.0333 0.0590 0.3344 474 ASN G C 2478 O O . ASN A 335 ? 1.8190 1.9703 1.9084 0.0324 0.0514 0.3783 474 ASN G O 2479 C CB . ASN A 335 ? 1.9143 2.0575 1.9580 0.0539 0.0294 0.3434 474 ASN G CB 2480 C CG . ASN A 335 ? 1.9775 2.1179 1.9531 0.0513 -0.0257 0.3177 474 ASN G CG 2481 O OD1 . ASN A 335 ? 2.0580 2.1961 2.0168 0.0423 -0.0337 0.3062 474 ASN G OD1 2482 N ND2 . ASN A 335 ? 1.9560 2.0921 1.8879 0.0598 -0.0628 0.3087 474 ASN G ND2 2483 N N . ILE A 336 ? 1.6465 1.7918 1.6785 0.0246 0.0479 0.2884 475 ILE G N 2484 C CA . ILE A 336 ? 1.5888 1.7266 1.5964 0.0118 0.0318 0.2909 475 ILE G CA 2485 C C . ILE A 336 ? 1.5417 1.6685 1.4995 0.0123 -0.0258 0.3236 475 ILE G C 2486 O O . ILE A 336 ? 1.5705 1.6917 1.5248 -0.0005 -0.0307 0.3441 475 ILE G O 2487 C CB . ILE A 336 ? 1.5978 1.7311 1.5584 0.0049 0.0225 0.2360 475 ILE G CB 2488 C CG1 . ILE A 336 ? 1.6530 1.7694 1.5836 -0.0104 0.0107 0.2420 475 ILE G CG1 2489 C CG2 . ILE A 336 ? 1.5920 1.7228 1.4893 0.0189 -0.0295 0.2122 475 ILE G CG2 2490 C CD1 . ILE A 336 ? 1.7632 1.8734 1.6499 -0.0179 0.0082 0.1904 475 ILE G CD1 2491 N N . LYS A 337 ? 1.4738 1.5964 1.3929 0.0241 -0.0666 0.3282 476 LYS G N 2492 C CA . LYS A 337 ? 1.4462 1.5553 1.3172 0.0209 -0.1167 0.3605 476 LYS G CA 2493 C C . LYS A 337 ? 1.4935 1.6184 1.4159 0.0126 -0.1016 0.4108 476 LYS G C 2494 O O . LYS A 337 ? 1.5026 1.6216 1.3943 0.0016 -0.1335 0.4360 476 LYS G O 2495 C CB . LYS A 337 ? 1.3465 1.4525 1.1874 0.0345 -0.1504 0.3663 476 LYS G CB 2496 C CG . LYS A 337 ? 1.2854 1.3797 1.0709 0.0451 -0.1747 0.3188 476 LYS G CG 2497 C CD . LYS A 337 ? 1.3295 1.4130 1.0717 0.0547 -0.2162 0.3305 476 LYS G CD 2498 C CE . LYS A 337 ? 1.4332 1.5140 1.1354 0.0698 -0.2334 0.2801 476 LYS G CE 2499 N NZ . LYS A 337 ? 1.5234 1.5950 1.1925 0.0793 -0.2651 0.2894 476 LYS G NZ 2500 N N . ASP A 338 ? 1.4900 1.6355 1.4898 0.0187 -0.0525 0.4251 477 ASP G N 2501 C CA . ASP A 338 ? 1.4957 1.6636 1.5531 0.0166 -0.0361 0.4723 477 ASP G CA 2502 C C . ASP A 338 ? 1.4706 1.6398 1.5365 -0.0023 -0.0235 0.4709 477 ASP G C 2503 O O . ASP A 338 ? 1.4444 1.6337 1.5343 -0.0097 -0.0302 0.5063 477 ASP G O 2504 C CB . ASP A 338 ? 1.6200 1.8018 1.7538 0.0324 0.0162 0.4880 477 ASP G CB 2505 C CG . ASP A 338 ? 1.7106 1.8892 1.8367 0.0494 0.0048 0.4997 477 ASP G CG 2506 O OD1 . ASP A 338 ? 1.7095 1.8878 1.7895 0.0495 -0.0459 0.5156 477 ASP G OD1 2507 O OD2 . ASP A 338 ? 1.7372 1.9101 1.9016 0.0608 0.0497 0.4942 477 ASP G OD2 2508 N N . ASN A 339 ? 1.4974 1.6481 1.5434 -0.0117 -0.0048 0.4282 478 ASN G N 2509 C CA . ASN A 339 ? 1.3877 1.5315 1.4278 -0.0330 0.0056 0.4225 478 ASN G CA 2510 C C . ASN A 339 ? 1.4238 1.5514 1.3930 -0.0468 -0.0488 0.4353 478 ASN G C 2511 O O . ASN A 339 ? 1.5041 1.6420 1.4882 -0.0635 -0.0474 0.4592 478 ASN G O 2512 C CB . ASN A 339 ? 1.3137 1.4373 1.3316 -0.0412 0.0297 0.3720 478 ASN G CB 2513 C CG . ASN A 339 ? 1.3218 1.4583 1.4070 -0.0332 0.0892 0.3561 478 ASN G CG 2514 O OD1 . ASN A 339 ? 1.3801 1.5341 1.5382 -0.0272 0.1280 0.3852 478 ASN G OD1 2515 N ND2 . ASN A 339 ? 1.3049 1.4327 1.3642 -0.0327 0.0971 0.3090 478 ASN G ND2 2516 N N . TRP A 340 ? 1.3679 1.4705 1.2612 -0.0400 -0.0946 0.4194 479 TRP G N 2517 C CA . TRP A 340 ? 1.3351 1.4118 1.1504 -0.0523 -0.1456 0.4309 479 TRP G CA 2518 C C . TRP A 340 ? 1.3861 1.4910 1.2300 -0.0557 -0.1618 0.4783 479 TRP G C 2519 O O . TRP A 340 ? 1.1705 1.2703 0.9871 -0.0771 -0.1801 0.4955 479 TRP G O 2520 C CB . TRP A 340 ? 1.2376 1.2789 0.9664 -0.0393 -0.1885 0.4025 479 TRP G CB 2521 C CG . TRP A 340 ? 1.3257 1.3582 1.0436 -0.0285 -0.1725 0.3549 479 TRP G CG 2522 C CD1 . TRP A 340 ? 1.3736 1.4035 1.0644 -0.0078 -0.1892 0.3245 479 TRP G CD1 2523 C CD2 . TRP A 340 ? 1.3551 1.3831 1.0846 -0.0402 -0.1385 0.3290 479 TRP G CD2 2524 N NE1 . TRP A 340 ? 1.3719 1.4031 1.0624 -0.0054 -0.1678 0.2810 479 TRP G NE1 2525 C CE2 . TRP A 340 ? 1.3384 1.3659 1.0493 -0.0256 -0.1370 0.2836 479 TRP G CE2 2526 C CE3 . TRP A 340 ? 1.3265 1.3539 1.0824 -0.0628 -0.1076 0.3382 479 TRP G CE3 2527 C CZ2 . TRP A 340 ? 1.3094 1.3359 1.0248 -0.0339 -0.1071 0.2485 479 TRP G CZ2 2528 C CZ3 . TRP A 340 ? 1.3446 1.3651 1.1032 -0.0709 -0.0761 0.3041 479 TRP G CZ3 2529 C CH2 . TRP A 340 ? 1.3548 1.3746 1.0915 -0.0570 -0.0767 0.2600 479 TRP G CH2 2530 N N . ARG A 341 ? 1.2893 1.4226 1.1817 -0.0362 -0.1563 0.4980 480 ARG G N 2531 C CA . ARG A 341 ? 1.1834 1.3504 1.1074 -0.0378 -0.1713 0.5442 480 ARG G CA 2532 C C . ARG A 341 ? 1.1780 1.3809 1.1658 -0.0518 -0.1449 0.5687 480 ARG G C 2533 O O . ARG A 341 ? 1.1861 1.4083 1.1669 -0.0686 -0.1685 0.5946 480 ARG G O 2534 C CB . ARG A 341 ? 1.2460 1.4361 1.2175 -0.0131 -0.1615 0.5633 480 ARG G CB 2535 C CG . ARG A 341 ? 1.2831 1.4480 1.1910 -0.0041 -0.1982 0.5513 480 ARG G CG 2536 C CD . ARG A 341 ? 1.2155 1.3930 1.1608 0.0177 -0.1833 0.5622 480 ARG G CD 2537 N NE . ARG A 341 ? 1.2759 1.4245 1.1528 0.0228 -0.2162 0.5391 480 ARG G NE 2538 C CZ . ARG A 341 ? 1.4569 1.5932 1.3325 0.0365 -0.1987 0.5051 480 ARG G CZ 2539 N NH1 . ARG A 341 ? 1.4389 1.5858 1.3749 0.0440 -0.1474 0.4927 480 ARG G NH1 2540 N NH2 . ARG A 341 ? 1.5729 1.6874 1.3882 0.0417 -0.2300 0.4827 480 ARG G NH2 2541 N N . SER A 342 ? 1.1946 1.4073 1.2438 -0.0468 -0.0945 0.5577 481 SER G N 2542 C CA . SER A 342 ? 1.3371 1.5849 1.4530 -0.0580 -0.0641 0.5774 481 SER G CA 2543 C C . SER A 342 ? 1.4159 1.6513 1.4848 -0.0919 -0.0812 0.5708 481 SER G C 2544 O O . SER A 342 ? 1.4280 1.7003 1.5502 -0.1050 -0.0628 0.5893 481 SER G O 2545 C CB . SER A 342 ? 1.4547 1.7020 1.6316 -0.0492 -0.0037 0.5590 481 SER G CB 2546 O OG . SER A 342 ? 1.4832 1.6876 1.6054 -0.0643 0.0036 0.5144 481 SER G OG 2547 N N . GLU A 343 ? 1.5374 1.7206 1.5059 -0.1056 -0.1154 0.5448 482 GLU G N 2548 C CA . GLU A 343 ? 1.6462 1.8053 1.5572 -0.1396 -0.1299 0.5385 482 GLU G CA 2549 C C . GLU A 343 ? 1.5744 1.7112 1.4028 -0.1525 -0.1840 0.5495 482 GLU G C 2550 O O . GLU A 343 ? 1.5397 1.6780 1.3431 -0.1826 -0.1961 0.5603 482 GLU G O 2551 C CB . GLU A 343 ? 1.7867 1.8897 1.6378 -0.1484 -0.1178 0.4963 482 GLU G CB 2552 C CG . GLU A 343 ? 1.8815 2.0030 1.8057 -0.1504 -0.0606 0.4848 482 GLU G CG 2553 C CD . GLU A 343 ? 1.9713 2.1296 1.9529 -0.1738 -0.0358 0.5059 482 GLU G CD 2554 O OE1 . GLU A 343 ? 2.0057 2.1583 1.9430 -0.1995 -0.0628 0.5167 482 GLU G OE1 2555 O OE2 . GLU A 343 ? 1.9949 2.1906 2.0693 -0.1658 0.0121 0.5121 482 GLU G OE2 2556 N N . LEU A 344 ? 1.5054 1.6216 1.2925 -0.1311 -0.2133 0.5448 483 LEU G N 2557 C CA . LEU A 344 ? 1.4780 1.5655 1.1819 -0.1389 -0.2631 0.5522 483 LEU G CA 2558 C C . LEU A 344 ? 1.4779 1.6189 1.2264 -0.1384 -0.2794 0.5921 483 LEU G C 2559 O O . LEU A 344 ? 1.4930 1.6144 1.1824 -0.1470 -0.3143 0.5929 483 LEU G O 2560 C CB . LEU A 344 ? 1.4758 1.5183 1.1165 -0.1143 -0.2858 0.5257 483 LEU G CB 2561 C CG . LEU A 344 ? 1.5655 1.5455 1.1261 -0.1127 -0.2909 0.4848 483 LEU G CG 2562 C CD1 . LEU A 344 ? 1.5535 1.5157 1.0856 -0.0813 -0.3069 0.4597 483 LEU G CD1 2563 C CD2 . LEU A 344 ? 1.6212 1.5444 1.0781 -0.1384 -0.3226 0.4842 483 LEU G CD2 2564 N N . TYR A 345 ? 1.4666 1.6705 1.3204 -0.1241 -0.2495 0.6155 484 TYR G N 2565 C CA . TYR A 345 ? 1.4085 1.6673 1.3108 -0.1150 -0.2640 0.6547 484 TYR G CA 2566 C C . TYR A 345 ? 1.5219 1.7988 1.3874 -0.1456 -0.3007 0.6759 484 TYR G C 2567 O O . TYR A 345 ? 1.4934 1.7809 1.3610 -0.1376 -0.3159 0.6694 484 TYR G O 2568 C CB . TYR A 345 ? 1.3241 1.6447 1.3433 -0.0964 -0.2221 0.6771 484 TYR G CB 2569 C CG . TYR A 345 ? 1.2820 1.6452 1.3527 -0.1183 -0.2020 0.6870 484 TYR G CG 2570 C CD1 . TYR A 345 ? 1.2664 1.6955 1.3792 -0.1285 -0.2177 0.7211 484 TYR G CD1 2571 C CD2 . TYR A 345 ? 1.2987 1.6403 1.3780 -0.1297 -0.1660 0.6603 484 TYR G CD2 2572 C CE1 . TYR A 345 ? 1.2903 1.7660 1.4558 -0.1492 -0.1978 0.7268 484 TYR G CE1 2573 C CE2 . TYR A 345 ? 1.3221 1.7031 1.4503 -0.1515 -0.1441 0.6669 484 TYR G CE2 2574 C CZ . TYR A 345 ? 1.3153 1.7653 1.4892 -0.1608 -0.1597 0.6996 484 TYR G CZ 2575 O OH . TYR A 345 ? 1.3124 1.8100 1.5404 -0.1834 -0.1373 0.7034 484 TYR G OH 2576 N N . LYS A 346 ? 1.6655 1.9405 1.5147 -0.1789 -0.2954 0.6689 485 LYS G N 2577 C CA . LYS A 346 ? 1.7456 2.0478 1.5720 -0.2144 -0.3213 0.6866 485 LYS G CA 2578 C C . LYS A 346 ? 1.7028 1.9282 1.4172 -0.2350 -0.3464 0.6461 485 LYS G C 2579 O O . LYS A 346 ? 1.7076 1.9456 1.3984 -0.2680 -0.3612 0.6494 485 LYS G O 2580 C CB . LYS A 346 ? 1.8381 2.1772 1.7117 -0.2425 -0.2932 0.6856 485 LYS G CB 2581 C CG . LYS A 346 ? 1.9323 2.2001 1.7426 -0.2618 -0.2750 0.6498 485 LYS G CG 2582 C CD . LYS A 346 ? 2.1020 2.4027 1.9419 -0.3000 -0.2528 0.6489 485 LYS G CD 2583 C CE . LYS A 346 ? 2.1964 2.5920 2.1754 -0.2828 -0.2187 0.6706 485 LYS G CE 2584 N NZ . LYS A 346 ? 2.2972 2.7378 2.3117 -0.3219 -0.1992 0.6695 485 LYS G NZ 2585 N N . TYR A 347 ? 1.6452 1.7940 1.2965 -0.2134 -0.3474 0.6054 486 TYR G N 2586 C CA . TYR A 347 ? 1.6497 1.7204 1.2022 -0.2226 -0.3623 0.5636 486 TYR G CA 2587 C C . TYR A 347 ? 1.5495 1.5913 1.0821 -0.1907 -0.3702 0.5347 486 TYR G C 2588 O O . TYR A 347 ? 1.4456 1.5031 1.0175 -0.1586 -0.3634 0.5348 486 TYR G O 2589 C CB . TYR A 347 ? 1.7452 1.7428 1.2246 -0.2240 -0.3566 0.5365 486 TYR G CB 2590 C CG . TYR A 347 ? 1.7526 1.7582 1.2299 -0.2591 -0.3441 0.5581 486 TYR G CG 2591 C CD1 . TYR A 347 ? 1.8175 1.7980 1.2394 -0.3027 -0.3475 0.5562 486 TYR G CD1 2592 C CD2 . TYR A 347 ? 1.7608 1.7894 1.2851 -0.2497 -0.3224 0.5746 486 TYR G CD2 2593 C CE1 . TYR A 347 ? 1.9280 1.9098 1.3406 -0.3392 -0.3300 0.5732 486 TYR G CE1 2594 C CE2 . TYR A 347 ? 1.8713 1.9035 1.4182 -0.2730 -0.2894 0.5651 486 TYR G CE2 2595 C CZ . TYR A 347 ? 1.9294 1.9387 1.4210 -0.3177 -0.2935 0.5643 486 TYR G CZ 2596 O OH . TYR A 347 ? 1.9298 1.9413 1.4426 -0.3440 -0.2580 0.5530 486 TYR G OH 2597 N N . LYS A 348 ? 1.5715 1.5673 1.0392 -0.2007 -0.3814 0.5103 487 LYS G N 2598 C CA . LYS A 348 ? 1.6557 1.6181 1.0961 -0.1705 -0.3851 0.4815 487 LYS G CA 2599 C C . LYS A 348 ? 1.7468 1.6418 1.1038 -0.1781 -0.3909 0.4521 487 LYS G C 2600 O O . LYS A 348 ? 1.6640 1.5448 0.9872 -0.2147 -0.3963 0.4571 487 LYS G O 2601 C CB . LYS A 348 ? 1.6498 1.6607 1.1375 -0.1690 -0.3905 0.4979 487 LYS G CB 2602 C CG . LYS A 348 ? 1.7718 1.8093 1.2573 -0.2090 -0.4025 0.5154 487 LYS G CG 2603 C CD . LYS A 348 ? 1.8590 1.9424 1.3840 -0.2071 -0.4099 0.5296 487 LYS G CD 2604 C CE . LYS A 348 ? 1.9433 1.9821 1.4257 -0.1879 -0.4121 0.5014 487 LYS G CE 2605 N NZ . LYS A 348 ? 1.3892 1.4736 0.9042 -0.1957 -0.4208 0.5190 487 LYS G NZ 2606 N N . VAL A 349 ? 1.8777 1.7356 1.2044 -0.1435 -0.3887 0.4229 488 VAL G N 2607 C CA . VAL A 349 ? 1.8775 1.6774 1.1350 -0.1433 -0.3919 0.3976 488 VAL G CA 2608 C C . VAL A 349 ? 2.0065 1.8131 1.2628 -0.1493 -0.3978 0.3982 488 VAL G C 2609 O O . VAL A 349 ? 1.9775 1.8132 1.2691 -0.1282 -0.3969 0.3992 488 VAL G O 2610 C CB . VAL A 349 ? 1.9077 1.6783 1.1407 -0.1041 -0.3879 0.3693 488 VAL G CB 2611 C CG1 . VAL A 349 ? 2.0052 1.7158 1.1688 -0.1078 -0.3910 0.3486 488 VAL G CG1 2612 C CG2 . VAL A 349 ? 1.9199 1.6950 1.1646 -0.0946 -0.3828 0.3695 488 VAL G CG2 2613 N N . VAL A 350 ? 2.1231 1.8963 1.3311 -0.1809 -0.4036 0.3967 489 VAL G N 2614 C CA . VAL A 350 ? 2.1358 1.9041 1.3290 -0.1905 -0.4097 0.3945 489 VAL G CA 2615 C C . VAL A 350 ? 2.2687 1.9657 1.3876 -0.1922 -0.4099 0.3718 489 VAL G C 2616 O O . VAL A 350 ? 2.2674 1.9189 1.3418 -0.2005 -0.4076 0.3632 489 VAL G O 2617 C CB . VAL A 350 ? 2.0293 1.8375 1.2430 -0.2367 -0.4188 0.4213 489 VAL G CB 2618 C CG1 . VAL A 350 ? 2.0032 1.8878 1.2980 -0.2310 -0.4193 0.4473 489 VAL G CG1 2619 C CG2 . VAL A 350 ? 1.9767 1.7552 1.1449 -0.2794 -0.4208 0.4250 489 VAL G CG2 2620 N N . GLN A 351 ? 2.4138 2.0982 1.5174 -0.1852 -0.4124 0.3629 490 GLN G N 2621 C CA . GLN A 351 ? 2.5346 2.1521 1.5723 -0.1828 -0.4126 0.3430 490 GLN G CA 2622 C C . GLN A 351 ? 2.7308 2.3148 1.7215 -0.2276 -0.4194 0.3480 490 GLN G C 2623 O O . GLN A 351 ? 2.8788 2.4904 1.8869 -0.2417 -0.4246 0.3572 490 GLN G O 2624 C CB . GLN A 351 ? 2.4861 2.1001 1.5292 -0.1493 -0.4142 0.3295 490 GLN G CB 2625 C CG . GLN A 351 ? 2.5058 2.0417 1.4765 -0.1567 -0.4220 0.3145 490 GLN G CG 2626 C CD . GLN A 351 ? 2.4668 2.0011 1.4430 -0.1327 -0.4269 0.3050 490 GLN G CD 2627 O OE1 . GLN A 351 ? 2.4278 1.9975 1.4338 -0.1380 -0.4288 0.3140 490 GLN G OE1 2628 N NE2 . GLN A 351 ? 2.4684 1.9609 1.4142 -0.1064 -0.4296 0.2866 490 GLN G NE2 2629 N N . ILE A 352 ? 2.9071 2.4273 1.8332 -0.2519 -0.4191 0.3410 491 ILE G N 2637 N N . VAL B 2 ? 1.7002 1.6391 1.5553 0.4895 -0.1460 -0.3907 2 VAL H N 2638 C CA . VAL B 2 ? 1.7317 1.6881 1.5352 0.4489 -0.1428 -0.3426 2 VAL H CA 2639 C C . VAL B 2 ? 1.7131 1.8105 1.5727 0.4114 -0.1204 -0.3687 2 VAL H C 2640 O O . VAL B 2 ? 1.7261 1.8884 1.6137 0.3696 -0.0797 -0.3981 2 VAL H O 2641 C CB . VAL B 2 ? 1.4699 1.3512 1.1890 0.3954 -0.1107 -0.2946 2 VAL H CB 2642 C CG1 . VAL B 2 ? 1.3421 1.2578 1.0267 0.3507 -0.0964 -0.2554 2 VAL H CG1 2643 C CG2 . VAL B 2 ? 1.6656 1.3988 1.3129 0.4203 -0.1308 -0.2591 2 VAL H CG2 2644 N N . GLN B 3 ? 1.7031 1.8368 1.5629 0.4172 -0.1462 -0.3529 3 GLN H N 2645 C CA . GLN B 3 ? 1.6655 1.9123 1.5573 0.3719 -0.1260 -0.3657 3 GLN H CA 2646 C C . GLN B 3 ? 1.6687 1.8815 1.4894 0.3456 -0.1325 -0.3139 3 GLN H C 2647 O O . GLN B 3 ? 1.7212 1.8593 1.4911 0.3764 -0.1669 -0.2828 3 GLN H O 2648 C CB . GLN B 3 ? 1.7090 2.0717 1.7023 0.4003 -0.1465 -0.4200 3 GLN H CB 2649 C CG . GLN B 3 ? 1.7954 2.2160 1.8777 0.4244 -0.1296 -0.4842 3 GLN H CG 2650 C CD . GLN B 3 ? 1.9568 2.2953 2.0551 0.4996 -0.1674 -0.4920 3 GLN H CD 2651 O OE1 . GLN B 3 ? 2.0139 2.3226 2.1164 0.5494 -0.2222 -0.4760 3 GLN H OE1 2652 N NE2 . GLN B 3 ? 2.0031 2.2986 2.1057 0.5061 -0.1408 -0.5169 3 GLN H NE2 2653 N N . LEU B 4 ? 1.6132 1.8789 1.4283 0.2880 -0.0998 -0.3071 4 LEU H N 2654 C CA . LEU B 4 ? 1.5020 1.7453 1.2614 0.2613 -0.1002 -0.2668 4 LEU H CA 2655 C C . LEU B 4 ? 1.4196 1.7660 1.2199 0.2250 -0.0934 -0.2900 4 LEU H C 2656 O O . LEU B 4 ? 1.4879 1.8979 1.3175 0.1818 -0.0622 -0.3080 4 LEU H O 2657 C CB . LEU B 4 ? 1.3773 1.5595 1.0796 0.2236 -0.0673 -0.2232 4 LEU H CB 2658 C CG . LEU B 4 ? 1.3479 1.4238 0.9977 0.2411 -0.0650 -0.1904 4 LEU H CG 2659 C CD1 . LEU B 4 ? 1.2629 1.3195 0.8859 0.1946 -0.0304 -0.1555 4 LEU H CD1 2660 C CD2 . LEU B 4 ? 1.3577 1.3541 0.9474 0.2751 -0.0933 -0.1621 4 LEU H CD2 2661 N N . VAL B 5 ? 1.3303 1.6903 1.1262 0.2375 -0.1238 -0.2897 5 VAL H N 2662 C CA . VAL B 5 ? 1.3457 1.8042 1.1834 0.2022 -0.1217 -0.3155 5 VAL H CA 2663 C C . VAL B 5 ? 1.5109 1.9298 1.2837 0.1728 -0.1236 -0.2818 5 VAL H C 2664 O O . VAL B 5 ? 1.6391 2.0008 1.3650 0.1989 -0.1538 -0.2642 5 VAL H O 2665 C CB . VAL B 5 ? 1.3268 1.8631 1.2396 0.2390 -0.1599 -0.3587 5 VAL H CB 2666 C CG1 . VAL B 5 ? 1.3071 1.9484 1.2629 0.1960 -0.1584 -0.3850 5 VAL H CG1 2667 C CG2 . VAL B 5 ? 1.3166 1.8950 1.3053 0.2726 -0.1543 -0.3997 5 VAL H CG2 2668 N N . GLN B 6 ? 1.5095 1.9521 1.2740 0.1177 -0.0928 -0.2735 6 GLN H N 2669 C CA . GLN B 6 ? 1.4744 1.8700 1.1796 0.0909 -0.0910 -0.2437 6 GLN H CA 2670 C C . GLN B 6 ? 1.4484 1.9135 1.1767 0.0629 -0.1072 -0.2700 6 GLN H C 2671 O O . GLN B 6 ? 1.4180 1.9854 1.2181 0.0535 -0.1118 -0.3113 6 GLN H O 2672 C CB . GLN B 6 ? 1.4331 1.7961 1.1109 0.0498 -0.0552 -0.2120 6 GLN H CB 2673 C CG . GLN B 6 ? 1.4603 1.7584 1.1166 0.0681 -0.0387 -0.1827 6 GLN H CG 2674 C CD . GLN B 6 ? 1.5079 1.7843 1.1491 0.0279 -0.0112 -0.1499 6 GLN H CD 2675 O OE1 . GLN B 6 ? 1.5351 1.8070 1.1860 0.0200 0.0039 -0.1390 6 GLN H OE1 2676 N NE2 . GLN B 6 ? 1.5256 1.7861 1.1436 0.0017 -0.0080 -0.1343 6 GLN H NE2 2677 N N . SER B 7 ? 1.5065 1.9154 1.1747 0.0488 -0.1139 -0.2489 7 SER H N 2678 C CA . SER B 7 ? 1.5725 2.0313 1.2489 0.0149 -0.1302 -0.2703 7 SER H CA 2679 C C . SER B 7 ? 1.6613 2.1678 1.3582 -0.0475 -0.0994 -0.2738 7 SER H C 2680 O O . SER B 7 ? 1.7585 2.2462 1.4519 -0.0606 -0.0704 -0.2542 7 SER H O 2681 C CB . SER B 7 ? 1.5223 1.8897 1.1150 0.0159 -0.1436 -0.2482 7 SER H CB 2682 O OG . SER B 7 ? 1.4823 1.7597 1.0194 0.0067 -0.1107 -0.2103 7 SER H OG 2683 N N . GLY B 8 ? 1.5914 2.1580 1.3059 -0.0907 -0.1081 -0.2972 8 GLY H N 2684 C CA . GLY B 8 ? 1.4715 2.0901 1.2042 -0.1554 -0.0811 -0.3033 8 GLY H CA 2685 C C . GLY B 8 ? 1.4388 1.9667 1.1017 -0.1930 -0.0653 -0.2633 8 GLY H C 2686 O O . GLY B 8 ? 1.4310 1.8600 1.0365 -0.1685 -0.0710 -0.2356 8 GLY H O 2687 N N . ALA B 9 ? 1.5441 2.1057 1.2119 -0.2542 -0.0452 -0.2621 9 ALA H N 2688 C CA . ALA B 9 ? 1.6682 2.1468 1.2786 -0.2931 -0.0332 -0.2216 9 ALA H CA 2689 C C . ALA B 9 ? 1.7666 2.1711 1.3245 -0.3043 -0.0480 -0.2127 9 ALA H C 2690 O O . ALA B 9 ? 1.6827 2.1263 1.2487 -0.3131 -0.0671 -0.2435 9 ALA H O 2691 C CB . ALA B 9 ? 1.6868 2.2214 1.3058 -0.3647 -0.0151 -0.2250 9 ALA H CB 2692 N N . GLU B 10 ? 1.8433 2.1396 1.3509 -0.3011 -0.0401 -0.1720 10 GLU H N 2693 C CA . GLU B 10 ? 1.8305 2.0358 1.2818 -0.3052 -0.0483 -0.1639 10 GLU H CA 2694 C C . GLU B 10 ? 1.6723 1.8034 1.0866 -0.3514 -0.0406 -0.1322 10 GLU H C 2695 O O . GLU B 10 ? 1.6226 1.7337 1.0444 -0.3556 -0.0298 -0.0993 10 GLU H O 2696 C CB . GLU B 10 ? 1.9295 2.0526 1.3525 -0.2391 -0.0446 -0.1482 10 GLU H CB 2697 C CG . GLU B 10 ? 1.9641 2.1295 1.4047 -0.1896 -0.0580 -0.1707 10 GLU H CG 2698 C CD . GLU B 10 ? 2.1057 2.2460 1.5043 -0.1806 -0.0816 -0.1936 10 GLU H CD 2699 O OE1 . GLU B 10 ? 2.2695 2.3642 1.6257 -0.2159 -0.0857 -0.1980 10 GLU H OE1 2700 O OE2 . GLU B 10 ? 2.0956 2.2543 1.4974 -0.1391 -0.0991 -0.2060 10 GLU H OE2 2701 N N . VAL B 11 ? 1.6054 1.6862 0.9763 -0.3838 -0.0503 -0.1407 11 VAL H N 2702 C CA . VAL B 11 ? 1.6324 1.6174 0.9594 -0.4216 -0.0478 -0.1109 11 VAL H CA 2703 C C . VAL B 11 ? 1.7632 1.6341 1.0365 -0.3933 -0.0489 -0.1127 11 VAL H C 2704 O O . VAL B 11 ? 1.8477 1.7248 1.0962 -0.3973 -0.0612 -0.1459 11 VAL H O 2705 C CB . VAL B 11 ? 1.6553 1.6775 0.9697 -0.5063 -0.0556 -0.1217 11 VAL H CB 2706 C CG1 . VAL B 11 ? 1.7601 1.6608 1.0201 -0.5412 -0.0582 -0.0864 11 VAL H CG1 2707 C CG2 . VAL B 11 ? 1.6018 1.7387 0.9620 -0.5393 -0.0475 -0.1269 11 VAL H CG2 2708 N N . LYS B 12 ? 1.7586 1.5266 1.0156 -0.3661 -0.0363 -0.0784 12 LYS H N 2709 C CA . LYS B 12 ? 1.7723 1.4272 0.9821 -0.3321 -0.0272 -0.0820 12 LYS H CA 2710 C C . LYS B 12 ? 1.8964 1.4402 1.0857 -0.3467 -0.0235 -0.0507 12 LYS H C 2711 O O . LYS B 12 ? 1.8505 1.4038 1.0694 -0.3647 -0.0282 -0.0159 12 LYS H O 2712 C CB . LYS B 12 ? 1.6713 1.3174 0.8986 -0.2595 -0.0074 -0.0762 12 LYS H CB 2713 C CG . LYS B 12 ? 1.6463 1.3820 0.8875 -0.2374 -0.0153 -0.1026 12 LYS H CG 2714 C CD . LYS B 12 ? 1.8157 1.5348 1.0013 -0.2419 -0.0302 -0.1398 12 LYS H CD 2715 C CE . LYS B 12 ? 1.8071 1.6058 1.0100 -0.2104 -0.0445 -0.1589 12 LYS H CE 2716 N NZ . LYS B 12 ? 1.9029 1.6963 1.0538 -0.2209 -0.0706 -0.1931 12 LYS H NZ 2717 N N . LYS B 13 ? 1.9789 1.4109 1.1158 -0.3361 -0.0162 -0.0624 13 LYS H N 2718 C CA . LYS B 13 ? 1.9595 1.2709 1.0821 -0.3371 -0.0123 -0.0347 13 LYS H CA 2719 C C . LYS B 13 ? 2.0054 1.2746 1.1658 -0.2609 0.0156 -0.0172 13 LYS H C 2720 O O . LYS B 13 ? 1.9376 1.2343 1.0974 -0.2187 0.0346 -0.0379 13 LYS H O 2721 C CB . LYS B 13 ? 1.9734 1.1793 1.0201 -0.3671 -0.0159 -0.0615 13 LYS H CB 2722 C CG . LYS B 13 ? 2.0717 1.3315 1.0839 -0.4440 -0.0412 -0.0862 13 LYS H CG 2723 C CD . LYS B 13 ? 2.2419 1.4791 1.2477 -0.5106 -0.0594 -0.0568 13 LYS H CD 2724 C CE . LYS B 13 ? 2.4036 1.5980 1.3418 -0.5872 -0.0763 -0.0829 13 LYS H CE 2725 N NZ . LYS B 13 ? 2.4258 1.6538 1.3323 -0.5904 -0.0793 -0.1349 13 LYS H NZ 2726 N N . PRO B 14 ? 2.1060 1.3081 1.3000 -0.2441 0.0169 0.0211 14 PRO H N 2727 C CA . PRO B 14 ? 2.0944 1.2579 1.3380 -0.1725 0.0458 0.0358 14 PRO H CA 2728 C C . PRO B 14 ? 2.1481 1.2384 1.3445 -0.1350 0.0803 -0.0049 14 PRO H C 2729 O O . PRO B 14 ? 2.2674 1.2760 1.3942 -0.1612 0.0775 -0.0314 14 PRO H O 2730 C CB . PRO B 14 ? 2.1465 1.2264 1.4209 -0.1726 0.0309 0.0772 14 PRO H CB 2731 C CG . PRO B 14 ? 2.2511 1.2862 1.4610 -0.2446 0.0004 0.0760 14 PRO H CG 2732 C CD . PRO B 14 ? 2.1968 1.3528 1.3851 -0.2930 -0.0109 0.0543 14 PRO H CD 2733 N N . GLY B 15 ? 2.0969 1.2137 1.3210 -0.0810 0.1132 -0.0114 15 GLY H N 2734 C CA . GLY B 15 ? 2.1984 1.2431 1.3654 -0.0506 0.1501 -0.0504 15 GLY H CA 2735 C C . GLY B 15 ? 2.1796 1.2770 1.2804 -0.0671 0.1444 -0.0837 15 GLY H C 2736 O O . GLY B 15 ? 2.2928 1.3440 1.3359 -0.0441 0.1733 -0.1137 15 GLY H O 2737 N N . ALA B 16 ? 2.0619 1.2507 1.1668 -0.1092 0.1061 -0.0802 16 ALA H N 2738 C CA . ALA B 16 ? 2.0220 1.2742 1.0820 -0.1218 0.0909 -0.1087 16 ALA H CA 2739 C C . ALA B 16 ? 1.8675 1.1959 0.9684 -0.0817 0.1029 -0.0964 16 ALA H C 2740 O O . ALA B 16 ? 1.7942 1.1319 0.9585 -0.0502 0.1239 -0.0675 16 ALA H O 2741 C CB . ALA B 16 ? 1.9945 1.3262 1.0605 -0.1799 0.0484 -0.1135 16 ALA H CB 2742 N N . SER B 17 ? 1.8220 1.1994 0.8864 -0.0828 0.0872 -0.1176 17 SER H N 2743 C CA . SER B 17 ? 1.8116 1.2563 0.9093 -0.0505 0.0918 -0.1053 17 SER H CA 2744 C C . SER B 17 ? 1.7844 1.3388 0.9142 -0.0722 0.0526 -0.1100 17 SER H C 2745 O O . SER B 17 ? 1.8370 1.4200 0.9512 -0.1111 0.0226 -0.1306 17 SER H O 2746 C CB . SER B 17 ? 1.9767 1.3691 0.9995 -0.0222 0.1109 -0.1233 17 SER H CB 2747 O OG . SER B 17 ? 2.1221 1.5128 1.0745 -0.0481 0.0774 -0.1537 17 SER H OG 2748 N N . VAL B 18 ? 1.7637 1.3794 0.9395 -0.0470 0.0548 -0.0945 18 VAL H N 2749 C CA . VAL B 18 ? 1.8621 1.5812 1.0772 -0.0588 0.0233 -0.1025 18 VAL H CA 2750 C C . VAL B 18 ? 1.8051 1.5461 1.0140 -0.0205 0.0203 -0.1028 18 VAL H C 2751 O O . VAL B 18 ? 1.7774 1.4769 0.9803 0.0107 0.0491 -0.0837 18 VAL H O 2752 C CB . VAL B 18 ? 1.9444 1.7273 1.2349 -0.0804 0.0225 -0.0816 18 VAL H CB 2753 C CG1 . VAL B 18 ? 1.9283 1.7009 1.2585 -0.0489 0.0487 -0.0490 18 VAL H CG1 2754 C CG2 . VAL B 18 ? 1.8881 1.7790 1.2174 -0.1004 -0.0051 -0.1008 18 VAL H CG2 2755 N N . LYS B 19 ? 1.8015 1.6065 1.0146 -0.0234 -0.0153 -0.1243 19 LYS H N 2756 C CA . LYS B 19 ? 1.8542 1.6716 1.0594 0.0136 -0.0262 -0.1230 19 LYS H CA 2757 C C . LYS B 19 ? 1.8338 1.7532 1.1117 0.0152 -0.0508 -0.1324 19 LYS H C 2758 O O . LYS B 19 ? 1.9176 1.9059 1.2223 -0.0045 -0.0815 -0.1589 19 LYS H O 2759 C CB . LYS B 19 ? 1.9225 1.6973 1.0465 0.0228 -0.0525 -0.1415 19 LYS H CB 2760 C CG . LYS B 19 ? 2.0075 1.6681 1.0417 0.0281 -0.0206 -0.1358 19 LYS H CG 2761 C CD . LYS B 19 ? 2.1077 1.7203 1.0456 0.0263 -0.0492 -0.1555 19 LYS H CD 2762 C CE . LYS B 19 ? 2.1205 1.7429 1.0395 0.0577 -0.0755 -0.1473 19 LYS H CE 2763 N NZ . LYS B 19 ? 2.2376 1.8013 1.0489 0.0549 -0.1071 -0.1605 19 LYS H NZ 2764 N N . VAL B 20 ? 1.7170 1.6462 1.0294 0.0376 -0.0341 -0.1129 20 VAL H N 2765 C CA . VAL B 20 ? 1.6639 1.6792 1.0455 0.0413 -0.0480 -0.1226 20 VAL H CA 2766 C C . VAL B 20 ? 1.6743 1.6765 1.0403 0.0841 -0.0674 -0.1244 20 VAL H C 2767 O O . VAL B 20 ? 1.6588 1.5846 0.9742 0.1077 -0.0518 -0.1016 20 VAL H O 2768 C CB . VAL B 20 ? 1.6014 1.6328 1.0299 0.0296 -0.0190 -0.0999 20 VAL H CB 2769 C CG1 . VAL B 20 ? 1.5637 1.6778 1.0536 0.0295 -0.0292 -0.1163 20 VAL H CG1 2770 C CG2 . VAL B 20 ? 1.5638 1.5940 1.0010 -0.0114 -0.0060 -0.0911 20 VAL H CG2 2771 N N . SER B 21 ? 1.6861 1.7629 1.1004 0.0936 -0.0989 -0.1506 21 SER H N 2772 C CA . SER B 21 ? 1.7777 1.8375 1.1816 0.1371 -0.1254 -0.1520 21 SER H CA 2773 C C . SER B 21 ? 1.7589 1.8638 1.2285 0.1503 -0.1172 -0.1562 21 SER H C 2774 O O . SER B 21 ? 1.7428 1.9135 1.2708 0.1227 -0.0982 -0.1670 21 SER H O 2775 C CB . SER B 21 ? 1.8584 1.9602 1.2693 0.1485 -0.1763 -0.1804 21 SER H CB 2776 O OG . SER B 21 ? 1.8486 2.0663 1.3518 0.1296 -0.1841 -0.2139 21 SER H OG 2777 N N . CYS B 22 ? 1.7876 1.8468 1.2373 0.1894 -0.1311 -0.1467 22 CYS H N 2778 C CA . CYS B 22 ? 1.7000 1.7824 1.2005 0.2030 -0.1220 -0.1510 22 CYS H CA 2779 C C . CYS B 22 ? 1.7861 1.8420 1.2817 0.2517 -0.1618 -0.1583 22 CYS H C 2780 O O . CYS B 22 ? 1.8663 1.8267 1.2886 0.2729 -0.1690 -0.1299 22 CYS H O 2781 C CB . CYS B 22 ? 1.5911 1.6158 1.0655 0.1901 -0.0808 -0.1164 22 CYS H CB 2782 S SG . CYS B 22 ? 2.0930 2.1136 1.6021 0.2074 -0.0739 -0.1175 22 CYS H SG 2783 N N . LYS B 23 ? 1.7322 1.8716 1.3059 0.2689 -0.1886 -0.1966 23 LYS H N 2784 C CA . LYS B 23 ? 1.6991 1.8162 1.2824 0.3215 -0.2334 -0.2052 23 LYS H CA 2785 C C . LYS B 23 ? 1.7503 1.8500 1.3671 0.3442 -0.2207 -0.2105 23 LYS H C 2786 O O . LYS B 23 ? 1.7711 1.9488 1.4642 0.3324 -0.1983 -0.2423 23 LYS H O 2787 C CB . LYS B 23 ? 1.5998 1.8248 1.2656 0.3339 -0.2725 -0.2485 23 LYS H CB 2788 C CG . LYS B 23 ? 1.6230 1.8449 1.3218 0.3936 -0.3304 -0.2623 23 LYS H CG 2789 C CD . LYS B 23 ? 1.7743 1.8791 1.3672 0.4187 -0.3728 -0.2231 23 LYS H CD 2790 C CE . LYS B 23 ? 1.9498 2.0508 1.5842 0.4814 -0.4385 -0.2347 23 LYS H CE 2791 N NZ . LYS B 23 ? 1.9349 2.0458 1.6439 0.5156 -0.4263 -0.2556 23 LYS H NZ 2792 N N . ALA B 24 ? 1.8224 1.8129 1.3736 0.3739 -0.2357 -0.1805 24 ALA H N 2793 C CA . ALA B 24 ? 1.8127 1.7576 1.3746 0.3929 -0.2250 -0.1794 24 ALA H CA 2794 C C . ALA B 24 ? 1.9184 1.8626 1.5242 0.4520 -0.2784 -0.2038 24 ALA H C 2795 O O . ALA B 24 ? 1.9920 1.8996 1.5613 0.4809 -0.3288 -0.1912 24 ALA H O 2796 C CB . ALA B 24 ? 1.8212 1.6429 1.2838 0.3828 -0.2057 -0.1299 24 ALA H CB 2797 N N . SER B 25 ? 1.9513 1.9274 1.6303 0.4711 -0.2698 -0.2375 25 SER H N 2798 C CA . SER B 25 ? 2.0519 1.9971 1.7679 0.5346 -0.3174 -0.2555 25 SER H CA 2799 C C . SER B 25 ? 2.1296 2.0188 1.8527 0.5434 -0.2923 -0.2644 25 SER H C 2800 O O . SER B 25 ? 2.1312 2.0409 1.8541 0.4978 -0.2389 -0.2681 25 SER H O 2801 C CB . SER B 25 ? 1.9654 2.0436 1.8028 0.5624 -0.3446 -0.3099 25 SER H CB 2802 O OG . SER B 25 ? 1.8161 2.0041 1.7379 0.5329 -0.2947 -0.3564 25 SER H OG 2803 N N . GLY B 26 ? 2.2073 2.0218 1.9349 0.6010 -0.3346 -0.2675 26 GLY H N 2804 C CA . GLY B 26 ? 2.2214 1.9835 1.9681 0.6169 -0.3168 -0.2873 26 GLY H CA 2805 C C . GLY B 26 ? 2.2915 1.9019 1.9216 0.5969 -0.3056 -0.2345 26 GLY H C 2806 O O . GLY B 26 ? 2.3971 1.9541 2.0260 0.5943 -0.2834 -0.2457 26 GLY H O 2807 N N . TYR B 27 ? 2.2331 1.7766 1.7636 0.5777 -0.3168 -0.1797 27 TYR H N 2808 C CA . TYR B 27 ? 2.2346 1.6350 1.6501 0.5564 -0.3066 -0.1268 27 TYR H CA 2809 C C . TYR B 27 ? 2.2698 1.5960 1.5815 0.5559 -0.3374 -0.0767 27 TYR H C 2810 O O . TYR B 27 ? 2.2831 1.6744 1.6096 0.5642 -0.3619 -0.0826 27 TYR H O 2811 C CB . TYR B 27 ? 2.1779 1.5990 1.5773 0.4906 -0.2398 -0.1152 27 TYR H CB 2812 C CG . TYR B 27 ? 2.1416 1.6335 1.5271 0.4468 -0.2105 -0.0977 27 TYR H CG 2813 C CD1 . TYR B 27 ? 2.0222 1.6497 1.4892 0.4316 -0.1942 -0.1331 27 TYR H CD1 2814 C CD2 . TYR B 27 ? 2.2166 1.6349 1.5056 0.4181 -0.1955 -0.0470 27 TYR H CD2 2815 C CE1 . TYR B 27 ? 1.9211 1.5982 1.3717 0.3927 -0.1697 -0.1159 27 TYR H CE1 2816 C CE2 . TYR B 27 ? 2.1148 1.5901 1.3948 0.3825 -0.1665 -0.0345 27 TYR H CE2 2817 C CZ . TYR B 27 ? 1.9481 1.5472 1.3080 0.3717 -0.1565 -0.0678 27 TYR H CZ 2818 O OH . TYR B 27 ? 1.8657 1.5053 1.2122 0.3383 -0.1304 -0.0540 27 TYR H OH 2819 N N . THR B 28 ? 2.3575 1.5473 1.5577 0.5392 -0.3329 -0.0285 28 THR H N 2820 C CA . THR B 28 ? 2.4057 1.5157 1.4872 0.5264 -0.3499 0.0200 28 THR H CA 2821 C C . THR B 28 ? 2.3167 1.4902 1.3794 0.4727 -0.2957 0.0310 28 THR H C 2822 O O . THR B 28 ? 2.2997 1.4481 1.3298 0.4279 -0.2418 0.0525 28 THR H O 2823 C CB . THR B 28 ? 2.4891 1.4332 1.4521 0.5175 -0.3552 0.0675 28 THR H CB 2824 O OG1 . THR B 28 ? 2.5511 1.4220 1.5287 0.5738 -0.4139 0.0588 28 THR H OG1 2825 C CG2 . THR B 28 ? 2.5877 1.4524 1.4191 0.4994 -0.3687 0.1138 28 THR H CG2 2826 N N . PHE B 29 ? 2.2383 1.4875 1.3205 0.4786 -0.3143 0.0174 29 PHE H N 2827 C CA . PHE B 29 ? 2.0982 1.4226 1.1852 0.4353 -0.2679 0.0164 29 PHE H CA 2828 C C . PHE B 29 ? 2.0723 1.3155 1.0546 0.3929 -0.2226 0.0597 29 PHE H C 2829 O O . PHE B 29 ? 1.9419 1.2329 0.9489 0.3546 -0.1662 0.0615 29 PHE H O 2830 C CB . PHE B 29 ? 2.1253 1.5103 1.2220 0.4487 -0.3057 0.0000 29 PHE H CB 2831 C CG . PHE B 29 ? 2.0048 1.4462 1.0939 0.4061 -0.2620 -0.0002 29 PHE H CG 2832 C CD1 . PHE B 29 ? 1.8937 1.4377 1.0736 0.3807 -0.2193 -0.0243 29 PHE H CD1 2833 C CD2 . PHE B 29 ? 2.0831 1.4666 1.0684 0.3900 -0.2637 0.0235 29 PHE H CD2 2834 C CE1 . PHE B 29 ? 1.8491 1.4346 1.0240 0.3447 -0.1830 -0.0228 29 PHE H CE1 2835 C CE2 . PHE B 29 ? 1.9925 1.4194 0.9739 0.3542 -0.2216 0.0197 29 PHE H CE2 2836 C CZ . PHE B 29 ? 1.8542 1.3812 0.9346 0.3339 -0.1832 -0.0025 29 PHE H CZ 2837 N N . THR B 30 ? 2.2336 1.3560 1.0991 0.3995 -0.2484 0.0943 30 THR H N 2838 C CA . THR B 30 ? 2.3160 1.3585 1.0729 0.3581 -0.2033 0.1327 30 THR H CA 2839 C C . THR B 30 ? 2.3351 1.3429 1.0980 0.3287 -0.1533 0.1503 30 THR H C 2840 O O . THR B 30 ? 2.2778 1.2586 0.9908 0.2876 -0.0985 0.1744 30 THR H O 2841 C CB . THR B 30 ? 2.4841 1.3950 1.0983 0.3683 -0.2484 0.1665 30 THR H CB 2842 O OG1 . THR B 30 ? 2.5196 1.3532 1.1253 0.4034 -0.3005 0.1756 30 THR H OG1 2843 C CG2 . THR B 30 ? 2.5596 1.5026 1.1542 0.3866 -0.2957 0.1529 30 THR H CG2 2844 N N . GLY B 31 ? 2.3595 1.3830 1.1967 0.3473 -0.1679 0.1325 31 GLY H N 2845 C CA . GLY B 31 ? 2.3914 1.3671 1.2258 0.3198 -0.1331 0.1485 31 GLY H CA 2846 C C . GLY B 31 ? 2.2954 1.3525 1.2018 0.2770 -0.0716 0.1432 31 GLY H C 2847 O O . GLY B 31 ? 2.3534 1.3630 1.2412 0.2454 -0.0418 0.1635 31 GLY H O 2848 N N . TYR B 32 ? 2.1341 1.3091 1.1184 0.2724 -0.0551 0.1192 32 TYR H N 2849 C CA . TYR B 32 ? 1.8577 1.1214 0.9261 0.2385 -0.0115 0.1106 32 TYR H CA 2850 C C . TYR B 32 ? 1.7313 1.0647 0.8178 0.2230 0.0167 0.1116 32 TYR H C 2851 O O . TYR B 32 ? 1.7477 1.1147 0.8363 0.2443 -0.0071 0.0939 32 TYR H O 2852 C CB . TYR B 32 ? 1.8838 1.2247 1.0467 0.2518 -0.0292 0.0704 32 TYR H CB 2853 C CG . TYR B 32 ? 2.1478 1.4281 1.3097 0.2763 -0.0594 0.0557 32 TYR H CG 2854 C CD1 . TYR B 32 ? 2.3052 1.5358 1.4436 0.3267 -0.1108 0.0437 32 TYR H CD1 2855 C CD2 . TYR B 32 ? 2.2071 1.4848 1.3996 0.2500 -0.0392 0.0500 32 TYR H CD2 2856 C CE1 . TYR B 32 ? 2.4415 1.6112 1.5871 0.3553 -0.1388 0.0275 32 TYR H CE1 2857 C CE2 . TYR B 32 ? 2.3407 1.5557 1.5318 0.2726 -0.0638 0.0311 32 TYR H CE2 2858 C CZ . TYR B 32 ? 2.4812 1.6401 1.6515 0.3282 -0.1126 0.0191 32 TYR H CZ 2859 O OH . TYR B 32 ? 2.5950 1.6838 1.7697 0.3574 -0.1382 -0.0019 32 TYR H OH 2860 N N . TYR B 33 ? 1.6712 1.0332 0.7834 0.1859 0.0653 0.1291 33 TYR H N 2861 C CA . TYR B 33 ? 1.6823 1.1099 0.8273 0.1721 0.0954 0.1292 33 TYR H CA 2862 C C . TYR B 33 ? 1.6823 1.2042 0.9038 0.1821 0.0733 0.0969 33 TYR H C 2863 O O . TYR B 33 ? 1.6579 1.2215 0.9350 0.1807 0.0590 0.0789 33 TYR H O 2864 C CB . TYR B 33 ? 1.6975 1.1534 0.8848 0.1354 0.1453 0.1512 33 TYR H CB 2865 C CG . TYR B 33 ? 1.7549 1.1377 0.8717 0.1184 0.1834 0.1807 33 TYR H CG 2866 C CD1 . TYR B 33 ? 1.9065 1.1856 0.9125 0.1294 0.1685 0.1916 33 TYR H CD1 2867 C CD2 . TYR B 33 ? 1.6703 1.0908 0.8323 0.0902 0.2347 0.1975 33 TYR H CD2 2868 C CE1 . TYR B 33 ? 1.9687 1.1792 0.8992 0.1056 0.2090 0.2182 33 TYR H CE1 2869 C CE2 . TYR B 33 ? 1.7681 1.1325 0.8721 0.0709 0.2780 0.2199 33 TYR H CE2 2870 C CZ . TYR B 33 ? 1.8751 1.1334 0.8579 0.0755 0.2677 0.2298 33 TYR H CZ 2871 O OH . TYR B 33 ? 1.9423 1.1441 0.8587 0.0480 0.3165 0.2519 33 TYR H OH 2872 N N . MET B 34 ? 1.7678 1.3212 0.9880 0.1865 0.0750 0.0885 34 MET H N 2873 C CA . MET B 34 ? 1.6140 1.2597 0.9063 0.1831 0.0637 0.0627 34 MET H CA 2874 C C . MET B 34 ? 1.5601 1.2500 0.8967 0.1562 0.1001 0.0760 34 MET H C 2875 O O . MET B 34 ? 1.6396 1.3002 0.9434 0.1548 0.1252 0.0889 34 MET H O 2876 C CB . MET B 34 ? 1.6332 1.2842 0.8968 0.2050 0.0323 0.0413 34 MET H CB 2877 C CG . MET B 34 ? 1.4865 1.2298 0.8190 0.2002 0.0150 0.0105 34 MET H CG 2878 S SD . MET B 34 ? 1.7143 1.5007 1.1038 0.2132 -0.0120 -0.0186 34 MET H SD 2879 C CE . MET B 34 ? 1.6578 1.3980 1.0014 0.2600 -0.0628 -0.0326 34 MET H CE 2880 N N . HIS B 35 ? 1.5177 1.2744 0.9273 0.1349 0.1019 0.0721 35 HIS H N 2881 C CA . HIS B 35 ? 1.4799 1.2842 0.9422 0.1112 0.1242 0.0857 35 HIS H CA 2882 C C . HIS B 35 ? 1.4496 1.3096 0.9389 0.1053 0.1070 0.0650 35 HIS H C 2883 O O . HIS B 35 ? 1.4963 1.3816 0.9840 0.1128 0.0800 0.0366 35 HIS H O 2884 C CB . HIS B 35 ? 1.4014 1.2397 0.9183 0.0836 0.1312 0.1002 35 HIS H CB 2885 C CG . HIS B 35 ? 1.5217 1.3115 1.0202 0.0793 0.1514 0.1229 35 HIS H CG 2886 N ND1 . HIS B 35 ? 1.6434 1.3782 1.0938 0.0910 0.1389 0.1161 35 HIS H ND1 2887 C CD2 . HIS B 35 ? 1.5650 1.3524 1.0890 0.0631 0.1830 0.1519 35 HIS H CD2 2888 C CE1 . HIS B 35 ? 1.6819 1.3764 1.1188 0.0769 0.1629 0.1414 35 HIS H CE1 2889 N NE2 . HIS B 35 ? 1.6616 1.3940 1.1470 0.0591 0.1917 0.1622 35 HIS H NE2 2890 N N . TRP B 36 ? 1.4042 1.2807 0.9198 0.0923 0.1232 0.0784 36 TRP H N 2891 C CA . TRP B 36 ? 1.3860 1.3115 0.9289 0.0755 0.1080 0.0652 36 TRP H CA 2892 C C . TRP B 36 ? 1.3846 1.3489 0.9872 0.0460 0.1138 0.0889 36 TRP H C 2893 O O . TRP B 36 ? 1.4460 1.3947 1.0742 0.0471 0.1353 0.1168 36 TRP H O 2894 C CB . TRP B 36 ? 1.3659 1.2601 0.8725 0.0868 0.1122 0.0576 36 TRP H CB 2895 C CG . TRP B 36 ? 1.2846 1.1475 0.7299 0.1100 0.0951 0.0346 36 TRP H CG 2896 C CD1 . TRP B 36 ? 1.2962 1.0950 0.6822 0.1325 0.1035 0.0408 36 TRP H CD1 2897 C CD2 . TRP B 36 ? 1.2439 1.1413 0.6827 0.1103 0.0626 0.0032 36 TRP H CD2 2898 N NE1 . TRP B 36 ? 1.3704 1.1556 0.7093 0.1491 0.0723 0.0183 36 TRP H NE1 2899 C CE2 . TRP B 36 ? 1.3804 1.2322 0.7596 0.1376 0.0467 -0.0064 36 TRP H CE2 2900 C CE3 . TRP B 36 ? 1.2085 1.1731 0.6863 0.0869 0.0455 -0.0172 36 TRP H CE3 2901 C CZ2 . TRP B 36 ? 1.4334 1.3122 0.8035 0.1467 0.0098 -0.0358 36 TRP H CZ2 2902 C CZ3 . TRP B 36 ? 1.2474 1.2435 0.7181 0.0930 0.0164 -0.0496 36 TRP H CZ3 2903 C CH2 . TRP B 36 ? 1.3317 1.2888 0.7554 0.1249 -0.0033 -0.0587 36 TRP H CH2 2904 N N . VAL B 37 ? 1.3300 1.3464 0.9552 0.0183 0.0939 0.0780 37 VAL H N 2905 C CA . VAL B 37 ? 1.3278 1.3777 0.9976 -0.0153 0.0894 0.1029 37 VAL H CA 2906 C C . VAL B 37 ? 1.3039 1.3826 0.9719 -0.0424 0.0728 0.0933 37 VAL H C 2907 O O . VAL B 37 ? 1.3334 1.4372 0.9804 -0.0480 0.0628 0.0600 37 VAL H O 2908 C CB . VAL B 37 ? 1.3518 1.4323 1.0384 -0.0385 0.0819 0.1040 37 VAL H CB 2909 C CG1 . VAL B 37 ? 1.3342 1.4482 1.0565 -0.0789 0.0691 0.1317 37 VAL H CG1 2910 C CG2 . VAL B 37 ? 1.3597 1.4064 1.0459 -0.0195 0.0979 0.1162 37 VAL H CG2 2911 N N . ARG B 38 ? 1.2637 1.3364 0.9555 -0.0581 0.0696 0.1221 38 ARG H N 2912 C CA . ARG B 38 ? 1.3355 1.4242 1.0164 -0.0912 0.0524 0.1181 38 ARG H CA 2913 C C . ARG B 38 ? 1.5121 1.6272 1.2148 -0.1347 0.0335 0.1470 38 ARG H C 2914 O O . ARG B 38 ? 1.5797 1.7003 1.3161 -0.1358 0.0313 0.1744 38 ARG H O 2915 C CB . ARG B 38 ? 1.2424 1.2837 0.9149 -0.0781 0.0567 0.1261 38 ARG H CB 2916 C CG . ARG B 38 ? 1.1625 1.1736 0.8777 -0.0690 0.0600 0.1666 38 ARG H CG 2917 C CD . ARG B 38 ? 1.2672 1.2249 0.9658 -0.0579 0.0645 0.1648 38 ARG H CD 2918 N NE . ARG B 38 ? 1.4685 1.3939 1.2166 -0.0453 0.0654 0.2008 38 ARG H NE 2919 C CZ . ARG B 38 ? 1.6623 1.5295 1.4047 -0.0326 0.0701 0.2027 38 ARG H CZ 2920 N NH1 . ARG B 38 ? 1.6193 1.4540 1.3017 -0.0350 0.0751 0.1709 38 ARG H NH1 2921 N NH2 . ARG B 38 ? 1.8225 1.6631 1.6232 -0.0161 0.0686 0.2352 38 ARG H NH2 2922 N N . GLN B 39 ? 1.5712 1.7023 1.2506 -0.1755 0.0177 0.1420 39 GLN H N 2923 C CA . GLN B 39 ? 1.5482 1.6987 1.2283 -0.2261 -0.0049 0.1695 39 GLN H CA 2924 C C . GLN B 39 ? 1.4483 1.5762 1.1010 -0.2545 -0.0178 0.1761 39 GLN H C 2925 O O . GLN B 39 ? 1.3896 1.5353 1.0087 -0.2738 -0.0128 0.1424 39 GLN H O 2926 C CB . GLN B 39 ? 1.5836 1.7885 1.2404 -0.2659 -0.0066 0.1440 39 GLN H CB 2927 C CG . GLN B 39 ? 1.6067 1.8486 1.2297 -0.2882 0.0023 0.0961 39 GLN H CG 2928 C CD . GLN B 39 ? 1.5696 1.8657 1.1712 -0.3340 0.0054 0.0697 39 GLN H CD 2929 O OE1 . GLN B 39 ? 1.6650 1.9631 1.2628 -0.3591 -0.0044 0.0916 39 GLN H OE1 2930 N NE2 . GLN B 39 ? 1.4422 1.7852 1.0304 -0.3498 0.0191 0.0216 39 GLN H NE2 2931 N N . ALA B 40 ? 1.4340 1.5166 1.1084 -0.2506 -0.0336 0.2196 40 ALA H N 2932 C CA . ALA B 40 ? 1.6648 1.7101 1.3092 -0.2822 -0.0514 0.2342 40 ALA H CA 2933 C C . ALA B 40 ? 1.7910 1.8517 1.4085 -0.3467 -0.0821 0.2630 40 ALA H C 2934 O O . ALA B 40 ? 1.8798 1.9670 1.5177 -0.3554 -0.0942 0.2835 40 ALA H O 2935 C CB . ALA B 40 ? 1.7805 1.7569 1.4599 -0.2416 -0.0539 0.2640 40 ALA H CB 2936 N N . PRO B 41 ? 1.7945 1.8380 1.3586 -0.3981 -0.0949 0.2640 41 PRO H N 2937 C CA . PRO B 41 ? 1.8988 1.9489 1.4208 -0.4672 -0.1247 0.2944 41 PRO H CA 2938 C C . PRO B 41 ? 1.9691 1.9811 1.5333 -0.4519 -0.1612 0.3562 41 PRO H C 2939 O O . PRO B 41 ? 1.8773 1.8444 1.4965 -0.3953 -0.1611 0.3738 41 PRO H O 2940 C CB . PRO B 41 ? 1.9482 1.9641 1.4091 -0.5174 -0.1314 0.2924 41 PRO H CB 2941 C CG . PRO B 41 ? 1.8824 1.9146 1.3503 -0.4862 -0.0975 0.2394 41 PRO H CG 2942 C CD . PRO B 41 ? 1.7794 1.8094 1.3093 -0.4060 -0.0800 0.2299 41 PRO H CD 2943 N N . GLY B 42 ? 2.0625 2.0943 1.6060 -0.4992 -0.1908 0.3859 42 GLY H N 2944 C CA . GLY B 42 ? 2.1051 2.1125 1.6990 -0.4851 -0.2324 0.4453 42 GLY H CA 2945 C C . GLY B 42 ? 2.0093 2.0330 1.7018 -0.4099 -0.2160 0.4460 42 GLY H C 2946 O O . GLY B 42 ? 2.0316 2.0380 1.7907 -0.3843 -0.2454 0.4920 42 GLY H O 2947 N N . GLN B 43 ? 1.9186 1.9759 1.6229 -0.3748 -0.1696 0.3957 43 GLN H N 2948 C CA . GLN B 43 ? 1.9240 1.9987 1.7057 -0.3148 -0.1483 0.3930 43 GLN H CA 2949 C C . GLN B 43 ? 1.8777 2.0086 1.6427 -0.3284 -0.1292 0.3602 43 GLN H C 2950 O O . GLN B 43 ? 1.9116 2.0654 1.6139 -0.3629 -0.1171 0.3230 43 GLN H O 2951 C CB . GLN B 43 ? 2.0299 2.0673 1.8388 -0.2534 -0.1134 0.3712 43 GLN H CB 2952 C CG . GLN B 43 ? 2.1796 2.1664 2.0534 -0.2139 -0.1260 0.4092 43 GLN H CG 2953 C CD . GLN B 43 ? 2.2344 2.1894 2.1351 -0.1511 -0.0811 0.3807 43 GLN H CD 2954 O OE1 . GLN B 43 ? 2.2591 2.2249 2.1217 -0.1398 -0.0470 0.3368 43 GLN H OE1 2955 N NE2 . GLN B 43 ? 2.2448 2.1583 2.2104 -0.1101 -0.0822 0.4050 43 GLN H NE2 2956 N N . GLY B 44 ? 1.8233 1.9758 1.6495 -0.3016 -0.1258 0.3735 44 GLY H N 2957 C CA . GLY B 44 ? 1.7603 1.9495 1.5799 -0.3013 -0.1033 0.3426 44 GLY H CA 2958 C C . GLY B 44 ? 1.6917 1.8700 1.5031 -0.2544 -0.0592 0.2974 44 GLY H C 2959 O O . GLY B 44 ? 1.7514 1.8996 1.5522 -0.2300 -0.0463 0.2854 44 GLY H O 2960 N N . LEU B 45 ? 1.5594 1.7563 1.3684 -0.2447 -0.0392 0.2722 45 LEU H N 2961 C CA . LEU B 45 ? 1.4599 1.6410 1.2538 -0.2016 -0.0047 0.2331 45 LEU H CA 2962 C C . LEU B 45 ? 1.5334 1.6893 1.3793 -0.1539 0.0147 0.2527 45 LEU H C 2963 O O . LEU B 45 ? 1.5875 1.7560 1.4872 -0.1536 0.0104 0.2833 45 LEU H O 2964 C CB . LEU B 45 ? 1.2586 1.4564 1.0231 -0.2063 0.0079 0.1964 45 LEU H CB 2965 C CG . LEU B 45 ? 1.1164 1.3451 0.8347 -0.2477 0.0022 0.1625 45 LEU H CG 2966 C CD1 . LEU B 45 ? 1.0152 1.2406 0.7261 -0.2325 0.0178 0.1339 45 LEU H CD1 2967 C CD2 . LEU B 45 ? 1.0819 1.3210 0.7679 -0.2488 0.0088 0.1278 45 LEU H CD2 2968 N N . GLU B 46 ? 1.5354 1.6583 1.3645 -0.1169 0.0372 0.2330 46 GLU H N 2969 C CA . GLU B 46 ? 1.5624 1.6563 1.4285 -0.0744 0.0631 0.2453 46 GLU H CA 2970 C C . GLU B 46 ? 1.5988 1.6629 1.4209 -0.0414 0.0931 0.2124 46 GLU H C 2971 O O . GLU B 46 ? 1.5906 1.6367 1.3626 -0.0337 0.0938 0.1836 46 GLU H O 2972 C CB . GLU B 46 ? 1.6566 1.7239 1.5429 -0.0652 0.0564 0.2624 46 GLU H CB 2973 C CG . GLU B 46 ? 1.7669 1.8040 1.7019 -0.0225 0.0844 0.2747 46 GLU H CG 2974 C CD . GLU B 46 ? 1.9131 1.9169 1.8668 -0.0171 0.0704 0.2905 46 GLU H CD 2975 O OE1 . GLU B 46 ? 1.9245 1.9089 1.8223 -0.0394 0.0521 0.2777 46 GLU H OE1 2976 O OE2 . GLU B 46 ? 1.9693 1.9654 1.9965 0.0091 0.0785 0.3145 46 GLU H OE2 2977 N N . TRP B 47 ? 1.5770 1.6374 1.4171 -0.0272 0.1142 0.2193 47 TRP H N 2978 C CA . TRP B 47 ? 1.4260 1.4467 1.2223 0.0025 0.1425 0.1990 47 TRP H CA 2979 C C . TRP B 47 ? 1.3364 1.3176 1.1275 0.0329 0.1690 0.1979 47 TRP H C 2980 O O . TRP B 47 ? 1.3106 1.2960 1.1604 0.0410 0.1828 0.2201 47 TRP H O 2981 C CB . TRP B 47 ? 1.4187 1.4421 1.2352 -0.0006 0.1586 0.2128 47 TRP H CB 2982 C CG . TRP B 47 ? 1.4428 1.4137 1.2048 0.0243 0.1878 0.1995 47 TRP H CG 2983 C CD1 . TRP B 47 ? 1.4688 1.4089 1.1655 0.0303 0.1797 0.1767 47 TRP H CD1 2984 C CD2 . TRP B 47 ? 1.4101 1.3523 1.1791 0.0428 0.2290 0.2109 47 TRP H CD2 2985 N NE1 . TRP B 47 ? 1.4854 1.3708 1.1372 0.0497 0.2075 0.1775 47 TRP H NE1 2986 C CE2 . TRP B 47 ? 1.4328 1.3202 1.1240 0.0542 0.2417 0.1969 47 TRP H CE2 2987 C CE3 . TRP B 47 ? 1.3641 1.3215 1.1992 0.0513 0.2571 0.2299 47 TRP H CE3 2988 C CZ2 . TRP B 47 ? 1.4590 1.3036 1.1226 0.0660 0.2838 0.2026 47 TRP H CZ2 2989 C CZ3 . TRP B 47 ? 1.4267 1.3511 1.2470 0.0667 0.3042 0.2299 47 TRP H CZ3 2990 C CH2 . TRP B 47 ? 1.4798 1.3463 1.2075 0.0704 0.3185 0.2168 47 TRP H CH2 2991 N N . MET B 48 ? 1.4029 1.3444 1.1241 0.0510 0.1761 0.1701 48 MET H N 2992 C CA . MET B 48 ? 1.5633 1.4563 1.2573 0.0764 0.2027 0.1621 48 MET H CA 2993 C C . MET B 48 ? 1.5948 1.4435 1.2465 0.0962 0.2383 0.1584 48 MET H C 2994 O O . MET B 48 ? 1.6336 1.4525 1.2901 0.1125 0.2758 0.1613 48 MET H O 2995 C CB . MET B 48 ? 1.5907 1.4656 1.2272 0.0766 0.1825 0.1342 48 MET H CB 2996 C CG . MET B 48 ? 1.5218 1.4336 1.1863 0.0502 0.1517 0.1367 48 MET H CG 2997 S SD . MET B 48 ? 1.4316 1.3302 1.0342 0.0435 0.1314 0.1020 48 MET H SD 2998 C CE . MET B 48 ? 1.9402 1.7637 1.5140 0.0694 0.1620 0.0990 48 MET H CE 2999 N N . GLY B 49 ? 1.5092 1.3481 1.1160 0.0939 0.2287 0.1511 49 GLY H N 3000 C CA . GLY B 49 ? 1.5889 1.3716 1.1339 0.1078 0.2575 0.1493 49 GLY H CA 3001 C C . GLY B 49 ? 1.5901 1.3483 1.0719 0.1101 0.2314 0.1373 49 GLY H C 3002 O O . GLY B 49 ? 1.5374 1.3289 1.0307 0.1044 0.1948 0.1243 49 GLY H O 3003 N N . TRP B 50 ? 1.5373 1.2349 0.9524 0.1178 0.2516 0.1416 50 TRP H N 3004 C CA . TRP B 50 ? 1.4953 1.1488 0.8392 0.1262 0.2240 0.1335 50 TRP H CA 3005 C C . TRP B 50 ? 1.6627 1.2388 0.9040 0.1398 0.2345 0.1290 50 TRP H C 3006 O O . TRP B 50 ? 1.7217 1.2742 0.9443 0.1379 0.2760 0.1330 50 TRP H O 3007 C CB . TRP B 50 ? 1.4307 1.0752 0.7861 0.1122 0.2276 0.1510 50 TRP H CB 3008 C CG . TRP B 50 ? 1.4791 1.0999 0.8352 0.0963 0.2760 0.1760 50 TRP H CG 3009 C CD1 . TRP B 50 ? 1.4382 1.1107 0.8795 0.0741 0.2984 0.1946 50 TRP H CD1 3010 C CD2 . TRP B 50 ? 1.5576 1.1010 0.8255 0.0963 0.3065 0.1849 50 TRP H CD2 3011 N NE1 . TRP B 50 ? 1.5067 1.1487 0.9308 0.0616 0.3450 0.2119 50 TRP H NE1 3012 C CE2 . TRP B 50 ? 1.5321 1.0916 0.8442 0.0729 0.3537 0.2061 50 TRP H CE2 3013 C CE3 . TRP B 50 ? 1.6189 1.0821 0.7722 0.1103 0.2971 0.1780 50 TRP H CE3 3014 C CZ2 . TRP B 50 ? 1.6063 1.1053 0.8498 0.0604 0.3984 0.2179 50 TRP H CZ2 3015 C CZ3 . TRP B 50 ? 1.7582 1.1518 0.8315 0.0974 0.3371 0.1927 50 TRP H CZ3 3016 C CH2 . TRP B 50 ? 1.7777 1.1897 0.8952 0.0714 0.3908 0.2114 50 TRP H CH2 3017 N N . ILE B 51 ? 1.7469 1.2852 0.9235 0.1541 0.1943 0.1183 51 ILE H N 3018 C CA . ILE B 51 ? 1.7771 1.2287 0.8377 0.1641 0.1898 0.1196 51 ILE H CA 3019 C C . ILE B 51 ? 1.8413 1.2360 0.8529 0.1686 0.1666 0.1337 51 ILE H C 3020 O O . ILE B 51 ? 1.7636 1.1870 0.8207 0.1778 0.1309 0.1260 51 ILE H O 3021 C CB . ILE B 51 ? 1.7477 1.2039 0.7755 0.1798 0.1496 0.0941 51 ILE H CB 3022 C CG1 . ILE B 51 ? 1.8025 1.1685 0.7024 0.1868 0.1371 0.0961 51 ILE H CG1 3023 C CG2 . ILE B 51 ? 1.7508 1.2603 0.8306 0.1937 0.0961 0.0763 51 ILE H CG2 3024 C CD1 . ILE B 51 ? 1.7923 1.1639 0.6611 0.1907 0.1169 0.0724 51 ILE H CD1 3025 N N . ASN B 52 ? 1.9815 1.2890 0.8949 0.1603 0.1884 0.1530 52 ASN H N 3026 C CA . ASN B 52 ? 2.0866 1.3104 0.9212 0.1649 0.1596 0.1695 52 ASN H CA 3027 C C . ASN B 52 ? 2.1539 1.3237 0.8994 0.1893 0.1052 0.1607 52 ASN H C 3028 O O . ASN B 52 ? 2.2601 1.3793 0.9135 0.1828 0.1169 0.1628 52 ASN H O 3029 C CB . ASN B 52 ? 2.1714 1.3232 0.9350 0.1352 0.2112 0.1984 52 ASN H CB 3030 C CG . ASN B 52 ? 2.3143 1.3559 0.9725 0.1348 0.1804 0.2211 52 ASN H CG 3031 O OD1 . ASN B 52 ? 2.3109 1.3169 0.9333 0.1636 0.1170 0.2156 52 ASN H OD1 3032 N ND2 . ASN B 52 ? 2.4323 1.4189 1.0429 0.1009 0.2254 0.2476 52 ASN H ND2 3033 N N . PRO B 53 A 2.0620 1.2475 0.8389 0.2171 0.0457 0.1481 52 PRO H N 3034 C CA . PRO B 53 A 2.0249 1.1935 0.7550 0.2441 -0.0139 0.1341 52 PRO H CA 3035 C C . PRO B 53 A 2.2116 1.2585 0.7939 0.2443 -0.0359 0.1585 52 PRO H C 3036 O O . PRO B 53 A 2.4667 1.4969 0.9855 0.2481 -0.0599 0.1506 52 PRO H O 3037 C CB . PRO B 53 A 1.9971 1.2088 0.8081 0.2746 -0.0643 0.1166 52 PRO H CB 3038 C CG . PRO B 53 A 1.8843 1.1814 0.8067 0.2579 -0.0252 0.1061 52 PRO H CG 3039 C CD . PRO B 53 A 1.9100 1.1764 0.8063 0.2228 0.0381 0.1329 52 PRO H CD 3040 N N . ASN B 54 ? 2.1440 1.1025 0.6643 0.2361 -0.0313 0.1883 53 ASN H N 3041 C CA . ASN B 54 ? 2.4853 1.3312 0.8727 0.2287 -0.0555 0.2111 53 ASN H CA 3042 C C . ASN B 54 ? 2.5450 1.3887 0.8887 0.1902 -0.0014 0.2073 53 ASN H C 3043 O O . ASN B 54 ? 2.6998 1.5151 0.9802 0.1876 -0.0287 0.2013 53 ASN H O 3044 C CB . ASN B 54 ? 2.7150 1.4767 1.0656 0.2139 -0.0500 0.2402 53 ASN H CB 3045 C CG . ASN B 54 ? 2.8263 1.5920 1.2374 0.2460 -0.0833 0.2406 53 ASN H CG 3046 O OD1 . ASN B 54 ? 2.8221 1.5422 1.2301 0.2277 -0.0605 0.2594 53 ASN H OD1 3047 N ND2 . ASN B 54 ? 2.8756 1.7198 1.3788 0.2867 -0.1332 0.2087 53 ASN H ND2 3048 N N . SER B 55 ? 2.4682 1.3460 0.8523 0.1618 0.0743 0.2087 54 SER H N 3049 C CA . SER B 55 ? 2.4714 1.3546 0.8313 0.1306 0.1332 0.1996 54 SER H CA 3050 C C . SER B 55 ? 2.4368 1.3767 0.8221 0.1411 0.1332 0.1701 54 SER H C 3051 O O . SER B 55 ? 2.6468 1.5590 0.9720 0.1251 0.1446 0.1592 54 SER H O 3052 C CB . SER B 55 ? 2.4889 1.4025 0.9043 0.1022 0.2113 0.2081 54 SER H CB 3053 O OG . SER B 55 ? 2.4918 1.4967 1.0089 0.1122 0.2417 0.1923 54 SER H OG 3054 N N . GLY B 56 ? 2.2871 1.3036 0.7580 0.1646 0.1215 0.1562 55 GLY H N 3055 C CA . GLY B 56 ? 2.2948 1.3716 0.8067 0.1674 0.1360 0.1290 55 GLY H CA 3056 C C . GLY B 56 ? 2.2861 1.4015 0.8608 0.1492 0.2154 0.1276 55 GLY H C 3057 O O . GLY B 56 ? 2.1315 1.2860 0.7421 0.1495 0.2385 0.1070 55 GLY H O 3058 N N . GLY B 57 ? 2.3678 1.4718 0.9602 0.1334 0.2549 0.1496 56 GLY H N 3059 C CA . GLY B 57 ? 2.2728 1.4211 0.9388 0.1174 0.3279 0.1512 56 GLY H CA 3060 C C . GLY B 57 ? 2.2048 1.4493 1.0035 0.1299 0.3281 0.1456 56 GLY H C 3061 O O . GLY B 57 ? 2.1804 1.4631 1.0313 0.1424 0.2767 0.1447 56 GLY H O 3062 N N . THR B 58 ? 2.2498 1.5422 1.1230 0.1252 0.3802 0.1385 57 THR H N 3063 C CA . THR B 58 ? 2.0722 1.4591 1.0833 0.1331 0.3702 0.1330 57 THR H CA 3064 C C . THR B 58 ? 1.9895 1.4308 1.1054 0.1227 0.4238 0.1458 57 THR H C 3065 O O . THR B 58 ? 2.0487 1.4656 1.1445 0.1145 0.4836 0.1469 57 THR H O 3066 C CB . THR B 58 ? 1.9807 1.3798 0.9958 0.1452 0.3597 0.1073 57 THR H CB 3067 O OG1 . THR B 58 ? 2.1309 1.5037 1.1305 0.1427 0.4218 0.0985 57 THR H OG1 3068 C CG2 . THR B 58 ? 2.0392 1.3877 0.9496 0.1524 0.3101 0.0926 57 THR H CG2 3069 N N . ASN B 59 ? 1.9362 1.4552 1.1663 0.1221 0.4016 0.1538 58 ASN H N 3070 C CA . ASN B 59 ? 1.9805 1.5651 1.3287 0.1172 0.4371 0.1644 58 ASN H CA 3071 C C . ASN B 59 ? 1.9714 1.6139 1.3998 0.1267 0.4025 0.1577 58 ASN H C 3072 O O . ASN B 59 ? 1.9139 1.5770 1.3441 0.1249 0.3514 0.1540 58 ASN H O 3073 C CB . ASN B 59 ? 1.9375 1.5536 1.3366 0.0956 0.4401 0.1891 58 ASN H CB 3074 C CG . ASN B 59 ? 1.9397 1.6339 1.4716 0.0877 0.4696 0.2041 58 ASN H CG 3075 O OD1 . ASN B 59 ? 1.9807 1.7176 1.5886 0.1020 0.4703 0.1996 58 ASN H OD1 3076 N ND2 . ASN B 59 ? 1.8859 1.5979 1.4489 0.0633 0.4900 0.2240 58 ASN H ND2 3077 N N . TYR B 60 ? 1.9428 1.6126 1.4437 0.1353 0.4334 0.1569 59 TYR H N 3078 C CA . TYR B 60 ? 1.8507 1.5614 1.4200 0.1417 0.4027 0.1546 59 TYR H CA 3079 C C . TYR B 60 ? 1.7911 1.5713 1.4921 0.1383 0.4108 0.1783 59 TYR H C 3080 O O . TYR B 60 ? 1.8461 1.6412 1.5979 0.1409 0.4577 0.1874 59 TYR H O 3081 C CB . TYR B 60 ? 1.8420 1.5070 1.3722 0.1588 0.4183 0.1307 59 TYR H CB 3082 C CG . TYR B 60 ? 1.8500 1.4453 1.2482 0.1604 0.4082 0.1064 59 TYR H CG 3083 C CD1 . TYR B 60 ? 1.8121 1.4101 1.1630 0.1535 0.3535 0.1010 59 TYR H CD1 3084 C CD2 . TYR B 60 ? 2.0464 1.5761 1.3716 0.1689 0.4508 0.0862 59 TYR H CD2 3085 C CE1 . TYR B 60 ? 1.8817 1.4240 1.1231 0.1563 0.3350 0.0803 59 TYR H CE1 3086 C CE2 . TYR B 60 ? 2.1797 1.6449 1.3791 0.1665 0.4335 0.0656 59 TYR H CE2 3087 C CZ . TYR B 60 ? 2.0987 1.5734 1.2612 0.1610 0.3718 0.0646 59 TYR H CZ 3088 O OH . TYR B 60 ? 2.2528 1.6700 1.2990 0.1596 0.3475 0.0463 59 TYR H OH 3089 N N . ALA B 61 ? 1.7022 1.5263 1.4585 0.1308 0.3647 0.1878 60 ALA H N 3090 C CA . ALA B 61 ? 1.7650 1.6520 1.6433 0.1270 0.3583 0.2139 60 ALA H CA 3091 C C . ALA B 61 ? 1.9199 1.7876 1.8397 0.1551 0.3976 0.2069 60 ALA H C 3092 O O . ALA B 61 ? 1.9823 1.7946 1.8394 0.1690 0.4024 0.1834 60 ALA H O 3093 C CB . ALA B 61 ? 1.7476 1.6680 1.6493 0.1094 0.3002 0.2238 60 ALA H CB 3094 N N . GLN B 62 ? 1.9744 1.8875 2.0028 0.1638 0.4266 0.2242 61 GLN H N 3095 C CA . GLN B 62 ? 2.0380 1.9275 2.1043 0.1959 0.4748 0.2095 61 GLN H CA 3096 C C . GLN B 62 ? 1.9087 1.7722 1.9937 0.2130 0.4453 0.2066 61 GLN H C 3097 O O . GLN B 62 ? 1.8978 1.7059 1.9585 0.2381 0.4813 0.1811 61 GLN H O 3098 C CB . GLN B 62 ? 2.1564 2.1142 2.3586 0.2051 0.5121 0.2269 61 GLN H CB 3099 C CG . GLN B 62 ? 2.2600 2.2318 2.4364 0.1854 0.5584 0.2254 61 GLN H CG 3100 C CD . GLN B 62 ? 2.3236 2.3703 2.6405 0.1923 0.6056 0.2366 61 GLN H CD 3101 O OE1 . GLN B 62 ? 2.3231 2.3924 2.6364 0.1690 0.6420 0.2401 61 GLN H OE1 3102 N NE2 . GLN B 62 ? 2.3717 2.4569 2.8161 0.2237 0.6040 0.2425 61 GLN H NE2 3103 N N . LYS B 63 ? 1.8615 1.7558 1.9838 0.1975 0.3835 0.2311 62 LYS H N 3104 C CA . LYS B 63 ? 2.0084 1.8635 2.1459 0.2142 0.3652 0.2289 62 LYS H CA 3105 C C . LYS B 63 ? 2.0033 1.7807 2.0072 0.2101 0.3662 0.1940 62 LYS H C 3106 O O . LYS B 63 ? 2.0169 1.7364 2.0052 0.2265 0.3718 0.1787 62 LYS H O 3107 C CB . LYS B 63 ? 2.0597 1.9541 2.2492 0.1919 0.2976 0.2646 62 LYS H CB 3108 C CG . LYS B 63 ? 2.0804 1.9810 2.1787 0.1511 0.2550 0.2621 62 LYS H CG 3109 C CD . LYS B 63 ? 2.1497 2.0814 2.2789 0.1207 0.1922 0.2940 62 LYS H CD 3110 C CE . LYS B 63 ? 2.1425 2.1494 2.3418 0.0991 0.1697 0.3258 62 LYS H CE 3111 N NZ . LYS B 63 ? 2.1605 2.1915 2.4337 0.0867 0.1183 0.3669 62 LYS H NZ 3112 N N . PHE B 64 ? 1.9148 1.6907 1.8261 0.1881 0.3588 0.1815 63 PHE H N 3113 C CA . PHE B 64 ? 1.8134 1.5297 1.6002 0.1815 0.3542 0.1494 63 PHE H CA 3114 C C . PHE B 64 ? 1.7768 1.4282 1.4823 0.1983 0.4060 0.1178 63 PHE H C 3115 O O . PHE B 64 ? 1.6915 1.2901 1.2984 0.1925 0.3959 0.0920 63 PHE H O 3116 C CB . PHE B 64 ? 1.7422 1.4881 1.4752 0.1540 0.3147 0.1500 63 PHE H CB 3117 C CG . PHE B 64 ? 1.7476 1.5343 1.5129 0.1289 0.2613 0.1660 63 PHE H CG 3118 C CD1 . PHE B 64 ? 1.7368 1.5034 1.5262 0.1271 0.2436 0.1714 63 PHE H CD1 3119 C CD2 . PHE B 64 ? 1.7710 1.6080 1.5350 0.1044 0.2305 0.1742 63 PHE H CD2 3120 C CE1 . PHE B 64 ? 1.6884 1.4860 1.4942 0.0965 0.1961 0.1881 63 PHE H CE1 3121 C CE2 . PHE B 64 ? 1.7289 1.6020 1.5129 0.0753 0.1870 0.1859 63 PHE H CE2 3122 C CZ . PHE B 64 ? 1.6842 1.5382 1.4854 0.0689 0.1697 0.1943 63 PHE H CZ 3123 N N . GLN B 65 ? 1.8095 1.4661 1.5542 0.2150 0.4610 0.1187 64 GLN H N 3124 C CA . GLN B 65 ? 1.9298 1.5195 1.5968 0.2283 0.5191 0.0871 64 GLN H CA 3125 C C . GLN B 65 ? 1.9286 1.4448 1.5462 0.2409 0.5274 0.0572 64 GLN H C 3126 O O . GLN B 65 ? 1.8661 1.3786 1.5608 0.2584 0.5256 0.0600 64 GLN H O 3127 C CB . GLN B 65 ? 2.0376 1.6544 1.7817 0.2442 0.5850 0.0905 64 GLN H CB 3128 C CG . GLN B 65 ? 2.0301 1.6920 1.7752 0.2237 0.5923 0.1107 64 GLN H CG 3129 C CD . GLN B 65 ? 2.1103 1.7072 1.7007 0.2070 0.6046 0.0933 64 GLN H CD 3130 O OE1 . GLN B 65 ? 2.1695 1.6942 1.6662 0.2131 0.6353 0.0634 64 GLN H OE1 3131 N NE2 . GLN B 65 ? 2.1094 1.7250 1.6683 0.1852 0.5788 0.1124 64 GLN H NE2 3132 N N . GLY B 66 ? 2.0338 1.4853 1.5160 0.2303 0.5333 0.0293 65 GLY H N 3133 C CA . GLY B 66 ? 2.1795 1.5480 1.5909 0.2374 0.5525 -0.0060 65 GLY H CA 3134 C C . GLY B 66 ? 2.2229 1.5721 1.5800 0.2176 0.4892 -0.0121 65 GLY H C 3135 O O . GLY B 66 ? 2.3942 1.6698 1.6612 0.2122 0.4929 -0.0435 65 GLY H O 3136 N N . ARG B 67 ? 2.0349 1.4496 1.4449 0.2027 0.4331 0.0148 66 ARG H N 3137 C CA . ARG B 67 ? 1.9649 1.3688 1.3301 0.1796 0.3795 0.0059 66 ARG H CA 3138 C C . ARG B 67 ? 1.9343 1.3887 1.2633 0.1565 0.3301 0.0113 66 ARG H C 3139 O O . ARG B 67 ? 2.0129 1.4684 1.3028 0.1348 0.2885 -0.0013 66 ARG H O 3140 C CB . ARG B 67 ? 1.9330 1.3605 1.4023 0.1811 0.3592 0.0292 66 ARG H CB 3141 C CG . ARG B 67 ? 1.9318 1.3284 1.3698 0.1570 0.3181 0.0204 66 ARG H CG 3142 C CD . ARG B 67 ? 1.8454 1.2663 1.3760 0.1505 0.2879 0.0530 66 ARG H CD 3143 N NE . ARG B 67 ? 1.7335 1.2364 1.3559 0.1528 0.2758 0.0902 66 ARG H NE 3144 C CZ . ARG B 67 ? 1.6720 1.2295 1.3246 0.1228 0.2286 0.1154 66 ARG H CZ 3145 N NH1 . ARG B 67 ? 1.6288 1.1759 1.2311 0.0873 0.1924 0.1072 66 ARG H NH1 3146 N NH2 . ARG B 67 ? 1.6529 1.2771 1.3827 0.1234 0.2193 0.1474 66 ARG H NH2 3147 N N . VAL B 68 ? 1.8856 1.3828 1.2330 0.1609 0.3359 0.0283 67 VAL H N 3148 C CA . VAL B 68 ? 1.7196 1.2597 1.0392 0.1467 0.2939 0.0316 67 VAL H CA 3149 C C . VAL B 68 ? 1.7828 1.2764 0.9961 0.1515 0.3030 0.0172 67 VAL H C 3150 O O . VAL B 68 ? 1.7692 1.2262 0.9590 0.1627 0.3505 0.0197 67 VAL H O 3151 C CB . VAL B 68 ? 1.5443 1.1568 0.9506 0.1436 0.2836 0.0614 67 VAL H CB 3152 C CG1 . VAL B 68 ? 1.6694 1.2776 1.1096 0.1590 0.3327 0.0774 67 VAL H CG1 3153 C CG2 . VAL B 68 ? 1.3617 1.0067 0.7363 0.1341 0.2458 0.0584 67 VAL H CG2 3154 N N . THR B 69 ? 1.7761 1.2697 0.9254 0.1421 0.2588 0.0025 68 THR H N 3155 C CA . THR B 69 ? 1.8402 1.2872 0.8883 0.1468 0.2561 -0.0037 68 THR H CA 3156 C C . THR B 69 ? 1.8023 1.2949 0.8577 0.1474 0.2071 0.0032 68 THR H C 3157 O O . THR B 69 ? 1.8569 1.3904 0.9265 0.1398 0.1610 -0.0106 68 THR H O 3158 C CB . THR B 69 ? 1.9916 1.3766 0.9336 0.1390 0.2427 -0.0322 68 THR H CB 3159 O OG1 . THR B 69 ? 2.1464 1.4750 1.0700 0.1397 0.2918 -0.0457 68 THR H OG1 3160 C CG2 . THR B 69 ? 2.1051 1.4370 0.9371 0.1419 0.2348 -0.0321 68 THR H CG2 3161 N N . MET B 70 ? 1.8056 1.2843 0.8426 0.1557 0.2171 0.0211 69 MET H N 3162 C CA . MET B 70 ? 1.8230 1.3307 0.8619 0.1612 0.1693 0.0244 69 MET H CA 3163 C C . MET B 70 ? 1.8699 1.3071 0.7925 0.1690 0.1488 0.0228 69 MET H C 3164 O O . MET B 70 ? 1.9246 1.2923 0.7726 0.1672 0.1850 0.0340 69 MET H O 3165 C CB . MET B 70 ? 1.8019 1.3468 0.9138 0.1619 0.1836 0.0479 69 MET H CB 3166 C CG . MET B 70 ? 1.6843 1.3041 0.9063 0.1510 0.1864 0.0518 69 MET H CG 3167 S SD . MET B 70 ? 1.6705 1.3302 0.9757 0.1441 0.2079 0.0808 69 MET H SD 3168 C CE . MET B 70 ? 1.1621 0.8972 0.5697 0.1269 0.1982 0.0837 69 MET H CE 3169 N N . THR B 71 ? 1.8867 1.3453 0.7985 0.1769 0.0892 0.0105 70 THR H N 3170 C CA . THR B 71 ? 2.0431 1.4360 0.8471 0.1862 0.0539 0.0117 70 THR H CA 3171 C C . THR B 71 ? 2.1028 1.5394 0.9510 0.2059 -0.0042 0.0102 70 THR H C 3172 O O . THR B 71 ? 2.0053 1.5201 0.9588 0.2080 -0.0071 0.0045 70 THR H O 3173 C CB . THR B 71 ? 2.1208 1.4828 0.8471 0.1762 0.0321 -0.0107 70 THR H CB 3174 O OG1 . THR B 71 ? 2.0176 1.4615 0.8205 0.1717 -0.0033 -0.0344 70 THR H OG1 3175 C CG2 . THR B 71 ? 2.1860 1.4897 0.8571 0.1594 0.0934 -0.0151 70 THR H CG2 3176 N N . ARG B 72 ? 2.2131 1.5939 0.9808 0.2209 -0.0479 0.0170 71 ARG H N 3177 C CA . ARG B 72 ? 2.1402 1.5648 0.9601 0.2471 -0.1092 0.0095 71 ARG H CA 3178 C C . ARG B 72 ? 2.1972 1.5722 0.9279 0.2611 -0.1729 0.0084 71 ARG H C 3179 O O . ARG B 72 ? 2.2680 1.5499 0.8730 0.2490 -0.1660 0.0233 71 ARG H O 3180 C CB . ARG B 72 ? 2.0873 1.4957 0.9376 0.2608 -0.0993 0.0298 71 ARG H CB 3181 C CG . ARG B 72 ? 2.1760 1.4751 0.9164 0.2713 -0.1173 0.0577 71 ARG H CG 3182 C CD . ARG B 72 ? 2.2019 1.4225 0.8422 0.2434 -0.0612 0.0773 71 ARG H CD 3183 N NE . ARG B 72 ? 2.3139 1.4212 0.8334 0.2433 -0.0712 0.1075 71 ARG H NE 3184 C CZ . ARG B 72 ? 2.3961 1.4334 0.8153 0.2192 -0.0530 0.1156 71 ARG H CZ 3185 N NH1 . ARG B 72 ? 2.5571 1.5080 0.8986 0.2089 -0.0608 0.1405 71 ARG H NH1 3186 N NH2 . ARG B 72 ? 2.4714 1.5330 0.8885 0.2002 -0.0231 0.0950 71 ARG H NH2 3187 N N . ASP B 73 ? 2.2276 1.6640 1.0238 0.2866 -0.2350 -0.0087 72 ASP H N 3188 C CA . ASP B 73 ? 2.4174 1.8192 1.1521 0.3070 -0.3096 -0.0075 72 ASP H CA 3189 C C . ASP B 73 ? 2.3694 1.7708 1.1533 0.3484 -0.3526 0.0003 72 ASP H C 3190 O O . ASP B 73 ? 2.2077 1.7082 1.1189 0.3694 -0.3714 -0.0262 72 ASP H O 3191 C CB . ASP B 73 ? 2.4802 1.9695 1.2639 0.3003 -0.3508 -0.0415 72 ASP H CB 3192 C CG . ASP B 73 ? 2.6399 2.1017 1.3644 0.3194 -0.4369 -0.0397 72 ASP H CG 3193 O OD1 . ASP B 73 ? 2.7100 2.1002 1.3829 0.3485 -0.4772 -0.0142 72 ASP H OD1 3194 O OD2 . ASP B 73 ? 2.6699 2.1811 1.4001 0.3035 -0.4692 -0.0629 72 ASP H OD2 3195 N N . THR B 74 ? 2.4800 1.7642 1.1596 0.3573 -0.3620 0.0356 73 THR H N 3196 C CA . THR B 74 ? 2.5127 1.7637 1.2183 0.3948 -0.3968 0.0489 73 THR H CA 3197 C C . THR B 74 ? 2.6156 1.8986 1.3623 0.4380 -0.4889 0.0352 73 THR H C 3198 O O . THR B 74 ? 2.6822 1.9859 1.5107 0.4785 -0.5199 0.0273 73 THR H O 3199 C CB . THR B 74 ? 2.4692 1.5692 1.0310 0.3854 -0.3859 0.0952 73 THR H CB 3200 O OG1 . THR B 74 ? 2.6482 1.6812 1.0985 0.3670 -0.4136 0.1094 73 THR H OG1 3201 C CG2 . THR B 74 ? 2.3156 1.3940 0.8571 0.3463 -0.2946 0.1080 73 THR H CG2 3202 N N . SER B 75 ? 2.6196 1.9095 1.3155 0.4300 -0.5330 0.0296 74 SER H N 3203 C CA . SER B 75 ? 2.5851 1.9139 1.3257 0.4700 -0.6275 0.0179 74 SER H CA 3204 C C . SER B 75 ? 2.3163 1.8021 1.2462 0.4945 -0.6338 -0.0290 74 SER H C 3205 O O . SER B 75 ? 2.2861 1.8201 1.2985 0.5407 -0.7024 -0.0438 74 SER H O 3206 C CB . SER B 75 ? 2.6676 1.9984 1.3515 0.4362 -0.6544 0.0160 74 SER H CB 3207 O OG . SER B 75 ? 2.8023 2.0131 1.3423 0.3936 -0.6176 0.0490 74 SER H OG 3208 N N . ILE B 76 ? 2.1196 1.6861 1.1172 0.4618 -0.5623 -0.0531 75 ILE H N 3209 C CA . ILE B 76 ? 1.9674 1.6795 1.1309 0.4725 -0.5533 -0.0979 75 ILE H CA 3210 C C . ILE B 76 ? 1.9586 1.6887 1.1758 0.4598 -0.4789 -0.1027 75 ILE H C 3211 O O . ILE B 76 ? 1.8850 1.7306 1.2143 0.4483 -0.4518 -0.1383 75 ILE H O 3212 C CB . ILE B 76 ? 1.8469 1.6617 1.0509 0.4368 -0.5514 -0.1282 75 ILE H CB 3213 C CG1 . ILE B 76 ? 1.8381 1.5894 0.9353 0.3847 -0.4925 -0.1097 75 ILE H CG1 3214 C CG2 . ILE B 76 ? 1.8652 1.6957 1.0535 0.4525 -0.6368 -0.1333 75 ILE H CG2 3215 C CD1 . ILE B 76 ? 1.8506 1.6906 0.9893 0.3428 -0.4732 -0.1390 75 ILE H CD1 3216 N N . SER B 77 ? 2.0432 1.6612 1.1797 0.4586 -0.4489 -0.0673 76 SER H N 3217 C CA . SER B 77 ? 1.9561 1.5824 1.1368 0.4448 -0.3848 -0.0677 76 SER H CA 3218 C C . SER B 77 ? 1.7204 1.4417 0.9620 0.4014 -0.3269 -0.0887 76 SER H C 3219 O O . SER B 77 ? 1.6874 1.4836 1.0230 0.3975 -0.3006 -0.1124 76 SER H O 3220 C CB . SER B 77 ? 2.0287 1.6869 1.3059 0.4877 -0.4075 -0.0904 76 SER H CB 3221 O OG . SER B 77 ? 2.2519 1.8060 1.4695 0.5295 -0.4631 -0.0663 76 SER H OG 3222 N N . THR B 78 ? 1.6835 1.3924 0.8635 0.3676 -0.3085 -0.0794 77 THR H N 3223 C CA . THR B 78 ? 1.5544 1.3369 0.7807 0.3270 -0.2615 -0.0947 77 THR H CA 3224 C C . THR B 78 ? 1.6319 1.3492 0.7880 0.2935 -0.2024 -0.0662 77 THR H C 3225 O O . THR B 78 ? 1.8556 1.4848 0.9085 0.2904 -0.2013 -0.0442 77 THR H O 3226 C CB . THR B 78 ? 1.7442 1.5904 0.9838 0.3142 -0.2943 -0.1202 77 THR H CB 3227 O OG1 . THR B 78 ? 1.6443 1.5680 0.9648 0.3454 -0.3505 -0.1499 77 THR H OG1 3228 C CG2 . THR B 78 ? 1.6973 1.6090 0.9791 0.2698 -0.2502 -0.1347 77 THR H CG2 3229 N N . ALA B 79 ? 1.5951 1.3518 0.8059 0.2695 -0.1533 -0.0656 78 ALA H N 3230 C CA . ALA B 79 ? 1.6167 1.3289 0.7848 0.2411 -0.0994 -0.0424 78 ALA H CA 3231 C C . ALA B 79 ? 1.5476 1.3107 0.7410 0.2118 -0.0855 -0.0583 78 ALA H C 3232 O O . ALA B 79 ? 1.5689 1.4178 0.8320 0.2034 -0.1044 -0.0849 78 ALA H O 3233 C CB . ALA B 79 ? 1.6055 1.3185 0.8140 0.2322 -0.0586 -0.0246 78 ALA H CB 3234 N N . TYR B 80 ? 1.5402 1.2480 0.6754 0.1952 -0.0523 -0.0449 79 TYR H N 3235 C CA . TYR B 80 ? 1.4783 1.2170 0.6294 0.1685 -0.0426 -0.0600 79 TYR H CA 3236 C C . TYR B 80 ? 1.5042 1.2151 0.6643 0.1537 0.0127 -0.0395 79 TYR H C 3237 O O . TYR B 80 ? 1.5634 1.2078 0.6758 0.1620 0.0445 -0.0189 79 TYR H O 3238 C CB . TYR B 80 ? 1.5362 1.2253 0.5999 0.1650 -0.0640 -0.0718 79 TYR H CB 3239 C CG . TYR B 80 ? 1.6538 1.3706 0.7096 0.1806 -0.1266 -0.0898 79 TYR H CG 3240 C CD1 . TYR B 80 ? 1.6283 1.4388 0.7550 0.1693 -0.1596 -0.1189 79 TYR H CD1 3241 C CD2 . TYR B 80 ? 1.7564 1.4057 0.7349 0.2055 -0.1545 -0.0763 79 TYR H CD2 3242 C CE1 . TYR B 80 ? 1.7111 1.5587 0.8477 0.1874 -0.2196 -0.1367 79 TYR H CE1 3243 C CE2 . TYR B 80 ? 1.7741 1.4475 0.7519 0.2248 -0.2201 -0.0896 79 TYR H CE2 3244 C CZ . TYR B 80 ? 1.7639 1.5417 0.8280 0.2179 -0.2527 -0.1210 79 TYR H CZ 3245 O OH . TYR B 80 ? 1.7755 1.5891 0.8559 0.2404 -0.3201 -0.1356 79 TYR H OH 3246 N N . MET B 81 ? 1.4680 1.2286 0.6877 0.1302 0.0231 -0.0453 80 MET H N 3247 C CA . MET B 81 ? 1.5243 1.2625 0.7640 0.1184 0.0667 -0.0267 80 MET H CA 3248 C C . MET B 81 ? 1.5343 1.2604 0.7600 0.0974 0.0677 -0.0408 80 MET H C 3249 O O . MET B 81 ? 1.5902 1.3701 0.8451 0.0762 0.0406 -0.0582 80 MET H O 3250 C CB . MET B 81 ? 1.5963 1.3943 0.9217 0.1086 0.0747 -0.0114 80 MET H CB 3251 C CG . MET B 81 ? 1.6541 1.4425 1.0221 0.0994 0.1108 0.0144 80 MET H CG 3252 S SD . MET B 81 ? 1.6824 1.4664 1.0692 0.0755 0.1150 0.0127 80 MET H SD 3253 C CE . MET B 81 ? 1.5195 1.3895 0.9448 0.0430 0.0758 -0.0045 80 MET H CE 3254 N N . GLU B 82 ? 1.5149 1.1664 0.6883 0.1014 0.0987 -0.0380 81 GLU H N 3255 C CA . GLU B 82 ? 1.5960 1.2193 0.7523 0.0821 0.1030 -0.0520 81 GLU H CA 3256 C C . GLU B 82 ? 1.7043 1.3051 0.9085 0.0827 0.1425 -0.0328 81 GLU H C 3257 O O . GLU B 82 ? 1.7947 1.3625 1.0013 0.1033 0.1809 -0.0178 81 GLU H O 3258 C CB . GLU B 82 ? 1.7743 1.3218 0.8261 0.0837 0.1033 -0.0728 81 GLU H CB 3259 C CG . GLU B 82 ? 1.8427 1.3510 0.8726 0.0611 0.1083 -0.0903 81 GLU H CG 3260 C CD . GLU B 82 ? 2.0612 1.5012 0.9803 0.0545 0.0987 -0.1162 81 GLU H CD 3261 O OE1 . GLU B 82 ? 2.1554 1.5578 1.0090 0.0720 0.1054 -0.1137 81 GLU H OE1 3262 O OE2 . GLU B 82 ? 2.1335 1.5540 1.0236 0.0277 0.0822 -0.1381 81 GLU H OE2 3263 N N . LEU B 83 ? 1.6492 1.2720 0.8980 0.0595 0.1316 -0.0310 82 LEU H N 3264 C CA . LEU B 83 ? 1.5999 1.1951 0.8981 0.0636 0.1603 -0.0101 82 LEU H CA 3265 C C . LEU B 83 ? 1.7322 1.2593 0.9885 0.0505 0.1636 -0.0279 82 LEU H C 3266 O O . LEU B 83 ? 1.8557 1.3959 1.0940 0.0185 0.1321 -0.0423 82 LEU H O 3267 C CB . LEU B 83 ? 1.5381 1.2014 0.9202 0.0465 0.1430 0.0156 82 LEU H CB 3268 C CG . LEU B 83 ? 1.5393 1.1792 0.9827 0.0533 0.1619 0.0439 82 LEU H CG 3269 C CD1 . LEU B 83 ? 1.5300 1.1490 0.9963 0.0902 0.2041 0.0555 82 LEU H CD1 3270 C CD2 . LEU B 83 ? 1.3477 1.0529 0.8558 0.0285 0.1356 0.0704 82 LEU H CD2 3271 N N . SER B 84 A 1.7883 1.2404 1.0243 0.0740 0.2050 -0.0312 82 SER H N 3272 C CA . SER B 84 A 1.9685 1.3363 1.1535 0.0664 0.2153 -0.0535 82 SER H CA 3273 C C . SER B 84 A 1.9867 1.3247 1.2377 0.0694 0.2247 -0.0351 82 SER H C 3274 O O . SER B 84 A 1.8872 1.2698 1.2256 0.0818 0.2271 -0.0028 82 SER H O 3275 C CB . SER B 84 A 2.0876 1.3793 1.1991 0.0906 0.2602 -0.0758 82 SER H CB 3276 O OG . SER B 84 A 2.1969 1.5007 1.2330 0.0864 0.2453 -0.0892 82 SER H OG 3277 N N . ARG B 85 B 2.0032 1.2630 1.2102 0.0553 0.2239 -0.0544 82 ARG H N 3278 C CA . ARG B 85 B 1.9920 1.1985 1.2517 0.0628 0.2313 -0.0384 82 ARG H CA 3279 C C . ARG B 85 B 1.9892 1.2639 1.3320 0.0455 0.1956 0.0029 82 ARG H C 3280 O O . ARG B 85 B 1.9926 1.2808 1.4204 0.0714 0.2055 0.0339 82 ARG H O 3281 C CB . ARG B 85 B 1.9994 1.1581 1.2974 0.1129 0.2866 -0.0394 82 ARG H CB 3282 C CG . ARG B 85 B 2.1980 1.2781 1.4018 0.1251 0.3284 -0.0829 82 ARG H CG 3283 C CD . ARG B 85 B 2.3729 1.3857 1.6224 0.1688 0.3840 -0.0907 82 ARG H CD 3284 N NE . ARG B 85 B 2.3420 1.4247 1.7126 0.2023 0.4023 -0.0568 82 ARG H NE 3285 C CZ . ARG B 85 B 2.3591 1.4943 1.7424 0.2188 0.4354 -0.0544 82 ARG H CZ 3286 N NH1 . ARG B 85 B 2.4332 1.5492 1.7086 0.2081 0.4545 -0.0823 82 ARG H NH1 3287 N NH2 . ARG B 85 B 2.3165 1.5172 1.8176 0.2441 0.4486 -0.0231 82 ARG H NH2 3288 N N . LEU B 86 C 1.9188 1.2441 1.2375 -0.0004 0.1544 0.0021 82 LEU H N 3289 C CA . LEU B 86 C 1.7934 1.1914 1.1725 -0.0250 0.1229 0.0364 82 LEU H CA 3290 C C . LEU B 86 C 1.8892 1.2367 1.3096 -0.0329 0.1090 0.0691 82 LEU H C 3291 O O . LEU B 86 C 1.9514 1.2085 1.3356 -0.0426 0.1073 0.0600 82 LEU H O 3292 C CB . LEU B 86 C 1.7185 1.1781 1.0592 -0.0757 0.0891 0.0201 82 LEU H CB 3293 C CG . LEU B 86 C 1.6519 1.1789 0.9782 -0.0604 0.0933 -0.0008 82 LEU H CG 3294 C CD1 . LEU B 86 C 1.6475 1.2288 0.9374 -0.1017 0.0630 -0.0286 82 LEU H CD1 3295 C CD2 . LEU B 86 C 1.5740 1.1718 0.9664 -0.0414 0.0972 0.0257 82 LEU H CD2 3296 N N . ARG B 87 ? 1.8637 1.2645 1.3564 -0.0304 0.0950 0.1084 83 ARG H N 3297 C CA . ARG B 87 ? 1.8561 1.2157 1.3879 -0.0411 0.0700 0.1472 83 ARG H CA 3298 C C . ARG B 87 ? 1.8700 1.2961 1.3911 -0.0996 0.0308 0.1667 83 ARG H C 3299 O O . ARG B 87 ? 1.9013 1.4152 1.4166 -0.1142 0.0305 0.1535 83 ARG H O 3300 C CB . ARG B 87 ? 1.9552 1.3149 1.5823 0.0092 0.0825 0.1793 83 ARG H CB 3301 C CG . ARG B 87 ? 2.1098 1.4021 1.7479 0.0649 0.1303 0.1535 83 ARG H CG 3302 C CD . ARG B 87 ? 2.1456 1.4926 1.8661 0.1126 0.1633 0.1626 83 ARG H CD 3303 N NE . ARG B 87 ? 2.2069 1.5809 2.0266 0.1211 0.1341 0.2123 83 ARG H NE 3304 C CZ . ARG B 87 ? 2.3414 1.6551 2.2293 0.1567 0.1343 0.2301 83 ARG H CZ 3305 N NH1 . ARG B 87 ? 2.4572 1.6762 2.3209 0.1864 0.1683 0.1977 83 ARG H NH1 3306 N NH2 . ARG B 87 ? 2.3494 1.6941 2.3296 0.1630 0.0981 0.2793 83 ARG H NH2 3307 N N . SER B 88 ? 1.9374 1.3158 1.4500 -0.1351 -0.0012 0.1959 84 SER H N 3308 C CA . SER B 88 ? 1.9084 1.3424 1.4016 -0.1986 -0.0354 0.2162 84 SER H CA 3309 C C . SER B 88 ? 1.8746 1.4038 1.4212 -0.1955 -0.0427 0.2398 84 SER H C 3310 O O . SER B 88 ? 1.8140 1.4214 1.3367 -0.2370 -0.0493 0.2277 84 SER H O 3311 C CB . SER B 88 ? 1.9465 1.2931 1.4184 -0.2343 -0.0700 0.2533 84 SER H CB 3312 O OG . SER B 88 ? 1.9621 1.2507 1.5007 -0.1843 -0.0768 0.2904 84 SER H OG 3313 N N . ASP B 89 ? 1.8939 1.4227 1.5149 -0.1467 -0.0380 0.2674 85 ASP H N 3314 C CA . ASP B 89 ? 1.9034 1.5225 1.5703 -0.1483 -0.0451 0.2865 85 ASP H CA 3315 C C . ASP B 89 ? 1.7871 1.4771 1.4547 -0.1268 -0.0125 0.2491 85 ASP H C 3316 O O . ASP B 89 ? 1.7551 1.5107 1.4596 -0.1236 -0.0134 0.2604 85 ASP H O 3317 C CB . ASP B 89 ? 2.0106 1.6179 1.7663 -0.1107 -0.0577 0.3321 85 ASP H CB 3318 C CG . ASP B 89 ? 2.1210 1.7074 1.9371 -0.0393 -0.0159 0.3171 85 ASP H CG 3319 O OD1 . ASP B 89 ? 2.1974 1.7889 1.9824 -0.0188 0.0238 0.2743 85 ASP H OD1 3320 O OD2 . ASP B 89 ? 2.1771 1.7458 2.0758 -0.0040 -0.0233 0.3494 85 ASP H OD2 3321 N N . ASP B 90 ? 1.7800 1.4501 1.4018 -0.1145 0.0123 0.2062 86 ASP H N 3322 C CA . ASP B 90 ? 1.7404 1.4706 1.3436 -0.1048 0.0318 0.1706 86 ASP H CA 3323 C C . ASP B 90 ? 1.7961 1.5890 1.3596 -0.1578 0.0133 0.1504 86 ASP H C 3324 O O . ASP B 90 ? 1.6060 1.4546 1.1596 -0.1517 0.0224 0.1202 86 ASP H O 3325 C CB . ASP B 90 ? 1.7472 1.4272 1.3141 -0.0691 0.0614 0.1354 86 ASP H CB 3326 C CG . ASP B 90 ? 1.7396 1.3751 1.3491 -0.0140 0.0935 0.1458 86 ASP H CG 3327 O OD1 . ASP B 90 ? 1.6672 1.3434 1.3381 0.0053 0.1002 0.1691 86 ASP H OD1 3328 O OD2 . ASP B 90 ? 1.8017 1.3632 1.3826 0.0078 0.1151 0.1271 86 ASP H OD2 3329 N N . THR B 91 ? 2.1270 1.9099 1.6693 -0.2099 -0.0120 0.1668 87 THR H N 3336 N N . ALA B 92 ? 1.9919 2.1148 1.2418 -0.2523 -0.0120 0.1797 88 ALA H N 3337 C CA . ALA B 92 ? 1.7358 1.8285 0.9476 -0.2399 -0.0276 0.1611 88 ALA H CA 3338 C C . ALA B 92 ? 1.5535 1.6898 0.7543 -0.1944 -0.0035 0.0826 88 ALA H C 3339 O O . ALA B 92 ? 1.3481 1.5399 0.5822 -0.1626 0.0214 0.0429 88 ALA H O 3340 C CB . ALA B 92 ? 1.6915 1.7133 0.9495 -0.2085 -0.0548 0.2058 88 ALA H CB 3341 N N . VAL B 93 ? 1.6371 1.7500 0.7932 -0.1923 -0.0138 0.0560 89 VAL H N 3342 C CA . VAL B 93 ? 1.6348 1.7670 0.7959 -0.1335 -0.0009 -0.0127 89 VAL H CA 3343 C C . VAL B 93 ? 1.6512 1.7070 0.8446 -0.0759 -0.0217 0.0123 89 VAL H C 3344 O O . VAL B 93 ? 1.7291 1.7155 0.9162 -0.0921 -0.0461 0.0584 89 VAL H O 3345 C CB . VAL B 93 ? 1.5533 1.6983 0.6513 -0.1560 0.0039 -0.0660 89 VAL H CB 3346 C CG1 . VAL B 93 ? 1.4234 1.5834 0.5391 -0.0873 0.0129 -0.1394 89 VAL H CG1 3347 C CG2 . VAL B 93 ? 1.5183 1.7364 0.5766 -0.2168 0.0329 -0.0923 89 VAL H CG2 3348 N N . TYR B 94 ? 1.5054 1.5728 0.7332 -0.0128 -0.0125 -0.0152 90 TYR H N 3349 C CA . TYR B 94 ? 1.4882 1.4767 0.7300 0.0402 -0.0270 0.0065 90 TYR H CA 3350 C C . TYR B 94 ? 1.5742 1.5448 0.7907 0.0907 -0.0326 -0.0536 90 TYR H C 3351 O O . TYR B 94 ? 1.6694 1.7062 0.8945 0.1214 -0.0217 -0.1169 90 TYR H O 3352 C CB . TYR B 94 ? 1.5245 1.5184 0.8079 0.0757 -0.0185 0.0258 90 TYR H CB 3353 C CG . TYR B 94 ? 1.5240 1.5172 0.8406 0.0302 -0.0154 0.0881 90 TYR H CG 3354 C CD1 . TYR B 94 ? 1.4810 1.5417 0.8062 -0.0176 -0.0042 0.0883 90 TYR H CD1 3355 C CD2 . TYR B 94 ? 1.5268 1.4492 0.8683 0.0322 -0.0227 0.1449 90 TYR H CD2 3356 C CE1 . TYR B 94 ? 1.4721 1.5226 0.8288 -0.0570 -0.0068 0.1455 90 TYR H CE1 3357 C CE2 . TYR B 94 ? 1.5895 1.5137 0.9742 -0.0058 -0.0224 0.1964 90 TYR H CE2 3358 C CZ . TYR B 94 ? 1.5174 1.5021 0.9092 -0.0479 -0.0178 0.1978 90 TYR H CZ 3359 O OH . TYR B 94 ? 1.4276 1.4045 0.8646 -0.0812 -0.0224 0.2493 90 TYR H OH 3360 N N . TYR B 95 ? 1.5458 1.4288 0.7385 0.0985 -0.0503 -0.0371 91 TYR H N 3361 C CA . TYR B 95 ? 1.5619 1.4040 0.7285 0.1471 -0.0602 -0.0888 91 TYR H CA 3362 C C . TYR B 95 ? 1.5570 1.2960 0.7184 0.1995 -0.0737 -0.0609 91 TYR H C 3363 O O . TYR B 95 ? 1.5024 1.1807 0.6706 0.1774 -0.0754 0.0015 91 TYR H O 3364 C CB . TYR B 95 ? 1.6273 1.4419 0.7554 0.1088 -0.0692 -0.1051 91 TYR H CB 3365 C CG . TYR B 95 ? 1.6453 1.5430 0.7509 0.0543 -0.0553 -0.1406 91 TYR H CG 3366 C CD1 . TYR B 95 ? 1.6551 1.6180 0.7546 0.0757 -0.0388 -0.2233 91 TYR H CD1 3367 C CD2 . TYR B 95 ? 1.6163 1.5158 0.7000 -0.0194 -0.0616 -0.0950 91 TYR H CD2 3368 C CE1 . TYR B 95 ? 1.6267 1.6625 0.6949 0.0189 -0.0180 -0.2597 91 TYR H CE1 3369 C CE2 . TYR B 95 ? 1.5535 1.5146 0.5935 -0.0752 -0.0491 -0.1250 91 TYR H CE2 3370 C CZ . TYR B 95 ? 1.5854 1.6142 0.6133 -0.0588 -0.0228 -0.2084 91 TYR H CZ 3371 O OH . TYR B 95 ? 1.6336 1.7231 0.6099 -0.1194 -0.0014 -0.2425 91 TYR H OH 3372 N N . CYS B 96 ? 1.5290 1.2381 0.6745 0.2646 -0.0845 -0.1080 92 CYS H N 3373 C CA . CYS B 96 ? 1.6914 1.2764 0.8077 0.3069 -0.1001 -0.0819 92 CYS H CA 3374 C C . CYS B 96 ? 1.8185 1.3329 0.9027 0.3123 -0.1148 -0.1113 92 CYS H C 3375 O O . CYS B 96 ? 1.8766 1.4417 0.9613 0.3214 -0.1167 -0.1768 92 CYS H O 3376 C CB . CYS B 96 ? 1.6413 1.2119 0.7509 0.3817 -0.1109 -0.0995 92 CYS H CB 3377 S SG . CYS B 96 ? 1.8626 1.4787 0.9791 0.4541 -0.1316 -0.1958 92 CYS H SG 3378 N N . ALA B 97 ? 1.8872 1.2877 0.9474 0.3018 -0.1214 -0.0662 93 ALA H N 3379 C CA . ALA B 97 ? 1.8092 1.1368 0.8414 0.2946 -0.1345 -0.0889 93 ALA H CA 3380 C C . ALA B 97 ? 1.9027 1.0838 0.8968 0.3311 -0.1461 -0.0634 93 ALA H C 3381 O O . ALA B 97 ? 1.9330 1.0626 0.9198 0.3371 -0.1380 -0.0098 93 ALA H O 3382 C CB . ALA B 97 ? 1.7852 1.1291 0.8289 0.2150 -0.1308 -0.0607 93 ALA H CB 3383 N N . ARG B 98 ? 1.9949 1.1041 0.9603 0.3514 -0.1626 -0.1032 94 ARG H N 3384 C CA . ARG B 98 ? 2.1064 1.0619 1.0253 0.3883 -0.1762 -0.0847 94 ARG H CA 3385 C C . ARG B 98 ? 2.3805 1.2517 1.2840 0.3492 -0.1819 -0.0889 94 ARG H C 3386 O O . ARG B 98 ? 2.1730 1.1015 1.0906 0.3187 -0.1845 -0.1325 94 ARG H O 3387 C CB . ARG B 98 ? 2.2144 1.1436 1.1103 0.4766 -0.2008 -0.1377 94 ARG H CB 3388 C CG . ARG B 98 ? 2.3030 1.0635 1.1356 0.5244 -0.2197 -0.1086 94 ARG H CG 3389 C CD . ARG B 98 ? 2.6812 1.3289 1.4871 0.5195 -0.2329 -0.1310 94 ARG H CD 3390 N NE . ARG B 98 ? 2.7505 1.3167 1.5252 0.6033 -0.2686 -0.1795 94 ARG H NE 3391 C CZ . ARG B 98 ? 2.8160 1.3067 1.5797 0.6166 -0.2853 -0.2254 94 ARG H CZ 3392 N NH1 . ARG B 98 ? 2.7987 1.2881 1.5745 0.5481 -0.2691 -0.2295 94 ARG H NH1 3393 N NH2 . ARG B 98 ? 2.7444 1.1591 1.4871 0.6997 -0.3219 -0.2693 94 ARG H NH2 3394 N N . GLY B 99 ? 2.5050 1.2364 1.3743 0.3473 -0.1822 -0.0448 95 GLY H N 3395 C CA . GLY B 99 ? 2.5207 1.1615 1.3794 0.3051 -0.1863 -0.0435 95 GLY H CA 3396 C C . GLY B 99 ? 2.5996 1.1811 1.4293 0.3441 -0.2100 -0.1123 95 GLY H C 3397 O O . GLY B 99 ? 2.4883 1.0611 1.3000 0.4173 -0.2265 -0.1535 95 GLY H O 3398 N N . LYS B 100 ? 2.6640 1.2091 1.4957 0.2954 -0.2141 -0.1295 96 LYS H N 3399 C CA . LYS B 100 ? 2.6919 1.1858 1.5015 0.3241 -0.2338 -0.2023 96 LYS H CA 3400 C C . LYS B 100 ? 2.8360 1.1656 1.5963 0.3896 -0.2517 -0.2036 96 LYS H C 3401 O O . LYS B 100 ? 2.7960 1.0034 1.5255 0.3761 -0.2461 -0.1425 96 LYS H O 3402 C CB . LYS B 100 ? 2.6911 1.1655 1.5068 0.2508 -0.2356 -0.2136 96 LYS H CB 3403 C CG . LYS B 100 ? 2.7088 1.2187 1.5168 0.2583 -0.2470 -0.3040 96 LYS H CG 3404 C CD . LYS B 100 ? 2.8023 1.1835 1.5862 0.2332 -0.2604 -0.3260 96 LYS H CD 3405 C CE . LYS B 100 ? 3.1612 1.5364 1.9293 0.2739 -0.2718 -0.4249 96 LYS H CE 3406 N NZ . LYS B 100 ? 3.0200 1.5611 1.8069 0.2831 -0.2599 -0.4805 96 LYS H NZ 3407 N N . TYR B 101 ? 3.0278 1.3518 1.7811 0.4589 -0.2731 -0.2755 97 TYR H N 3408 C CA . TYR B 101 ? 3.2993 1.4613 2.0049 0.5303 -0.3003 -0.2834 97 TYR H CA 3409 C C . TYR B 101 ? 3.5349 1.5430 2.2081 0.4939 -0.3045 -0.2777 97 TYR H C 3410 O O . TYR B 101 ? 3.5833 1.6285 2.2792 0.4406 -0.2981 -0.3148 97 TYR H O 3411 C CB . TYR B 101 ? 3.3907 1.5967 2.1171 0.6133 -0.3253 -0.3736 97 TYR H CB 3412 C CG . TYR B 101 ? 3.6728 1.7028 2.3534 0.6931 -0.3633 -0.3866 97 TYR H CG 3413 C CD1 . TYR B 101 ? 3.7414 1.7326 2.3984 0.7388 -0.3807 -0.3305 97 TYR H CD1 3414 C CD2 . TYR B 101 ? 3.7897 1.7491 2.4764 0.7002 -0.3770 -0.4410 97 TYR H CD2 3415 C CE1 . TYR B 101 ? 3.8751 1.7800 2.5195 0.7809 -0.4110 -0.3227 97 TYR H CE1 3416 C CE2 . TYR B 101 ? 3.9039 1.7746 2.5887 0.7468 -0.4050 -0.4321 97 TYR H CE2 3417 C CZ . TYR B 101 ? 3.9325 1.7740 2.5925 0.7867 -0.4236 -0.3724 97 TYR H CZ 3418 O OH . TYR B 101 ? 4.0342 1.7809 2.6797 0.8297 -0.4556 -0.3645 97 TYR H OH 3419 N N . CYS B 102 ? 3.7305 1.5602 2.3441 0.5196 -0.3158 -0.2317 98 CYS H N 3420 C CA . CYS B 102 ? 3.9156 1.5812 2.4953 0.4857 -0.3190 -0.2256 98 CYS H CA 3421 C C . CYS B 102 ? 3.9923 1.5609 2.5444 0.5245 -0.3319 -0.1880 98 CYS H C 3422 O O . CYS B 102 ? 3.9795 1.5565 2.5381 0.5983 -0.3620 -0.2284 98 CYS H O 3423 C CB . CYS B 102 ? 3.9067 1.5759 2.5026 0.3838 -0.2855 -0.1621 98 CYS H CB 3424 S SG . CYS B 102 ? 3.4937 1.3993 2.1684 0.3196 -0.2606 -0.1538 98 CYS H SG 3425 N N . TYR B 107 D 3.5063 1.1834 2.1288 0.2158 -0.1615 0.1113 99 TYR H N 3426 C CA . TYR B 107 D 3.4325 1.1996 2.0880 0.2089 -0.1779 0.0722 99 TYR H CA 3427 C C . TYR B 107 D 3.2829 1.1706 2.0153 0.1376 -0.1466 0.1149 99 TYR H C 3428 O O . TYR B 107 D 3.1638 1.0347 1.8939 0.1220 -0.1145 0.1721 99 TYR H O 3429 C CB . TYR B 107 D 3.3607 1.2247 2.0077 0.2876 -0.2004 0.0342 99 TYR H CB 3430 C CG . TYR B 107 D 3.2109 1.1086 1.8389 0.3158 -0.1844 0.0827 99 TYR H CG 3431 C CD1 . TYR B 107 D 3.0221 1.0754 1.7139 0.2820 -0.1626 0.1035 99 TYR H CD1 3432 C CD2 . TYR B 107 D 3.3113 1.1542 1.8907 0.3631 -0.1884 0.1018 99 TYR H CD2 3433 C CE1 . TYR B 107 D 3.0073 1.0901 1.6821 0.3063 -0.1469 0.1427 99 TYR H CE1 3434 C CE2 . TYR B 107 D 3.2847 1.1960 1.8602 0.3784 -0.1724 0.1367 99 TYR H CE2 3435 C CZ . TYR B 107 D 3.1384 1.1560 1.7563 0.3529 -0.1510 0.1561 99 TYR H CZ 3436 O OH . TYR B 107 D 3.0547 1.1430 1.6734 0.3655 -0.1337 0.1841 99 TYR H OH 3437 N N . TYR B 108 ? 3.2268 1.2411 2.0295 0.0942 -0.1570 0.0842 100 TYR H N 3438 C CA . TYR B 108 ? 3.0701 1.2038 1.9554 0.0305 -0.1385 0.1195 100 TYR H CA 3439 C C . TYR B 108 ? 2.9738 1.2390 1.8853 0.0531 -0.1282 0.1395 100 TYR H C 3440 O O . TYR B 108 ? 2.9789 1.3179 1.9550 0.0096 -0.1081 0.1794 100 TYR H O 3441 C CB . TYR B 108 ? 2.9533 1.2026 1.8904 -0.0094 -0.1646 0.0770 100 TYR H CB 3442 C CG . TYR B 108 ? 2.8945 1.2532 1.9205 -0.0764 -0.1577 0.1124 100 TYR H CG 3443 C CD1 . TYR B 108 ? 2.9416 1.2729 2.0142 -0.1115 -0.1261 0.1692 100 TYR H CD1 3444 C CD2 . TYR B 108 ? 2.8168 1.3031 1.8790 -0.1047 -0.1835 0.0875 100 TYR H CD2 3445 C CE1 . TYR B 108 ? 2.8685 1.3029 2.0377 -0.1671 -0.1236 0.1970 100 TYR H CE1 3446 C CE2 . TYR B 108 ? 2.7661 1.3448 1.9106 -0.1610 -0.1864 0.1217 100 TYR H CE2 3447 C CZ . TYR B 108 ? 2.7807 1.3358 1.9864 -0.1890 -0.1582 0.1747 100 TYR H CZ 3448 O OH . TYR B 108 ? 2.7374 1.3870 2.0401 -0.2395 -0.1643 0.2046 100 TYR H OH 3449 N N . ASN B 109 ? 2.9118 1.2048 1.7791 0.1228 -0.1430 0.1076 101 ASN H N 3450 C CA . ASN B 109 ? 2.7961 1.1864 1.6716 0.1566 -0.1332 0.1234 101 ASN H CA 3451 C C . ASN B 109 ? 2.6063 1.1613 1.5557 0.1180 -0.1302 0.1274 101 ASN H C 3452 O O . ASN B 109 ? 2.6132 1.2396 1.5791 0.1333 -0.1161 0.1504 101 ASN H O 3453 C CB . ASN B 109 ? 2.8095 1.1228 1.6620 0.1570 -0.1010 0.1858 101 ASN H CB 3454 C CG . ASN B 109 ? 2.6383 1.0270 1.4828 0.2002 -0.0928 0.1986 101 ASN H CG 3455 O OD1 . ASN B 109 ? 2.4342 0.9288 1.3400 0.1692 -0.0744 0.2223 101 ASN H OD1 3456 N ND2 . ASN B 109 ? 2.6639 0.9983 1.4367 0.2737 -0.1108 0.1800 101 ASN H ND2 3457 N N . TRP B 110 ? 2.5153 1.1253 1.5025 0.0683 -0.1466 0.1045 102 TRP H N 3458 C CA . TRP B 110 ? 2.4358 1.1882 1.4810 0.0300 -0.1507 0.1116 102 TRP H CA 3459 C C . TRP B 110 ? 2.4386 1.2559 1.4623 0.0290 -0.1755 0.0505 102 TRP H C 3460 O O . TRP B 110 ? 2.3007 1.2327 1.3375 0.0226 -0.1786 0.0396 102 TRP H O 3461 C CB . TRP B 110 ? 2.3840 1.1523 1.5003 -0.0435 -0.1507 0.1502 102 TRP H CB 3462 C CG . TRP B 110 ? 2.3071 1.0727 1.4722 -0.0544 -0.1199 0.2079 102 TRP H CG 3463 C CD1 . TRP B 110 ? 2.2897 0.9796 1.4889 -0.0886 -0.0988 0.2422 102 TRP H CD1 3464 C CD2 . TRP B 110 ? 2.1952 1.0390 1.3837 -0.0346 -0.1022 0.2336 102 TRP H CD2 3465 N NE1 . TRP B 110 ? 2.2268 0.9448 1.4687 -0.0904 -0.0659 0.2858 102 TRP H NE1 3466 C CE2 . TRP B 110 ? 2.2005 1.0108 1.4355 -0.0562 -0.0696 0.2814 102 TRP H CE2 3467 C CE3 . TRP B 110 ? 2.0215 0.9607 1.1983 -0.0036 -0.1078 0.2173 102 TRP H CE3 3468 C CZ2 . TRP B 110 ? 2.1015 0.9673 1.3685 -0.0448 -0.0442 0.3116 102 TRP H CZ2 3469 C CZ3 . TRP B 110 ? 1.9191 0.9104 1.1286 0.0063 -0.0854 0.2499 102 TRP H CZ3 3470 C CH2 . TRP B 110 ? 1.9142 0.8678 1.1669 -0.0126 -0.0549 0.2957 102 TRP H CH2 3471 N N . ASP B 111 ? 2.5166 1.2549 1.5034 0.0326 -0.1903 0.0086 103 ASP H N 3472 C CA . ASP B 111 ? 2.4101 1.2022 1.3727 0.0253 -0.2089 -0.0549 103 ASP H CA 3473 C C . ASP B 111 ? 2.2990 1.1563 1.2409 0.0879 -0.2005 -0.0903 103 ASP H C 3474 O O . ASP B 111 ? 2.3382 1.1293 1.2500 0.1519 -0.2007 -0.1172 103 ASP H O 3475 C CB . ASP B 111 ? 2.5958 1.2762 1.5222 0.0273 -0.2231 -0.0986 103 ASP H CB 3476 C CG . ASP B 111 ? 2.7250 1.3556 1.6805 -0.0436 -0.2339 -0.0715 103 ASP H CG 3477 O OD1 . ASP B 111 ? 2.8264 1.5423 1.8234 -0.1008 -0.2437 -0.0463 103 ASP H OD1 3478 O OD2 . ASP B 111 ? 2.7231 1.2265 1.6622 -0.0423 -0.2352 -0.0761 103 ASP H OD2 3479 N N . PHE B 112 ? 2.1471 1.1320 1.1046 0.0684 -0.1967 -0.0961 104 PHE H N 3480 C CA . PHE B 112 ? 2.1000 1.1610 1.0538 0.1208 -0.1846 -0.1254 104 PHE H CA 3481 C C . PHE B 112 ? 2.1456 1.2490 1.0716 0.1479 -0.1864 -0.2125 104 PHE H C 3482 O O . PHE B 112 ? 2.3016 1.5048 1.2218 0.1138 -0.1803 -0.2443 104 PHE H O 3483 C CB . PHE B 112 ? 2.1795 1.3501 1.1682 0.0927 -0.1727 -0.0848 104 PHE H CB 3484 C CG . PHE B 112 ? 2.1223 1.2584 1.1494 0.0765 -0.1655 -0.0073 104 PHE H CG 3485 C CD1 . PHE B 112 ? 2.1111 1.1468 1.1284 0.1198 -0.1572 0.0166 104 PHE H CD1 3486 C CD2 . PHE B 112 ? 2.0887 1.2927 1.1593 0.0228 -0.1651 0.0396 104 PHE H CD2 3487 C CE1 . PHE B 112 ? 2.0264 1.0317 1.0759 0.1036 -0.1414 0.0823 104 PHE H CE1 3488 C CE2 . PHE B 112 ? 1.8175 0.9968 0.9354 0.0123 -0.1535 0.1027 104 PHE H CE2 3489 C CZ . PHE B 112 ? 1.9642 1.0471 1.0714 0.0510 -0.1375 0.1220 104 PHE H CZ 3490 N N . GLN B 113 ? 2.2259 1.2485 1.1346 0.2132 -0.1933 -0.2504 105 GLN H N 3491 C CA . GLN B 113 ? 2.3387 1.3663 1.2306 0.2513 -0.1977 -0.3399 105 GLN H CA 3492 C C . GLN B 113 ? 2.2406 1.3856 1.1577 0.2961 -0.1845 -0.3838 105 GLN H C 3493 O O . GLN B 113 ? 2.2549 1.4793 1.1735 0.2957 -0.1738 -0.4592 105 GLN H O 3494 C CB . GLN B 113 ? 2.5197 1.3967 1.3899 0.3091 -0.2165 -0.3539 105 GLN H CB 3495 C CG . GLN B 113 ? 2.6073 1.4699 1.4703 0.3613 -0.2254 -0.4505 105 GLN H CG 3496 C CD . GLN B 113 ? 2.5731 1.5170 1.4287 0.3102 -0.2134 -0.5155 105 GLN H CD 3497 O OE1 . GLN B 113 ? 2.6437 1.5722 1.4775 0.2372 -0.2149 -0.4928 105 GLN H OE1 3498 N NE2 . GLN B 113 ? 2.5352 1.5684 1.4087 0.3472 -0.2017 -0.6003 105 GLN H NE2 3499 N N . HIS B 114 ? 2.2291 1.3902 1.1672 0.3299 -0.1824 -0.3400 106 HIS H N 3500 C CA . HIS B 114 ? 2.1279 1.3969 1.0980 0.3761 -0.1736 -0.3843 106 HIS H CA 3501 C C . HIS B 114 ? 2.0092 1.3771 1.0045 0.3419 -0.1555 -0.3343 106 HIS H C 3502 O O . HIS B 114 ? 1.9738 1.2953 0.9681 0.3295 -0.1570 -0.2591 106 HIS H O 3503 C CB . HIS B 114 ? 2.1814 1.3748 1.1529 0.4676 -0.1965 -0.3916 106 HIS H CB 3504 C CG . HIS B 114 ? 2.3818 1.4651 1.3324 0.5170 -0.2200 -0.4409 106 HIS H CG 3505 N ND1 . HIS B 114 ? 2.4291 1.5638 1.4035 0.5489 -0.2207 -0.5380 106 HIS H ND1 3506 C CD2 . HIS B 114 ? 2.4541 1.3727 1.3632 0.5413 -0.2424 -0.4079 106 HIS H CD2 3507 C CE1 . HIS B 114 ? 2.5667 1.5708 1.5186 0.5939 -0.2463 -0.5631 106 HIS H CE1 3508 N NE2 . HIS B 114 ? 2.5584 1.4257 1.4663 0.5890 -0.2606 -0.4829 106 HIS H NE2 3509 N N . TRP B 115 ? 1.9975 1.4999 1.0157 0.3232 -0.1350 -0.3796 107 TRP H N 3510 C CA . TRP B 115 ? 1.9493 1.5503 0.9927 0.2893 -0.1165 -0.3416 107 TRP H CA 3511 C C . TRP B 115 ? 2.0118 1.7158 1.0988 0.3390 -0.1062 -0.3960 107 TRP H C 3512 O O . TRP B 115 ? 2.1493 1.9003 1.2535 0.3723 -0.1022 -0.4804 107 TRP H O 3513 C CB . TRP B 115 ? 1.9336 1.5996 0.9586 0.2007 -0.1000 -0.3296 107 TRP H CB 3514 C CG . TRP B 115 ? 1.9508 1.5309 0.9475 0.1490 -0.1162 -0.2706 107 TRP H CG 3515 C CD1 . TRP B 115 ? 2.0365 1.5249 1.0037 0.1467 -0.1327 -0.2857 107 TRP H CD1 3516 C CD2 . TRP B 115 ? 1.8574 1.4348 0.8640 0.0951 -0.1200 -0.1897 107 TRP H CD2 3517 N NE1 . TRP B 115 ? 2.0094 1.4460 0.9699 0.0910 -0.1464 -0.2207 107 TRP H NE1 3518 C CE2 . TRP B 115 ? 1.9075 1.3990 0.8956 0.0610 -0.1400 -0.1615 107 TRP H CE2 3519 C CE3 . TRP B 115 ? 1.7927 1.4317 0.8290 0.0735 -0.1098 -0.1416 107 TRP H CE3 3520 C CZ2 . TRP B 115 ? 1.8061 1.2802 0.8129 0.0086 -0.1516 -0.0897 107 TRP H CZ2 3521 C CZ3 . TRP B 115 ? 1.7958 1.4101 0.8466 0.0238 -0.1208 -0.0692 107 TRP H CZ3 3522 C CH2 . TRP B 115 ? 1.8533 1.3898 0.8935 -0.0071 -0.1425 -0.0447 107 TRP H CH2 3523 N N . GLY B 116 ? 1.9141 1.6576 1.0265 0.3441 -0.1017 -0.3542 108 GLY H N 3524 C CA . GLY B 116 ? 1.8571 1.7226 1.0174 0.3682 -0.0876 -0.4045 108 GLY H CA 3525 C C . GLY B 116 ? 1.7971 1.7772 0.9618 0.2998 -0.0533 -0.4423 108 GLY H C 3526 O O . GLY B 116 ? 1.7453 1.7028 0.8677 0.2327 -0.0462 -0.4132 108 GLY H O 3527 N N . GLN B 117 ? 1.8024 1.9039 1.0148 0.3108 -0.0322 -0.5023 109 GLN H N 3528 C CA . GLN B 117 ? 1.7414 1.9492 0.9487 0.2405 0.0078 -0.5413 109 GLN H CA 3529 C C . GLN B 117 ? 1.6542 1.8825 0.8453 0.1705 0.0208 -0.4652 109 GLN H C 3530 O O . GLN B 117 ? 1.7049 1.9956 0.8707 0.0985 0.0500 -0.4713 109 GLN H O 3531 C CB . GLN B 117 ? 1.7149 2.0509 0.9925 0.2660 0.0334 -0.6344 109 GLN H CB 3532 C CG . GLN B 117 ? 1.6706 2.0946 1.0105 0.2584 0.0474 -0.6200 109 GLN H CG 3533 C CD . GLN B 117 ? 1.6633 2.0686 1.0476 0.3437 0.0115 -0.6156 109 GLN H CD 3534 O OE1 . GLN B 117 ? 1.7176 2.0160 1.0695 0.4033 -0.0267 -0.5939 109 GLN H OE1 3535 N NE2 . GLN B 117 ? 1.5783 2.0779 1.0388 0.3450 0.0222 -0.6310 109 GLN H NE2 3536 N N . GLY B 118 ? 1.5593 1.7325 0.7628 0.1915 -0.0001 -0.3948 110 GLY H N 3537 C CA . GLY B 118 ? 1.5240 1.7154 0.7241 0.1320 0.0105 -0.3274 110 GLY H CA 3538 C C . GLY B 118 ? 1.5762 1.8591 0.8283 0.1389 0.0283 -0.3417 110 GLY H C 3539 O O . GLY B 118 ? 1.5273 1.9007 0.8200 0.1652 0.0442 -0.4181 110 GLY H O 3540 N N . THR B 119 ? 1.6067 1.8637 0.8661 0.1189 0.0238 -0.2697 111 THR H N 3541 C CA . THR B 119 ? 1.5032 1.8381 0.8075 0.1131 0.0408 -0.2747 111 THR H CA 3542 C C . THR B 119 ? 1.5173 1.8496 0.8016 0.0329 0.0530 -0.2109 111 THR H C 3543 O O . THR B 119 ? 1.5319 1.7841 0.8006 0.0174 0.0347 -0.1387 111 THR H O 3544 C CB . THR B 119 ? 1.4765 1.7756 0.8118 0.1791 0.0201 -0.2550 111 THR H CB 3545 O OG1 . THR B 119 ? 1.5266 1.8172 0.8714 0.2560 0.0003 -0.3129 111 THR H OG1 3546 C CG2 . THR B 119 ? 1.5228 1.9025 0.9055 0.1700 0.0362 -0.2631 111 THR H CG2 3547 N N . LEU B 120 ? 1.4845 1.9033 0.7709 -0.0198 0.0838 -0.2400 112 LEU H N 3548 C CA . LEU B 120 ? 1.5223 1.9347 0.7862 -0.0954 0.0927 -0.1798 112 LEU H CA 3549 C C . LEU B 120 ? 1.6116 2.0321 0.9265 -0.0869 0.0934 -0.1450 112 LEU H C 3550 O O . LEU B 120 ? 1.5861 2.0789 0.9491 -0.0604 0.1093 -0.1934 112 LEU H O 3551 C CB . LEU B 120 ? 1.6806 2.1701 0.9122 -0.1624 0.1293 -0.2219 112 LEU H CB 3552 C CG . LEU B 120 ? 1.7628 2.2449 0.9650 -0.2424 0.1392 -0.1630 112 LEU H CG 3553 C CD1 . LEU B 120 ? 1.8053 2.1886 0.9498 -0.2784 0.1042 -0.0827 112 LEU H CD1 3554 C CD2 . LEU B 120 ? 1.8800 2.4207 1.0873 -0.2936 0.1765 -0.2071 112 LEU H CD2 3555 N N . VAL B 121 ? 1.6771 2.0275 0.9865 -0.1118 0.0758 -0.0649 113 VAL H N 3556 C CA . VAL B 121 ? 1.5604 1.9137 0.9155 -0.1151 0.0796 -0.0296 113 VAL H CA 3557 C C . VAL B 121 ? 1.6429 1.9818 0.9787 -0.1915 0.0825 0.0245 113 VAL H C 3558 O O . VAL B 121 ? 1.5913 1.8628 0.8991 -0.2202 0.0583 0.0825 113 VAL H O 3559 C CB . VAL B 121 ? 1.4240 1.7030 0.8076 -0.0645 0.0572 0.0148 113 VAL H CB 3560 C CG1 . VAL B 121 ? 1.3862 1.6686 0.8170 -0.0697 0.0645 0.0455 113 VAL H CG1 3561 C CG2 . VAL B 121 ? 1.3796 1.6565 0.7682 0.0113 0.0501 -0.0322 113 VAL H CG2 3562 N N . THR B 122 ? 1.7315 2.1316 1.0825 -0.2257 0.1095 0.0044 114 THR H N 3563 C CA . THR B 122 ? 1.7570 2.1299 1.0899 -0.2949 0.1098 0.0606 114 THR H CA 3564 C C . THR B 122 ? 1.7380 2.0954 1.1370 -0.2797 0.1081 0.0923 114 THR H C 3565 O O . THR B 122 ? 1.6117 2.0259 1.0578 -0.2521 0.1280 0.0480 114 THR H O 3566 C CB . THR B 122 ? 1.6697 2.1026 0.9537 -0.3659 0.1445 0.0266 114 THR H CB 3567 O OG1 . THR B 122 ? 1.7046 2.1378 0.9288 -0.3824 0.1451 0.0004 114 THR H OG1 3568 C CG2 . THR B 122 ? 1.7734 2.1530 1.0325 -0.4333 0.1365 0.0936 114 THR H CG2 3569 N N . VAL B 123 ? 1.9804 2.2596 1.3861 -0.2946 0.0807 0.1659 115 VAL H N 3576 N N . SER B 124 ? 2.8804 2.4905 1.7744 -0.6420 0.5080 -0.1123 116 SER H N 3577 C CA . SER B 124 ? 2.4937 2.1924 1.4876 -0.6242 0.5036 -0.1454 116 SER H CA 3578 C C . SER B 124 ? 2.3527 2.0529 1.3036 -0.6410 0.4933 -0.1562 116 SER H C 3579 O O . SER B 124 ? 2.3781 2.0419 1.2243 -0.6492 0.4580 -0.1202 116 SER H O 3580 C CB . SER B 124 ? 2.4311 2.1800 1.4935 -0.5618 0.4358 -0.1106 116 SER H CB 3581 O OG . SER B 124 ? 2.3376 2.1584 1.5002 -0.5350 0.4238 -0.1395 116 SER H OG 3582 N N . SER B 125 ? 2.2588 2.0086 1.2962 -0.6404 0.5211 -0.2050 117 SER H N 3583 C CA . SER B 125 ? 2.3263 2.0720 1.3319 -0.6608 0.5211 -0.2236 117 SER H CA 3584 C C . SER B 125 ? 2.2027 1.9845 1.1933 -0.6347 0.4654 -0.1945 117 SER H C 3585 O O . SER B 125 ? 2.3466 2.1285 1.2986 -0.6546 0.4544 -0.2040 117 SER H O 3586 C CB . SER B 125 ? 2.3711 2.1418 1.4755 -0.6658 0.5790 -0.2858 117 SER H CB 3587 O OG . SER B 125 ? 2.3306 2.1674 1.5466 -0.6178 0.5804 -0.2971 117 SER H OG 3588 N N . ALA B 126 ? 1.9122 1.7249 0.9473 -0.5885 0.4239 -0.1602 118 ALA H N 3589 C CA . ALA B 126 ? 1.8437 1.6979 0.9040 -0.5514 0.3631 -0.1338 118 ALA H CA 3590 C C . ALA B 126 ? 2.0419 1.8802 0.9748 -0.5723 0.3194 -0.0932 118 ALA H C 3591 O O . ALA B 126 ? 2.3132 2.1007 1.1519 -0.5987 0.3285 -0.0755 118 ALA H O 3592 C CB . ALA B 126 ? 1.5653 1.4514 0.7206 -0.4928 0.3277 -0.1090 118 ALA H CB 3593 N N . SER B 127 ? 1.7259 1.6100 0.6627 -0.5584 0.2711 -0.0806 119 SER H N 3594 C CA . SER B 127 ? 1.9284 1.8248 0.7613 -0.5679 0.2176 -0.0409 119 SER H CA 3595 C C . SER B 127 ? 1.7315 1.6750 0.6159 -0.5117 0.1524 0.0033 119 SER H C 3596 O O . SER B 127 ? 1.6817 1.6516 0.6774 -0.4746 0.1494 -0.0048 119 SER H O 3597 C CB . SER B 127 ? 1.9737 1.8983 0.7729 -0.6095 0.2148 -0.0736 119 SER H CB 3598 O OG . SER B 127 ? 2.1262 2.0006 0.8895 -0.6536 0.2652 -0.1076 119 SER H OG 3599 N N . THR B 128 ? 1.9152 1.8643 0.7168 -0.5005 0.1028 0.0528 120 THR H N 3600 C CA . THR B 128 ? 1.8868 1.8841 0.7361 -0.4440 0.0414 0.0965 120 THR H CA 3601 C C . THR B 128 ? 1.8568 1.9298 0.8005 -0.4394 0.0260 0.0646 120 THR H C 3602 O O . THR B 128 ? 1.9540 2.0622 0.8697 -0.4831 0.0303 0.0292 120 THR H O 3603 C CB . THR B 128 ? 2.0544 2.0703 0.7978 -0.4332 -0.0152 0.1484 120 THR H CB 3604 O OG1 . THR B 128 ? 2.2779 2.2013 0.9338 -0.4274 0.0047 0.1846 120 THR H OG1 3605 C CG2 . THR B 128 ? 1.9489 2.0271 0.7642 -0.3711 -0.0741 0.1865 120 THR H CG2 3606 N N . LYS B 129 ? 1.7767 1.8690 0.8240 -0.3911 0.0127 0.0749 121 LYS H N 3607 C CA . LYS B 129 ? 1.7411 1.8879 0.8723 -0.3867 0.0077 0.0454 121 LYS H CA 3608 C C . LYS B 129 ? 1.6898 1.8722 0.9025 -0.3310 -0.0294 0.0745 121 LYS H C 3609 O O . LYS B 129 ? 1.6046 1.7506 0.8496 -0.2929 -0.0264 0.0995 121 LYS H O 3610 C CB . LYS B 129 ? 1.7509 1.8607 0.9363 -0.3988 0.0663 -0.0003 121 LYS H CB 3611 C CG . LYS B 129 ? 1.7364 1.8797 0.9928 -0.3931 0.0698 -0.0273 121 LYS H CG 3612 C CD . LYS B 129 ? 1.7203 1.8219 1.0152 -0.4009 0.1287 -0.0695 121 LYS H CD 3613 C CE . LYS B 129 ? 1.7597 1.8777 1.1037 -0.3964 0.1350 -0.0903 121 LYS H CE 3614 N NZ . LYS B 129 ? 1.7359 1.8687 1.1522 -0.3408 0.1081 -0.0624 121 LYS H NZ 3615 N N . GLY B 130 ? 1.7529 2.0089 0.9963 -0.3322 -0.0606 0.0667 122 GLY H N 3616 C CA . GLY B 130 ? 1.7706 2.0666 1.0959 -0.2853 -0.0897 0.0862 122 GLY H CA 3617 C C . GLY B 130 ? 1.7778 2.0379 1.1793 -0.2721 -0.0504 0.0606 122 GLY H C 3618 O O . GLY B 130 ? 1.8707 2.1014 1.2686 -0.3017 -0.0086 0.0227 122 GLY H O 3619 N N . PRO B 131 ? 1.7128 1.9711 1.1789 -0.2247 -0.0617 0.0823 123 PRO H N 3620 C CA . PRO B 131 ? 1.6574 1.8849 1.1849 -0.2084 -0.0297 0.0614 123 PRO H CA 3621 C C . PRO B 131 ? 1.6141 1.8686 1.1792 -0.2205 -0.0189 0.0324 123 PRO H C 3622 O O . PRO B 131 ? 1.5418 1.8578 1.1111 -0.2373 -0.0419 0.0270 123 PRO H O 3623 C CB . PRO B 131 ? 1.6054 1.8240 1.1763 -0.1596 -0.0469 0.0936 123 PRO H CB 3624 C CG . PRO B 131 ? 1.6279 1.8934 1.1862 -0.1467 -0.0902 0.1258 123 PRO H CG 3625 C CD . PRO B 131 ? 1.7216 1.9937 1.1984 -0.1816 -0.0988 0.1280 123 PRO H CD 3626 N N . SER B 132 ? 1.6037 1.8114 1.1956 -0.2101 0.0182 0.0133 124 SER H N 3627 C CA . SER B 132 ? 1.5284 1.7312 1.1533 -0.2093 0.0386 -0.0070 124 SER H CA 3628 C C . SER B 132 ? 1.3637 1.5623 1.0376 -0.1619 0.0253 0.0160 124 SER H C 3629 O O . SER B 132 ? 1.2312 1.4055 0.9131 -0.1322 0.0218 0.0330 124 SER H O 3630 C CB . SER B 132 ? 1.6029 1.7423 1.2144 -0.2168 0.0898 -0.0349 124 SER H CB 3631 O OG . SER B 132 ? 1.6604 1.7972 1.2268 -0.2681 0.1130 -0.0651 124 SER H OG 3632 N N . VAL B 133 ? 1.4357 1.6577 1.1416 -0.1598 0.0232 0.0111 125 VAL H N 3633 C CA . VAL B 133 ? 1.4541 1.6696 1.2012 -0.1185 0.0143 0.0306 125 VAL H CA 3634 C C . VAL B 133 ? 1.4902 1.6625 1.2470 -0.1125 0.0498 0.0140 125 VAL H C 3635 O O . VAL B 133 ? 1.5078 1.6942 1.2707 -0.1408 0.0669 -0.0081 125 VAL H O 3636 C CB . VAL B 133 ? 1.4505 1.7326 1.2326 -0.1094 -0.0223 0.0485 125 VAL H CB 3637 C CG1 . VAL B 133 ? 1.4432 1.7091 1.2657 -0.0711 -0.0215 0.0628 125 VAL H CG1 3638 C CG2 . VAL B 133 ? 1.3933 1.6985 1.1516 -0.1044 -0.0554 0.0748 125 VAL H CG2 3639 N N . PHE B 134 ? 1.4689 1.5895 1.2228 -0.0771 0.0621 0.0235 126 PHE H N 3640 C CA . PHE B 134 ? 1.4293 1.4934 1.1718 -0.0656 0.0972 0.0142 126 PHE H CA 3641 C C . PHE B 134 ? 1.3112 1.3685 1.0738 -0.0328 0.0887 0.0302 126 PHE H C 3642 O O . PHE B 134 ? 1.2735 1.3480 1.0519 -0.0090 0.0630 0.0471 126 PHE H O 3643 C CB . PHE B 134 ? 1.4611 1.4680 1.1727 -0.0467 0.1219 0.0108 126 PHE H CB 3644 C CG . PHE B 134 ? 1.5214 1.5233 1.2105 -0.0807 0.1410 -0.0095 126 PHE H CG 3645 C CD1 . PHE B 134 ? 1.4848 1.4787 1.1564 -0.1262 0.1689 -0.0352 126 PHE H CD1 3646 C CD2 . PHE B 134 ? 1.5048 1.5058 1.1891 -0.0707 0.1392 -0.0092 126 PHE H CD2 3647 C CE1 . PHE B 134 ? 1.4730 1.4571 1.1166 -0.1627 0.1916 -0.0589 126 PHE H CE1 3648 C CE2 . PHE B 134 ? 1.3931 1.3817 1.0526 -0.1040 0.1643 -0.0314 126 PHE H CE2 3649 C CZ . PHE B 134 ? 1.4185 1.3955 1.0540 -0.1499 0.1903 -0.0555 126 PHE H CZ 3650 N N . PRO B 135 ? 1.2835 1.3092 1.0404 -0.0366 0.1166 0.0213 127 PRO H N 3651 C CA . PRO B 135 ? 1.3132 1.3261 1.0800 -0.0083 0.1131 0.0343 127 PRO H CA 3652 C C . PRO B 135 ? 1.4331 1.3938 1.1643 0.0331 0.1157 0.0481 127 PRO H C 3653 O O . PRO B 135 ? 1.4777 1.3908 1.1709 0.0449 0.1356 0.0467 127 PRO H O 3654 C CB . PRO B 135 ? 1.3416 1.3294 1.1042 -0.0317 0.1512 0.0163 127 PRO H CB 3655 C CG . PRO B 135 ? 1.4762 1.4173 1.1989 -0.0560 0.1866 -0.0015 127 PRO H CG 3656 C CD . PRO B 135 ? 1.3865 1.3831 1.1246 -0.0723 0.1580 -0.0042 127 PRO H CD 3657 N N . LEU B 136 ? 1.4161 1.3912 1.1606 0.0562 0.0949 0.0599 128 LEU H N 3658 C CA . LEU B 136 ? 1.4477 1.3831 1.1540 0.0924 0.0969 0.0684 128 LEU H CA 3659 C C . LEU B 136 ? 1.5163 1.4115 1.1988 0.0980 0.1175 0.0700 128 LEU H C 3660 O O . LEU B 136 ? 1.5512 1.4688 1.2557 0.1000 0.1057 0.0710 128 LEU H O 3661 C CB . LEU B 136 ? 1.3663 1.3437 1.0924 0.1087 0.0640 0.0726 128 LEU H CB 3662 C CG . LEU B 136 ? 1.2566 1.2651 0.9978 0.1044 0.0509 0.0685 128 LEU H CG 3663 C CD1 . LEU B 136 ? 1.3119 1.3618 1.0794 0.1055 0.0268 0.0668 128 LEU H CD1 3664 C CD2 . LEU B 136 ? 1.1596 1.1414 0.8704 0.1310 0.0622 0.0674 128 LEU H CD2 3665 N N . ALA B 137 ? 1.6046 1.4306 1.2363 0.0995 0.1546 0.0693 129 ALA H N 3666 C CA . ALA B 137 ? 1.6682 1.4469 1.2742 0.0900 0.1884 0.0652 129 ALA H CA 3667 C C . ALA B 137 ? 1.7287 1.4732 1.2838 0.1242 0.1825 0.0790 129 ALA H C 3668 O O . ALA B 137 ? 1.7178 1.4519 1.2348 0.1607 0.1634 0.0927 129 ALA H O 3669 C CB . ALA B 137 ? 1.8119 1.5139 1.3708 0.0732 0.2397 0.0575 129 ALA H CB 3670 N N . PRO B 138 ? 1.8583 1.5945 1.4154 0.1123 0.1976 0.0725 130 PRO H N 3671 C CA . PRO B 138 ? 1.9384 1.6489 1.4451 0.1358 0.1922 0.0800 130 PRO H CA 3672 C C . PRO B 138 ? 2.1109 1.7536 1.5181 0.1766 0.1945 0.1005 130 PRO H C 3673 O O . PRO B 138 ? 2.2039 1.7566 1.5304 0.1825 0.2338 0.1091 130 PRO H O 3674 C CB . PRO B 138 ? 1.9368 1.6160 1.4444 0.1084 0.2342 0.0662 130 PRO H CB 3675 C CG . PRO B 138 ? 1.8676 1.6134 1.4720 0.0755 0.2350 0.0493 130 PRO H CG 3676 C CD . PRO B 138 ? 1.8775 1.6414 1.4936 0.0734 0.2205 0.0531 130 PRO H CD 3677 N N . THR B 147 ? 3.1862 2.7876 2.2643 0.1498 0.1911 0.0253 139 THR H N 3678 C CA . THR B 147 ? 3.0656 2.7544 2.2585 0.1401 0.1614 0.0102 139 THR H CA 3679 C C . THR B 147 ? 2.9551 2.6638 2.2163 0.1565 0.1488 0.0319 139 THR H C 3680 O O . THR B 147 ? 2.9773 2.6592 2.1831 0.1876 0.1389 0.0571 139 THR H O 3681 C CB . THR B 147 ? 2.1260 1.8872 1.2909 0.1494 0.1108 -0.0037 139 THR H CB 3682 O OG1 . THR B 147 ? 2.1869 1.9357 1.2892 0.1250 0.1239 -0.0313 139 THR H OG1 3683 C CG2 . THR B 147 ? 2.0262 1.8678 1.2987 0.1382 0.0852 -0.0185 139 THR H CG2 3684 N N . ALA B 148 ? 2.8012 2.5519 2.1725 0.1385 0.1497 0.0236 140 ALA H N 3685 C CA . ALA B 148 ? 2.6524 2.4222 2.0788 0.1482 0.1391 0.0409 140 ALA H CA 3686 C C . ALA B 148 ? 2.4938 2.3282 2.0225 0.1359 0.1199 0.0347 140 ALA H C 3687 O O . ALA B 148 ? 2.5753 2.4231 2.1572 0.1173 0.1315 0.0211 140 ALA H O 3688 C CB . ALA B 148 ? 2.5996 2.3139 2.0266 0.1375 0.1822 0.0478 140 ALA H CB 3689 N N . ALA B 149 ? 2.2263 2.0880 1.7746 0.1490 0.0966 0.0474 141 ALA H N 3690 C CA . ALA B 149 ? 1.9095 1.8177 1.5348 0.1398 0.0814 0.0494 141 ALA H CA 3691 C C . ALA B 149 ? 1.7906 1.6936 1.4439 0.1356 0.0903 0.0614 141 ALA H C 3692 O O . ALA B 149 ? 1.8803 1.7448 1.4880 0.1462 0.1027 0.0700 141 ALA H O 3693 C CB . ALA B 149 ? 1.8678 1.8245 1.4940 0.1504 0.0474 0.0448 141 ALA H CB 3694 N N . LEU B 150 ? 1.6976 1.6370 1.4183 0.1204 0.0845 0.0618 142 LEU H N 3695 C CA . LEU B 150 ? 1.6148 1.5646 1.3603 0.1103 0.0878 0.0676 142 LEU H CA 3696 C C . LEU B 150 ? 1.6269 1.6251 1.4199 0.1029 0.0630 0.0720 142 LEU H C 3697 O O . LEU B 150 ? 1.6207 1.6336 1.4333 0.1039 0.0524 0.0715 142 LEU H O 3698 C CB . LEU B 150 ? 1.5291 1.4721 1.3015 0.0939 0.1159 0.0617 142 LEU H CB 3699 C CG . LEU B 150 ? 1.4695 1.4474 1.3075 0.0895 0.1168 0.0589 142 LEU H CG 3700 C CD1 . LEU B 150 ? 1.4656 1.5022 1.3633 0.0830 0.0959 0.0660 142 LEU H CD1 3701 C CD2 . LEU B 150 ? 1.4753 1.4338 1.3228 0.0803 0.1540 0.0457 142 LEU H CD2 3702 N N . GLY B 151 ? 1.5914 1.6057 1.3943 0.0921 0.0588 0.0748 143 GLY H N 3703 C CA . GLY B 151 ? 1.5125 1.5645 1.3434 0.0837 0.0371 0.0807 143 GLY H CA 3704 C C . GLY B 151 ? 1.4706 1.5446 1.3083 0.0649 0.0336 0.0809 143 GLY H C 3705 O O . GLY B 151 ? 1.5260 1.5939 1.3595 0.0520 0.0505 0.0728 143 GLY H O 3706 N N . CYS B 152 ? 1.4147 1.5115 1.2581 0.0580 0.0158 0.0871 144 CYS H N 3707 C CA . CYS B 152 ? 1.3807 1.4977 1.2178 0.0364 0.0114 0.0848 144 CYS H CA 3708 C C . CYS B 152 ? 1.4179 1.5281 1.2341 0.0344 0.0082 0.0820 144 CYS H C 3709 O O . CYS B 152 ? 1.4998 1.6097 1.3195 0.0419 0.0008 0.0857 144 CYS H O 3710 C CB . CYS B 152 ? 1.1514 1.3116 1.0131 0.0272 -0.0085 0.0977 144 CYS H CB 3711 S SG . CYS B 152 ? 2.8950 3.1003 2.7993 0.0206 -0.0079 0.0926 144 CYS H SG 3712 N N . LEU B 153 ? 1.3125 1.4158 1.1086 0.0207 0.0201 0.0707 145 LEU H N 3713 C CA . LEU B 153 ? 1.2972 1.3990 1.0798 0.0160 0.0232 0.0631 145 LEU H CA 3714 C C . LEU B 153 ? 1.4788 1.5990 1.2477 -0.0165 0.0187 0.0629 145 LEU H C 3715 O O . LEU B 153 ? 1.5152 1.6381 1.2726 -0.0376 0.0280 0.0533 145 LEU H O 3716 C CB . LEU B 153 ? 1.2145 1.2869 0.9810 0.0313 0.0455 0.0505 145 LEU H CB 3717 C CG . LEU B 153 ? 1.2421 1.3176 1.0045 0.0293 0.0560 0.0375 145 LEU H CG 3718 C CD1 . LEU B 153 ? 1.2993 1.4056 1.0843 0.0403 0.0415 0.0349 145 LEU H CD1 3719 C CD2 . LEU B 153 ? 1.2831 1.3213 1.0299 0.0548 0.0817 0.0301 145 LEU H CD2 3720 N N . VAL B 154 ? 1.5259 1.6548 1.2886 -0.0240 0.0081 0.0708 146 VAL H N 3721 C CA . VAL B 154 ? 1.4501 1.5928 1.1852 -0.0515 -0.0014 0.0782 146 VAL H CA 3722 C C . VAL B 154 ? 1.4075 1.5369 1.1169 -0.0723 0.0180 0.0612 146 VAL H C 3723 O O . VAL B 154 ? 1.2141 1.3339 0.9223 -0.0718 0.0233 0.0612 146 VAL H O 3724 C CB . VAL B 154 ? 1.0916 1.2372 0.8236 -0.0428 -0.0222 0.1063 146 VAL H CB 3725 C CG1 . VAL B 154 ? 1.1852 1.3412 0.8721 -0.0660 -0.0346 0.1189 146 VAL H CG1 3726 C CG2 . VAL B 154 ? 1.1095 1.2730 0.8764 -0.0194 -0.0373 0.1207 146 VAL H CG2 3727 N N . LYS B 155 ? 1.5696 1.6957 1.2614 -0.0932 0.0355 0.0418 147 LYS H N 3728 C CA . LYS B 155 ? 1.6019 1.7106 1.2838 -0.1040 0.0648 0.0188 147 LYS H CA 3729 C C . LYS B 155 ? 1.6402 1.7476 1.2728 -0.1486 0.0746 0.0085 147 LYS H C 3730 O O . LYS B 155 ? 1.6136 1.7379 1.2206 -0.1718 0.0616 0.0113 147 LYS H O 3731 C CB . LYS B 155 ? 1.5840 1.6706 1.2829 -0.0831 0.0897 0.0022 147 LYS H CB 3732 C CG . LYS B 155 ? 1.5974 1.6704 1.3029 -0.0771 0.1210 -0.0200 147 LYS H CG 3733 C CD . LYS B 155 ? 1.6428 1.6895 1.3659 -0.0358 0.1403 -0.0249 147 LYS H CD 3734 C CE . LYS B 155 ? 1.6701 1.7183 1.4158 -0.0156 0.1670 -0.0445 147 LYS H CE 3735 N NZ . LYS B 155 ? 1.6233 1.6456 1.3442 -0.0513 0.2060 -0.0686 147 LYS H NZ 3736 N N . ASP B 156 ? 1.7305 1.8255 1.3500 -0.1631 0.0969 -0.0057 148 ASP H N 3737 C CA . ASP B 156 ? 1.8169 1.9009 1.3823 -0.2085 0.1170 -0.0222 148 ASP H CA 3738 C C . ASP B 156 ? 1.8077 1.9018 1.3111 -0.2373 0.0901 -0.0005 148 ASP H C 3739 O O . ASP B 156 ? 1.9167 2.0215 1.3751 -0.2718 0.0886 -0.0104 148 ASP H O 3740 C CB . ASP B 156 ? 1.9442 2.0137 1.5017 -0.2252 0.1458 -0.0501 148 ASP H CB 3741 C CG . ASP B 156 ? 2.0314 2.0768 1.6323 -0.1950 0.1826 -0.0708 148 ASP H CG 3742 O OD1 . ASP B 156 ? 1.9887 2.0446 1.6234 -0.1735 0.1871 -0.0727 148 ASP H OD1 3743 O OD2 . ASP B 156 ? 2.1287 2.1454 1.7290 -0.1927 0.2092 -0.0864 148 ASP H OD2 3744 N N . TYR B 157 ? 1.7299 1.8197 1.2269 -0.2222 0.0694 0.0288 149 TYR H N 3745 C CA . TYR B 157 ? 1.7768 1.8645 1.2042 -0.2393 0.0456 0.0570 149 TYR H CA 3746 C C . TYR B 157 ? 1.7226 1.7645 1.0988 -0.2611 0.0720 0.0582 149 TYR H C 3747 O O . TYR B 157 ? 1.7321 1.7574 1.1465 -0.2588 0.1037 0.0372 149 TYR H O 3748 C CB . TYR B 157 ? 1.8232 1.9281 1.2717 -0.2012 0.0055 0.0960 149 TYR H CB 3749 C CG . TYR B 157 ? 1.8597 1.9321 1.3404 -0.1721 0.0131 0.1104 149 TYR H CG 3750 C CD1 . TYR B 157 ? 1.7869 1.8701 1.3413 -0.1445 0.0177 0.0976 149 TYR H CD1 3751 C CD2 . TYR B 157 ? 1.9389 1.9643 1.3678 -0.1744 0.0185 0.1361 149 TYR H CD2 3752 C CE1 . TYR B 157 ? 1.7437 1.8043 1.3251 -0.1251 0.0253 0.1037 149 TYR H CE1 3753 C CE2 . TYR B 157 ? 1.9380 1.9292 1.3952 -0.1561 0.0334 0.1418 149 TYR H CE2 3754 C CZ . TYR B 157 ? 1.8277 1.8432 1.3641 -0.1336 0.0351 0.1229 149 TYR H CZ 3755 O OH . TYR B 157 ? 1.8419 1.8307 1.4037 -0.1226 0.0503 0.1216 149 TYR H OH 3756 N N . PHE B 158 ? 1.6798 1.7051 0.9669 -0.2844 0.0606 0.0799 150 PHE H N 3757 C CA . PHE B 158 ? 1.7386 1.7044 0.9605 -0.3068 0.0899 0.0866 150 PHE H CA 3758 C C . PHE B 158 ? 1.8399 1.7828 0.9532 -0.3127 0.0618 0.1308 150 PHE H C 3759 O O . PHE B 158 ? 1.9034 1.8892 0.9766 -0.3238 0.0299 0.1358 150 PHE H O 3760 C CB . PHE B 158 ? 1.7518 1.7049 0.9639 -0.3507 0.1403 0.0387 150 PHE H CB 3761 C CG . PHE B 158 ? 1.8307 1.7223 0.9711 -0.3860 0.1813 0.0359 150 PHE H CG 3762 C CD1 . PHE B 158 ? 1.8730 1.7300 0.8919 -0.4220 0.1818 0.0513 150 PHE H CD1 3763 C CD2 . PHE B 158 ? 1.8466 1.7186 1.0384 -0.3874 0.2221 0.0132 150 PHE H CD2 3764 C CE1 . PHE B 158 ? 1.9751 1.7635 0.9183 -0.4580 0.2271 0.0479 150 PHE H CE1 3765 C CE2 . PHE B 158 ? 1.8561 1.6698 0.9842 -0.4274 0.2688 0.0041 150 PHE H CE2 3766 C CZ . PHE B 158 ? 1.9550 1.7190 0.9553 -0.4624 0.2739 0.0231 150 PHE H CZ 3767 N N . PRO B 159 ? 1.8425 1.7166 0.9015 -0.3060 0.0751 0.1623 151 PRO H N 3768 C CA . PRO B 159 ? 1.8191 1.6422 0.9167 -0.2994 0.1138 0.1556 151 PRO H CA 3769 C C . PRO B 159 ? 1.7643 1.5940 0.9280 -0.2474 0.0884 0.1825 151 PRO H C 3770 O O . PRO B 159 ? 1.7900 1.6667 0.9751 -0.2138 0.0412 0.2068 151 PRO H O 3771 C CB . PRO B 159 ? 1.8984 1.6302 0.8753 -0.3244 0.1426 0.1812 151 PRO H CB 3772 C CG . PRO B 159 ? 1.9180 1.6562 0.8046 -0.3065 0.0916 0.2315 151 PRO H CG 3773 C CD . PRO B 159 ? 1.8501 1.6880 0.7846 -0.3087 0.0531 0.2087 151 PRO H CD 3774 N N . GLU B 160 ? 1.7052 1.4886 0.8956 -0.2463 0.1232 0.1746 152 GLU H N 3775 C CA . GLU B 160 ? 1.7239 1.4974 0.9618 -0.2045 0.1093 0.1971 152 GLU H CA 3776 C C . GLU B 160 ? 1.7885 1.5125 0.9394 -0.1769 0.0844 0.2590 152 GLU H C 3777 O O . GLU B 160 ? 1.9532 1.6309 1.0014 -0.1978 0.0926 0.2788 152 GLU H O 3778 C CB . GLU B 160 ? 1.8611 1.5851 1.1228 -0.2222 0.1597 0.1721 152 GLU H CB 3779 C CG . GLU B 160 ? 1.7816 1.5752 1.1555 -0.2226 0.1659 0.1212 152 GLU H CG 3780 C CD . GLU B 160 ? 1.8150 1.6437 1.2538 -0.1774 0.1312 0.1344 152 GLU H CD 3781 O OE1 . GLU B 160 ? 1.8282 1.6602 1.2476 -0.1457 0.0942 0.1746 152 GLU H OE1 3782 O OE2 . GLU B 160 ? 1.8268 1.6857 1.3364 -0.1744 0.1410 0.1024 152 GLU H OE2 3783 N N . PRO B 161 ? 1.7224 1.4609 0.9110 -0.1269 0.0520 0.2908 153 PRO H N 3784 C CA . PRO B 161 ? 1.7492 1.5276 1.0455 -0.1057 0.0495 0.2676 153 PRO H CA 3785 C C . PRO B 161 ? 1.6501 1.5001 0.9939 -0.0638 -0.0021 0.2884 153 PRO H C 3786 O O . PRO B 161 ? 1.7881 1.6521 1.0845 -0.0431 -0.0365 0.3271 153 PRO H O 3787 C CB . PRO B 161 ? 1.8438 1.5313 1.1221 -0.0907 0.0827 0.2879 153 PRO H CB 3788 C CG . PRO B 161 ? 1.7994 1.4242 0.9767 -0.0653 0.0696 0.3496 153 PRO H CG 3789 C CD . PRO B 161 ? 1.7752 1.4279 0.8832 -0.0956 0.0533 0.3492 153 PRO H CD 3790 N N . VAL B 162 ? 1.3572 1.2564 0.7923 -0.0520 -0.0071 0.2613 154 VAL H N 3791 C CA . VAL B 162 ? 1.4750 1.4418 0.9632 -0.0187 -0.0466 0.2728 154 VAL H CA 3792 C C . VAL B 162 ? 1.5456 1.4919 1.0878 0.0180 -0.0401 0.2828 154 VAL H C 3793 O O . VAL B 162 ? 1.5887 1.4916 1.1478 0.0084 -0.0064 0.2623 154 VAL H O 3794 C CB . VAL B 162 ? 1.4335 1.4706 0.9724 -0.0390 -0.0539 0.2317 154 VAL H CB 3795 C CG1 . VAL B 162 ? 1.5284 1.6203 1.0355 -0.0541 -0.0831 0.2352 154 VAL H CG1 3796 C CG2 . VAL B 162 ? 1.3526 1.3692 0.8943 -0.0724 -0.0183 0.1921 154 VAL H CG2 3797 N N . THR B 163 ? 1.5928 1.5756 1.1625 0.0582 -0.0710 0.3114 155 THR H N 3798 C CA . THR B 163 ? 1.6712 1.6405 1.2992 0.0950 -0.0630 0.3185 155 THR H CA 3799 C C . THR B 163 ? 1.6509 1.7035 1.3582 0.1017 -0.0818 0.2944 155 THR H C 3800 O O . THR B 163 ? 1.6281 1.7551 1.3452 0.0938 -0.1112 0.2893 155 THR H O 3801 C CB . THR B 163 ? 1.7423 1.6775 1.3517 0.1459 -0.0727 0.3710 155 THR H CB 3802 O OG1 . THR B 163 ? 1.7709 1.7966 1.3959 0.1704 -0.1222 0.3920 155 THR H OG1 3803 C CG2 . THR B 163 ? 1.8632 1.6914 1.3776 0.1417 -0.0455 0.4010 155 THR H CG2 3804 N N . VAL B 164 ? 1.6492 1.6848 1.4064 0.1124 -0.0607 0.2775 156 VAL H N 3805 C CA . VAL B 164 ? 1.5037 1.5996 1.3273 0.1186 -0.0687 0.2557 156 VAL H CA 3806 C C . VAL B 164 ? 1.4873 1.5653 1.3553 0.1577 -0.0580 0.2704 156 VAL H C 3807 O O . VAL B 164 ? 1.4658 1.4720 1.3228 0.1632 -0.0275 0.2712 156 VAL H O 3808 C CB . VAL B 164 ? 1.3388 1.4286 1.1721 0.0908 -0.0484 0.2149 156 VAL H CB 3809 C CG1 . VAL B 164 ? 1.2949 1.4305 1.1796 0.0962 -0.0509 0.1963 156 VAL H CG1 3810 C CG2 . VAL B 164 ? 1.2302 1.3256 1.0236 0.0566 -0.0494 0.1988 156 VAL H CG2 3811 N N . SER B 165 ? 1.4745 1.6224 1.3975 0.1803 -0.0785 0.2753 157 SER H N 3812 C CA . SER B 165 ? 1.5215 1.6683 1.5047 0.2124 -0.0628 0.2760 157 SER H CA 3813 C C . SER B 165 ? 1.4659 1.6696 1.5003 0.1949 -0.0590 0.2398 157 SER H C 3814 O O . SER B 165 ? 1.3497 1.5938 1.3730 0.1628 -0.0705 0.2193 157 SER H O 3815 C CB . SER B 165 ? 1.6096 1.7887 1.6211 0.2640 -0.0849 0.3167 157 SER H CB 3816 O OG . SER B 165 ? 1.6437 1.9336 1.6840 0.2615 -0.1258 0.3150 157 SER H OG 3817 N N . TRP B 166 ? 1.4649 1.6598 1.5487 0.2138 -0.0353 0.2308 158 TRP H N 3818 C CA . TRP B 166 ? 1.3671 1.6069 1.4956 0.1984 -0.0243 0.1984 158 TRP H CA 3819 C C . TRP B 166 ? 1.3013 1.6071 1.5144 0.2286 -0.0242 0.1998 158 TRP H C 3820 O O . TRP B 166 ? 1.1882 1.4657 1.4309 0.2667 -0.0091 0.2169 158 TRP H O 3821 C CB . TRP B 166 ? 1.4041 1.5731 1.5054 0.1813 0.0114 0.1738 158 TRP H CB 3822 C CG . TRP B 166 ? 1.3864 1.5274 1.4246 0.1493 0.0076 0.1611 158 TRP H CG 3823 C CD1 . TRP B 166 ? 1.3346 1.4288 1.3253 0.1420 0.0076 0.1676 158 TRP H CD1 3824 C CD2 . TRP B 166 ? 1.3583 1.5164 1.3779 0.1227 0.0075 0.1388 158 TRP H CD2 3825 N NE1 . TRP B 166 ? 1.2677 1.3621 1.2218 0.1161 0.0038 0.1496 158 TRP H NE1 3826 C CE2 . TRP B 166 ? 1.2946 1.4210 1.2616 0.1074 0.0039 0.1349 158 TRP H CE2 3827 C CE3 . TRP B 166 ? 1.3745 1.5665 1.4163 0.1096 0.0160 0.1201 158 TRP H CE3 3828 C CZ2 . TRP B 166 ? 1.3171 1.4426 1.2543 0.0888 0.0061 0.1180 158 TRP H CZ2 3829 C CZ3 . TRP B 166 ? 1.4100 1.5865 1.4109 0.0857 0.0231 0.1033 158 TRP H CZ3 3830 C CH2 . TRP B 166 ? 1.3856 1.5283 1.3352 0.0800 0.0168 0.1048 158 TRP H CH2 3831 N N . ASN B 167 ? 1.3793 1.7733 1.6342 0.2101 -0.0366 0.1785 159 ASN H N 3832 C CA . ASN B 167 ? 1.4763 1.9552 1.8260 0.2327 -0.0350 0.1699 159 ASN H CA 3833 C C . ASN B 167 ? 1.5445 2.0598 1.9287 0.2899 -0.0644 0.2116 159 ASN H C 3834 O O . ASN B 167 ? 1.5613 2.0884 2.0124 0.3323 -0.0489 0.2192 159 ASN H O 3835 C CB . ASN B 167 ? 1.5378 1.9717 1.9188 0.2335 0.0146 0.1459 159 ASN H CB 3836 C CG . ASN B 167 ? 1.5566 1.9604 1.9010 0.1829 0.0437 0.1077 159 ASN H CG 3837 O OD1 . ASN B 167 ? 1.5526 1.9788 1.8650 0.1488 0.0300 0.0959 159 ASN H OD1 3838 N ND2 . ASN B 167 ? 1.5667 1.9120 1.9086 0.1789 0.0875 0.0890 159 ASN H ND2 3839 N N . SER B 168 ? 1.5935 2.1175 1.9241 0.2925 -0.1035 0.2400 160 SER H N 3840 C CA . SER B 168 ? 1.6558 2.2158 1.9973 0.3488 -0.1397 0.2872 160 SER H CA 3841 C C . SER B 168 ? 1.7600 2.2117 2.0904 0.3972 -0.1087 0.3196 160 SER H C 3842 O O . SER B 168 ? 1.8460 2.3200 2.2179 0.4608 -0.1200 0.3554 160 SER H O 3843 C CB . SER B 168 ? 1.6061 2.3195 2.0516 0.3746 -0.1699 0.2796 160 SER H CB 3844 O OG . SER B 168 ? 1.5624 2.3708 2.0117 0.3198 -0.1924 0.2430 160 SER H OG 3845 N N . GLY B 169 ? 1.7549 2.0913 2.0312 0.3674 -0.0667 0.3043 161 GLY H N 3846 C CA . GLY B 169 ? 1.8439 2.0632 2.0915 0.3976 -0.0304 0.3277 161 GLY H CA 3847 C C . GLY B 169 ? 1.8804 2.0714 2.1861 0.4056 0.0175 0.3012 161 GLY H C 3848 O O . GLY B 169 ? 1.8949 1.9793 2.1732 0.4143 0.0600 0.3049 161 GLY H O 3849 N N . ALA B 170 ? 1.8828 2.1642 2.2634 0.3958 0.0168 0.2695 162 ALA H N 3850 C CA . ALA B 170 ? 1.8573 2.1171 2.2934 0.4010 0.0658 0.2414 162 ALA H CA 3851 C C . ALA B 170 ? 1.7996 1.9708 2.1716 0.3482 0.1043 0.2057 162 ALA H C 3852 O O . ALA B 170 ? 1.8148 1.9351 2.2022 0.3478 0.1512 0.1843 162 ALA H O 3853 C CB . ALA B 170 ? 1.8003 2.1867 2.3351 0.4012 0.0579 0.2147 162 ALA H CB 3854 N N . LEU B 171 ? 1.7246 1.8825 2.0246 0.3055 0.0842 0.1984 163 LEU H N 3855 C CA . LEU B 171 ? 1.6934 1.7801 1.9283 0.2627 0.1104 0.1690 163 LEU H CA 3856 C C . LEU B 171 ? 1.7585 1.7703 1.9180 0.2496 0.1099 0.1797 163 LEU H C 3857 O O . LEU B 171 ? 1.8175 1.8451 1.9358 0.2300 0.0806 0.1856 163 LEU H O 3858 C CB . LEU B 171 ? 1.5750 1.7051 1.7891 0.2226 0.0960 0.1440 163 LEU H CB 3859 C CG . LEU B 171 ? 1.4534 1.5268 1.5966 0.1865 0.1124 0.1186 163 LEU H CG 3860 C CD1 . LEU B 171 ? 1.5285 1.5452 1.6676 0.1858 0.1556 0.0983 163 LEU H CD1 3861 C CD2 . LEU B 171 ? 1.3518 1.4611 1.4835 0.1601 0.1064 0.1002 163 LEU H CD2 3862 N N . THR B 172 ? 1.7777 1.7076 1.9208 0.2559 0.1479 0.1770 164 THR H N 3863 C CA . THR B 172 ? 1.8034 1.6632 1.8802 0.2363 0.1562 0.1795 164 THR H CA 3864 C C . THR B 172 ? 1.8312 1.6424 1.8617 0.1945 0.1851 0.1388 164 THR H C 3865 O O . THR B 172 ? 1.7907 1.5849 1.7721 0.1646 0.1793 0.1282 164 THR H O 3866 C CB . THR B 172 ? 1.8664 1.6581 1.9501 0.2752 0.1819 0.2109 164 THR H CB 3867 O OG1 . THR B 172 ? 1.9321 1.6838 2.0519 0.2899 0.2283 0.1946 164 THR H OG1 3868 C CG2 . THR B 172 ? 1.8692 1.7160 1.9882 0.3235 0.1443 0.2572 164 THR H CG2 3869 N N . SER B 173 ? 1.8815 1.6768 1.9290 0.1915 0.2170 0.1133 165 SER H N 3870 C CA . SER B 173 ? 1.8367 1.5954 1.8361 0.1522 0.2419 0.0721 165 SER H CA 3871 C C . SER B 173 ? 1.6194 1.4314 1.5830 0.1261 0.2077 0.0552 165 SER H C 3872 O O . SER B 173 ? 1.4402 1.3014 1.4223 0.1354 0.1858 0.0636 165 SER H O 3873 C CB . SER B 173 ? 1.8750 1.5982 1.8945 0.1560 0.2882 0.0500 165 SER H CB 3874 O OG . SER B 173 ? 1.8341 1.6092 1.8907 0.1678 0.2803 0.0493 165 SER H OG 3875 N N . GLY B 174 ? 1.6458 1.4482 1.5595 0.0941 0.2066 0.0294 166 GLY H N 3876 C CA . GLY B 174 ? 1.6488 1.4986 1.5269 0.0788 0.1757 0.0150 166 GLY H CA 3877 C C . GLY B 174 ? 1.5977 1.4904 1.4791 0.0836 0.1377 0.0359 166 GLY H C 3878 O O . GLY B 174 ? 1.5623 1.4915 1.4195 0.0793 0.1134 0.0294 166 GLY H O 3879 N N . VAL B 175 ? 1.5842 1.4676 1.4909 0.0962 0.1348 0.0631 167 VAL H N 3880 C CA . VAL B 175 ? 1.4143 1.3324 1.3186 0.0969 0.1034 0.0822 167 VAL H CA 3881 C C . VAL B 175 ? 1.4228 1.3348 1.2974 0.0703 0.1037 0.0660 167 VAL H C 3882 O O . VAL B 175 ? 1.5069 1.3720 1.3717 0.0564 0.1321 0.0561 167 VAL H O 3883 C CB . VAL B 175 ? 1.2402 1.1557 1.1737 0.1225 0.0968 0.1198 167 VAL H CB 3884 C CG1 . VAL B 175 ? 1.2448 1.1860 1.1603 0.1154 0.0694 0.1359 167 VAL H CG1 3885 C CG2 . VAL B 175 ? 1.1206 1.0731 1.0979 0.1446 0.0905 0.1290 167 VAL H CG2 3886 N N . HIS B 176 ? 1.3468 1.3037 1.2093 0.0613 0.0786 0.0594 168 HIS H N 3887 C CA . HIS B 176 ? 1.4576 1.4225 1.3057 0.0373 0.0787 0.0454 168 HIS H CA 3888 C C . HIS B 176 ? 1.5242 1.5129 1.3708 0.0408 0.0574 0.0663 168 HIS H C 3889 O O . HIS B 176 ? 1.6046 1.6320 1.4529 0.0484 0.0373 0.0655 168 HIS H O 3890 C CB . HIS B 176 ? 1.5260 1.5351 1.3652 0.0214 0.0717 0.0067 168 HIS H CB 3891 C CG . HIS B 176 ? 1.6652 1.6585 1.4953 0.0071 0.0925 -0.0229 168 HIS H CG 3892 N ND1 . HIS B 176 ? 1.6526 1.6723 1.4670 0.0145 0.0816 -0.0395 168 HIS H ND1 3893 C CD2 . HIS B 176 ? 1.7819 1.7294 1.6076 -0.0177 0.1278 -0.0412 168 HIS H CD2 3894 C CE1 . HIS B 176 ? 1.7463 1.7460 1.5484 -0.0075 0.1058 -0.0691 168 HIS H CE1 3895 N NE2 . HIS B 176 ? 1.8269 1.7813 1.6386 -0.0289 0.1367 -0.0728 168 HIS H NE2 3896 N N . THR B 177 ? 1.5030 1.4593 1.3378 0.0345 0.0661 0.0855 169 THR H N 3897 C CA . THR B 177 ? 1.4265 1.4006 1.2466 0.0279 0.0510 0.0991 169 THR H CA 3898 C C . THR B 177 ? 1.3921 1.3678 1.1975 -0.0045 0.0664 0.0728 169 THR H C 3899 O O . THR B 177 ? 1.4244 1.3519 1.2129 -0.0233 0.0952 0.0677 169 THR H O 3900 C CB . THR B 177 ? 1.4738 1.4176 1.2791 0.0430 0.0466 0.1397 169 THR H CB 3901 O OG1 . THR B 177 ? 1.5044 1.4712 1.3390 0.0718 0.0300 0.1572 169 THR H OG1 3902 C CG2 . THR B 177 ? 1.4459 1.4088 1.2243 0.0290 0.0323 0.1484 169 THR H CG2 3903 N N . PHE B 178 ? 1.3301 1.3581 1.1441 -0.0118 0.0534 0.0532 170 PHE H N 3904 C CA . PHE B 178 ? 1.3619 1.4128 1.1799 -0.0414 0.0688 0.0187 170 PHE H CA 3905 C C . PHE B 178 ? 1.3706 1.3937 1.1598 -0.0662 0.0854 0.0266 170 PHE H C 3906 O O . PHE B 178 ? 1.3590 1.3647 1.1226 -0.0574 0.0737 0.0580 170 PHE H O 3907 C CB . PHE B 178 ? 1.3658 1.4871 1.2099 -0.0298 0.0495 -0.0042 170 PHE H CB 3908 C CG . PHE B 178 ? 1.3255 1.4754 1.1841 -0.0104 0.0364 -0.0183 170 PHE H CG 3909 C CD1 . PHE B 178 ? 1.2546 1.3852 1.1043 0.0169 0.0237 0.0054 170 PHE H CD1 3910 C CD2 . PHE B 178 ? 1.2955 1.4971 1.1740 -0.0221 0.0376 -0.0583 170 PHE H CD2 3911 C CE1 . PHE B 178 ? 1.1798 1.3267 1.0283 0.0327 0.0155 -0.0064 170 PHE H CE1 3912 C CE2 . PHE B 178 ? 1.2074 1.4369 1.0858 -0.0040 0.0221 -0.0699 170 PHE H CE2 3913 C CZ . PHE B 178 ? 1.1561 1.3507 1.0134 0.0238 0.0125 -0.0419 170 PHE H CZ 3914 N N . PRO B 179 ? 1.3946 1.4159 1.1847 -0.1019 0.1151 -0.0059 171 PRO H N 3915 C CA . PRO B 179 ? 1.4871 1.4874 1.2484 -0.1316 0.1371 -0.0079 171 PRO H CA 3916 C C . PRO B 179 ? 1.4330 1.4837 1.2048 -0.1224 0.1168 -0.0087 171 PRO H C 3917 O O . PRO B 179 ? 1.3204 1.4374 1.1367 -0.1053 0.0995 -0.0306 171 PRO H O 3918 C CB . PRO B 179 ? 1.5540 1.5769 1.3398 -0.1731 0.1718 -0.0605 171 PRO H CB 3919 C CG . PRO B 179 ? 1.5374 1.5601 1.3425 -0.1697 0.1739 -0.0756 171 PRO H CG 3920 C CD . PRO B 179 ? 1.4098 1.4577 1.2288 -0.1221 0.1318 -0.0498 171 PRO H CD 3921 N N . ALA B 180 ? 1.5164 1.5320 1.2416 -0.1329 0.1212 0.0147 172 ALA H N 3922 C CA . ALA B 180 ? 1.4070 1.4625 1.1382 -0.1336 0.1133 0.0055 172 ALA H CA 3923 C C . ALA B 180 ? 1.3742 1.4805 1.1464 -0.1557 0.1375 -0.0432 172 ALA H C 3924 O O . ALA B 180 ? 1.4806 1.5817 1.2592 -0.1874 0.1681 -0.0698 172 ALA H O 3925 C CB . ALA B 180 ? 1.4860 1.4945 1.1495 -0.1477 0.1151 0.0358 172 ALA H CB 3926 N N . VAL B 181 ? 1.3533 1.5078 1.1550 -0.1392 0.1280 -0.0563 173 VAL H N 3927 C CA . VAL B 181 ? 1.4424 1.6493 1.2856 -0.1524 0.1512 -0.0983 173 VAL H CA 3928 C C . VAL B 181 ? 1.4144 1.5966 1.2214 -0.1714 0.1703 -0.0967 173 VAL H C 3929 O O . VAL B 181 ? 1.3790 1.5281 1.1437 -0.1621 0.1543 -0.0671 173 VAL H O 3930 C CB . VAL B 181 ? 1.6080 1.8909 1.5181 -0.1091 0.1300 -0.1175 173 VAL H CB 3931 C CG1 . VAL B 181 ? 1.6873 2.0028 1.6265 -0.0962 0.1114 -0.1257 173 VAL H CG1 3932 C CG2 . VAL B 181 ? 1.6848 1.9460 1.5752 -0.0736 0.1090 -0.0882 173 VAL H CG2 3933 N N . LEU B 182 ? 1.4701 1.6700 1.2921 -0.2035 0.2079 -0.1326 174 LEU H N 3934 C CA . LEU B 182 ? 1.4922 1.6694 1.2798 -0.2247 0.2326 -0.1383 174 LEU H CA 3935 C C . LEU B 182 ? 1.4750 1.7096 1.3270 -0.1934 0.2372 -0.1648 174 LEU H C 3936 O O . LEU B 182 ? 1.5102 1.8141 1.4378 -0.1851 0.2517 -0.2035 174 LEU H O 3937 C CB . LEU B 182 ? 1.5575 1.7086 1.3164 -0.2800 0.2806 -0.1628 174 LEU H CB 3938 C CG . LEU B 182 ? 1.6117 1.7313 1.3220 -0.3123 0.3143 -0.1731 174 LEU H CG 3939 C CD1 . LEU B 182 ? 1.6621 1.7224 1.2824 -0.3110 0.2876 -0.1273 174 LEU H CD1 3940 C CD2 . LEU B 182 ? 1.6628 1.7477 1.3374 -0.3702 0.3671 -0.1975 174 LEU H CD2 3941 N N . GLN B 183 ? 1.4500 1.6560 1.2719 -0.1780 0.2298 -0.1471 175 GLN H N 3942 C CA . GLN B 183 ? 1.4149 1.6497 1.2842 -0.1432 0.2416 -0.1661 175 GLN H CA 3943 C C . GLN B 183 ? 1.4055 1.6415 1.2823 -0.1708 0.2914 -0.2021 175 GLN H C 3944 O O . GLN B 183 ? 1.5257 1.7262 1.3488 -0.2242 0.3164 -0.2082 175 GLN H O 3945 C CB . GLN B 183 ? 1.4733 1.6621 1.3004 -0.1250 0.2266 -0.1385 175 GLN H CB 3946 C CG . GLN B 183 ? 1.4368 1.6208 1.2580 -0.0959 0.1839 -0.1052 175 GLN H CG 3947 C CD . GLN B 183 ? 1.4829 1.6189 1.2513 -0.1016 0.1774 -0.0838 175 GLN H CD 3948 O OE1 . GLN B 183 ? 1.5220 1.6502 1.2799 -0.0873 0.1479 -0.0583 175 GLN H OE1 3949 N NE2 . GLN B 183 ? 1.5148 1.6219 1.2519 -0.1275 0.2090 -0.0996 175 GLN H NE2 3950 N N . SER B 184 ? 1.4610 1.7327 1.4001 -0.1317 0.3086 -0.2246 176 SER H N 3951 C CA . SER B 184 ? 1.5831 1.8538 1.5374 -0.1524 0.3629 -0.2619 176 SER H CA 3952 C C . SER B 184 ? 1.6602 1.8451 1.5174 -0.1993 0.3874 -0.2539 176 SER H C 3953 O O . SER B 184 ? 1.5764 1.7410 1.4076 -0.2458 0.4334 -0.2819 176 SER H O 3954 C CB . SER B 184 ? 1.6370 1.9504 1.6719 -0.0869 0.3746 -0.2783 176 SER H CB 3955 O OG . SER B 184 ? 1.7055 1.9974 1.7292 -0.0337 0.3383 -0.2424 176 SER H OG 3956 N N . SER B 185 ? 1.7432 1.8835 1.5456 -0.1915 0.3570 -0.2193 177 SER H N 3957 C CA . SER B 185 ? 1.7570 1.8331 1.4688 -0.2373 0.3713 -0.2142 177 SER H CA 3958 C C . SER B 185 ? 1.7097 1.7617 1.3403 -0.2996 0.3708 -0.2074 177 SER H C 3959 O O . SER B 185 ? 1.7201 1.7310 1.2720 -0.3453 0.3886 -0.2126 177 SER H O 3960 C CB . SER B 185 ? 1.7422 1.7948 1.4265 -0.2167 0.3356 -0.1827 177 SER H CB 3961 O OG . SER B 185 ? 1.6973 1.7685 1.3746 -0.2088 0.2849 -0.1489 177 SER H OG 3962 N N . GLY B 186 ? 1.7410 1.8143 1.3840 -0.3014 0.3530 -0.1962 178 GLY H N 3963 C CA . GLY B 186 ? 1.7957 1.8315 1.3538 -0.3502 0.3528 -0.1804 178 GLY H CA 3964 C C . GLY B 186 ? 1.7741 1.7941 1.2847 -0.3382 0.2980 -0.1306 178 GLY H C 3965 O O . GLY B 186 ? 1.8215 1.8062 1.2602 -0.3635 0.2899 -0.1059 178 GLY H O 3966 N N . LEU B 187 ? 1.7048 1.7475 1.2555 -0.2963 0.2635 -0.1150 179 LEU H N 3967 C CA . LEU B 187 ? 1.6371 1.6755 1.1590 -0.2810 0.2141 -0.0726 179 LEU H CA 3968 C C . LEU B 187 ? 1.5657 1.6273 1.1489 -0.2406 0.1894 -0.0577 179 LEU H C 3969 O O . LEU B 187 ? 1.5076 1.6033 1.1644 -0.2127 0.1977 -0.0792 179 LEU H O 3970 C CB . LEU B 187 ? 1.5448 1.5890 1.0618 -0.2724 0.1989 -0.0698 179 LEU H CB 3971 C CG . LEU B 187 ? 1.4408 1.4639 0.8970 -0.3183 0.2274 -0.0929 179 LEU H CG 3972 C CD1 . LEU B 187 ? 1.3436 1.3701 0.8034 -0.3149 0.2225 -0.0997 179 LEU H CD1 3973 C CD2 . LEU B 187 ? 1.5501 1.5567 0.9121 -0.3583 0.2126 -0.0726 179 LEU H CD2 3974 N N . TYR B 188 ? 1.5733 1.6184 1.1244 -0.2353 0.1590 -0.0214 180 TYR H N 3975 C CA . TYR B 188 ? 1.5100 1.5690 1.1115 -0.2023 0.1403 -0.0100 180 TYR H CA 3976 C C . TYR B 188 ? 1.5357 1.6190 1.1735 -0.1648 0.1097 0.0021 180 TYR H C 3977 O O . TYR B 188 ? 1.5206 1.6029 1.1317 -0.1690 0.0972 0.0117 180 TYR H O 3978 C CB . TYR B 188 ? 1.5414 1.5579 1.0922 -0.2100 0.1314 0.0232 180 TYR H CB 3979 C CG . TYR B 188 ? 1.5273 1.5035 1.0357 -0.2491 0.1710 0.0109 180 TYR H CG 3980 C CD1 . TYR B 188 ? 1.5094 1.4909 1.0625 -0.2565 0.1980 -0.0156 180 TYR H CD1 3981 C CD2 . TYR B 188 ? 1.5717 1.5063 0.9915 -0.2834 0.1847 0.0214 180 TYR H CD2 3982 C CE1 . TYR B 188 ? 1.6321 1.5740 1.1484 -0.2990 0.2429 -0.0328 180 TYR H CE1 3983 C CE2 . TYR B 188 ? 1.6644 1.5502 1.0359 -0.3228 0.2288 0.0095 180 TYR H CE2 3984 C CZ . TYR B 188 ? 1.7329 1.6205 1.1560 -0.3316 0.2608 -0.0188 180 TYR H CZ 3985 O OH . TYR B 188 ? 1.8613 1.6988 1.2407 -0.3777 0.3136 -0.0374 180 TYR H OH 3986 N N . SER B 189 ? 1.5990 1.7036 1.2920 -0.1336 0.1002 -0.0009 181 SER H N 3987 C CA . SER B 189 ? 1.6039 1.7217 1.3254 -0.0979 0.0754 0.0119 181 SER H CA 3988 C C . SER B 189 ? 1.5239 1.6474 1.2741 -0.0763 0.0613 0.0203 181 SER H C 3989 O O . SER B 189 ? 1.5781 1.7186 1.3555 -0.0792 0.0732 -0.0006 181 SER H O 3990 C CB . SER B 189 ? 1.6295 1.7656 1.3844 -0.0753 0.0860 -0.0092 181 SER H CB 3991 O OG . SER B 189 ? 1.6885 1.8238 1.4571 -0.0438 0.0682 0.0042 181 SER H OG 3992 N N . LEU B 190 ? 1.4231 1.5370 1.1703 -0.0590 0.0396 0.0454 182 LEU H N 3993 C CA . LEU B 190 ? 1.4194 1.5347 1.1935 -0.0390 0.0321 0.0481 182 LEU H CA 3994 C C . LEU B 190 ? 1.4224 1.5423 1.2115 -0.0111 0.0160 0.0593 182 LEU H C 3995 O O . LEU B 190 ? 1.4440 1.5642 1.2230 -0.0111 0.0107 0.0675 182 LEU H O 3996 C CB . LEU B 190 ? 1.4075 1.4860 1.1578 -0.0503 0.0356 0.0679 182 LEU H CB 3997 C CG . LEU B 190 ? 1.3628 1.4164 1.0866 -0.0406 0.0191 0.1064 182 LEU H CG 3998 C CD1 . LEU B 190 ? 1.2085 1.2746 0.9634 -0.0114 0.0022 0.1182 182 LEU H CD1 3999 C CD2 . LEU B 190 ? 1.5128 1.5136 1.2041 -0.0484 0.0342 0.1240 182 LEU H CD2 4000 N N . SER B 191 ? 1.3916 1.5150 1.2018 0.0067 0.0128 0.0546 183 SER H N 4001 C CA . SER B 191 ? 1.3403 1.4593 1.1579 0.0295 0.0041 0.0639 183 SER H CA 4002 C C . SER B 191 ? 1.3409 1.4410 1.1657 0.0344 0.0026 0.0768 183 SER H C 4003 O O . SER B 191 ? 1.3561 1.4447 1.1820 0.0251 0.0116 0.0699 183 SER H O 4004 C CB . SER B 191 ? 1.3388 1.4727 1.1634 0.0518 0.0040 0.0471 183 SER H CB 4005 O OG . SER B 191 ? 1.3954 1.5445 1.2196 0.0544 0.0101 0.0345 183 SER H OG 4006 N N . SER B 192 ? 1.2447 1.3397 1.0772 0.0469 -0.0024 0.0913 184 SER H N 4007 C CA . SER B 192 ? 1.1786 1.2557 1.0259 0.0583 0.0015 0.1006 184 SER H CA 4008 C C . SER B 192 ? 1.2758 1.3523 1.1307 0.0724 0.0059 0.0933 184 SER H C 4009 O O . SER B 192 ? 1.3431 1.4284 1.1978 0.0740 0.0052 0.0944 184 SER H O 4010 C CB . SER B 192 ? 1.1700 1.2455 1.0268 0.0640 -0.0057 0.1274 184 SER H CB 4011 O OG . SER B 192 ? 1.1838 1.2373 1.0610 0.0807 0.0049 0.1336 184 SER H OG 4012 N N . VAL B 193 ? 1.2973 1.3578 1.1522 0.0777 0.0156 0.0826 185 VAL H N 4013 C CA . VAL B 193 ? 1.2364 1.2877 1.0829 0.0888 0.0231 0.0742 185 VAL H CA 4014 C C . VAL B 193 ? 1.3984 1.4261 1.2607 0.0927 0.0395 0.0742 185 VAL H C 4015 O O . VAL B 193 ? 1.4348 1.4470 1.3089 0.0887 0.0469 0.0771 185 VAL H O 4016 C CB . VAL B 193 ? 1.1320 1.1923 0.9495 0.0930 0.0182 0.0553 185 VAL H CB 4017 C CG1 . VAL B 193 ? 1.0113 1.0937 0.8219 0.0950 0.0071 0.0546 185 VAL H CG1 4018 C CG2 . VAL B 193 ? 1.2455 1.3121 1.0661 0.0803 0.0211 0.0368 185 VAL H CG2 4019 N N . VAL B 194 ? 1.5016 1.5172 1.3608 0.0998 0.0522 0.0703 186 VAL H N 4020 C CA . VAL B 194 ? 1.5660 1.5560 1.4382 0.1023 0.0745 0.0641 186 VAL H CA 4021 C C . VAL B 194 ? 1.6595 1.6314 1.4895 0.1024 0.0854 0.0485 186 VAL H C 4022 O O . VAL B 194 ? 1.6316 1.6038 1.4372 0.1065 0.0820 0.0521 186 VAL H O 4023 C CB . VAL B 194 ? 1.3479 1.3457 1.2729 0.1134 0.0839 0.0792 186 VAL H CB 4024 C CG1 . VAL B 194 ? 1.2768 1.2978 1.2114 0.1117 0.0846 0.0789 186 VAL H CG1 4025 C CG2 . VAL B 194 ? 1.3997 1.3653 1.3413 0.1192 0.1143 0.0700 186 VAL H CG2 4026 N N . THR B 195 ? 1.7683 1.7161 1.5810 0.0965 0.1027 0.0310 187 THR H N 4027 C CA . THR B 195 ? 1.7765 1.7002 1.5367 0.0953 0.1161 0.0161 187 THR H CA 4028 C C . THR B 195 ? 1.7689 1.6599 1.5453 0.0929 0.1525 0.0103 187 THR H C 4029 O O . THR B 195 ? 1.6948 1.5760 1.5166 0.0918 0.1716 0.0076 187 THR H O 4030 C CB . THR B 195 ? 1.7781 1.7060 1.4949 0.0836 0.1103 -0.0087 187 THR H CB 4031 O OG1 . THR B 195 ? 1.7555 1.6738 1.5052 0.0673 0.1268 -0.0217 187 THR H OG1 4032 C CG2 . THR B 195 ? 1.7623 1.7340 1.4577 0.0902 0.0749 -0.0090 187 THR H CG2 4033 N N . VAL B 196 ? 1.8797 1.7471 1.6157 0.0938 0.1674 0.0084 188 VAL H N 4034 C CA . VAL B 196 ? 1.9705 1.8103 1.7258 0.0883 0.2081 -0.0010 188 VAL H CA 4035 C C . VAL B 196 ? 2.0947 1.8854 1.7622 0.0807 0.2304 -0.0134 188 VAL H C 4036 O O . VAL B 196 ? 2.0902 1.8706 1.6823 0.0878 0.2099 -0.0068 188 VAL H O 4037 C CB . VAL B 196 ? 1.7954 1.6629 1.6167 0.0919 0.2147 0.0105 188 VAL H CB 4038 C CG1 . VAL B 196 ? 1.7005 1.6169 1.6001 0.1031 0.1916 0.0258 188 VAL H CG1 4039 C CG2 . VAL B 196 ? 1.8505 1.7110 1.6268 0.0897 0.2067 0.0188 188 VAL H CG2 4040 N N . PRO B 197 ? 2.2109 1.9688 1.8840 0.0692 0.2744 -0.0305 189 PRO H N 4041 C CA . PRO B 197 ? 2.3396 2.0402 1.9232 0.0587 0.3049 -0.0411 189 PRO H CA 4042 C C . PRO B 197 ? 2.3379 2.0233 1.9042 0.0617 0.3123 -0.0260 189 PRO H C 4043 O O . PRO B 197 ? 2.2441 1.9634 1.8938 0.0595 0.3195 -0.0233 189 PRO H O 4044 C CB . PRO B 197 ? 2.3861 2.0623 2.0068 0.0434 0.3574 -0.0656 189 PRO H CB 4045 C CG . PRO B 197 ? 2.3187 2.0319 2.0295 0.0512 0.3480 -0.0670 189 PRO H CG 4046 C CD . PRO B 197 ? 2.2225 1.9890 1.9810 0.0684 0.3019 -0.0407 189 PRO H CD 4047 N N . SER B 198 ? 2.4309 2.0660 1.8866 0.0673 0.3108 -0.0167 190 SER H N 4048 C CA . SER B 198 ? 2.4388 2.0329 1.8558 0.0688 0.3291 -0.0027 190 SER H CA 4049 C C . SER B 198 ? 2.3807 1.9593 1.8494 0.0416 0.3867 -0.0226 190 SER H C 4050 O O . SER B 198 ? 2.3441 1.9328 1.8557 0.0310 0.4027 -0.0228 190 SER H O 4051 C CB . SER B 198 ? 2.6038 2.1236 1.8755 0.0835 0.3311 0.0114 190 SER H CB 4052 O OG . SER B 198 ? 2.6377 2.1961 1.8778 0.1101 0.2745 0.0233 190 SER H OG 4053 N N . SER B 199 ? 2.3760 1.9389 1.8483 0.0276 0.4191 -0.0445 191 SER H N 4054 C CA . SER B 199 ? 2.3674 1.9166 1.8871 0.0019 0.4811 -0.0703 191 SER H CA 4055 C C . SER B 199 ? 2.2756 1.9152 1.9502 0.0004 0.4787 -0.0790 191 SER H C 4056 O O . SER B 199 ? 2.2324 1.8845 1.9659 -0.0204 0.5260 -0.1021 191 SER H O 4057 C CB . SER B 199 ? 2.3797 1.8976 1.8744 -0.0090 0.5128 -0.0933 191 SER H CB 4058 O OG . SER B 199 ? 2.3068 1.8658 1.8344 0.0057 0.4734 -0.0921 191 SER H OG 4059 N N . SER B 200 ? 2.2189 1.9253 1.9559 0.0220 0.4236 -0.0614 192 SER H N 4060 C CA . SER B 200 ? 2.1169 1.9148 1.9902 0.0284 0.4106 -0.0635 192 SER H CA 4061 C C . SER B 200 ? 2.0263 1.8739 1.9418 0.0180 0.3989 -0.0608 192 SER H C 4062 O O . SER B 200 ? 2.0071 1.9402 2.0344 0.0191 0.3936 -0.0689 192 SER H O 4063 C CB . SER B 200 ? 2.0461 1.8819 1.9563 0.0550 0.3623 -0.0449 192 SER H CB 4064 O OG . SER B 200 ? 2.0520 1.8822 1.9023 0.0623 0.3169 -0.0236 192 SER H OG 4065 N N . LEU B 201 ? 1.9382 1.7363 1.7661 0.0097 0.3949 -0.0504 193 LEU H N 4066 C CA . LEU B 201 ? 1.8251 1.6594 1.6825 -0.0065 0.3895 -0.0524 193 LEU H CA 4067 C C . LEU B 201 ? 1.7497 1.6264 1.6844 -0.0399 0.4373 -0.0870 193 LEU H C 4068 O O . LEU B 201 ? 1.6791 1.5743 1.6263 -0.0676 0.4504 -0.1008 193 LEU H O 4069 C CB . LEU B 201 ? 1.9209 1.6668 1.6583 -0.0090 0.3966 -0.0382 193 LEU H CB 4070 C CG . LEU B 201 ? 1.9647 1.6944 1.6425 0.0247 0.3447 -0.0081 193 LEU H CG 4071 C CD1 . LEU B 201 ? 2.0091 1.6502 1.5702 0.0335 0.3552 0.0083 193 LEU H CD1 4072 C CD2 . LEU B 201 ? 1.9529 1.7690 1.7088 0.0347 0.2930 0.0017 193 LEU H CD2 4073 N N . GLN B 204 ? 1.6397 1.8239 1.9175 -0.0487 0.4208 -0.1369 196 GLN H N 4074 C CA . GLN B 204 ? 1.6092 1.8847 1.9641 -0.0079 0.3578 -0.1112 196 GLN H CA 4075 C C . GLN B 204 ? 1.6208 1.9207 1.9452 -0.0064 0.3026 -0.0879 196 GLN H C 4076 O O . GLN B 204 ? 1.6424 1.8587 1.8644 -0.0184 0.3021 -0.0767 196 GLN H O 4077 C CB . GLN B 204 ? 1.6154 1.8358 1.9475 0.0335 0.3477 -0.0847 196 GLN H CB 4078 C CG . GLN B 204 ? 1.6308 1.8933 1.9864 0.0723 0.2851 -0.0479 196 GLN H CG 4079 C CD . GLN B 204 ? 1.7361 2.0051 2.1478 0.1152 0.2844 -0.0339 196 GLN H CD 4080 O OE1 . GLN B 204 ? 1.9100 2.1214 2.3117 0.1159 0.3286 -0.0480 196 GLN H OE1 4081 N NE2 . GLN B 204 ? 1.6248 1.9567 2.0899 0.1515 0.2383 -0.0056 196 GLN H NE2 4082 N N . THR B 205 ? 1.5742 1.9904 1.9865 0.0107 0.2571 -0.0807 197 THR H N 4083 C CA . THR B 205 ? 1.4758 1.9242 1.8619 0.0052 0.2092 -0.0645 197 THR H CA 4084 C C . THR B 205 ? 1.3497 1.7605 1.6926 0.0464 0.1632 -0.0190 197 THR H C 4085 O O . THR B 205 ? 1.2332 1.6508 1.6140 0.0867 0.1522 0.0011 197 THR H O 4086 C CB . THR B 205 ? 1.9955 2.5988 2.4877 -0.0041 0.1817 -0.0835 197 THR H CB 4087 O OG1 . THR B 205 ? 1.9633 2.6454 2.5478 0.0474 0.1547 -0.0652 197 THR H OG1 4088 C CG2 . THR B 205 ? 2.0144 2.6633 2.5514 -0.0585 0.2322 -0.1389 197 THR H CG2 4089 N N . TYR B 206 ? 1.4237 1.7853 1.6850 0.0338 0.1453 -0.0063 198 TYR H N 4090 C CA . TYR B 206 ? 1.4962 1.8241 1.7129 0.0615 0.1072 0.0294 198 TYR H CA 4091 C C . TYR B 206 ? 1.5606 1.9295 1.7592 0.0488 0.0695 0.0384 198 TYR H C 4092 O O . TYR B 206 ? 1.6693 2.0160 1.8225 0.0160 0.0813 0.0223 198 TYR H O 4093 C CB . TYR B 206 ? 1.5350 1.7541 1.6621 0.0633 0.1241 0.0360 198 TYR H CB 4094 C CG . TYR B 206 ? 1.6513 1.8192 1.7744 0.0752 0.1571 0.0297 198 TYR H CG 4095 C CD1 . TYR B 206 ? 1.7094 1.9062 1.8993 0.1006 0.1596 0.0346 198 TYR H CD1 4096 C CD2 . TYR B 206 ? 1.6888 1.7747 1.7343 0.0640 0.1866 0.0204 198 TYR H CD2 4097 C CE1 . TYR B 206 ? 1.7447 1.8898 1.9279 0.1069 0.1959 0.0241 198 TYR H CE1 4098 C CE2 . TYR B 206 ? 1.7865 1.8251 1.8168 0.0703 0.2170 0.0122 198 TYR H CE2 4099 C CZ . TYR B 206 ? 1.7938 1.8616 1.8945 0.0881 0.2240 0.0112 198 TYR H CZ 4100 O OH . TYR B 206 ? 1.8694 1.8858 1.9531 0.0897 0.2606 -0.0018 198 TYR H OH 4101 N N . ILE B 207 ? 1.4992 1.9159 1.7233 0.0756 0.0288 0.0652 199 ILE H N 4102 C CA . ILE B 207 ? 1.3478 1.8087 1.5505 0.0624 -0.0078 0.0740 199 ILE H CA 4103 C C . ILE B 207 ? 1.3064 1.7263 1.4677 0.0909 -0.0344 0.1116 199 ILE H C 4104 O O . ILE B 207 ? 1.2834 1.6986 1.4707 0.1292 -0.0419 0.1363 199 ILE H O 4105 C CB . ILE B 207 ? 1.2401 1.8282 1.5150 0.0577 -0.0337 0.0638 199 ILE H CB 4106 C CG1 . ILE B 207 ? 1.1434 1.7664 1.4517 0.0133 0.0025 0.0160 199 ILE H CG1 4107 C CG2 . ILE B 207 ? 1.2805 1.9105 1.5179 0.0428 -0.0735 0.0740 199 ILE H CG2 4108 C CD1 . ILE B 207 ? 1.1783 1.9465 1.5797 0.0047 -0.0164 -0.0067 199 ILE H CD1 4109 N N . CYS B 208 ? 1.2872 1.6727 1.3838 0.0704 -0.0422 0.1139 200 CYS H N 4110 C CA . CYS B 208 ? 1.3438 1.6926 1.3985 0.0874 -0.0614 0.1436 200 CYS H CA 4111 C C . CYS B 208 ? 1.4522 1.8640 1.4997 0.0843 -0.0985 0.1592 200 CYS H C 4112 O O . CYS B 208 ? 1.4679 1.9314 1.5116 0.0511 -0.1062 0.1381 200 CYS H O 4113 C CB . CYS B 208 ? 1.3340 1.6116 1.3254 0.0695 -0.0461 0.1357 200 CYS H CB 4114 S SG . CYS B 208 ? 1.5788 1.8709 1.5304 0.0270 -0.0454 0.1132 200 CYS H SG 4115 N N . ASN B 209 ? 1.4849 1.8891 1.5257 0.1188 -0.1187 0.1959 201 ASN H N 4116 C CA . ASN B 209 ? 1.4551 1.9149 1.4766 0.1252 -0.1581 0.2195 201 ASN H CA 4117 C C . ASN B 209 ? 1.4616 1.8442 1.3994 0.1156 -0.1556 0.2379 201 ASN H C 4118 O O . ASN B 209 ? 1.5158 1.8207 1.4312 0.1369 -0.1390 0.2586 201 ASN H O 4119 C CB . ASN B 209 ? 1.4665 1.9700 1.5352 0.1805 -0.1817 0.2545 201 ASN H CB 4120 C CG . ASN B 209 ? 1.5314 2.0744 1.6912 0.1989 -0.1644 0.2363 201 ASN H CG 4121 O OD1 . ASN B 209 ? 1.5662 2.0486 1.7454 0.2304 -0.1391 0.2483 201 ASN H OD1 4122 N ND2 . ASN B 209 ? 1.5918 2.2373 1.8078 0.1756 -0.1733 0.2037 201 ASN H ND2 4123 N N . VAL B 210 ? 1.3929 1.7952 1.2853 0.0766 -0.1648 0.2232 202 VAL H N 4124 C CA . VAL B 210 ? 1.3532 1.6884 1.1704 0.0557 -0.1539 0.2281 202 VAL H CA 4125 C C . VAL B 210 ? 1.4180 1.7856 1.1814 0.0552 -0.1879 0.2547 202 VAL H C 4126 O O . VAL B 210 ? 1.4122 1.8667 1.1831 0.0386 -0.2155 0.2435 202 VAL H O 4127 C CB . VAL B 210 ? 1.3296 1.6490 1.1307 0.0117 -0.1289 0.1876 202 VAL H CB 4128 C CG1 . VAL B 210 ? 1.3837 1.6492 1.1169 -0.0101 -0.1171 0.1893 202 VAL H CG1 4129 C CG2 . VAL B 210 ? 1.3439 1.6278 1.1834 0.0191 -0.0994 0.1677 202 VAL H CG2 4130 N N . ASN B 211 ? 1.5239 1.8204 1.2261 0.0696 -0.1836 0.2878 203 ASN H N 4131 C CA . ASN B 211 ? 1.6353 1.9450 1.2656 0.0727 -0.2136 0.3200 203 ASN H CA 4132 C C . ASN B 211 ? 1.6985 1.9254 1.2396 0.0386 -0.1876 0.3193 203 ASN H C 4133 O O . ASN B 211 ? 1.7845 1.9212 1.3091 0.0419 -0.1519 0.3244 203 ASN H O 4134 C CB . ASN B 211 ? 1.7483 2.0497 1.3789 0.1354 -0.2356 0.3739 203 ASN H CB 4135 C CG . ASN B 211 ? 1.8772 2.2222 1.4391 0.1488 -0.2807 0.4105 203 ASN H CG 4136 O OD1 . ASN B 211 ? 1.9075 2.3706 1.5090 0.1641 -0.3263 0.4119 203 ASN H OD1 4137 N ND2 . ASN B 211 ? 1.9322 2.1879 1.3876 0.1398 -0.2679 0.4374 203 ASN H ND2 4138 N N . HIS B 212 ? 1.6444 1.9068 1.1288 0.0012 -0.2025 0.3082 204 HIS H N 4139 C CA . HIS B 212 ? 1.6475 1.8401 1.0389 -0.0338 -0.1789 0.3081 204 HIS H CA 4140 C C . HIS B 212 ? 1.9068 2.1080 1.2035 -0.0281 -0.2121 0.3473 204 HIS H C 4141 O O . HIS B 212 ? 2.0229 2.2988 1.2921 -0.0573 -0.2396 0.3316 204 HIS H O 4142 C CB . HIS B 212 ? 1.5385 1.7520 0.9305 -0.0909 -0.1570 0.2545 204 HIS H CB 4143 C CG . HIS B 212 ? 1.5379 1.6830 0.8491 -0.1302 -0.1234 0.2449 204 HIS H CG 4144 N ND1 . HIS B 212 ? 1.4814 1.6481 0.7288 -0.1767 -0.1238 0.2242 204 HIS H ND1 4145 C CD2 . HIS B 212 ? 1.5822 1.6422 0.8716 -0.1360 -0.0823 0.2448 204 HIS H CD2 4146 C CE1 . HIS B 212 ? 1.4441 1.5378 0.6327 -0.2060 -0.0837 0.2154 204 HIS H CE1 4147 N NE2 . HIS B 212 ? 1.5963 1.6285 0.8126 -0.1828 -0.0582 0.2265 204 HIS H NE2 4148 N N . LYS B 213 ? 2.0411 2.1587 1.2774 0.0062 -0.2056 0.3967 205 LYS H N 4149 C CA . LYS B 213 ? 2.0933 2.2137 1.2323 0.0297 -0.2433 0.4480 205 LYS H CA 4150 C C . LYS B 213 ? 2.0455 2.1559 1.0773 -0.0298 -0.2377 0.4313 205 LYS H C 4151 O O . LYS B 213 ? 2.1197 2.3011 1.0953 -0.0304 -0.2852 0.4469 205 LYS H O 4152 C CB . LYS B 213 ? 2.2517 2.2546 1.3373 0.0803 -0.2238 0.5065 205 LYS H CB 4153 C CG . LYS B 213 ? 2.3134 2.3250 1.4912 0.1457 -0.2316 0.5299 205 LYS H CG 4154 C CD . LYS B 213 ? 2.5125 2.3858 1.6272 0.1920 -0.1997 0.5855 205 LYS H CD 4155 C CE . LYS B 213 ? 2.5362 2.4168 1.7460 0.2571 -0.2021 0.6049 205 LYS H CE 4156 N NZ . LYS B 213 ? 2.6995 2.4284 1.8447 0.3007 -0.1602 0.6563 205 LYS H NZ 4157 N N . PRO B 214 ? 1.9891 2.0247 0.9986 -0.0822 -0.1803 0.3938 206 PRO H N 4158 C CA . PRO B 214 ? 2.0822 2.0986 0.9832 -0.1386 -0.1679 0.3786 206 PRO H CA 4159 C C . PRO B 214 ? 2.2038 2.3334 1.1055 -0.1768 -0.2022 0.3429 206 PRO H C 4160 O O . PRO B 214 ? 2.2541 2.3888 1.0456 -0.2065 -0.2165 0.3500 206 PRO H O 4161 C CB . PRO B 214 ? 2.0052 1.9492 0.9274 -0.1829 -0.0988 0.3327 206 PRO H CB 4162 C CG . PRO B 214 ? 1.9852 1.8698 0.9663 -0.1444 -0.0754 0.3488 206 PRO H CG 4163 C CD . PRO B 214 ? 1.9330 1.8923 0.9973 -0.0894 -0.1237 0.3699 206 PRO H CD 4164 N N . SER B 215 ? 2.4252 2.6342 1.4407 -0.1824 -0.2077 0.3012 207 SER H N 4170 N N . ASN B 216 ? 2.5293 2.7884 2.4495 -0.3903 -0.2054 0.9299 208 ASN H N 4171 C CA . ASN B 216 ? 2.3659 2.7022 2.3451 -0.3498 -0.2218 1.0035 208 ASN H CA 4172 C C . ASN B 216 ? 2.1759 2.6256 2.1734 -0.3681 -0.2116 0.9442 208 ASN H C 4173 O O . ASN B 216 ? 2.1519 2.7468 2.1952 -0.3469 -0.2250 0.9648 208 ASN H O 4174 C CB . ASN B 216 ? 2.3065 2.7529 2.3142 -0.3219 -0.2521 1.0563 208 ASN H CB 4175 C CG . ASN B 216 ? 2.3762 2.8757 2.4502 -0.2524 -0.2735 1.1521 208 ASN H CG 4176 O OD1 . ASN B 216 ? 2.3130 2.9638 2.4297 -0.2390 -0.2810 1.1468 208 ASN H OD1 4177 N ND2 . ASN B 216 ? 2.5284 2.9061 2.6173 -0.1996 -0.2824 1.2347 208 ASN H ND2 4178 N N . THR B 217 ? 2.0403 2.4199 2.0000 -0.4037 -0.1840 0.8675 209 THR H N 4179 C CA . THR B 217 ? 1.8868 2.3499 1.8516 -0.4206 -0.1685 0.8017 209 THR H CA 4180 C C . THR B 217 ? 1.9222 2.3154 1.9108 -0.4097 -0.1449 0.8464 209 THR H C 4181 O O . THR B 217 ? 2.0222 2.2488 2.0028 -0.4155 -0.1271 0.8667 209 THR H O 4182 C CB . THR B 217 ? 1.8128 2.2477 1.7281 -0.4535 -0.1539 0.6797 209 THR H CB 4183 O OG1 . THR B 217 ? 1.7338 2.2261 1.6514 -0.4558 -0.1764 0.6459 209 THR H OG1 4184 C CG2 . THR B 217 ? 1.7159 2.2253 1.6309 -0.4607 -0.1396 0.6019 209 THR H CG2 4185 N N . LYS B 218 ? 1.7954 2.3152 1.8245 -0.3928 -0.1408 0.8584 210 LYS H N 4186 C CA . LYS B 218 ? 1.7856 2.2532 1.8681 -0.3639 -0.1090 0.8427 210 LYS H CA 4187 C C . LYS B 218 ? 1.6986 2.3135 1.7811 -0.3795 -0.0847 0.7475 210 LYS H C 4188 O O . LYS B 218 ? 1.7133 2.5016 1.8144 -0.3612 -0.1022 0.7605 210 LYS H O 4189 C CB . LYS B 218 ? 1.8846 2.3155 2.0689 -0.2580 -0.1264 0.8942 210 LYS H CB 4190 C CG . LYS B 218 ? 1.9625 2.5238 2.1658 -0.2206 -0.1743 0.9936 210 LYS H CG 4191 C CD . LYS B 218 ? 2.2048 2.6951 2.5044 -0.1160 -0.1896 1.0560 210 LYS H CD 4192 C CE . LYS B 218 ? 2.2749 2.8120 2.6793 -0.0340 -0.1700 0.9922 210 LYS H CE 4193 N NZ . LYS B 218 ? 2.4492 2.8554 2.9414 0.0604 -0.1697 1.0411 210 LYS H NZ 4194 N N . VAL B 219 ? 1.6406 2.1895 1.6947 -0.4197 -0.0439 0.6534 211 VAL H N 4195 C CA . VAL B 219 ? 1.4772 2.1486 1.5247 -0.4367 -0.0140 0.5577 211 VAL H CA 4196 C C . VAL B 219 ? 1.4876 2.0790 1.6007 -0.3851 0.0220 0.4679 211 VAL H C 4197 O O . VAL B 219 ? 1.6086 2.0308 1.7262 -0.3839 0.0375 0.4505 211 VAL H O 4198 C CB . VAL B 219 ? 1.0807 1.7086 1.0307 -0.4756 -0.0157 0.4581 211 VAL H CB 4199 C CG1 . VAL B 219 ? 1.0047 1.7028 0.9409 -0.4585 0.0002 0.3501 211 VAL H CG1 4200 C CG2 . VAL B 219 ? 1.1292 1.7734 1.0510 -0.4617 -0.0687 0.4632 211 VAL H CG2 4201 N N . ASP B 220 ? 1.4052 2.1193 1.5690 -0.3441 0.0372 0.4096 212 ASP H N 4202 C CA . ASP B 220 ? 1.4994 2.1572 1.7038 -0.3143 0.0795 0.3073 212 ASP H CA 4203 C C . ASP B 220 ? 1.4547 2.2086 1.5965 -0.3744 0.1119 0.2221 212 ASP H C 4204 O O . ASP B 220 ? 1.3441 2.2652 1.4772 -0.3837 0.1081 0.2213 212 ASP H O 4205 C CB . ASP B 220 ? 1.5289 2.2420 1.8471 -0.2143 0.0787 0.3002 212 ASP H CB 4206 C CG . ASP B 220 ? 1.6208 2.2257 2.0090 -0.1444 0.0537 0.3803 212 ASP H CG 4207 O OD1 . ASP B 220 ? 1.7702 2.2012 2.1348 -0.1618 0.0575 0.3998 212 ASP H OD1 4208 O OD2 . ASP B 220 ? 1.5056 2.2002 1.9753 -0.0701 0.0324 0.4226 212 ASP H OD2 4209 N N . LYS B 221 ? 1.5287 2.1779 1.6266 -0.4151 0.1455 0.1498 213 LYS H N 4210 C CA . LYS B 221 ? 1.5046 2.2289 1.5461 -0.4583 0.1781 0.0640 213 LYS H CA 4211 C C . LYS B 221 ? 1.5559 2.2545 1.6355 -0.4287 0.2233 -0.0412 213 LYS H C 4212 O O . LYS B 221 ? 1.7108 2.2596 1.7987 -0.4224 0.2395 -0.0785 213 LYS H O 4213 C CB . LYS B 221 ? 1.5580 2.1258 1.4853 -0.4722 0.1441 0.0469 213 LYS H CB 4214 C CG . LYS B 221 ? 1.5678 2.1047 1.4147 -0.4304 0.1027 -0.0237 213 LYS H CG 4215 C CD . LYS B 221 ? 1.5924 2.1654 1.4032 -0.4118 0.0374 -0.0010 213 LYS H CD 4216 C CE . LYS B 221 ? 1.5638 2.0936 1.3612 -0.3821 0.0160 -0.0555 213 LYS H CE 4217 N NZ . LYS B 221 ? 1.5980 2.1347 1.4215 -0.3458 -0.0107 -0.0301 213 LYS H NZ 4218 N N . ARG B 222 ? 1.4389 2.2450 1.5336 -0.3899 0.2299 -0.0885 214 ARG H N 4219 C CA . ARG B 222 ? 1.3946 2.1754 1.5036 -0.3630 0.2665 -0.1898 214 ARG H CA 4220 C C . ARG B 222 ? 1.4353 2.0745 1.4235 -0.3811 0.2275 -0.2332 214 ARG H C 4221 O O . ARG B 222 ? 1.3697 1.9736 1.2885 -0.3732 0.1592 -0.2120 214 ARG H O 4222 C CB . ARG B 222 ? 1.3002 2.1704 1.4452 -0.3001 0.2534 -0.2086 214 ARG H CB 4223 C CG . ARG B 222 ? 1.3402 2.1746 1.5100 -0.2666 0.2832 -0.2980 214 ARG H CG 4224 C CD . ARG B 222 ? 1.4002 2.2932 1.5891 -0.2171 0.2585 -0.2991 214 ARG H CD 4225 N NE . ARG B 222 ? 1.5923 2.4553 1.8239 -0.1814 0.2881 -0.3687 214 ARG H NE 4226 C CZ . ARG B 222 ? 1.6606 2.5687 1.9316 -0.1354 0.2842 -0.3778 214 ARG H CZ 4227 N NH1 . ARG B 222 ? 1.6163 2.6073 1.8923 -0.1210 0.2555 -0.3303 214 ARG H NH1 4228 N NH2 . ARG B 222 ? 1.7060 2.5665 2.0056 -0.1077 0.3073 -0.4325 214 ARG H NH2 4229 N N . VAL B 223 ? 1.6140 2.1809 1.6047 -0.4011 0.2672 -0.3027 215 VAL H N 4230 C CA . VAL B 223 ? 1.7073 2.1719 1.6241 -0.4241 0.2208 -0.3386 215 VAL H CA 4231 C C . VAL B 223 ? 1.8205 2.2871 1.7978 -0.3977 0.2139 -0.3769 215 VAL H C 4232 O O . VAL B 223 ? 1.7177 2.1808 1.7475 -0.3988 0.2698 -0.4359 215 VAL H O 4233 C CB . VAL B 223 ? 1.7292 2.0948 1.6014 -0.4736 0.2581 -0.3613 215 VAL H CB 4234 C CG1 . VAL B 223 ? 1.6723 2.0172 1.4942 -0.4857 0.2328 -0.2750 215 VAL H CG1 4235 C CG2 . VAL B 223 ? 1.8701 2.2245 1.8375 -0.4890 0.3583 -0.4088 215 VAL H CG2 4239 O O . GLU B 224 ? 1.9698 2.3786 2.0195 -0.3384 0.1694 -0.3369 216 GLU H O 4245 N N . VAL C 3 ? 2.4601 2.7997 3.0066 -0.3569 -0.1400 0.6557 3 VAL L N 4246 C CA . VAL C 3 ? 2.4597 2.7372 2.8806 -0.3549 -0.1220 0.5792 3 VAL L CA 4247 C C . VAL C 3 ? 2.4668 2.6709 2.7933 -0.3985 -0.1866 0.5736 3 VAL L C 4248 O O . VAL C 3 ? 2.4782 2.6837 2.8272 -0.4288 -0.2416 0.6203 3 VAL L O 4249 C CB . VAL C 3 ? 2.4816 2.7310 2.8968 -0.3284 -0.0849 0.5401 3 VAL L CB 4250 C CG1 . VAL C 3 ? 2.4423 2.6679 2.7699 -0.3092 -0.0389 0.4635 3 VAL L CG1 4251 C CG2 . VAL C 3 ? 2.4690 2.7799 3.0104 -0.2923 -0.0466 0.5706 3 VAL L CG2 4252 N N . LEU C 4 ? 2.4526 2.5923 2.6757 -0.4011 -0.1805 0.5170 4 LEU L N 4253 C CA . LEU C 4 ? 2.4236 2.4921 2.5462 -0.4358 -0.2321 0.5033 4 LEU L CA 4254 C C . LEU C 4 ? 2.3323 2.3499 2.4163 -0.4471 -0.2521 0.5030 4 LEU L C 4255 O O . LEU C 4 ? 2.3193 2.3192 2.3721 -0.4295 -0.2143 0.4648 4 LEU L O 4256 C CB . LEU C 4 ? 2.4477 2.4864 2.4749 -0.4316 -0.2093 0.4411 4 LEU L CB 4257 C CG . LEU C 4 ? 2.3835 2.4593 2.4250 -0.4299 -0.2027 0.4415 4 LEU L CG 4258 C CD1 . LEU C 4 ? 2.3565 2.3903 2.3016 -0.4303 -0.1907 0.3833 4 LEU L CD1 4259 C CD2 . LEU C 4 ? 2.3700 2.4508 2.4509 -0.4598 -0.2634 0.4960 4 LEU L CD2 4260 N N . THR C 5 ? 2.2696 2.2648 2.3571 -0.4785 -0.3147 0.5492 5 THR L N 4261 C CA . THR C 5 ? 2.2071 2.1559 2.2485 -0.4935 -0.3388 0.5555 5 THR L CA 4262 C C . THR C 5 ? 2.1260 2.0014 2.0294 -0.5229 -0.3796 0.5277 5 THR L C 4263 O O . THR C 5 ? 2.0291 1.8796 1.9067 -0.5523 -0.4390 0.5501 5 THR L O 4264 C CB . THR C 5 ? 2.2309 2.2026 2.3658 -0.5089 -0.3828 0.6293 5 THR L CB 4265 O OG1 . THR C 5 ? 2.2868 2.2594 2.4374 -0.5393 -0.4446 0.6702 5 THR L OG1 4266 C CG2 . THR C 5 ? 2.1504 2.1913 2.4248 -0.4736 -0.3358 0.6543 5 THR L CG2 4267 N N . GLN C 6 ? 2.1070 1.9469 1.9256 -0.5146 -0.3488 0.4819 6 GLN L N 4268 C CA . GLN C 6 ? 2.1064 1.8814 1.7880 -0.5321 -0.3684 0.4444 6 GLN L CA 4269 C C . GLN C 6 ? 2.1652 1.9098 1.7985 -0.5505 -0.3940 0.4684 6 GLN L C 4270 O O . GLN C 6 ? 2.1331 1.8996 1.8165 -0.5384 -0.3671 0.4843 6 GLN L O 4271 C CB . GLN C 6 ? 2.0103 1.7772 1.6380 -0.5084 -0.3111 0.3803 6 GLN L CB 4272 C CG . GLN C 6 ? 1.9989 1.7065 1.4993 -0.5190 -0.3231 0.3363 6 GLN L CG 4273 C CD . GLN C 6 ? 1.8678 1.5773 1.3384 -0.4943 -0.2658 0.2805 6 GLN L CD 4274 O OE1 . GLN C 6 ? 1.7145 1.4680 1.2554 -0.4734 -0.2282 0.2719 6 GLN L OE1 4275 N NE2 . GLN C 6 ? 1.8977 1.5607 1.2629 -0.4964 -0.2598 0.2435 6 GLN L NE2 4276 N N . SER C 7 ? 2.2177 1.9095 1.7518 -0.5803 -0.4483 0.4713 7 SER L N 4277 C CA . SER C 7 ? 2.2718 1.9344 1.7406 -0.6011 -0.4761 0.4954 7 SER L CA 4278 C C . SER C 7 ? 2.3577 1.9516 1.6635 -0.6183 -0.5008 0.4559 7 SER L C 4279 O O . SER C 7 ? 2.3265 1.8922 1.5921 -0.6197 -0.5148 0.4224 7 SER L O 4280 C CB . SER C 7 ? 2.3337 2.0148 1.8830 -0.6259 -0.5372 0.5687 7 SER L CB 4281 O OG . SER C 7 ? 2.4056 2.0600 1.9320 -0.6517 -0.6002 0.5787 7 SER L OG 4282 N N . PRO C 8 ? 2.4591 2.0271 1.6710 -0.6284 -0.5012 0.4583 8 PRO L N 4283 C CA . PRO C 8 ? 2.4448 2.0471 1.7128 -0.6264 -0.4825 0.5004 8 PRO L CA 4284 C C . PRO C 8 ? 2.3658 1.9957 1.6682 -0.5927 -0.4043 0.4653 8 PRO L C 4285 O O . PRO C 8 ? 2.4334 2.0528 1.6964 -0.5746 -0.3686 0.4100 8 PRO L O 4286 C CB . PRO C 8 ? 2.5243 2.0846 1.6560 -0.6531 -0.5155 0.5129 8 PRO L CB 4287 C CG . PRO C 8 ? 2.5424 2.0509 1.5336 -0.6483 -0.5054 0.4457 8 PRO L CG 4288 C CD . PRO C 8 ? 2.5217 2.0250 1.5654 -0.6432 -0.5226 0.4232 8 PRO L CD 4289 N N . ALA C 9 ? 2.2518 1.9147 1.6350 -0.5854 -0.3827 0.4990 9 ALA L N 4290 C CA . ALA C 9 ? 2.1753 1.8598 1.5976 -0.5573 -0.3167 0.4701 9 ALA L CA 4291 C C . ALA C 9 ? 2.1822 1.8412 1.4846 -0.5542 -0.2833 0.4294 9 ALA L C 4292 O O . ALA C 9 ? 2.0879 1.7518 1.3887 -0.5316 -0.2364 0.3807 9 ALA L O 4293 C CB . ALA C 9 ? 2.1739 1.8869 1.6997 -0.5550 -0.3115 0.5189 9 ALA L CB 4294 N N . THR C 10 ? 2.2841 1.9189 1.4855 -0.5769 -0.3076 0.4516 10 THR L N 4295 C CA . THR C 10 ? 2.3479 1.9657 1.4356 -0.5724 -0.2717 0.4199 10 THR L CA 4296 C C . THR C 10 ? 2.4772 2.0485 1.4092 -0.5920 -0.3066 0.4083 10 THR L C 4297 O O . THR C 10 ? 2.5676 2.1181 1.4755 -0.6171 -0.3686 0.4374 10 THR L O 4298 C CB . THR C 10 ? 2.2973 1.9391 1.4052 -0.5772 -0.2505 0.4619 10 THR L CB 4299 O OG1 . THR C 10 ? 2.3234 1.9613 1.4163 -0.6070 -0.3041 0.5239 10 THR L OG1 4300 C CG2 . THR C 10 ? 2.1990 1.8767 1.4570 -0.5579 -0.2189 0.4701 10 THR L CG2 4301 N N . LEU C 11 ? 2.4827 2.0355 1.3107 -0.5789 -0.2676 0.3620 11 LEU L N 4302 C CA . LEU C 11 ? 2.5805 2.0815 1.2526 -0.5907 -0.2953 0.3364 11 LEU L CA 4303 C C . LEU C 11 ? 2.6550 2.1547 1.2170 -0.5783 -0.2427 0.3144 11 LEU L C 4304 O O . LEU C 11 ? 2.5856 2.0924 1.1517 -0.5509 -0.1881 0.2690 11 LEU L O 4305 C CB . LEU C 11 ? 2.5198 1.9869 1.1866 -0.5806 -0.3099 0.2839 11 LEU L CB 4306 C CG . LEU C 11 ? 2.6208 2.0233 1.1603 -0.6013 -0.3698 0.2671 11 LEU L CG 4307 C CD1 . LEU C 11 ? 2.7039 2.1065 1.2450 -0.6370 -0.4350 0.3321 11 LEU L CD1 4308 C CD2 . LEU C 11 ? 2.5984 1.9744 1.1778 -0.5967 -0.3964 0.2330 11 LEU L CD2 4309 N N . SER C 12 ? 2.7829 2.2781 1.2493 -0.5990 -0.2591 0.3509 12 SER L N 4310 C CA . SER C 12 ? 2.8714 2.3731 1.2259 -0.5883 -0.2078 0.3390 12 SER L CA 4311 C C . SER C 12 ? 2.9893 2.4359 1.1853 -0.5838 -0.2245 0.2890 12 SER L C 4312 O O . SER C 12 ? 3.0613 2.4861 1.2076 -0.6023 -0.2784 0.3056 12 SER L O 4313 C CB . SER C 12 ? 2.9578 2.5004 1.3221 -0.6087 -0.2075 0.4128 12 SER L CB 4314 O OG . SER C 12 ? 2.8797 2.4691 1.4178 -0.6046 -0.1926 0.4487 12 SER L OG 4315 N N . LEU C 13 ? 3.0502 2.4775 1.1944 -0.5524 -0.1782 0.2229 13 LEU L N 4316 C CA . LEU C 13 ? 3.2697 2.6441 1.2956 -0.5367 -0.1920 0.1655 13 LEU L CA 4317 C C . LEU C 13 ? 3.3418 2.7246 1.2912 -0.4965 -0.1192 0.1183 13 LEU L C 4318 O O . LEU C 13 ? 3.2703 2.6932 1.2698 -0.4779 -0.0554 0.1168 13 LEU L O 4319 C CB . LEU C 13 ? 3.3136 2.6307 1.3564 -0.5384 -0.2373 0.1212 13 LEU L CB 4320 C CG . LEU C 13 ? 3.2879 2.5912 1.3960 -0.5758 -0.3182 0.1636 13 LEU L CG 4321 C CD1 . LEU C 13 ? 3.2484 2.5048 1.3873 -0.5739 -0.3535 0.1217 13 LEU L CD1 4322 C CD2 . LEU C 13 ? 3.3586 2.6444 1.4018 -0.5990 -0.3727 0.1925 13 LEU L CD2 4323 N N . SER C 14 ? 3.4709 2.8181 1.3018 -0.4829 -0.1297 0.0819 14 SER L N 4324 C CA . SER C 14 ? 3.5518 2.9082 1.3042 -0.4403 -0.0622 0.0357 14 SER L CA 4325 C C . SER C 14 ? 3.5390 2.8418 1.2889 -0.4141 -0.0576 -0.0401 14 SER L C 4326 O O . SER C 14 ? 3.6072 2.8548 1.3741 -0.4311 -0.1200 -0.0585 14 SER L O 4327 C CB . SER C 14 ? 3.7740 3.1216 1.3944 -0.4357 -0.0745 0.0324 14 SER L CB 4328 O OG . SER C 14 ? 3.8158 3.1982 1.4466 -0.4695 -0.1044 0.1065 14 SER L OG 4329 N N . PRO C 15 ? 3.4863 2.8071 1.2224 -0.3727 0.0150 -0.0803 15 PRO L N 4330 C CA . PRO C 15 ? 3.4987 2.7693 1.2258 -0.3416 0.0256 -0.1549 15 PRO L CA 4331 C C . PRO C 15 ? 3.5844 2.7801 1.2110 -0.3365 -0.0267 -0.2075 15 PRO L C 4332 O O . PRO C 15 ? 3.6753 2.8728 1.1966 -0.3311 -0.0280 -0.2096 15 PRO L O 4333 C CB . PRO C 15 ? 3.5353 2.8551 1.2510 -0.2980 0.1177 -0.1732 15 PRO L CB 4334 C CG . PRO C 15 ? 3.4414 2.8404 1.2162 -0.3136 0.1537 -0.1008 15 PRO L CG 4335 C CD . PRO C 15 ? 3.4542 2.8515 1.2022 -0.3542 0.0923 -0.0483 15 PRO L CD 4336 N N . GLY C 16 ? 3.5524 2.6848 1.2117 -0.3390 -0.0708 -0.2476 16 GLY L N 4337 C CA . GLY C 16 ? 3.6539 2.7114 1.2289 -0.3378 -0.1261 -0.2951 16 GLY L CA 4338 C C . GLY C 16 ? 3.6189 2.6365 1.2218 -0.3846 -0.2199 -0.2632 16 GLY L C 4339 O O . GLY C 16 ? 3.6860 2.6346 1.2785 -0.3898 -0.2763 -0.2990 16 GLY L O 4340 N N . GLU C 17 ? 3.5269 2.5904 1.1741 -0.4190 -0.2370 -0.1918 17 GLU L N 4341 C CA . GLU C 17 ? 3.5196 2.5588 1.2062 -0.4646 -0.3226 -0.1493 17 GLU L CA 4342 C C . GLU C 17 ? 3.4644 2.4868 1.2687 -0.4766 -0.3533 -0.1481 17 GLU L C 4343 O O . GLU C 17 ? 3.3529 2.3805 1.2020 -0.4510 -0.3093 -0.1807 17 GLU L O 4344 C CB . GLU C 17 ? 3.4341 2.5345 1.1486 -0.4945 -0.3257 -0.0709 17 GLU L CB 4345 C CG . GLU C 17 ? 3.5844 2.7100 1.1877 -0.4871 -0.3004 -0.0595 17 GLU L CG 4346 C CD . GLU C 17 ? 3.5221 2.7076 1.1652 -0.5184 -0.3078 0.0238 17 GLU L CD 4347 O OE1 . GLU C 17 ? 3.6162 2.8108 1.1747 -0.5276 -0.3209 0.0467 17 GLU L OE1 4348 O OE2 . GLU C 17 ? 3.3072 2.5318 1.0665 -0.5329 -0.3004 0.0664 17 GLU L OE2 4349 N N . THR C 18 ? 3.5240 2.5294 1.3810 -0.5155 -0.4295 -0.1078 18 THR L N 4350 C CA . THR C 18 ? 3.4749 2.4756 1.4493 -0.5293 -0.4619 -0.0963 18 THR L CA 4351 C C . THR C 18 ? 3.3782 2.4393 1.4517 -0.5614 -0.4780 -0.0209 18 THR L C 4352 O O . THR C 18 ? 3.4367 2.5110 1.5000 -0.5885 -0.5140 0.0281 18 THR L O 4353 C CB . THR C 18 ? 3.5210 2.4508 1.4961 -0.5450 -0.5411 -0.1134 18 THR L CB 4354 O OG1 . THR C 18 ? 3.6438 2.5157 1.5400 -0.5118 -0.5249 -0.1884 18 THR L OG1 4355 C CG2 . THR C 18 ? 3.3382 2.2774 1.4476 -0.5634 -0.5782 -0.0859 18 THR L CG2 4356 N N . ALA C 19 ? 3.1850 2.2845 1.3550 -0.5572 -0.4513 -0.0118 19 ALA L N 4357 C CA . ALA C 19 ? 3.0328 2.1923 1.3039 -0.5828 -0.4638 0.0551 19 ALA L CA 4358 C C . ALA C 19 ? 2.9050 2.0612 1.2808 -0.6057 -0.5285 0.0816 19 ALA L C 4359 O O . ALA C 19 ? 2.9111 2.0458 1.3244 -0.5937 -0.5312 0.0470 19 ALA L O 4360 C CB . ALA C 19 ? 2.9481 2.1734 1.2980 -0.5545 -0.3820 0.0536 19 ALA L CB 4361 N N . ILE C 20 ? 2.8189 2.0037 1.2596 -0.6358 -0.5773 0.1477 20 ILE L N 4362 C CA . ILE C 20 ? 2.7320 1.9347 1.3030 -0.6533 -0.6286 0.1849 20 ILE L CA 4363 C C . ILE C 20 ? 2.6970 1.9908 1.4311 -0.6483 -0.5994 0.2430 20 ILE L C 4364 O O . ILE C 20 ? 2.7361 2.0599 1.5021 -0.6657 -0.6181 0.2983 20 ILE L O 4365 C CB . ILE C 20 ? 2.7773 1.9356 1.3274 -0.6892 -0.7174 0.2156 20 ILE L CB 4366 C CG1 . ILE C 20 ? 2.8525 1.9250 1.3026 -0.6793 -0.7358 0.1535 20 ILE L CG1 4367 C CG2 . ILE C 20 ? 2.7042 1.8970 1.3998 -0.7118 -0.7709 0.2707 20 ILE L CG2 4368 C CD1 . ILE C 20 ? 2.9327 1.9715 1.2361 -0.6641 -0.7047 0.1147 20 ILE L CD1 4369 N N . ILE C 21 ? 2.6476 1.9831 1.4814 -0.6231 -0.5531 0.2282 21 ILE L N 4370 C CA . ILE C 21 ? 2.5495 1.9664 1.5344 -0.6125 -0.5213 0.2709 21 ILE L CA 4371 C C . ILE C 21 ? 2.5035 1.9438 1.6021 -0.6274 -0.5686 0.3103 21 ILE L C 4372 O O . ILE C 21 ? 2.5736 1.9795 1.6615 -0.6334 -0.5998 0.2891 21 ILE L O 4373 C CB . ILE C 21 ? 2.5294 1.9826 1.5516 -0.5769 -0.4424 0.2333 21 ILE L CB 4374 C CG1 . ILE C 21 ? 2.6382 2.0716 1.5563 -0.5622 -0.3953 0.1970 21 ILE L CG1 4375 C CG2 . ILE C 21 ? 2.4177 1.9481 1.5810 -0.5644 -0.4097 0.2708 21 ILE L CG2 4376 C CD1 . ILE C 21 ? 2.5895 2.0480 1.5341 -0.5302 -0.3266 0.1561 21 ILE L CD1 4377 N N . SER C 22 ? 2.4191 1.9179 1.6315 -0.6330 -0.5745 0.3702 22 SER L N 4378 C CA . SER C 22 ? 2.4210 1.9540 1.7524 -0.6471 -0.6170 0.4196 22 SER L CA 4379 C C . SER C 22 ? 2.4080 2.0245 1.8738 -0.6179 -0.5562 0.4358 22 SER L C 4380 O O . SER C 22 ? 2.3783 2.0238 1.8568 -0.5951 -0.4988 0.4256 22 SER L O 4381 C CB . SER C 22 ? 2.4364 1.9673 1.7926 -0.6804 -0.6851 0.4838 22 SER L CB 4382 O OG . SER C 22 ? 2.3612 1.9293 1.8412 -0.6944 -0.7264 0.5359 22 SER L OG 4383 N N . CYS C 23 ? 2.4542 2.1091 2.0186 -0.6184 -0.5685 0.4608 23 CYS L N 4384 C CA . CYS C 23 ? 2.3779 2.1139 2.0610 -0.5895 -0.5106 0.4747 23 CYS L CA 4385 C C . CYS C 23 ? 2.2629 2.0544 2.0761 -0.6009 -0.5439 0.5407 23 CYS L C 4386 O O . CYS C 23 ? 2.1224 1.8965 1.9418 -0.6222 -0.5929 0.5537 23 CYS L O 4387 C CB . CYS C 23 ? 2.3550 2.0911 2.0074 -0.5667 -0.4627 0.4187 23 CYS L CB 4388 S SG . CYS C 23 ? 2.4662 2.2875 2.2138 -0.5268 -0.3797 0.4124 23 CYS L SG 4389 N N . ARG C 24 ? 2.2829 2.1404 2.2052 -0.5864 -0.5184 0.5846 24 ARG L N 4390 C CA . ARG C 24 ? 2.2756 2.2018 2.3376 -0.5900 -0.5357 0.6515 24 ARG L CA 4391 C C . ARG C 24 ? 2.2452 2.2532 2.3985 -0.5532 -0.4654 0.6509 24 ARG L C 4392 O O . ARG C 24 ? 2.2203 2.2578 2.3921 -0.5201 -0.4017 0.6285 24 ARG L O 4393 C CB . ARG C 24 ? 2.2901 2.2381 2.4263 -0.5998 -0.5627 0.7118 24 ARG L CB 4394 C CG . ARG C 24 ? 2.2719 2.2876 2.5555 -0.6086 -0.5914 0.7898 24 ARG L CG 4395 C CD . ARG C 24 ? 2.2994 2.3326 2.6587 -0.6192 -0.6223 0.8512 24 ARG L CD 4396 N NE . ARG C 24 ? 2.3948 2.3467 2.6452 -0.6580 -0.6924 0.8489 24 ARG L NE 4397 C CZ . ARG C 24 ? 2.4669 2.3797 2.6951 -0.7019 -0.7801 0.8807 24 ARG L CZ 4398 N NH1 . ARG C 24 ? 2.4496 2.3991 2.7679 -0.7136 -0.8085 0.9204 24 ARG L NH1 4399 N NH2 . ARG C 24 ? 2.5621 2.3981 2.6736 -0.7347 -0.8400 0.8721 24 ARG L NH2 4400 N N . THR C 25 ? 2.2689 2.3105 2.4766 -0.5618 -0.4827 0.6779 25 THR L N 4401 C CA . THR C 25 ? 2.2499 2.3753 2.5419 -0.5333 -0.4264 0.6890 25 THR L CA 4402 C C . THR C 25 ? 2.2295 2.4280 2.6666 -0.5410 -0.4500 0.7752 25 THR L C 4403 O O . THR C 25 ? 2.2810 2.4546 2.7433 -0.5749 -0.5209 0.8218 25 THR L O 4404 C CB . THR C 25 ? 2.3117 2.4302 2.5722 -0.5425 -0.4357 0.6716 25 THR L CB 4405 O OG1 . THR C 25 ? 2.3864 2.5005 2.6978 -0.5794 -0.5103 0.7280 25 THR L OG1 4406 C CG2 . THR C 25 ? 2.3738 2.4065 2.4931 -0.5454 -0.4358 0.5957 25 THR L CG2 4407 N N . SER C 26 ? 2.1858 2.4763 2.7168 -0.5098 -0.3910 0.7973 26 SER L N 4408 C CA . SER C 26 ? 2.1821 2.5579 2.8655 -0.5113 -0.4017 0.8839 26 SER L CA 4409 C C . SER C 26 ? 2.0931 2.5401 2.8312 -0.5074 -0.3825 0.9115 26 SER L C 4410 O O . SER C 26 ? 2.0481 2.5731 2.9155 -0.5133 -0.3948 0.9906 26 SER L O 4411 C CB . SER C 26 ? 2.2252 2.6571 2.9856 -0.4697 -0.3385 0.8920 26 SER L CB 4412 O OG . SER C 26 ? 2.2315 2.6934 2.9581 -0.4271 -0.2550 0.8362 26 SER L OG 4413 N N . GLN C 27 ? 2.0879 2.5075 2.7294 -0.5006 -0.3570 0.8511 27 GLN L N 4414 C CA . GLN C 27 ? 2.0379 2.5173 2.7024 -0.4945 -0.3308 0.8629 27 GLN L CA 4415 C C . GLN C 27 ? 2.0389 2.4409 2.6255 -0.5313 -0.3933 0.8413 27 GLN L C 4416 O O . GLN C 27 ? 2.0437 2.3529 2.5143 -0.5376 -0.4086 0.7762 27 GLN L O 4417 C CB . GLN C 27 ? 1.9958 2.5169 2.6193 -0.4494 -0.2398 0.8095 27 GLN L CB 4418 C CG . GLN C 27 ? 1.9819 2.5557 2.6563 -0.4063 -0.1728 0.8059 27 GLN L CG 4419 C CD . GLN C 27 ? 2.3678 3.0667 3.1455 -0.3757 -0.1129 0.8553 27 GLN L CD 4420 O OE1 . GLN C 27 ? 2.3415 3.0852 3.1072 -0.3756 -0.0947 0.8615 27 GLN L OE1 4421 N NE2 . GLN C 27 ? 2.3759 3.1332 3.2586 -0.3508 -0.0842 0.8954 27 GLN L NE2 4422 N N . SER C 28 ? 2.0663 2.5017 2.7157 -0.5554 -0.4306 0.8945 28 SER L N 4423 C CA . SER C 28 ? 2.1328 2.4824 2.7066 -0.5872 -0.4907 0.8656 28 SER L CA 4424 C C . SER C 28 ? 2.0459 2.4017 2.5588 -0.5696 -0.4457 0.8182 28 SER L C 4425 O O . SER C 28 ? 1.9972 2.4399 2.5444 -0.5410 -0.3790 0.8276 28 SER L O 4426 C CB . SER C 28 ? 2.2328 2.5914 2.8973 -0.6262 -0.5711 0.9396 28 SER L CB 4427 O OG . SER C 28 ? 2.3573 2.6763 3.0371 -0.6421 -0.6328 0.9586 28 SER L OG 4428 N N . GLY C 29 ? 2.0209 2.2794 2.4365 -0.5861 -0.4833 0.7639 29 GLY L N 4429 C CA . GLY C 29 ? 1.9116 2.1564 2.2569 -0.5710 -0.4476 0.7096 29 GLY L CA 4430 C C . GLY C 29 ? 1.8021 1.9337 2.0210 -0.5724 -0.4627 0.6292 29 GLY L C 4431 O O . GLY C 29 ? 1.7696 1.8409 1.9443 -0.5805 -0.4889 0.6116 29 GLY L O 4432 N N . SER C 30 ? 1.7237 1.8324 1.8888 -0.5646 -0.4455 0.5854 30 SER L N 4433 C CA . SER C 30 ? 1.7040 1.7161 1.7551 -0.5604 -0.4485 0.5079 30 SER L CA 4434 C C . SER C 30 ? 1.6963 1.6817 1.6776 -0.5411 -0.4111 0.4623 30 SER L C 4435 O O . SER C 30 ? 1.6208 1.6662 1.6166 -0.5155 -0.3503 0.4577 30 SER L O 4436 C CB . SER C 30 ? 1.7652 1.8038 1.8017 -0.5437 -0.4079 0.4818 30 SER L CB 4437 O OG . SER C 30 ? 1.8065 1.8871 1.9175 -0.5597 -0.4343 0.5323 30 SER L OG 4438 N N . LEU C 31 ? 1.8409 1.7380 1.7458 -0.5527 -0.4461 0.4291 31 LEU L N 4439 C CA . LEU C 31 ? 1.7925 1.6642 1.6293 -0.5366 -0.4117 0.3897 31 LEU L CA 4440 C C . LEU C 31 ? 1.7670 1.5644 1.5004 -0.5292 -0.4031 0.3213 31 LEU L C 4441 O O . LEU C 31 ? 1.8152 1.5488 1.5131 -0.5445 -0.4485 0.3059 31 LEU L O 4442 C CB . LEU C 31 ? 1.7948 1.6377 1.6251 -0.5538 -0.4508 0.4137 31 LEU L CB 4443 C CG . LEU C 31 ? 1.8440 1.6648 1.6066 -0.5372 -0.4124 0.3764 31 LEU L CG 4444 C CD1 . LEU C 31 ? 1.8591 1.7164 1.6809 -0.5404 -0.4175 0.4237 31 LEU L CD1 4445 C CD2 . LEU C 31 ? 1.9687 1.6938 1.6114 -0.5476 -0.4398 0.3291 31 LEU L CD2 4446 N N . ALA C 32 ? 1.6906 1.4949 1.3808 -0.5049 -0.3456 0.2809 32 ALA L N 4447 C CA . ALA C 32 ? 1.7019 1.4502 1.3092 -0.4945 -0.3291 0.2218 32 ALA L CA 4448 C C . ALA C 32 ? 1.7653 1.4801 1.2999 -0.4857 -0.3050 0.1910 32 ALA L C 4449 O O . ALA C 32 ? 1.8798 1.6261 1.4393 -0.4830 -0.2901 0.2128 32 ALA L O 4450 C CB . ALA C 32 ? 1.6320 1.4256 1.2635 -0.4752 -0.2828 0.2047 32 ALA L CB 4451 N N . TRP C 33 ? 1.7157 1.3679 1.1651 -0.4809 -0.3015 0.1437 33 TRP L N 4452 C CA . TRP C 33 ? 1.7410 1.3689 1.1221 -0.4729 -0.2752 0.1199 33 TRP L CA 4453 C C . TRP C 33 ? 1.7250 1.3541 1.0777 -0.4500 -0.2226 0.0759 33 TRP L C 4454 O O . TRP C 33 ? 1.7394 1.3473 1.0814 -0.4437 -0.2228 0.0499 33 TRP L O 4455 C CB . TRP C 33 ? 1.8840 1.4349 1.1741 -0.4885 -0.3182 0.1063 33 TRP L CB 4456 C CG . TRP C 33 ? 1.9527 1.4924 1.2583 -0.5157 -0.3782 0.1501 33 TRP L CG 4457 C CD1 . TRP C 33 ? 1.9736 1.4820 1.2942 -0.5376 -0.4410 0.1673 33 TRP L CD1 4458 C CD2 . TRP C 33 ? 1.9717 1.5296 1.2860 -0.5258 -0.3861 0.1858 33 TRP L CD2 4459 N NE1 . TRP C 33 ? 1.9958 1.5047 1.3347 -0.5617 -0.4881 0.2126 33 TRP L NE1 4460 C CE2 . TRP C 33 ? 1.9790 1.5188 1.3145 -0.5543 -0.4548 0.2252 33 TRP L CE2 4461 C CE3 . TRP C 33 ? 1.9733 1.5608 1.2884 -0.5148 -0.3452 0.1919 33 TRP L CE3 4462 C CZ2 . TRP C 33 ? 2.0114 1.5649 1.3689 -0.5715 -0.4828 0.2716 33 TRP L CZ2 4463 C CZ3 . TRP C 33 ? 2.0004 1.5987 1.3376 -0.5308 -0.3722 0.2368 33 TRP L CZ3 4464 C CH2 . TRP C 33 ? 2.0142 1.5974 1.3726 -0.5584 -0.4397 0.2767 33 TRP L CH2 4465 N N . TYR C 34 ? 1.7458 1.4000 1.0959 -0.4385 -0.1807 0.0718 34 TYR L N 4466 C CA . TYR C 34 ? 1.7298 1.3890 1.0604 -0.4195 -0.1322 0.0374 34 TYR L CA 4467 C C . TYR C 34 ? 1.7003 1.3299 0.9618 -0.4173 -0.1148 0.0247 34 TYR L C 4468 O O . TYR C 34 ? 1.6204 1.2482 0.8711 -0.4278 -0.1274 0.0497 34 TYR L O 4469 C CB . TYR C 34 ? 1.6502 1.3716 1.0512 -0.4082 -0.0972 0.0454 34 TYR L CB 4470 C CG . TYR C 34 ? 1.6150 1.3751 1.0766 -0.4090 -0.1073 0.0599 34 TYR L CG 4471 C CD1 . TYR C 34 ? 1.6295 1.4212 1.1426 -0.4179 -0.1295 0.0988 34 TYR L CD1 4472 C CD2 . TYR C 34 ? 1.6419 1.4141 1.1153 -0.4007 -0.0930 0.0402 34 TYR L CD2 4473 C CE1 . TYR C 34 ? 1.6804 1.5163 1.2492 -0.4185 -0.1349 0.1185 34 TYR L CE1 4474 C CE2 . TYR C 34 ? 1.6432 1.4566 1.1695 -0.4033 -0.1027 0.0598 34 TYR L CE2 4475 C CZ . TYR C 34 ? 1.6702 1.5169 1.2415 -0.4120 -0.1218 0.0992 34 TYR L CZ 4476 O OH . TYR C 34 ? 1.6525 1.5491 1.2773 -0.4147 -0.1281 0.1256 34 TYR L OH 4477 N N . GLN C 35 ? 1.7256 1.3420 0.9517 -0.4026 -0.0817 -0.0084 35 GLN L N 4478 C CA . GLN C 35 ? 1.8922 1.4944 1.0610 -0.3976 -0.0546 -0.0168 35 GLN L CA 4479 C C . GLN C 35 ? 1.9119 1.5536 1.1242 -0.3837 -0.0073 -0.0233 35 GLN L C 4480 O O . GLN C 35 ? 1.9389 1.5936 1.1807 -0.3722 0.0102 -0.0432 35 GLN L O 4481 C CB . GLN C 35 ? 2.0494 1.5994 1.1320 -0.3899 -0.0529 -0.0503 35 GLN L CB 4482 C CG . GLN C 35 ? 2.1850 1.7303 1.2065 -0.3833 -0.0184 -0.0544 35 GLN L CG 4483 C CD . GLN C 35 ? 2.3017 1.8162 1.2619 -0.3634 0.0091 -0.0940 35 GLN L CD 4484 O OE1 . GLN C 35 ? 2.3796 1.8709 1.2539 -0.3589 0.0251 -0.1025 35 GLN L OE1 4485 N NE2 . GLN C 35 ? 2.2809 1.7991 1.2873 -0.3496 0.0177 -0.1165 35 GLN L NE2 4486 N N . GLN C 36 ? 1.8868 1.5471 1.1097 -0.3866 0.0093 -0.0039 36 GLN L N 4487 C CA . GLN C 36 ? 1.8026 1.4941 1.0678 -0.3759 0.0489 -0.0100 36 GLN L CA 4488 C C . GLN C 36 ? 1.8230 1.5062 1.0406 -0.3740 0.0753 -0.0061 36 GLN L C 4489 O O . GLN C 36 ? 1.6840 1.3643 0.8838 -0.3847 0.0677 0.0206 36 GLN L O 4490 C CB . GLN C 36 ? 1.7708 1.4970 1.1120 -0.3782 0.0492 0.0077 36 GLN L CB 4491 C CG . GLN C 36 ? 1.7692 1.5205 1.1550 -0.3698 0.0820 -0.0020 36 GLN L CG 4492 C CD . GLN C 36 ? 1.7247 1.4993 1.1754 -0.3700 0.0809 0.0083 36 GLN L CD 4493 O OE1 . GLN C 36 ? 1.7463 1.5199 1.2098 -0.3753 0.0628 0.0298 36 GLN L OE1 4494 N NE2 . GLN C 36 ? 1.6757 1.4705 1.1704 -0.3634 0.0979 -0.0081 36 GLN L NE2 4495 N N . ARG C 37 ? 2.0042 1.6901 1.2108 -0.3601 0.1075 -0.0275 37 ARG L N 4496 C CA . ARG C 37 ? 2.2308 1.9205 1.4005 -0.3550 0.1418 -0.0211 37 ARG L CA 4497 C C . ARG C 37 ? 2.2445 1.9738 1.4924 -0.3575 0.1630 -0.0008 37 ARG L C 4498 O O . ARG C 37 ? 2.2777 2.0260 1.5961 -0.3570 0.1578 -0.0072 37 ARG L O 4499 C CB . ARG C 37 ? 2.3891 2.0662 1.5200 -0.3358 0.1691 -0.0515 37 ARG L CB 4500 C CG . ARG C 37 ? 2.5072 2.1346 1.5638 -0.3310 0.1454 -0.0794 37 ARG L CG 4501 C CD . ARG C 37 ? 2.5812 2.2010 1.6217 -0.3064 0.1802 -0.1108 37 ARG L CD 4502 N NE . ARG C 37 ? 2.7547 2.3171 1.7185 -0.2978 0.1607 -0.1444 37 ARG L NE 4503 C CZ . ARG C 37 ? 2.8942 2.4371 1.8316 -0.2723 0.1890 -0.1777 37 ARG L CZ 4504 N NH1 . ARG C 37 ? 2.8385 2.4232 1.8286 -0.2542 0.2384 -0.1756 37 ARG L NH1 4505 N NH2 . ARG C 37 ? 3.0529 2.5333 1.9189 -0.2644 0.1658 -0.2126 37 ARG L NH2 4506 N N . PRO C 38 ? 2.3025 2.0431 1.5362 -0.3617 0.1838 0.0251 38 PRO L N 4507 C CA . PRO C 38 ? 2.3217 2.0940 1.6326 -0.3677 0.1983 0.0505 38 PRO L CA 4508 C C . PRO C 38 ? 2.2621 2.0584 1.6392 -0.3578 0.2191 0.0324 38 PRO L C 4509 O O . PRO C 38 ? 2.3283 2.1351 1.6920 -0.3459 0.2491 0.0244 38 PRO L O 4510 C CB . PRO C 38 ? 2.4116 2.1924 1.6767 -0.3715 0.2223 0.0814 38 PRO L CB 4511 C CG . PRO C 38 ? 2.4857 2.2377 1.6386 -0.3633 0.2253 0.0623 38 PRO L CG 4512 C CD . PRO C 38 ? 2.4207 2.1404 1.5591 -0.3659 0.1843 0.0382 38 PRO L CD 4513 N N . GLY C 39 ? 2.0930 1.8982 1.5406 -0.3619 0.2027 0.0262 39 GLY L N 4514 C CA . GLY C 39 ? 1.9784 1.8057 1.4908 -0.3579 0.2137 0.0136 39 GLY L CA 4515 C C . GLY C 39 ? 1.9142 1.7414 1.4239 -0.3480 0.2093 -0.0169 39 GLY L C 4516 O O . GLY C 39 ? 1.9621 1.8096 1.5212 -0.3452 0.2183 -0.0241 39 GLY L O 4517 N N . GLN C 40 ? 1.7992 1.6044 1.2578 -0.3448 0.1914 -0.0306 40 GLN L N 4518 C CA . GLN C 40 ? 1.6894 1.4936 1.1509 -0.3372 0.1828 -0.0540 40 GLN L CA 4519 C C . GLN C 40 ? 1.6281 1.4278 1.0931 -0.3438 0.1506 -0.0571 40 GLN L C 4520 O O . GLN C 40 ? 1.6608 1.4509 1.1109 -0.3508 0.1373 -0.0432 40 GLN L O 4521 C CB . GLN C 40 ? 1.7314 1.5121 1.1349 -0.3248 0.1929 -0.0676 40 GLN L CB 4522 C CG . GLN C 40 ? 1.7553 1.5484 1.1582 -0.3124 0.2335 -0.0650 40 GLN L CG 4523 C CD . GLN C 40 ? 1.8080 1.5905 1.1483 -0.3128 0.2515 -0.0493 40 GLN L CD 4524 O OE1 . GLN C 40 ? 1.8172 1.5833 1.1221 -0.3254 0.2300 -0.0370 40 GLN L OE1 4525 N NE2 . GLN C 40 ? 1.8460 1.6421 1.1744 -0.2987 0.2921 -0.0462 40 GLN L NE2 4526 N N . ALA C 41 ? 1.5594 1.3687 1.0444 -0.3413 0.1384 -0.0705 41 ALA L N 4527 C CA . ALA C 41 ? 1.5234 1.3371 1.0130 -0.3462 0.1116 -0.0688 41 ALA L CA 4528 C C . ALA C 41 ? 1.6429 1.4274 1.0844 -0.3484 0.0916 -0.0641 41 ALA L C 4529 O O . ALA C 41 ? 1.7403 1.4989 1.1449 -0.3429 0.0939 -0.0747 41 ALA L O 4530 C CB . ALA C 41 ? 1.4059 1.2425 0.9281 -0.3450 0.1041 -0.0780 41 ALA L CB 4531 N N . PRO C 42 ? 1.6223 1.4094 1.0666 -0.3557 0.0705 -0.0488 42 PRO L N 4532 C CA . PRO C 42 ? 1.7031 1.4614 1.1085 -0.3618 0.0423 -0.0412 42 PRO L CA 4533 C C . PRO C 42 ? 1.7658 1.5103 1.1647 -0.3592 0.0281 -0.0544 42 PRO L C 4534 O O . PRO C 42 ? 1.7643 1.5350 1.2028 -0.3555 0.0330 -0.0598 42 PRO L O 4535 C CB . PRO C 42 ? 1.6397 1.4207 1.0795 -0.3688 0.0229 -0.0183 42 PRO L CB 4536 C CG . PRO C 42 ? 1.5881 1.3936 1.0633 -0.3643 0.0454 -0.0163 42 PRO L CG 4537 C CD . PRO C 42 ? 1.5452 1.3591 1.0305 -0.3574 0.0702 -0.0382 42 PRO L CD 4538 N N . ARG C 43 ? 1.8404 1.5406 1.1886 -0.3615 0.0085 -0.0603 43 ARG L N 4539 C CA . ARG C 43 ? 1.8625 1.5406 1.2111 -0.3596 -0.0124 -0.0721 43 ARG L CA 4540 C C . ARG C 43 ? 1.8303 1.4851 1.1672 -0.3748 -0.0581 -0.0546 43 ARG L C 4541 O O . ARG C 43 ? 1.8625 1.4884 1.1520 -0.3828 -0.0731 -0.0488 43 ARG L O 4542 C CB . ARG C 43 ? 1.9585 1.5996 1.2660 -0.3441 0.0070 -0.1028 43 ARG L CB 4543 C CG . ARG C 43 ? 2.0922 1.6908 1.3191 -0.3407 0.0141 -0.1155 43 ARG L CG 4544 C CD . ARG C 43 ? 2.2463 1.8296 1.4549 -0.3183 0.0492 -0.1453 43 ARG L CD 4545 N NE . ARG C 43 ? 2.4897 2.0106 1.6126 -0.3092 0.0429 -0.1730 43 ARG L NE 4546 C CZ . ARG C 43 ? 2.5527 2.0605 1.6227 -0.2901 0.0833 -0.1935 43 ARG L CZ 4547 N NH1 . ARG C 43 ? 2.5069 2.0639 1.6146 -0.2811 0.1297 -0.1826 43 ARG L NH1 4548 N NH2 . ARG C 43 ? 2.5864 2.0327 1.5661 -0.2800 0.0768 -0.2242 43 ARG L NH2 4549 N N . LEU C 44 ? 1.7864 1.4584 1.1719 -0.3810 -0.0826 -0.0409 44 LEU L N 4550 C CA . LEU C 44 ? 1.8338 1.4851 1.2238 -0.3973 -0.1314 -0.0197 44 LEU L CA 4551 C C . LEU C 44 ? 1.9470 1.5217 1.2688 -0.3982 -0.1569 -0.0451 44 LEU L C 4552 O O . LEU C 44 ? 2.0041 1.5452 1.3052 -0.3844 -0.1472 -0.0773 44 LEU L O 4553 C CB . LEU C 44 ? 1.7225 1.4070 1.1799 -0.4029 -0.1502 0.0010 44 LEU L CB 4554 C CG . LEU C 44 ? 1.7256 1.3951 1.2062 -0.4224 -0.2041 0.0311 44 LEU L CG 4555 C CD1 . LEU C 44 ? 1.6545 1.3602 1.1567 -0.4337 -0.2116 0.0682 44 LEU L CD1 4556 C CD2 . LEU C 44 ? 1.7056 1.4079 1.2528 -0.4271 -0.2196 0.0528 44 LEU L CD2 4557 N N . VAL C 45 ? 1.9353 1.4826 1.2248 -0.4144 -0.1919 -0.0295 45 VAL L N 4558 C CA . VAL C 45 ? 2.0634 1.5322 1.2719 -0.4193 -0.2243 -0.0533 45 VAL L CA 4559 C C . VAL C 45 ? 2.1138 1.5518 1.3448 -0.4415 -0.2908 -0.0324 45 VAL L C 4560 O O . VAL C 45 ? 2.1710 1.5384 1.3585 -0.4421 -0.3230 -0.0610 45 VAL L O 4561 C CB . VAL C 45 ? 2.2527 1.7060 1.3891 -0.4248 -0.2190 -0.0507 45 VAL L CB 4562 C CG1 . VAL C 45 ? 1.8031 1.1855 0.8688 -0.4426 -0.2760 -0.0553 45 VAL L CG1 4563 C CG2 . VAL C 45 ? 1.7124 1.1649 0.7963 -0.4031 -0.1626 -0.0815 45 VAL L CG2 4564 N N . ILE C 46 ? 2.0763 1.5658 1.3781 -0.4588 -0.3115 0.0176 46 ILE L N 4565 C CA . ILE C 46 ? 2.0994 1.5683 1.4376 -0.4835 -0.3777 0.0486 46 ILE L CA 4566 C C . ILE C 46 ? 2.0502 1.6015 1.4970 -0.4931 -0.3807 0.1050 46 ILE L C 4567 O O . ILE C 46 ? 1.9992 1.6141 1.4770 -0.4856 -0.3425 0.1241 46 ILE L O 4568 C CB . ILE C 46 ? 2.4393 1.8571 1.7182 -0.5049 -0.4262 0.0578 46 ILE L CB 4569 C CG1 . ILE C 46 ? 2.5341 1.8537 1.7019 -0.5009 -0.4461 0.0029 46 ILE L CG1 4570 C CG2 . ILE C 46 ? 2.4551 1.8808 1.8043 -0.5349 -0.4927 0.1112 46 ILE L CG2 4571 C CD1 . ILE C 46 ? 2.6226 1.8824 1.7281 -0.5271 -0.5096 0.0115 46 ILE L CD1 4572 N N . TYR C 47 ? 2.0918 1.6417 1.5976 -0.5084 -0.4249 0.1312 47 TYR L N 4573 C CA . TYR C 47 ? 2.0300 1.6614 1.6388 -0.5196 -0.4316 0.1928 47 TYR L CA 4574 C C . TYR C 47 ? 2.0826 1.6899 1.7376 -0.5500 -0.5064 0.2354 47 TYR L C 4575 O O . TYR C 47 ? 2.0887 1.6073 1.6933 -0.5623 -0.5571 0.2101 47 TYR L O 4576 C CB . TYR C 47 ? 2.0130 1.7009 1.6734 -0.5060 -0.3963 0.1960 47 TYR L CB 4577 C CG . TYR C 47 ? 2.1227 1.7610 1.7891 -0.5088 -0.4267 0.1781 47 TYR L CG 4578 C CD1 . TYR C 47 ? 2.1443 1.7221 1.7449 -0.4899 -0.4071 0.1177 47 TYR L CD1 4579 C CD2 . TYR C 47 ? 2.1277 1.7758 1.8708 -0.5301 -0.4774 0.2238 47 TYR L CD2 4580 C CE1 . TYR C 47 ? 2.1326 1.6608 1.7463 -0.4887 -0.4340 0.0994 47 TYR L CE1 4581 C CE2 . TYR C 47 ? 2.1033 1.6988 1.8597 -0.5325 -0.5095 0.2078 47 TYR L CE2 4582 C CZ . TYR C 47 ? 2.0900 1.6235 1.7814 -0.5104 -0.4872 0.1432 47 TYR L CZ 4583 O OH . TYR C 47 ? 2.0638 1.5437 1.7765 -0.5088 -0.5167 0.1259 47 TYR L OH 4584 N N . SER C 48 ? 2.0890 1.7757 1.8383 -0.5615 -0.5123 0.3002 48 SER L N 4585 C CA . SER C 48 ? 2.1697 1.8528 1.9854 -0.5930 -0.5821 0.3564 48 SER L CA 4586 C C . SER C 48 ? 2.3536 1.9756 2.1165 -0.6101 -0.6260 0.3526 48 SER L C 4587 O O . SER C 48 ? 2.4287 2.0201 2.2256 -0.6404 -0.6979 0.3882 48 SER L O 4588 C CB . SER C 48 ? 2.1700 1.8053 2.0116 -0.6078 -0.6333 0.3562 48 SER L CB 4589 O OG . SER C 48 ? 2.0832 1.7765 1.9723 -0.5939 -0.5954 0.3637 48 SER L OG 4590 N N . GLY C 49 ? 2.4429 2.0485 2.1251 -0.5932 -0.5864 0.3136 49 GLY L N 4591 C CA . GLY C 49 ? 2.5722 2.1258 2.1961 -0.6096 -0.6247 0.3128 49 GLY L CA 4592 C C . GLY C 49 ? 2.7135 2.1517 2.2239 -0.6151 -0.6631 0.2527 49 GLY L C 4593 O O . GLY C 49 ? 2.7537 2.1432 2.1637 -0.6121 -0.6589 0.2187 49 GLY L O 4594 N N . SER C 50 ? 2.7733 2.1670 2.2974 -0.6216 -0.6989 0.2391 50 SER L N 4595 C CA . SER C 50 ? 2.9377 2.2128 2.3586 -0.6268 -0.7442 0.1815 50 SER L CA 4596 C C . SER C 50 ? 2.9280 2.1573 2.3106 -0.6012 -0.7164 0.1201 50 SER L C 4597 O O . SER C 50 ? 3.0608 2.1886 2.3597 -0.6009 -0.7509 0.0678 50 SER L O 4598 C CB . SER C 50 ? 3.0844 2.3186 2.5587 -0.6654 -0.8405 0.2220 50 SER L CB 4599 O OG . SER C 50 ? 3.1301 2.4148 2.6617 -0.6879 -0.8677 0.2886 50 SER L OG 4600 N N . THR C 51 ? 2.7771 2.0777 2.2195 -0.5790 -0.6561 0.1249 51 THR L N 4601 C CA . THR C 51 ? 2.7169 1.9786 2.1475 -0.5580 -0.6391 0.0780 51 THR L CA 4602 C C . THR C 51 ? 2.6339 1.9055 1.9987 -0.5223 -0.5599 0.0263 51 THR L C 4603 O O . THR C 51 ? 2.4838 1.8378 1.8785 -0.5106 -0.5032 0.0447 51 THR L O 4604 C CB . THR C 51 ? 2.6181 1.9446 2.1721 -0.5631 -0.6423 0.1245 51 THR L CB 4605 O OG1 . THR C 51 ? 2.6502 1.9778 2.2789 -0.5979 -0.7150 0.1825 51 THR L OG1 4606 C CG2 . THR C 51 ? 2.6164 1.8928 2.1694 -0.5455 -0.6394 0.0817 51 THR L CG2 4607 N N . ARG C 52 ? 2.6913 1.8783 1.9710 -0.5043 -0.5564 -0.0382 52 ARG L N 4608 C CA . ARG C 52 ? 2.6072 1.8038 1.8321 -0.4702 -0.4821 -0.0840 52 ARG L CA 4609 C C . ARG C 52 ? 2.4070 1.6545 1.7094 -0.4512 -0.4417 -0.0822 52 ARG L C 4610 O O . ARG C 52 ? 2.4026 1.6414 1.7754 -0.4577 -0.4753 -0.0684 52 ARG L O 4611 C CB . ARG C 52 ? 2.8122 1.9072 1.9174 -0.4534 -0.4850 -0.1526 52 ARG L CB 4612 C CG . ARG C 52 ? 3.0403 2.0961 2.0463 -0.4696 -0.5110 -0.1563 52 ARG L CG 4613 C CD . ARG C 52 ? 3.3240 2.2813 2.1919 -0.4523 -0.5108 -0.2258 52 ARG L CD 4614 N NE . ARG C 52 ? 3.5174 2.3737 2.3625 -0.4529 -0.5675 -0.2656 52 ARG L NE 4615 C CZ . ARG C 52 ? 3.6121 2.4288 2.4567 -0.4208 -0.5407 -0.3157 52 ARG L CZ 4616 N NH1 . ARG C 52 ? 3.5657 2.4396 2.4309 -0.3886 -0.4605 -0.3273 52 ARG L NH1 4617 N NH2 . ARG C 52 ? 3.7309 2.4488 2.5599 -0.4206 -0.5959 -0.3535 52 ARG L NH2 4618 N N . ALA C 53 ? 2.3258 1.6268 1.6177 -0.4300 -0.3732 -0.0926 53 ALA L N 4619 C CA . ALA C 53 ? 2.3300 1.6792 1.6848 -0.4116 -0.3323 -0.0940 53 ALA L CA 4620 C C . ALA C 53 ? 2.4125 1.7052 1.7285 -0.3823 -0.3072 -0.1503 53 ALA L C 4621 O O . ALA C 53 ? 2.5132 1.7257 1.7437 -0.3731 -0.3175 -0.1942 53 ALA L O 4622 C CB . ALA C 53 ? 2.2839 1.7188 1.6565 -0.4055 -0.2765 -0.0751 53 ALA L CB 4623 N N . ALA C 54 ? 2.4187 1.7560 1.7997 -0.3674 -0.2746 -0.1472 54 ALA L N 4624 C CA . ALA C 54 ? 2.5279 1.8278 1.9012 -0.3369 -0.2457 -0.1917 54 ALA L CA 4625 C C . ALA C 54 ? 2.5690 1.8644 1.8625 -0.3129 -0.1867 -0.2282 54 ALA L C 4626 O O . ALA C 54 ? 2.4227 1.7819 1.7168 -0.3152 -0.1490 -0.2093 54 ALA L O 4627 C CB . ALA C 54 ? 2.4775 1.8379 1.9517 -0.3318 -0.2303 -0.1675 54 ALA L CB 4628 N N . GLY C 55 ? 2.7278 1.9478 1.9546 -0.2892 -0.1785 -0.2801 55 GLY L N 4629 C CA . GLY C 55 ? 2.7441 1.9621 1.8950 -0.2636 -0.1185 -0.3128 55 GLY L CA 4630 C C . GLY C 55 ? 2.7729 1.9677 1.8186 -0.2777 -0.1273 -0.3157 55 GLY L C 4631 O O . GLY C 55 ? 2.8384 2.0292 1.8064 -0.2608 -0.0828 -0.3379 55 GLY L O 4632 N N . ILE C 56 ? 2.7101 1.8945 1.7586 -0.3101 -0.1859 -0.2872 56 ILE L N 4633 C CA . ILE C 56 ? 2.6965 1.8532 1.6513 -0.3272 -0.2066 -0.2855 56 ILE L CA 4634 C C . ILE C 56 ? 2.7604 1.8093 1.6171 -0.3220 -0.2449 -0.3350 56 ILE L C 4635 O O . ILE C 56 ? 2.7804 1.7774 1.6696 -0.3314 -0.3009 -0.3411 56 ILE L O 4636 C CB . ILE C 56 ? 2.6160 1.8113 1.6255 -0.3639 -0.2541 -0.2295 56 ILE L CB 4637 C CG1 . ILE C 56 ? 2.4001 1.6941 1.5087 -0.3660 -0.2199 -0.1878 56 ILE L CG1 4638 C CG2 . ILE C 56 ? 2.7127 1.8854 1.6369 -0.3833 -0.2777 -0.2202 56 ILE L CG2 4639 C CD1 . ILE C 56 ? 2.3594 1.7016 1.4424 -0.3563 -0.1633 -0.1842 56 ILE L CD1 4640 N N . PRO C 57 ? 2.7505 1.7643 1.4854 -0.3067 -0.2155 -0.3705 57 PRO L N 4641 C CA . PRO C 57 ? 2.9762 1.8823 1.5947 -0.2962 -0.2439 -0.4286 57 PRO L CA 4642 C C . PRO C 57 ? 3.0832 1.9334 1.6401 -0.3341 -0.3248 -0.4166 57 PRO L C 4643 O O . PRO C 57 ? 2.9716 1.8779 1.5731 -0.3657 -0.3470 -0.3593 57 PRO L O 4644 C CB . PRO C 57 ? 3.0196 1.9317 1.5324 -0.2665 -0.1725 -0.4600 57 PRO L CB 4645 C CG . PRO C 57 ? 2.7842 1.8025 1.3911 -0.2556 -0.1052 -0.4234 57 PRO L CG 4646 C CD . PRO C 57 ? 2.6304 1.7058 1.3377 -0.2912 -0.1434 -0.3634 57 PRO L CD 4647 N N . ASP C 58 ? 3.2525 1.9939 1.7126 -0.3306 -0.3689 -0.4696 58 ASP L N 4648 C CA . ASP C 58 ? 3.3425 2.0534 1.7808 -0.3603 -0.4444 -0.4486 58 ASP L CA 4649 C C . ASP C 58 ? 3.4238 2.1765 1.7965 -0.3797 -0.4397 -0.4128 58 ASP L C 4650 O O . ASP C 58 ? 3.4235 2.1743 1.8115 -0.4132 -0.5022 -0.3725 58 ASP L O 4651 C CB . ASP C 58 ? 3.4885 2.1108 1.8636 -0.3390 -0.4731 -0.5074 58 ASP L CB 4652 C CG . ASP C 58 ? 3.4003 1.9712 1.8582 -0.3279 -0.5014 -0.5332 58 ASP L CG 4653 O OD1 . ASP C 58 ? 3.3414 1.9466 1.9131 -0.3453 -0.5155 -0.4939 58 ASP L OD1 4654 O OD2 . ASP C 58 ? 3.6695 2.1668 2.0812 -0.3030 -0.5117 -0.5912 58 ASP L OD2 4655 N N . ARG C 59 ? 3.6854 2.4752 1.9908 -0.3584 -0.3667 -0.4242 59 ARG L N 4666 N N . PHE C 60 ? 3.6803 2.3103 2.0766 -0.6493 -0.4615 0.1236 60 PHE L N 4667 C CA . PHE C 60 ? 3.1956 1.9755 1.6997 -0.6271 -0.4905 0.1247 60 PHE L CA 4668 C C . PHE C 60 ? 2.9747 1.8173 1.4944 -0.6344 -0.5418 0.1870 60 PHE L C 4669 O O . PHE C 60 ? 2.9173 1.7995 1.4301 -0.6324 -0.5352 0.2095 60 PHE L O 4670 C CB . PHE C 60 ? 2.9368 1.8981 1.5556 -0.5846 -0.4562 0.0704 60 PHE L CB 4671 C CG . PHE C 60 ? 2.8260 1.7641 1.4717 -0.5793 -0.4049 -0.0033 60 PHE L CG 4672 C CD1 . PHE C 60 ? 2.8468 1.7450 1.4669 -0.5832 -0.3579 -0.0399 60 PHE L CD1 4673 C CD2 . PHE C 60 ? 2.7431 1.6984 1.4453 -0.5708 -0.3997 -0.0370 60 PHE L CD2 4674 C CE1 . PHE C 60 ? 2.8476 1.7319 1.5128 -0.5841 -0.3058 -0.1122 60 PHE L CE1 4675 C CE2 . PHE C 60 ? 2.7809 1.7076 1.5176 -0.5722 -0.3456 -0.1083 60 PHE L CE2 4676 C CZ . PHE C 60 ? 2.8202 1.7148 1.5458 -0.5818 -0.2982 -0.1477 60 PHE L CZ 4677 N N . SER C 61 ? 2.9091 1.7638 1.4553 -0.6404 -0.5888 0.2146 61 SER L N 4678 C CA . SER C 61 ? 2.9095 1.8372 1.4953 -0.6519 -0.6359 0.2712 61 SER L CA 4679 C C . SER C 61 ? 2.8939 1.9343 1.5740 -0.6308 -0.6670 0.2805 61 SER L C 4680 O O . SER C 61 ? 2.9537 1.9516 1.6251 -0.6202 -0.6701 0.2570 61 SER L O 4681 C CB . SER C 61 ? 2.9731 1.7421 1.4554 -0.7009 -0.6794 0.3108 61 SER L CB 4682 O OG . SER C 61 ? 2.9360 1.6063 1.3703 -0.7090 -0.7164 0.3095 61 SER L OG 4683 N N . GLY C 62 ? 2.4862 1.6701 1.2560 -0.6196 -0.6819 0.3161 62 GLY L N 4684 C CA . GLY C 62 ? 2.4429 1.7422 1.3066 -0.5967 -0.7101 0.3315 62 GLY L CA 4685 C C . GLY C 62 ? 3.0331 2.3550 1.9313 -0.6300 -0.7626 0.3915 62 GLY L C 4686 O O . GLY C 62 ? 3.0107 2.2993 1.8856 -0.6637 -0.7646 0.4207 62 GLY L O 4687 N N . SER C 63 ? 3.0903 2.4665 2.0463 -0.6218 -0.8042 0.4083 63 SER L N 4688 C CA . SER C 63 ? 3.1678 2.5869 2.1810 -0.6551 -0.8573 0.4591 63 SER L CA 4689 C C . SER C 63 ? 3.1668 2.7409 2.2968 -0.6146 -0.8701 0.4736 63 SER L C 4690 O O . SER C 63 ? 3.0725 2.6823 2.2104 -0.5657 -0.8438 0.4418 63 SER L O 4691 C CB . SER C 63 ? 3.2673 2.5317 2.1869 -0.6986 -0.9173 0.4618 63 SER L CB 4692 O OG . SER C 63 ? 3.2698 2.4674 2.1336 -0.6687 -0.9287 0.4337 63 SER L OG 4693 N N . ARG C 64 ? 3.2624 2.9328 2.4901 -0.6338 -0.9054 0.5198 64 ARG L N 4694 C CA . ARG C 64 ? 3.3049 3.1342 2.6483 -0.5875 -0.9072 0.5363 64 ARG L CA 4695 C C . ARG C 64 ? 3.2841 3.1784 2.7143 -0.6115 -0.9735 0.5747 64 ARG L C 4696 O O . ARG C 64 ? 3.3067 3.1775 2.7567 -0.6701 -1.0057 0.5988 64 ARG L O 4697 C CB . ARG C 64 ? 3.4162 3.3676 2.8260 -0.5527 -0.8429 0.5476 64 ARG L CB 4698 C CG . ARG C 64 ? 3.5877 3.5225 2.9395 -0.5130 -0.7861 0.5033 64 ARG L CG 4699 C CD . ARG C 64 ? 3.7305 3.8037 3.1611 -0.4794 -0.7393 0.5345 64 ARG L CD 4700 N NE . ARG C 64 ? 3.8685 4.0912 3.4098 -0.4351 -0.7408 0.5606 64 ARG L NE 4701 C CZ . ARG C 64 ? 3.9504 4.3046 3.5731 -0.3978 -0.7022 0.5982 64 ARG L CZ 4702 N NH1 . ARG C 64 ? 3.9827 4.3317 3.5770 -0.3937 -0.6566 0.6094 64 ARG L NH1 4703 N NH2 . ARG C 64 ? 3.9559 4.4397 3.6756 -0.3549 -0.7032 0.6226 64 ARG L NH2 4704 N N . TRP C 65 ? 3.1810 3.1576 2.6656 -0.5668 -0.9947 0.5776 65 TRP L N 4705 C CA . TRP C 65 ? 3.1505 3.2313 2.7467 -0.5800 -1.0536 0.6151 65 TRP L CA 4706 C C . TRP C 65 ? 3.0561 3.2993 2.7611 -0.5150 -1.0426 0.6336 65 TRP L C 4707 O O . TRP C 65 ? 3.0483 3.2662 2.7071 -0.4674 -1.0554 0.6131 65 TRP L O 4708 C CB . TRP C 65 ? 3.2652 3.2303 2.7796 -0.6036 -1.1319 0.6001 65 TRP L CB 4709 C CG . TRP C 65 ? 3.3146 3.3686 2.9399 -0.6441 -1.2030 0.6305 65 TRP L CG 4710 C CD1 . TRP C 65 ? 3.3793 3.3733 2.9996 -0.7178 -1.2476 0.6333 65 TRP L CD1 4711 C CD2 . TRP C 65 ? 3.2869 3.5113 3.0540 -0.6152 -1.2375 0.6581 65 TRP L CD2 4712 N NE1 . TRP C 65 ? 3.3714 3.4919 3.1300 -0.7414 -1.3105 0.6555 65 TRP L NE1 4713 C CE2 . TRP C 65 ? 3.3089 3.5772 3.1625 -0.6781 -1.3052 0.6730 65 TRP L CE2 4714 C CE3 . TRP C 65 ? 3.2238 3.5670 3.0537 -0.5416 -1.2177 0.6696 65 TRP L CE3 4715 C CZ2 . TRP C 65 ? 3.2777 3.7172 3.2902 -0.6705 -1.3536 0.6981 65 TRP L CZ2 4716 C CZ3 . TRP C 65 ? 3.1996 3.7051 3.1750 -0.5289 -1.2628 0.7004 65 TRP L CZ3 4717 C CH2 . TRP C 65 ? 3.2237 3.7822 3.2948 -0.5936 -1.3305 0.7140 65 TRP L CH2 4718 N N . GLY C 66 ? 2.9827 3.3835 2.8265 -0.5098 -1.0141 0.6748 66 GLY L N 4719 C CA . GLY C 66 ? 2.8888 3.4468 2.8350 -0.4428 -0.9947 0.6965 66 GLY L CA 4720 C C . GLY C 66 ? 2.8074 3.3492 2.6837 -0.3716 -0.9415 0.6604 66 GLY L C 4721 O O . GLY C 66 ? 2.7910 3.3150 2.6288 -0.3612 -0.8855 0.6426 66 GLY L O 4722 N N . ALA C 67 ? 2.7881 3.3339 2.6458 -0.3205 -0.9594 0.6457 67 ALA L N 4723 C CA . ALA C 67 ? 2.7686 3.2988 2.5699 -0.2552 -0.9090 0.6057 67 ALA L CA 4724 C C . ALA C 67 ? 2.7657 3.1072 2.4189 -0.2780 -0.9039 0.5487 67 ALA L C 4725 O O . ALA C 67 ? 2.7243 3.0267 2.3239 -0.2455 -0.8564 0.5019 67 ALA L O 4726 C CB . ALA C 67 ? 2.8385 3.4376 2.6754 -0.1893 -0.9210 0.6144 67 ALA L CB 4727 N N . ASP C 68 ? 2.8009 3.0273 2.3922 -0.3335 -0.9532 0.5509 68 ASP L N 4728 C CA . ASP C 68 ? 2.8326 2.8668 2.2778 -0.3532 -0.9497 0.5045 68 ASP L CA 4729 C C . ASP C 68 ? 2.7380 2.7130 2.1409 -0.3954 -0.9136 0.4848 68 ASP L C 4730 O O . ASP C 68 ? 2.6828 2.7108 2.1385 -0.4338 -0.9203 0.5166 68 ASP L O 4731 C CB . ASP C 68 ? 2.9444 2.8711 2.3222 -0.3826 -1.0185 0.5152 68 ASP L CB 4732 C CG . ASP C 68 ? 2.9757 2.9615 2.3868 -0.3330 -1.0590 0.5350 68 ASP L CG 4733 O OD1 . ASP C 68 ? 2.9228 2.9170 2.3209 -0.2723 -1.0222 0.5175 68 ASP L OD1 4734 O OD2 . ASP C 68 ? 3.0446 3.0662 2.4928 -0.3535 -1.1287 0.5645 68 ASP L OD2 4735 N N . TYR C 69 ? 2.7163 2.5880 2.0316 -0.3854 -0.8693 0.4318 69 TYR L N 4736 C CA . TYR C 69 ? 2.6967 2.5200 1.9712 -0.4158 -0.8329 0.4089 69 TYR L CA 4737 C C . TYR C 69 ? 2.7858 2.4166 1.9303 -0.4410 -0.8263 0.3690 69 TYR L C 4738 O O . TYR C 69 ? 2.8687 2.4334 1.9696 -0.4125 -0.8077 0.3345 69 TYR L O 4739 C CB . TYR C 69 ? 2.6566 2.5823 1.9775 -0.3693 -0.7746 0.3763 69 TYR L CB 4740 C CG . TYR C 69 ? 2.6082 2.7085 2.0390 -0.3444 -0.7674 0.4203 69 TYR L CG 4741 C CD1 . TYR C 69 ? 2.5915 2.8053 2.1101 -0.3128 -0.7889 0.4592 69 TYR L CD1 4742 C CD2 . TYR C 69 ? 2.5321 2.6819 1.9758 -0.3458 -0.7336 0.4256 69 TYR L CD2 4743 C CE1 . TYR C 69 ? 2.5125 2.8813 2.1335 -0.2875 -0.7732 0.5035 69 TYR L CE1 4744 C CE2 . TYR C 69 ? 2.4635 2.7599 1.9980 -0.3160 -0.7167 0.4699 69 TYR L CE2 4745 C CZ . TYR C 69 ? 2.4640 2.8690 2.0901 -0.2890 -0.7346 0.5098 69 TYR L CZ 4746 O OH . TYR C 69 ? 2.4454 2.9941 2.1654 -0.2572 -0.7085 0.5589 69 TYR L OH 4747 N N . ASN C 70 ? 2.7852 2.3154 1.8623 -0.4912 -0.8332 0.3727 70 ASN L N 4748 C CA . ASN C 70 ? 2.8284 2.1724 1.7792 -0.5070 -0.8174 0.3357 70 ASN L CA 4749 C C . ASN C 70 ? 2.7305 2.0301 1.6438 -0.5246 -0.7660 0.3015 70 ASN L C 4750 O O . ASN C 70 ? 2.7068 2.0495 1.6391 -0.5471 -0.7651 0.3221 70 ASN L O 4751 C CB . ASN C 70 ? 3.0326 2.2449 1.8952 -0.5431 -0.8764 0.3635 70 ASN L CB 4752 C CG . ASN C 70 ? 3.1968 2.4346 2.0767 -0.5158 -0.9296 0.3873 70 ASN L CG 4753 O OD1 . ASN C 70 ? 3.2289 2.4771 2.1141 -0.4682 -0.9078 0.3696 70 ASN L OD1 4754 N ND2 . ASN C 70 ? 3.2815 2.5248 2.1672 -0.5444 -1.0002 0.4239 70 ASN L ND2 4755 N N . LEU C 71 ? 2.7255 1.9397 1.5892 -0.5117 -0.7185 0.2478 71 LEU L N 4756 C CA . LEU C 71 ? 2.8000 1.9427 1.6136 -0.5314 -0.6724 0.2107 71 LEU L CA 4757 C C . LEU C 71 ? 2.9526 1.8824 1.6348 -0.5591 -0.6717 0.2065 71 LEU L C 4758 O O . LEU C 71 ? 3.0309 1.8701 1.6690 -0.5431 -0.6658 0.1943 71 LEU L O 4759 C CB . LEU C 71 ? 2.7815 1.9998 1.6542 -0.4985 -0.6136 0.1450 71 LEU L CB 4760 C CG . LEU C 71 ? 2.4739 1.6066 1.3004 -0.5157 -0.5602 0.0916 71 LEU L CG 4761 C CD1 . LEU C 71 ? 2.4419 1.6077 1.2563 -0.5318 -0.5597 0.1094 71 LEU L CD1 4762 C CD2 . LEU C 71 ? 2.4256 1.6329 1.3241 -0.4856 -0.5102 0.0162 71 LEU L CD2 4763 N N . SER C 72 ? 2.6815 1.5244 1.2921 -0.5949 -0.6744 0.2199 72 SER L N 4764 C CA . SER C 72 ? 4.7811 3.4172 3.2533 -0.6185 -0.6757 0.2228 72 SER L CA 4765 C C . SER C 72 ? 4.8512 3.4202 3.2832 -0.6310 -0.6121 0.1849 72 SER L C 4766 O O . SER C 72 ? 4.8824 3.5186 3.3407 -0.6419 -0.6031 0.1884 72 SER L O 4767 C CB . SER C 72 ? 4.8881 3.4675 3.3000 -0.6506 -0.7446 0.2747 72 SER L CB 4768 O OG . SER C 72 ? 5.1674 3.5515 3.4362 -0.6738 -0.7367 0.2736 72 SER L OG 4769 N N . ILE C 73 ? 4.7415 3.1757 3.1096 -0.6266 -0.5630 0.1500 73 ILE L N 4777 N N . SER C 74 ? 4.3348 2.4381 2.5693 -0.1932 -0.4363 -0.0031 74 SER L N 4778 C CA . SER C 74 ? 4.2725 2.0985 2.2585 -0.1936 -0.4406 -0.0271 74 SER L CA 4779 C C . SER C 74 ? 4.1937 2.0103 2.0776 -0.1031 -0.3307 -0.0536 74 SER L C 4780 O O . SER C 74 ? 3.9864 1.9588 1.9548 -0.0332 -0.2529 -0.0423 74 SER L O 4781 C CB . SER C 74 ? 4.4009 1.9752 2.2335 -0.2141 -0.5011 -0.0041 74 SER L CB 4782 O OG . SER C 74 ? 4.3367 1.9596 2.1978 -0.1444 -0.4467 0.0122 74 SER L OG 4783 N N . ASN C 75 ? 4.3301 1.9648 2.0325 -0.1054 -0.3256 -0.0813 75 ASN L N 4784 C CA . ASN C 75 ? 4.3478 1.9431 1.9279 -0.0174 -0.2242 -0.0977 75 ASN L CA 4785 C C . ASN C 75 ? 4.0325 1.9428 1.8093 0.0258 -0.1485 -0.0935 75 ASN L C 4786 O O . ASN C 75 ? 3.9615 1.9614 1.7560 0.1067 -0.0619 -0.0731 75 ASN L O 4787 C CB . ASN C 75 ? 4.4975 1.9078 1.9067 0.0577 -0.1719 -0.0830 75 ASN L CB 4788 C CG . ASN C 75 ? 4.5947 1.8546 1.7970 0.1424 -0.0814 -0.0943 75 ASN L CG 4789 O OD1 . ASN C 75 ? 4.4865 1.9277 1.7647 0.2085 0.0069 -0.0850 75 ASN L OD1 4790 N ND2 . ASN C 75 ? 4.8177 1.7376 1.7488 0.1399 -0.1046 -0.1085 75 ASN L ND2 4791 N N . LEU C 76 ? 3.8406 1.9163 1.7634 -0.0316 -0.1825 -0.1067 76 LEU L N 4792 C CA . LEU C 76 ? 3.6164 1.9845 1.7239 -0.0097 -0.1267 -0.1030 76 LEU L CA 4793 C C . LEU C 76 ? 3.7437 2.1596 1.7915 0.0795 -0.0234 -0.0928 76 LEU L C 4794 O O . LEU C 76 ? 3.9710 2.2014 1.8323 0.1175 0.0051 -0.1015 76 LEU L O 4795 C CB . LEU C 76 ? 3.3873 1.8485 1.5858 -0.0785 -0.1709 -0.1259 76 LEU L CB 4796 C CG . LEU C 76 ? 3.1769 1.7760 1.5566 -0.1512 -0.2360 -0.1197 76 LEU L CG 4797 C CD1 . LEU C 76 ? 3.3066 1.7598 1.6558 -0.1978 -0.3160 -0.1008 76 LEU L CD1 4798 C CD2 . LEU C 76 ? 3.0787 1.7218 1.4980 -0.2051 -0.2627 -0.1425 76 LEU L CD2 4799 N N . GLU C 77 ? 3.6173 2.2829 1.8219 0.1127 0.0325 -0.0669 77 GLU L N 4800 C CA . GLU C 77 ? 3.6998 2.4700 1.8905 0.1896 0.1290 -0.0394 77 GLU L CA 4801 C C . GLU C 77 ? 3.6298 2.7045 2.0240 0.1682 0.1467 -0.0255 77 GLU L C 4802 O O . GLU C 77 ? 3.5102 2.7087 2.0498 0.1117 0.0994 -0.0343 77 GLU L O 4803 C CB . GLU C 77 ? 3.7129 2.4358 1.8372 0.2748 0.2010 0.0019 77 GLU L CB 4804 C CG . GLU C 77 ? 3.9248 2.3214 1.8148 0.3062 0.1959 -0.0083 77 GLU L CG 4805 C CD . GLU C 77 ? 3.9594 2.3142 1.7868 0.3962 0.2770 0.0359 77 GLU L CD 4806 O OE1 . GLU C 77 ? 3.7776 2.3664 1.7725 0.4179 0.3178 0.0735 77 GLU L OE1 4807 O OE2 . GLU C 77 ? 4.1634 2.2458 1.7681 0.4446 0.3015 0.0347 77 GLU L OE2 4808 N N . SER C 78 ? 3.7318 2.9156 2.1248 0.2136 0.2139 0.0011 78 SER L N 4809 C CA . SER C 78 ? 3.6309 3.0798 2.1837 0.1854 0.2261 0.0159 78 SER L CA 4810 C C . SER C 78 ? 3.4981 3.1611 2.2334 0.1491 0.2136 0.0293 78 SER L C 4811 O O . SER C 78 ? 3.4231 3.2390 2.2724 0.0911 0.1853 0.0159 78 SER L O 4812 C CB . SER C 78 ? 3.7016 3.2511 2.2299 0.2591 0.3152 0.0740 78 SER L CB 4813 O OG . SER C 78 ? 3.7847 3.3393 2.2905 0.3332 0.3824 0.1260 78 SER L OG 4814 N N . GLY C 79 ? 3.4764 3.1427 2.2310 0.1844 0.2361 0.0559 79 GLY L N 4815 C CA . GLY C 79 ? 3.2411 3.1063 2.1616 0.1590 0.2301 0.0735 79 GLY L CA 4816 C C . GLY C 79 ? 3.1292 2.9732 2.1233 0.0864 0.1461 0.0310 79 GLY L C 4817 O O . GLY C 79 ? 3.0755 3.0936 2.2097 0.0501 0.1318 0.0349 79 GLY L O 4818 N N . ASP C 80 ? 3.1021 2.7292 1.9955 0.0660 0.0919 -0.0027 80 ASP L N 4819 C CA . ASP C 80 ? 2.9388 2.5165 1.8870 0.0039 0.0111 -0.0268 80 ASP L CA 4820 C C . ASP C 80 ? 2.7431 2.4084 1.7767 -0.0647 -0.0312 -0.0542 80 ASP L C 4821 O O . ASP C 80 ? 2.7124 2.4113 1.8364 -0.1073 -0.0803 -0.0573 80 ASP L O 4822 C CB . ASP C 80 ? 3.0999 2.4073 1.8976 -0.0014 -0.0358 -0.0418 80 ASP L CB 4823 C CG . ASP C 80 ? 3.2014 2.3834 1.8913 0.0648 0.0030 -0.0176 80 ASP L CG 4824 O OD1 . ASP C 80 ? 3.0821 2.4015 1.8528 0.1072 0.0524 0.0148 80 ASP L OD1 4825 O OD2 . ASP C 80 ? 3.4132 2.3519 1.9290 0.0739 -0.0142 -0.0297 80 ASP L OD2 4826 N N . PHE C 81 ? 2.6058 2.3028 1.6092 -0.0726 -0.0111 -0.0694 81 PHE L N 4827 C CA . PHE C 81 ? 2.4660 2.2167 1.5310 -0.1364 -0.0496 -0.0972 81 PHE L CA 4828 C C . PHE C 81 ? 2.3121 2.2710 1.5222 -0.1627 -0.0427 -0.0896 81 PHE L C 4829 O O . PHE C 81 ? 2.2747 2.3801 1.5318 -0.1363 0.0048 -0.0640 81 PHE L O 4830 C CB . PHE C 81 ? 2.5007 2.2353 1.4964 -0.1367 -0.0296 -0.1132 81 PHE L CB 4831 C CG . PHE C 81 ? 2.7365 2.2553 1.5761 -0.1143 -0.0374 -0.1248 81 PHE L CG 4832 C CD1 . PHE C 81 ? 2.8077 2.1778 1.5993 -0.1631 -0.0988 -0.1521 81 PHE L CD1 4833 C CD2 . PHE C 81 ? 2.7871 2.2483 1.5213 -0.0439 0.0195 -0.1029 81 PHE L CD2 4834 C CE1 . PHE C 81 ? 2.8777 2.0398 1.5126 -0.1488 -0.1096 -0.1628 81 PHE L CE1 4835 C CE2 . PHE C 81 ? 2.8731 2.1167 1.4431 -0.0206 0.0154 -0.1151 81 PHE L CE2 4836 C CZ . PHE C 81 ? 2.9428 2.0337 1.4592 -0.0765 -0.0522 -0.1480 81 PHE L CZ 4837 N N . GLY C 82 ? 2.1639 2.1299 1.4377 -0.2150 -0.0885 -0.1068 82 GLY L N 4838 C CA . GLY C 82 ? 1.9193 2.0497 1.3082 -0.2411 -0.0838 -0.1033 82 GLY L CA 4839 C C . GLY C 82 ? 1.8406 1.9373 1.2891 -0.2808 -0.1328 -0.1084 82 GLY L C 4840 O O . GLY C 82 ? 1.8568 1.8321 1.2651 -0.3076 -0.1702 -0.1203 82 GLY L O 4841 N N . VAL C 83 ? 1.7246 1.9277 1.2693 -0.2824 -0.1319 -0.0917 83 VAL L N 4842 C CA . VAL C 83 ? 1.6006 1.7695 1.2037 -0.3083 -0.1737 -0.0816 83 VAL L CA 4843 C C . VAL C 83 ? 1.5448 1.7406 1.2172 -0.2824 -0.1885 -0.0453 83 VAL L C 4844 O O . VAL C 83 ? 1.4232 1.7262 1.1352 -0.2531 -0.1567 -0.0337 83 VAL L O 4845 C CB . VAL C 83 ? 1.6009 1.8585 1.2532 -0.3402 -0.1615 -0.0947 83 VAL L CB 4846 C CG1 . VAL C 83 ? 1.7347 1.9519 1.3226 -0.3712 -0.1558 -0.1282 83 VAL L CG1 4847 C CG2 . VAL C 83 ? 1.5695 1.9854 1.2714 -0.3291 -0.1223 -0.0906 83 VAL L CG2 4848 N N . TYR C 84 ? 1.6082 1.7134 1.3010 -0.2958 -0.2390 -0.0203 84 TYR L N 4849 C CA . TYR C 84 ? 1.6022 1.7147 1.3555 -0.2731 -0.2638 0.0208 84 TYR L CA 4850 C C . TYR C 84 ? 1.4598 1.6363 1.3200 -0.2832 -0.2848 0.0557 84 TYR L C 4851 O O . TYR C 84 ? 1.3603 1.5049 1.2282 -0.3129 -0.3004 0.0601 84 TYR L O 4852 C CB . TYR C 84 ? 1.7577 1.6925 1.4299 -0.2784 -0.3129 0.0356 84 TYR L CB 4853 C CG . TYR C 84 ? 1.7644 1.6340 1.3272 -0.2490 -0.2813 0.0104 84 TYR L CG 4854 C CD1 . TYR C 84 ? 1.7493 1.5553 1.2138 -0.2580 -0.2616 -0.0258 84 TYR L CD1 4855 C CD2 . TYR C 84 ? 1.7717 1.6439 1.3300 -0.2072 -0.2669 0.0282 84 TYR L CD2 4856 C CE1 . TYR C 84 ? 1.8219 1.5713 1.1850 -0.2212 -0.2246 -0.0395 84 TYR L CE1 4857 C CE2 . TYR C 84 ? 1.8557 1.6646 1.3095 -0.1712 -0.2275 0.0137 84 TYR L CE2 4858 C CZ . TYR C 84 ? 1.9255 1.6724 1.2801 -0.1760 -0.2051 -0.0181 84 TYR L CZ 4859 O OH . TYR C 84 ? 2.0668 1.7509 1.3142 -0.1305 -0.1586 -0.0235 84 TYR L OH 4860 N N . TYR C 85 ? 1.4476 1.7200 1.3925 -0.2532 -0.2798 0.0854 85 TYR L N 4861 C CA . TYR C 85 ? 1.3720 1.7190 1.4237 -0.2496 -0.2925 0.1268 85 TYR L CA 4862 C C . TYR C 85 ? 1.4652 1.7986 1.5822 -0.2304 -0.3380 0.1843 85 TYR L C 4863 O O . TYR C 85 ? 1.4472 1.7888 1.5588 -0.2055 -0.3350 0.1851 85 TYR L O 4864 C CB . TYR C 85 ? 1.1463 1.6501 1.2488 -0.2331 -0.2384 0.1101 85 TYR L CB 4865 C CG . TYR C 85 ? 1.1456 1.6695 1.1868 -0.2589 -0.1989 0.0606 85 TYR L CG 4866 C CD1 . TYR C 85 ? 1.0537 1.5328 1.0815 -0.2848 -0.2014 0.0566 85 TYR L CD1 4867 C CD2 . TYR C 85 ? 1.2422 1.8332 1.2405 -0.2579 -0.1586 0.0257 85 TYR L CD2 4868 C CE1 . TYR C 85 ? 1.0816 1.5720 1.0480 -0.3111 -0.1680 0.0114 85 TYR L CE1 4869 C CE2 . TYR C 85 ? 1.2415 1.8537 1.1841 -0.2873 -0.1300 -0.0125 85 TYR L CE2 4870 C CZ . TYR C 85 ? 1.1945 1.7513 1.1179 -0.3149 -0.1364 -0.0234 85 TYR L CZ 4871 O OH . TYR C 85 ? 1.2265 1.7978 1.0890 -0.3464 -0.1106 -0.0613 85 TYR L OH 4872 N N . CYS C 86 ? 1.5416 1.8554 1.7217 -0.2413 -0.3797 0.2397 86 CYS L N 4873 C CA . CYS C 86 ? 1.6057 1.9422 1.8734 -0.2221 -0.4230 0.3065 86 CYS L CA 4874 C C . CYS C 86 ? 1.5669 2.0672 1.9500 -0.1856 -0.3884 0.3299 86 CYS L C 4875 O O . CYS C 86 ? 1.6538 2.2076 2.0409 -0.1863 -0.3471 0.3103 86 CYS L O 4876 C CB . CYS C 86 ? 1.6527 1.8877 1.9336 -0.2549 -0.4924 0.3727 86 CYS L CB 4877 S SG . CYS C 86 ? 2.0227 2.3097 2.3640 -0.2626 -0.4716 0.4050 86 CYS L SG 4878 N N . GLN C 87 ? 1.4425 2.0159 1.9115 -0.1535 -0.4039 0.3710 87 GLN L N 4879 C CA . GLN C 87 ? 1.2175 1.9499 1.7920 -0.1153 -0.3686 0.3917 87 GLN L CA 4880 C C . GLN C 87 ? 1.0533 1.8346 1.7470 -0.0884 -0.4147 0.4757 87 GLN L C 4881 O O . GLN C 87 ? 1.0127 1.7403 1.7087 -0.0908 -0.4610 0.4998 87 GLN L O 4882 C CB . GLN C 87 ? 1.1281 1.9661 1.6952 -0.0950 -0.3129 0.3392 87 GLN L CB 4883 C CG . GLN C 87 ? 1.1035 2.1033 1.7700 -0.0603 -0.2781 0.3586 87 GLN L CG 4884 C CD . GLN C 87 ? 1.0978 2.2126 1.8194 -0.0316 -0.2578 0.3562 87 GLN L CD 4885 O OE1 . GLN C 87 ? 1.1648 2.2330 1.8523 -0.0315 -0.2680 0.3454 87 GLN L OE1 4886 N NE2 . GLN C 87 ? 1.0741 2.2582 1.8211 -0.0064 -0.2089 0.3449 87 GLN L NE2 4887 N N . GLN C 88 ? 0.9947 1.8296 1.7464 -0.0621 -0.3842 0.5061 88 GLN L N 4888 C CA . GLN C 88 ? 1.0074 1.8188 1.7942 -0.0334 -0.3703 0.5393 88 GLN L CA 4889 C C . GLN C 88 ? 1.0349 1.9383 1.8478 0.0078 -0.3057 0.5219 88 GLN L C 4890 O O . GLN C 88 ? 1.0024 1.9297 1.8228 0.0168 -0.2808 0.5392 88 GLN L O 4891 C CB . GLN C 88 ? 1.0361 1.7551 1.8295 -0.0550 -0.3988 0.6014 88 GLN L CB 4892 C CG . GLN C 88 ? 1.2099 1.8951 2.0301 -0.0494 -0.4008 0.6335 88 GLN L CG 4893 C CD . GLN C 88 ? 1.4040 2.0147 2.2391 -0.0851 -0.4266 0.6950 88 GLN L CD 4894 O OE1 . GLN C 88 ? 1.5334 2.0627 2.3562 -0.1263 -0.4770 0.7159 88 GLN L OE1 4895 N NE2 . GLN C 88 ? 1.4104 2.0525 2.2743 -0.0725 -0.3909 0.7265 88 GLN L NE2 4896 N N . TYR C 89 ? 1.0474 1.9917 1.8670 0.0309 -0.2812 0.4914 89 TYR L N 4897 C CA . TYR C 89 ? 0.9755 1.9908 1.8003 0.0601 -0.2274 0.4663 89 TYR L CA 4898 C C . TYR C 89 ? 0.9524 2.0458 1.7576 0.0506 -0.1980 0.4342 89 TYR L C 4899 O O . TYR C 89 ? 0.9570 2.0873 1.7419 0.0274 -0.2005 0.3993 89 TYR L O 4900 C CB . TYR C 89 ? 0.9589 1.9465 1.7998 0.0803 -0.2138 0.5099 89 TYR L CB 4901 C CG . TYR C 89 ? 1.0493 1.9754 1.9053 0.0795 -0.2364 0.5393 89 TYR L CG 4902 C CD1 . TYR C 89 ? 1.0459 1.9772 1.9022 0.0874 -0.2369 0.5115 89 TYR L CD1 4903 C CD2 . TYR C 89 ? 1.1512 2.0185 2.0231 0.0650 -0.2560 0.5981 89 TYR L CD2 4904 C CE1 . TYR C 89 ? 1.0723 1.9638 1.9529 0.0786 -0.2576 0.5551 89 TYR L CE1 4905 C CE2 . TYR C 89 ? 1.1373 1.9607 2.0268 0.0537 -0.2757 0.6285 89 TYR L CE2 4906 C CZ . TYR C 89 ? 1.0889 1.9323 1.9926 0.0569 -0.2777 0.6194 89 TYR L CZ 4907 O OH . TYR C 89 ? 1.0970 1.9166 2.0451 0.0333 -0.2989 0.6783 89 TYR L OH 4908 N N . GLU C 90 ? 0.9372 2.0588 1.7431 0.0645 -0.1696 0.4505 90 GLU L N 4909 C CA . GLU C 90 ? 0.9858 2.1934 1.7645 0.0499 -0.1370 0.4178 90 GLU L CA 4910 C C . GLU C 90 ? 1.1235 2.3298 1.8956 0.0176 -0.1582 0.4285 90 GLU L C 4911 O O . GLU C 90 ? 1.2618 2.4445 1.9336 -0.0123 -0.1195 0.3652 90 GLU L O 4912 C CB . GLU C 90 ? 0.8478 2.1062 1.6188 0.0788 -0.0898 0.4243 90 GLU L CB 4913 C CG . GLU C 90 ? 0.8858 2.1015 1.6774 0.1207 -0.0806 0.4649 90 GLU L CG 4914 C CD . GLU C 90 ? 0.8839 2.0228 1.7042 0.1345 -0.1010 0.5310 90 GLU L CD 4915 O OE1 . GLU C 90 ? 0.9233 2.0299 1.7521 0.1136 -0.1286 0.5513 90 GLU L OE1 4916 O OE2 . GLU C 90 ? 0.8818 1.9921 1.7117 0.1606 -0.0880 0.5646 90 GLU L OE2 4917 N N . PHE C 91 ? 1.1636 2.2777 1.9561 0.0117 -0.2054 0.4767 91 PHE L N 4918 C CA . PHE C 91 ? 1.1739 2.1682 1.8878 -0.0253 -0.2122 0.4636 91 PHE L CA 4919 C C . PHE C 91 ? 1.2244 2.1330 1.8622 -0.0728 -0.2401 0.4104 91 PHE L C 4920 O O . PHE C 91 ? 1.2841 2.1906 1.9492 -0.0746 -0.2792 0.4195 91 PHE L O 4921 C CB . PHE C 91 ? 1.1322 2.0809 1.9111 -0.0100 -0.2469 0.5585 91 PHE L CB 4922 C CG . PHE C 91 ? 1.1389 2.1436 1.9737 0.0444 -0.2094 0.6152 91 PHE L CG 4923 C CD1 . PHE C 91 ? 1.1396 2.1660 1.9224 0.0625 -0.1453 0.5880 91 PHE L CD1 4924 C CD2 . PHE C 91 ? 1.2407 2.1855 2.0939 0.0614 -0.2098 0.6543 91 PHE L CD2 4925 C CE1 . PHE C 91 ? 1.1939 2.2734 2.0259 0.1221 -0.1090 0.6497 91 PHE L CE1 4926 C CE2 . PHE C 91 ? 1.2738 2.2346 2.1408 0.1026 -0.1634 0.6901 91 PHE L CE2 4927 C CZ . PHE C 91 ? 1.2697 2.2944 2.1271 0.1385 -0.1149 0.6934 91 PHE L CZ 4928 N N . PHE C 92 ? 1.2155 2.0474 1.7502 -0.1084 -0.2164 0.3554 92 PHE L N 4929 C CA . PHE C 92 ? 1.2330 1.9759 1.6863 -0.1495 -0.2375 0.3074 92 PHE L CA 4930 C C . PHE C 92 ? 1.3276 1.9483 1.7364 -0.1815 -0.2606 0.3212 92 PHE L C 4931 O O . PHE C 92 ? 1.3636 1.9721 1.7889 -0.1744 -0.2444 0.3558 92 PHE L O 4932 C CB . PHE C 92 ? 1.1439 1.9166 1.5115 -0.1694 -0.1903 0.2264 92 PHE L CB 4933 C CG . PHE C 92 ? 1.0285 1.9200 1.4294 -0.1497 -0.1690 0.2116 92 PHE L CG 4934 C CD1 . PHE C 92 ? 0.9696 1.9696 1.4187 -0.1249 -0.1366 0.2237 92 PHE L CD1 4935 C CD2 . PHE C 92 ? 1.0371 1.9307 1.4169 -0.1537 -0.1768 0.1899 92 PHE L CD2 4936 C CE1 . PHE C 92 ? 0.9006 2.0216 1.3861 -0.1115 -0.1166 0.2146 92 PHE L CE1 4937 C CE2 . PHE C 92 ? 0.9557 1.9704 1.3743 -0.1345 -0.1512 0.1851 92 PHE L CE2 4938 C CZ . PHE C 92 ? 0.8789 2.0138 1.3560 -0.1166 -0.1234 0.1980 92 PHE L CZ 4939 N N . GLY C 93 ? 1.3532 1.8795 1.7049 -0.2140 -0.2973 0.3013 93 GLY L N 4940 C CA . GLY C 93 ? 1.4666 1.8840 1.7686 -0.2507 -0.3152 0.3063 93 GLY L CA 4941 C C . GLY C 93 ? 1.5392 1.9470 1.7518 -0.2712 -0.2649 0.2291 93 GLY L C 4942 O O . GLY C 93 ? 1.4885 1.9677 1.6741 -0.2625 -0.2261 0.1778 93 GLY L O 4943 N N . GLN C 94 ? 1.5693 1.8945 1.7405 -0.3018 -0.2682 0.2280 94 GLN L N 4944 C CA . GLN C 94 ? 1.5505 1.8582 1.6406 -0.3249 -0.2258 0.1629 94 GLN L CA 4945 C C . GLN C 94 ? 1.5335 1.8142 1.5441 -0.3468 -0.2301 0.0986 94 GLN L C 4946 O O . GLN C 94 ? 1.5154 1.8080 1.4620 -0.3636 -0.1963 0.0427 94 GLN L O 4947 C CB . GLN C 94 ? 1.5832 1.8145 1.6632 -0.3483 -0.2269 0.1883 94 GLN L CB 4948 C CG . GLN C 94 ? 1.6239 1.8713 1.7892 -0.3217 -0.2260 0.2761 94 GLN L CG 4949 C CD . GLN C 94 ? 1.7484 1.9800 1.9882 -0.3205 -0.2909 0.3562 94 GLN L CD 4950 O OE1 . GLN C 94 ? 1.8277 2.0046 2.0359 -0.3475 -0.3389 0.3414 94 GLN L OE1 4951 N NE2 . GLN C 94 ? 1.7577 2.0309 2.0896 -0.2889 -0.2930 0.4465 94 GLN L NE2 4952 N N . GLY C 95 ? 1.5433 1.7859 1.5531 -0.3439 -0.2705 0.1115 95 GLY L N 4953 C CA . GLY C 95 ? 1.6246 1.8303 1.5509 -0.3542 -0.2679 0.0597 95 GLY L CA 4954 C C . GLY C 95 ? 1.7733 1.8502 1.6312 -0.3886 -0.3001 0.0515 95 GLY L C 4955 O O . GLY C 95 ? 1.8468 1.8776 1.7183 -0.4134 -0.3145 0.0750 95 GLY L O 4956 N N . THR C 96 ? 1.8224 1.8364 1.6068 -0.3871 -0.3115 0.0264 96 THR L N 4957 C CA . THR C 96 ? 1.8255 1.7122 1.5228 -0.4176 -0.3368 0.0090 96 THR L CA 4958 C C . THR C 96 ? 1.8569 1.7484 1.4702 -0.4050 -0.3002 -0.0457 96 THR L C 4959 O O . THR C 96 ? 1.8669 1.7715 1.4550 -0.3722 -0.2863 -0.0501 96 THR L O 4960 C CB . THR C 96 ? 1.8464 1.6065 1.5130 -0.4284 -0.3981 0.0479 96 THR L CB 4961 O OG1 . THR C 96 ? 1.8378 1.5932 1.5848 -0.4492 -0.4385 0.1128 96 THR L OG1 4962 C CG2 . THR C 96 ? 1.9480 1.5697 1.4999 -0.4570 -0.4188 0.0213 96 THR L CG2 4963 N N . LYS C 97 ? 1.7996 1.6864 1.3734 -0.4279 -0.2816 -0.0806 97 LYS L N 4964 C CA . LYS C 97 ? 1.8030 1.7003 1.3018 -0.4143 -0.2491 -0.1202 97 LYS L CA 4965 C C . LYS C 97 ? 2.0575 1.8047 1.4568 -0.4169 -0.2767 -0.1259 97 LYS L C 4966 O O . LYS C 97 ? 2.1274 1.7800 1.4986 -0.4523 -0.3096 -0.1251 97 LYS L O 4967 C CB . LYS C 97 ? 1.7729 1.7410 1.2695 -0.4359 -0.2170 -0.1531 97 LYS L CB 4968 C CG . LYS C 97 ? 1.7868 1.6940 1.2780 -0.4765 -0.2344 -0.1610 97 LYS L CG 4969 C CD . LYS C 97 ? 1.7330 1.7267 1.2306 -0.4947 -0.1985 -0.1904 97 LYS L CD 4970 C CE . LYS C 97 ? 1.7331 1.6735 1.2288 -0.5327 -0.2072 -0.1987 97 LYS L CE 4971 N NZ . LYS C 97 ? 1.7872 1.6462 1.2188 -0.5469 -0.2243 -0.2175 97 LYS L NZ 4972 N N . VAL C 98 ? 2.1259 1.8467 1.4678 -0.3780 -0.2615 -0.1269 98 VAL L N 4973 C CA . VAL C 98 ? 2.1603 1.7250 1.3793 -0.3697 -0.2763 -0.1353 98 VAL L CA 4974 C C . VAL C 98 ? 2.1729 1.7701 1.3261 -0.3410 -0.2256 -0.1622 98 VAL L C 4975 O O . VAL C 98 ? 2.1008 1.7919 1.2644 -0.2991 -0.1796 -0.1554 98 VAL L O 4976 C CB . VAL C 98 ? 2.1703 1.6474 1.3491 -0.3411 -0.2938 -0.1102 98 VAL L CB 4977 C CG1 . VAL C 98 ? 2.3232 1.5996 1.3508 -0.3409 -0.3166 -0.1187 98 VAL L CG1 4978 C CG2 . VAL C 98 ? 2.1431 1.6278 1.4127 -0.3661 -0.3428 -0.0712 98 VAL L CG2 4979 N N . GLN C 99 ? 2.2540 1.7851 1.3482 -0.3641 -0.2339 -0.1847 99 GLN L N 4980 C CA . GLN C 99 ? 2.3548 1.9222 1.3936 -0.3387 -0.1902 -0.2027 99 GLN L CA 4981 C C . GLN C 99 ? 2.4390 1.8381 1.3380 -0.3225 -0.1964 -0.2130 99 GLN L C 4982 O O . GLN C 99 ? 2.4144 1.6580 1.2538 -0.3507 -0.2447 -0.2142 99 GLN L O 4983 C CB . GLN C 99 ? 2.4003 2.0745 1.5016 -0.3766 -0.1837 -0.2216 99 GLN L CB 4984 C CG . GLN C 99 ? 2.5243 2.1259 1.6434 -0.4307 -0.2286 -0.2310 99 GLN L CG 4985 C CD . GLN C 99 ? 2.5560 2.2712 1.7514 -0.4655 -0.2169 -0.2451 99 GLN L CD 4986 O OE1 . GLN C 99 ? 2.6059 2.3521 1.7782 -0.4732 -0.2007 -0.2652 99 GLN L OE1 4987 N NE2 . GLN C 99 ? 2.4991 2.2707 1.7796 -0.4845 -0.2239 -0.2320 99 GLN L NE2 4988 N N . VAL C 100 ? 2.5317 1.9671 1.3766 -0.2779 -0.1466 -0.2142 100 VAL L N 4989 C CA . VAL C 100 ? 2.7287 2.0149 1.4276 -0.2419 -0.1336 -0.2189 100 VAL L CA 4990 C C . VAL C 100 ? 2.7757 2.0358 1.4474 -0.2724 -0.1477 -0.2430 100 VAL L C 4991 O O . VAL C 100 ? 2.7290 2.1321 1.4761 -0.2875 -0.1314 -0.2485 100 VAL L O 4992 C CB . VAL C 100 ? 2.7834 2.1249 1.4370 -0.1643 -0.0632 -0.1924 100 VAL L CB 4993 C CG1 . VAL C 100 ? 2.7235 2.2698 1.4630 -0.1617 -0.0253 -0.1806 100 VAL L CG1 4994 C CG2 . VAL C 100 ? 2.9649 2.1160 1.4444 -0.1147 -0.0444 -0.1922 100 VAL L CG2 4995 N N . ASP C 101 ? 2.8860 1.9565 1.4431 -0.2847 -0.1807 -0.2556 101 ASP L N 4996 C CA . ASP C 101 ? 2.9572 1.9847 1.4683 -0.3039 -0.1896 -0.2761 101 ASP L CA 4997 C C . ASP C 101 ? 2.9866 1.8168 1.3145 -0.2573 -0.1776 -0.2764 101 ASP L C 4998 O O . ASP C 101 ? 3.1090 1.7729 1.3717 -0.2767 -0.2172 -0.2727 101 ASP L O 4999 C CB . ASP C 101 ? 3.0785 2.1042 1.6872 -0.3753 -0.2435 -0.2799 101 ASP L CB 5000 C CG . ASP C 101 ? 3.3321 2.2177 1.9213 -0.3991 -0.2907 -0.2570 101 ASP L CG 5001 O OD1 . ASP C 101 ? 3.5393 2.3695 2.0833 -0.3913 -0.3023 -0.2497 101 ASP L OD1 5002 O OD2 . ASP C 101 ? 3.2970 2.1351 1.9140 -0.4265 -0.3164 -0.2403 101 ASP L OD2 5003 N N . ILE C 102 ? 2.9017 1.7711 1.1759 -0.1880 -0.1157 -0.2648 102 ILE L N 5004 C CA . ILE C 102 ? 3.0781 1.7520 1.1624 -0.1324 -0.0925 -0.2630 102 ILE L CA 5005 C C . ILE C 102 ? 3.0919 1.6976 1.1713 -0.1649 -0.1239 -0.2763 102 ILE L C 5006 O O . ILE C 102 ? 2.8828 1.6159 1.0447 -0.1801 -0.1191 -0.2833 102 ILE L O 5007 C CB . ILE C 102 ? 3.0383 1.8005 1.0927 -0.0398 -0.0085 -0.2294 102 ILE L CB 5008 C CG1 . ILE C 102 ? 2.9266 1.8210 1.0620 -0.0029 0.0327 -0.1947 102 ILE L CG1 5009 C CG2 . ILE C 102 ? 3.1819 1.7264 1.0224 0.0287 0.0253 -0.2245 102 ILE L CG2 5010 C CD1 . ILE C 102 ? 2.6750 1.6846 0.8021 0.0831 0.1159 -0.1444 102 ILE L CD1 5011 N N . LYS C 103 ? 2.8888 1.3047 0.8836 -0.1757 -0.1547 -0.2713 103 LYS L N 5012 C CA . LYS C 103 ? 2.9077 1.2705 0.9146 -0.2107 -0.1851 -0.2709 103 LYS L CA 5013 C C . LYS C 103 ? 3.4697 1.8144 1.3894 -0.1469 -0.1350 -0.2728 103 LYS L C 5014 O O . LYS C 103 ? 3.1007 1.3783 0.8948 -0.0661 -0.0789 -0.2613 103 LYS L O 5015 C CB . LYS C 103 ? 3.1378 1.3033 1.0576 -0.2402 -0.2301 -0.2514 103 LYS L CB 5016 C CG . LYS C 103 ? 3.0381 1.2449 1.0799 -0.3205 -0.2939 -0.2318 103 LYS L CG 5017 C CD . LYS C 103 ? 2.8746 1.2263 1.0388 -0.3355 -0.2965 -0.2379 103 LYS L CD 5018 C CE . LYS C 103 ? 2.7947 1.1708 1.0653 -0.4019 -0.3545 -0.2062 103 LYS L CE 5019 N NZ . LYS C 103 ? 2.6569 1.1564 1.0393 -0.4153 -0.3596 -0.2074 103 LYS L NZ 5020 N N . ARG C 104 ? 3.3113 1.7271 1.3038 -0.1751 -0.1485 -0.2799 104 ARG L N 5021 C CA . ARG C 104 ? 3.2408 1.6509 1.1620 -0.1165 -0.1057 -0.2779 104 ARG L CA 5022 C C . ARG C 104 ? 3.0876 1.5187 1.0832 -0.1712 -0.1443 -0.2853 104 ARG L C 5023 O O . ARG C 104 ? 2.9821 1.4665 1.0985 -0.2440 -0.1911 -0.2859 104 ARG L O 5024 C CB . ARG C 104 ? 3.1437 1.7398 1.1140 -0.0718 -0.0559 -0.2723 104 ARG L CB 5025 C CG . ARG C 104 ? 2.9902 1.7767 1.1335 -0.1387 -0.0870 -0.2884 104 ARG L CG 5026 C CD . ARG C 104 ? 2.8919 1.8682 1.0813 -0.1089 -0.0463 -0.2739 104 ARG L CD 5027 N NE . ARG C 104 ? 2.9936 1.9791 1.1039 -0.0336 0.0031 -0.2463 104 ARG L NE 5028 C CZ . ARG C 104 ? 2.9930 1.9802 1.1127 -0.0379 -0.0073 -0.2529 104 ARG L CZ 5029 N NH1 . ARG C 104 ? 2.9242 1.9267 1.1444 -0.1160 -0.0617 -0.2841 104 ARG L NH1 5030 N NH2 . ARG C 104 ? 3.0044 2.0100 1.0566 0.0398 0.0422 -0.2178 104 ARG L NH2 5031 N N . THR C 105 ? 3.0970 1.5047 1.0296 -0.1286 -0.1175 -0.2837 105 THR L N 5032 C CA . THR C 105 ? 3.0520 1.4923 1.0559 -0.1751 -0.1487 -0.2898 105 THR L CA 5033 C C . THR C 105 ? 2.8302 1.4988 1.0211 -0.2169 -0.1586 -0.3026 105 THR L C 5034 O O . THR C 105 ? 2.6986 1.4906 0.9202 -0.1902 -0.1297 -0.3044 105 THR L O 5035 C CB . THR C 105 ? 3.2002 1.5581 1.0888 -0.1172 -0.1183 -0.2846 105 THR L CB 5036 O OG1 . THR C 105 ? 3.2320 1.7031 1.1117 -0.0458 -0.0634 -0.2773 105 THR L OG1 5037 C CG2 . THR C 105 ? 3.4437 1.5541 1.1387 -0.0781 -0.1084 -0.2693 105 THR L CG2 5038 N N . VAL C 106 ? 2.7471 1.4721 1.0596 -0.2805 -0.1961 -0.3038 106 VAL L N 5039 C CA . VAL C 106 ? 2.5677 1.4878 1.0585 -0.3191 -0.2042 -0.3120 106 VAL L CA 5040 C C . VAL C 106 ? 2.4512 1.4781 0.9454 -0.2836 -0.1759 -0.3215 106 VAL L C 5041 O O . VAL C 106 ? 2.4298 1.3997 0.8455 -0.2524 -0.1648 -0.3203 106 VAL L O 5042 C CB . VAL C 106 ? 2.5782 1.5223 1.1816 -0.3764 -0.2375 -0.3006 106 VAL L CB 5043 C CG1 . VAL C 106 ? 2.4299 1.5568 1.1981 -0.3977 -0.2342 -0.3075 106 VAL L CG1 5044 C CG2 . VAL C 106 ? 2.6872 1.5802 1.3159 -0.4136 -0.2644 -0.2792 106 VAL L CG2 5045 N N . ALA C 107 ? 2.3762 1.5598 0.9574 -0.2892 -0.1652 -0.3253 107 ALA L N 5046 C CA . ALA C 107 ? 2.3142 1.6207 0.9059 -0.2638 -0.1436 -0.3226 107 ALA L CA 5047 C C . ALA C 107 ? 2.2381 1.7042 1.0015 -0.3147 -0.1614 -0.3280 107 ALA L C 5048 O O . ALA C 107 ? 2.1757 1.7036 1.0185 -0.3429 -0.1665 -0.3280 107 ALA L O 5049 C CB . ALA C 107 ? 2.3358 1.6785 0.8312 -0.2067 -0.1014 -0.3016 107 ALA L CB 5050 N N . ALA C 108 ? 2.3921 1.9126 1.2086 -0.3219 -0.1683 -0.3298 108 ALA L N 5051 C CA . ALA C 108 ? 2.3155 1.9685 1.2894 -0.3613 -0.1796 -0.3290 108 ALA L CA 5052 C C . ALA C 108 ? 2.2324 2.0203 1.2248 -0.3591 -0.1647 -0.3159 108 ALA L C 5053 O O . ALA C 108 ? 2.1466 1.9595 1.0342 -0.3190 -0.1434 -0.2991 108 ALA L O 5054 C CB . ALA C 108 ? 2.2950 1.9609 1.3137 -0.3660 -0.1895 -0.3308 108 ALA L CB 5055 N N . PRO C 109 ? 2.3924 2.2683 1.5145 -0.3980 -0.1700 -0.3124 109 PRO L N 5062 N N . SER C 110 ? 2.0039 2.0454 1.6215 0.0719 0.1618 0.1174 110 SER L N 5063 C CA . SER C 110 ? 1.6840 1.8025 1.3593 0.0845 0.1846 0.1313 110 SER L CA 5064 C C . SER C 110 ? 1.5901 1.7333 1.3278 0.0808 0.1734 0.1682 110 SER L C 5065 O O . SER C 110 ? 1.5914 1.6998 1.3523 0.0927 0.1594 0.1682 110 SER L O 5066 C CB . SER C 110 ? 1.5831 1.7133 1.2865 0.1262 0.2063 0.0971 110 SER L CB 5067 O OG . SER C 110 ? 1.6353 1.7513 1.2834 0.1332 0.2249 0.0571 110 SER L OG 5068 N N . VAL C 111 ? 1.5159 1.7118 1.2748 0.0639 0.1787 0.1988 111 VAL L N 5069 C CA . VAL C 111 ? 1.3823 1.5895 1.1910 0.0604 0.1674 0.2300 111 VAL L CA 5070 C C . VAL C 111 ? 1.2503 1.4970 1.1053 0.0699 0.1834 0.2410 111 VAL L C 5071 O O . VAL C 111 ? 1.2758 1.5621 1.1212 0.0615 0.2009 0.2437 111 VAL L O 5072 C CB . VAL C 111 ? 1.4009 1.6229 1.2002 0.0357 0.1512 0.2587 111 VAL L CB 5073 C CG1 . VAL C 111 ? 1.4118 1.6371 1.2621 0.0386 0.1407 0.2807 111 VAL L CG1 5074 C CG2 . VAL C 111 ? 1.4280 1.6239 1.1739 0.0177 0.1369 0.2447 111 VAL L CG2 5075 N N . PHE C 112 ? 1.2370 1.4723 1.1353 0.0820 0.1777 0.2451 112 PHE L N 5076 C CA . PHE C 112 ? 1.2089 1.4790 1.1500 0.0842 0.1886 0.2568 112 PHE L CA 5077 C C . PHE C 112 ? 1.1591 1.4073 1.1248 0.0772 0.1752 0.2796 112 PHE L C 5078 O O . PHE C 112 ? 1.1648 1.3764 1.1282 0.0803 0.1622 0.2741 112 PHE L O 5079 C CB . PHE C 112 ? 0.9939 1.2749 0.9642 0.1088 0.1944 0.2316 112 PHE L CB 5080 C CG . PHE C 112 ? 1.4600 1.7543 1.4093 0.1263 0.2089 0.1985 112 PHE L CG 5081 C CD1 . PHE C 112 ? 1.4244 1.6656 1.3553 0.1508 0.1956 0.1710 112 PHE L CD1 5082 C CD2 . PHE C 112 ? 1.5074 1.8587 1.4454 0.1154 0.2358 0.1933 112 PHE L CD2 5083 C CE1 . PHE C 112 ? 1.4611 1.7017 1.3680 0.1721 0.2092 0.1345 112 PHE L CE1 5084 C CE2 . PHE C 112 ? 1.5040 1.8674 1.4179 0.1327 0.2546 0.1551 112 PHE L CE2 5085 C CZ . PHE C 112 ? 1.5179 1.8235 1.4187 0.1651 0.2414 0.1235 112 PHE L CZ 5086 N N . ILE C 113 ? 1.1512 1.4166 1.1340 0.0647 0.1792 0.3035 113 ILE L N 5087 C CA . ILE C 113 ? 1.1202 1.3573 1.1246 0.0619 0.1695 0.3184 113 ILE L CA 5088 C C . ILE C 113 ? 1.2039 1.4530 1.2345 0.0564 0.1751 0.3216 113 ILE L C 5089 O O . ILE C 113 ? 1.1980 1.4881 1.2330 0.0460 0.1874 0.3258 113 ILE L O 5090 C CB . ILE C 113 ? 1.1239 1.3515 1.1218 0.0539 0.1614 0.3445 113 ILE L CB 5091 C CG1 . ILE C 113 ? 1.1481 1.3413 1.1687 0.0584 0.1546 0.3509 113 ILE L CG1 5092 C CG2 . ILE C 113 ? 1.1141 1.3615 1.0952 0.0365 0.1664 0.3660 113 ILE L CG2 5093 C CD1 . ILE C 113 ? 1.1392 1.3244 1.1646 0.0652 0.1421 0.3675 113 ILE L CD1 5094 N N . PHE C 114 ? 1.2318 1.4502 1.2769 0.0583 0.1665 0.3182 114 PHE L N 5095 C CA . PHE C 114 ? 1.2005 1.4253 1.2681 0.0485 0.1653 0.3214 114 PHE L CA 5096 C C . PHE C 114 ? 1.2372 1.4163 1.2998 0.0354 0.1602 0.3350 114 PHE L C 5097 O O . PHE C 114 ? 1.2745 1.4154 1.3284 0.0413 0.1555 0.3271 114 PHE L O 5098 C CB . PHE C 114 ? 1.1404 1.3601 1.2198 0.0612 0.1542 0.3026 114 PHE L CB 5099 C CG . PHE C 114 ? 1.1420 1.3930 1.2278 0.0834 0.1564 0.2831 114 PHE L CG 5100 C CD1 . PHE C 114 ? 1.1330 1.4482 1.2533 0.0890 0.1660 0.2765 114 PHE L CD1 5101 C CD2 . PHE C 114 ? 1.1764 1.3945 1.2329 0.0973 0.1508 0.2688 114 PHE L CD2 5102 C CE1 . PHE C 114 ? 1.1429 1.4859 1.2730 0.1172 0.1707 0.2512 114 PHE L CE1 5103 C CE2 . PHE C 114 ? 1.2077 1.4386 1.2626 0.1205 0.1520 0.2466 114 PHE L CE2 5104 C CZ . PHE C 114 ? 1.1782 1.4708 1.2719 0.1348 0.1630 0.2357 114 PHE L CZ 5105 N N . PRO C 115 ? 1.2277 1.4087 1.2923 0.0145 0.1625 0.3531 115 PRO L N 5106 C CA . PRO C 115 ? 1.2553 1.3799 1.3095 0.0010 0.1568 0.3629 115 PRO L CA 5107 C C . PRO C 115 ? 1.3101 1.4217 1.3704 -0.0083 0.1497 0.3502 115 PRO L C 5108 O O . PRO C 115 ? 1.3052 1.4614 1.3859 -0.0074 0.1457 0.3424 115 PRO L O 5109 C CB . PRO C 115 ? 1.2174 1.3464 1.2613 -0.0262 0.1584 0.3878 115 PRO L CB 5110 C CG . PRO C 115 ? 1.2295 1.4213 1.2752 -0.0257 0.1685 0.3911 115 PRO L CG 5111 C CD . PRO C 115 ? 1.2307 1.4639 1.2991 -0.0021 0.1725 0.3643 115 PRO L CD 5112 N N . PRO C 116 ? 1.2949 1.3455 1.3368 -0.0173 0.1464 0.3480 116 PRO L N 5113 C CA . PRO C 116 ? 1.3099 1.3376 1.3430 -0.0350 0.1371 0.3379 116 PRO L CA 5114 C C . PRO C 116 ? 1.3181 1.3796 1.3654 -0.0641 0.1274 0.3497 116 PRO L C 5115 O O . PRO C 116 ? 1.2138 1.2908 1.2642 -0.0818 0.1318 0.3670 116 PRO L O 5116 C CB . PRO C 116 ? 1.3581 1.3096 1.3612 -0.0405 0.1419 0.3319 116 PRO L CB 5117 C CG . PRO C 116 ? 1.3289 1.2758 1.3394 -0.0111 0.1520 0.3327 116 PRO L CG 5118 C CD . PRO C 116 ? 1.2745 1.2718 1.3013 -0.0080 0.1504 0.3522 116 PRO L CD 5119 N N . SER C 117 ? 1.4050 1.4864 1.4630 -0.0711 0.1118 0.3421 117 SER L N 5120 C CA . SER C 117 ? 1.4341 1.5624 1.5164 -0.0998 0.0991 0.3524 117 SER L CA 5121 C C . SER C 117 ? 1.6165 1.6799 1.6599 -0.1407 0.0950 0.3606 117 SER L C 5122 O O . SER C 117 ? 1.7720 1.7540 1.7725 -0.1391 0.0992 0.3506 117 SER L O 5123 C CB . SER C 117 ? 1.2848 1.4471 1.3910 -0.0919 0.0751 0.3440 117 SER L CB 5124 O OG . SER C 117 ? 1.2562 1.3454 1.3166 -0.1010 0.0615 0.3359 117 SER L OG 5125 N N . ASP C 118 ? 1.5854 1.6833 1.6412 -0.1789 0.0886 0.3759 118 ASP L N 5126 C CA . ASP C 118 ? 1.7382 1.7609 1.7464 -0.2236 0.0809 0.3828 118 ASP L CA 5127 C C . ASP C 118 ? 1.7282 1.7009 1.7045 -0.2387 0.0625 0.3688 118 ASP L C 5128 O O . ASP C 118 ? 1.7567 1.6324 1.6746 -0.2567 0.0642 0.3604 118 ASP L O 5129 C CB . ASP C 118 ? 1.9179 1.9994 1.9456 -0.2717 0.0748 0.4031 118 ASP L CB 5130 C CG . ASP C 118 ? 2.0755 2.1894 2.1118 -0.2721 0.0943 0.4194 118 ASP L CG 5131 O OD1 . ASP C 118 ? 2.1735 2.1984 2.1602 -0.2761 0.1004 0.4291 118 ASP L OD1 5132 O OD2 . ASP C 118 ? 2.0932 2.3199 2.1841 -0.2661 0.1029 0.4212 118 ASP L OD2 5133 N N . GLU C 119 ? 1.6835 1.7201 1.6950 -0.2306 0.0434 0.3655 119 GLU L N 5134 C CA . GLU C 119 ? 1.6736 1.6726 1.6523 -0.2490 0.0185 0.3572 119 GLU L CA 5135 C C . GLU C 119 ? 1.6500 1.5585 1.5709 -0.2308 0.0338 0.3366 119 GLU L C 5136 O O . GLU C 119 ? 1.8403 1.6708 1.6980 -0.2598 0.0303 0.3247 119 GLU L O 5137 C CB . GLU C 119 ? 1.6681 1.7536 1.7022 -0.2338 -0.0106 0.3613 119 GLU L CB 5138 C CG . GLU C 119 ? 1.8263 1.8762 1.8232 -0.2598 -0.0474 0.3603 119 GLU L CG 5139 C CD . GLU C 119 ? 1.8870 2.0195 1.9454 -0.2381 -0.0851 0.3681 119 GLU L CD 5140 O OE1 . GLU C 119 ? 1.9053 2.1442 2.0453 -0.2251 -0.0862 0.3751 119 GLU L OE1 5141 O OE2 . GLU C 119 ? 1.9037 1.9950 1.9279 -0.2355 -0.1147 0.3668 119 GLU L OE2 5142 N N . GLN C 120 ? 1.4326 1.3540 1.3728 -0.1864 0.0545 0.3301 120 GLN L N 5143 C CA . GLN C 120 ? 1.4247 1.2820 1.3217 -0.1709 0.0725 0.3096 120 GLN L CA 5144 C C . GLN C 120 ? 1.4578 1.2421 1.3192 -0.1781 0.0945 0.2997 120 GLN L C 5145 O O . GLN C 120 ? 1.4927 1.2126 1.3045 -0.1865 0.1053 0.2773 120 GLN L O 5146 C CB . GLN C 120 ? 1.3989 1.2926 1.3258 -0.1272 0.0862 0.3058 120 GLN L CB 5147 C CG . GLN C 120 ? 1.4500 1.2950 1.3392 -0.1176 0.1062 0.2840 120 GLN L CG 5148 C CD . GLN C 120 ? 1.4708 1.3514 1.3852 -0.0830 0.1177 0.2810 120 GLN L CD 5149 O OE1 . GLN C 120 ? 1.4927 1.3540 1.3819 -0.0812 0.1298 0.2646 120 GLN L OE1 5150 N NE2 . GLN C 120 ? 1.4385 1.3734 1.3979 -0.0610 0.1156 0.2952 120 GLN L NE2 5151 N N . LEU C 121 ? 1.4923 1.2817 1.3747 -0.1730 0.1019 0.3143 121 LEU L N 5152 C CA . LEU C 121 ? 1.7018 1.4057 1.5480 -0.1749 0.1157 0.3066 121 LEU L CA 5153 C C . LEU C 121 ? 1.8578 1.4897 1.6451 -0.2212 0.1054 0.2961 121 LEU L C 5154 O O . LEU C 121 ? 1.9841 1.5290 1.7240 -0.2203 0.1197 0.2719 121 LEU L O 5155 C CB . LEU C 121 ? 1.7826 1.4928 1.6476 -0.1736 0.1153 0.3318 121 LEU L CB 5156 C CG . LEU C 121 ? 1.8125 1.5755 1.7196 -0.1286 0.1269 0.3377 121 LEU L CG 5157 C CD1 . LEU C 121 ? 1.8263 1.6652 1.7667 -0.1389 0.1211 0.3648 121 LEU L CD1 5158 C CD2 . LEU C 121 ? 1.9002 1.5935 1.7932 -0.1003 0.1371 0.3328 121 LEU L CD2 5159 N N . LYS C 122 ? 1.7887 1.4619 1.5811 -0.2609 0.0800 0.3118 122 LYS L N 5160 C CA . LYS C 122 ? 1.8629 1.4769 1.5968 -0.3132 0.0634 0.3048 122 LYS L CA 5161 C C . LYS C 122 ? 2.0198 1.5896 1.7044 -0.3125 0.0698 0.2757 122 LYS L C 5162 O O . LYS C 122 ? 2.1818 1.6714 1.7960 -0.3490 0.0683 0.2576 122 LYS L O 5163 C CB . LYS C 122 ? 1.8159 1.5064 1.5793 -0.3539 0.0302 0.3290 122 LYS L CB 5164 C CG . LYS C 122 ? 1.8026 1.5097 1.5807 -0.3868 0.0247 0.3528 122 LYS L CG 5165 C CD . LYS C 122 ? 1.7599 1.5604 1.5760 -0.4305 -0.0073 0.3724 122 LYS L CD 5166 C CE . LYS C 122 ? 1.7064 1.5970 1.5812 -0.4419 -0.0030 0.3975 122 LYS L CE 5167 N NZ . LYS C 122 ? 1.7818 1.5887 1.6033 -0.4804 0.0058 0.4087 122 LYS L NZ 5168 N N . SER C 123 ? 1.9380 1.5561 1.6499 -0.2779 0.0768 0.2704 123 SER L N 5169 C CA . SER C 123 ? 2.0088 1.5860 1.6641 -0.2874 0.0843 0.2446 123 SER L CA 5170 C C . SER C 123 ? 2.0202 1.5425 1.6515 -0.2602 0.1270 0.2104 123 SER L C 5171 O O . SER C 123 ? 2.0719 1.5590 1.6501 -0.2731 0.1435 0.1821 123 SER L O 5172 C CB . SER C 123 ? 2.0343 1.6749 1.7155 -0.2720 0.0688 0.2545 123 SER L CB 5173 O OG . SER C 123 ? 1.9921 1.6812 1.7296 -0.2228 0.0876 0.2569 123 SER L OG 5174 N N . GLY C 124 ? 1.9898 1.5063 1.6591 -0.2249 0.1437 0.2127 124 GLY L N 5175 C CA . GLY C 124 ? 2.0551 1.5256 1.7180 -0.1904 0.1789 0.1812 124 GLY L CA 5176 C C . GLY C 124 ? 2.0134 1.5496 1.7241 -0.1475 0.1993 0.1732 124 GLY L C 5177 O O . GLY C 124 ? 2.0651 1.5875 1.7744 -0.1231 0.2306 0.1406 124 GLY L O 5178 N N . THR C 125 ? 1.9114 1.5231 1.6668 -0.1387 0.1819 0.2012 125 THR L N 5179 C CA . THR C 125 ? 1.8864 1.5608 1.6844 -0.1047 0.1946 0.1994 125 THR L CA 5180 C C . THR C 125 ? 1.8274 1.5577 1.6802 -0.0835 0.1777 0.2322 125 THR L C 5181 O O . THR C 125 ? 1.7392 1.4760 1.5974 -0.1006 0.1567 0.2551 125 THR L O 5182 C CB . THR C 125 ? 1.8939 1.5930 1.6640 -0.1263 0.1919 0.1919 125 THR L CB 5183 O OG1 . THR C 125 ? 1.8130 1.5067 1.5574 -0.1602 0.1580 0.2113 125 THR L OG1 5184 C CG2 . THR C 125 ? 2.0291 1.6941 1.7499 -0.1421 0.2226 0.1533 125 THR L CG2 5185 N N . ALA C 126 ? 1.8089 1.5852 1.7013 -0.0497 0.1882 0.2328 126 ALA L N 5186 C CA . ALA C 126 ? 1.6595 1.4846 1.5938 -0.0313 0.1761 0.2598 126 ALA L CA 5187 C C . ALA C 126 ? 1.5593 1.4389 1.5131 -0.0153 0.1796 0.2564 126 ALA L C 5188 O O . ALA C 126 ? 1.5706 1.4585 1.5288 -0.0032 0.1970 0.2377 126 ALA L O 5189 C CB . ALA C 126 ? 1.6526 1.4568 1.6067 -0.0081 0.1797 0.2699 126 ALA L CB 5190 N N . SER C 127 ? 1.4280 1.3449 1.3916 -0.0181 0.1630 0.2716 127 SER L N 5191 C CA . SER C 127 ? 1.3182 1.2735 1.2912 -0.0057 0.1620 0.2698 127 SER L CA 5192 C C . SER C 127 ? 1.2449 1.2426 1.2492 0.0132 0.1569 0.2875 127 SER L C 5193 O O . SER C 127 ? 1.2796 1.2953 1.2937 0.0090 0.1465 0.2994 127 SER L O 5194 C CB . SER C 127 ? 1.3334 1.2796 1.2777 -0.0239 0.1446 0.2666 127 SER L CB 5195 O OG . SER C 127 ? 1.3348 1.2408 1.2353 -0.0496 0.1496 0.2507 127 SER L OG 5196 N N . VAL C 128 ? 1.1777 1.1997 1.1969 0.0310 0.1644 0.2874 128 VAL L N 5197 C CA . VAL C 128 ? 1.2059 1.2658 1.2411 0.0437 0.1600 0.3021 128 VAL L CA 5198 C C . VAL C 128 ? 1.1223 1.2010 1.1462 0.0452 0.1549 0.2924 128 VAL L C 5199 O O . VAL C 128 ? 1.0268 1.1043 1.0413 0.0420 0.1583 0.2812 128 VAL L O 5200 C CB . VAL C 128 ? 1.2073 1.2759 1.2601 0.0599 0.1634 0.3123 128 VAL L CB 5201 C CG1 . VAL C 128 ? 1.1683 1.2682 1.2227 0.0634 0.1572 0.3312 128 VAL L CG1 5202 C CG2 . VAL C 128 ? 1.2026 1.2276 1.2579 0.0615 0.1655 0.3172 128 VAL L CG2 5203 N N . VAL C 129 ? 1.2197 1.3168 1.2438 0.0494 0.1479 0.2949 129 VAL L N 5204 C CA . VAL C 129 ? 1.4055 1.4991 1.4099 0.0528 0.1398 0.2827 129 VAL L CA 5205 C C . VAL C 129 ? 1.5176 1.6425 1.5223 0.0636 0.1435 0.2844 129 VAL L C 5206 O O . VAL C 129 ? 1.5516 1.7056 1.5694 0.0698 0.1488 0.2906 129 VAL L O 5207 C CB . VAL C 129 ? 1.3725 1.4517 1.3729 0.0557 0.1246 0.2766 129 VAL L CB 5208 C CG1 . VAL C 129 ? 1.3299 1.3870 1.3027 0.0637 0.1120 0.2640 129 VAL L CG1 5209 C CG2 . VAL C 129 ? 1.3577 1.4013 1.3459 0.0374 0.1166 0.2772 129 VAL L CG2 5210 N N . CYS C 130 ? 1.5392 1.6580 1.5220 0.0599 0.1403 0.2768 130 CYS L N 5211 C CA . CYS C 130 ? 1.5123 1.6531 1.4824 0.0641 0.1410 0.2760 130 CYS L CA 5212 C C . CYS C 130 ? 1.5114 1.6210 1.4447 0.0646 0.1311 0.2575 130 CYS L C 5213 O O . CYS C 130 ? 1.6422 1.7185 1.5495 0.0494 0.1218 0.2510 130 CYS L O 5214 C CB . CYS C 130 ? 1.4693 1.6328 1.4460 0.0565 0.1413 0.2859 130 CYS L CB 5215 S SG . CYS C 130 ? 2.8298 3.0217 2.7839 0.0534 0.1367 0.2907 130 CYS L SG 5216 N N . LEU C 131 ? 1.3652 1.4830 1.2934 0.0808 0.1341 0.2474 131 LEU L N 5217 C CA . LEU C 131 ? 1.2541 1.3320 1.1462 0.0909 0.1243 0.2251 131 LEU L CA 5218 C C . LEU C 131 ? 1.2319 1.3120 1.0848 0.0842 0.1280 0.2154 131 LEU L C 5219 O O . LEU C 131 ? 1.2378 1.3629 1.0967 0.0853 0.1426 0.2195 131 LEU L O 5220 C CB . LEU C 131 ? 1.2062 1.2943 1.1252 0.1204 0.1260 0.2124 131 LEU L CB 5221 C CG . LEU C 131 ? 1.2594 1.3083 1.1518 0.1458 0.1174 0.1839 131 LEU L CG 5222 C CD1 . LEU C 131 ? 1.2610 1.2227 1.1134 0.1405 0.0871 0.1811 131 LEU L CD1 5223 C CD2 . LEU C 131 ? 1.0856 1.1810 1.0300 0.1803 0.1256 0.1706 131 LEU L CD2 5224 N N . LEU C 132 ? 1.2869 1.3114 1.0900 0.0718 0.1128 0.2029 132 LEU L N 5225 C CA . LEU C 132 ? 1.2915 1.2982 1.0413 0.0608 0.1109 0.1882 132 LEU L CA 5226 C C . LEU C 132 ? 1.3200 1.2552 1.0270 0.0821 0.1019 0.1575 132 LEU L C 5227 O O . LEU C 132 ? 1.3599 1.2220 1.0323 0.0745 0.0801 0.1527 132 LEU L O 5228 C CB . LEU C 132 ? 1.3144 1.3114 1.0352 0.0212 0.0975 0.1984 132 LEU L CB 5229 C CG . LEU C 132 ? 1.3856 1.4545 1.1440 0.0033 0.1018 0.2231 132 LEU L CG 5230 C CD1 . LEU C 132 ? 1.2861 1.3894 1.1069 0.0164 0.1110 0.2402 132 LEU L CD1 5231 C CD2 . LEU C 132 ? 1.5270 1.5937 1.2598 -0.0356 0.0876 0.2254 132 LEU L CD2 5232 N N . ASN C 133 ? 1.3965 1.3490 1.1010 0.1077 0.1185 0.1354 133 ASN L N 5233 C CA . ASN C 133 ? 1.5602 1.4530 1.2429 0.1435 0.1130 0.1011 133 ASN L CA 5234 C C . ASN C 133 ? 1.7512 1.5785 1.3539 0.1380 0.1099 0.0706 133 ASN L C 5235 O O . ASN C 133 ? 1.8216 1.6848 1.3967 0.1188 0.1271 0.0662 133 ASN L O 5236 C CB . ASN C 133 ? 1.6405 1.6037 1.3834 0.1826 0.1382 0.0872 133 ASN L CB 5237 C CG . ASN C 133 ? 1.8217 1.7738 1.6158 0.2173 0.1227 0.0861 133 ASN L CG 5238 O OD1 . ASN C 133 ? 1.9293 1.7958 1.6950 0.2203 0.0907 0.0866 133 ASN L OD1 5239 N ND2 . ASN C 133 ? 1.8801 1.9177 1.7460 0.2375 0.1412 0.0881 133 ASN L ND2 5240 N N . ASN C 134 ? 1.8438 1.5669 1.4039 0.1541 0.0848 0.0505 134 ASN L N 5241 C CA . ASN C 134 ? 1.9518 1.5869 1.4290 0.1572 0.0788 0.0140 134 ASN L CA 5242 C C . ASN C 134 ? 2.0279 1.6396 1.4255 0.1031 0.0764 0.0142 134 ASN L C 5243 O O . ASN C 134 ? 2.2992 1.9098 1.6533 0.1048 0.0941 -0.0146 134 ASN L O 5244 C CB . ASN C 134 ? 2.0462 1.7111 1.5464 0.2122 0.1078 -0.0286 134 ASN L CB 5245 C CG . ASN C 134 ? 2.1088 1.7826 1.6840 0.2732 0.1019 -0.0385 134 ASN L CG 5246 O OD1 . ASN C 134 ? 2.0490 1.7163 1.6608 0.2705 0.0773 -0.0078 134 ASN L OD1 5247 N ND2 . ASN C 134 ? 2.1955 1.9097 1.8042 0.3253 0.1291 -0.0800 134 ASN L ND2 5248 N N . PHE C 135 ? 1.8425 1.4384 1.2186 0.0518 0.0542 0.0446 135 PHE L N 5249 C CA . PHE C 135 ? 1.7608 1.3698 1.0848 -0.0062 0.0494 0.0544 135 PHE L CA 5250 C C . PHE C 135 ? 1.8144 1.3095 1.0482 -0.0504 0.0163 0.0496 135 PHE L C 5251 O O . PHE C 135 ? 1.8552 1.2673 1.0725 -0.0444 -0.0056 0.0510 135 PHE L O 5252 C CB . PHE C 135 ? 1.6053 1.3264 0.9963 -0.0341 0.0553 0.0958 135 PHE L CB 5253 C CG . PHE C 135 ? 1.7574 1.4743 1.1819 -0.0479 0.0413 0.1201 135 PHE L CG 5254 C CD1 . PHE C 135 ? 1.8589 1.5504 1.2424 -0.1039 0.0210 0.1321 135 PHE L CD1 5255 C CD2 . PHE C 135 ? 1.7313 1.4720 1.2225 -0.0114 0.0491 0.1295 135 PHE L CD2 5256 C CE1 . PHE C 135 ? 1.8111 1.5030 1.2173 -0.1228 0.0134 0.1511 135 PHE L CE1 5257 C CE2 . PHE C 135 ? 1.6919 1.4239 1.2006 -0.0298 0.0377 0.1492 135 PHE L CE2 5258 C CZ . PHE C 135 ? 1.7502 1.4582 1.2149 -0.0853 0.0221 0.1590 135 PHE L CZ 5259 N N . TYR C 136 ? 1.8466 1.3390 1.0181 -0.1011 0.0097 0.0475 136 TYR L N 5260 C CA . TYR C 136 ? 1.9942 1.3936 1.0743 -0.1606 -0.0212 0.0463 136 TYR L CA 5261 C C . TYR C 136 ? 2.1060 1.5728 1.1636 -0.2257 -0.0271 0.0620 136 TYR L C 5262 O O . TYR C 136 ? 2.1888 1.7091 1.2435 -0.2220 -0.0133 0.0545 136 TYR L O 5263 C CB . TYR C 136 ? 2.1328 1.3790 1.1119 -0.1420 -0.0338 0.0023 136 TYR L CB 5264 C CG . TYR C 136 ? 2.2493 1.3722 1.1232 -0.2060 -0.0712 0.0035 136 TYR L CG 5265 C CD1 . TYR C 136 ? 2.3429 1.4544 1.1386 -0.2720 -0.0819 -0.0013 136 TYR L CD1 5266 C CD2 . TYR C 136 ? 2.2801 1.3007 1.1262 -0.2105 -0.0988 0.0131 136 TYR L CD2 5267 C CE1 . TYR C 136 ? 2.4558 1.4617 1.1514 -0.3423 -0.1161 0.0015 136 TYR L CE1 5268 C CE2 . TYR C 136 ? 2.4888 1.3935 1.2259 -0.2827 -0.1340 0.0176 136 TYR L CE2 5269 C CZ . TYR C 136 ? 2.5221 1.4230 1.1861 -0.3494 -0.1409 0.0109 136 TYR L CZ 5270 O OH . TYR C 136 ? 2.5991 1.3923 1.1514 -0.4315 -0.1755 0.0158 136 TYR L OH 5271 N N . PRO C 137 ? 2.1496 1.6117 1.1833 -0.2909 -0.0502 0.0828 137 PRO L N 5272 C CA . PRO C 137 ? 2.2689 1.6580 1.2821 -0.3124 -0.0683 0.0927 137 PRO L CA 5273 C C . PRO C 137 ? 2.2122 1.6911 1.3292 -0.2898 -0.0531 0.1198 137 PRO L C 5274 O O . PRO C 137 ? 2.0157 1.6108 1.2236 -0.2556 -0.0297 0.1311 137 PRO L O 5275 C CB . PRO C 137 ? 2.3241 1.7205 1.2828 -0.4041 -0.0903 0.1063 137 PRO L CB 5276 C CG . PRO C 137 ? 2.1624 1.7034 1.1799 -0.4171 -0.0796 0.1196 137 PRO L CG 5277 C CD . PRO C 137 ? 2.1493 1.6896 1.1721 -0.3564 -0.0614 0.0992 137 PRO L CD 5278 N N . ARG C 138 ? 2.3776 1.7979 1.4704 -0.3168 -0.0681 0.1309 138 ARG L N 5279 C CA . ARG C 138 ? 2.3491 1.8248 1.5191 -0.2950 -0.0551 0.1505 138 ARG L CA 5280 C C . ARG C 138 ? 2.2689 1.9045 1.5324 -0.3129 -0.0328 0.1721 138 ARG L C 5281 O O . ARG C 138 ? 2.1678 1.8717 1.5135 -0.2750 -0.0132 0.1823 138 ARG L O 5282 C CB . ARG C 138 ? 2.4536 1.8200 1.5530 -0.3350 -0.0799 0.1584 138 ARG L CB 5283 C CG . ARG C 138 ? 2.3906 1.7973 1.5488 -0.3219 -0.0693 0.1770 138 ARG L CG 5284 C CD . ARG C 138 ? 2.5102 1.7956 1.5808 -0.3671 -0.0983 0.1875 138 ARG L CD 5285 N NE . ARG C 138 ? 2.5858 1.8702 1.5922 -0.4620 -0.1058 0.1975 138 ARG L NE 5286 C CZ . ARG C 138 ? 2.5345 1.9348 1.5855 -0.5114 -0.0826 0.2116 138 ARG L CZ 5287 N NH1 . ARG C 138 ? 2.4153 1.9247 1.5674 -0.4718 -0.0524 0.2165 138 ARG L NH1 5288 N NH2 . ARG C 138 ? 2.6085 2.0163 1.6021 -0.6021 -0.0885 0.2182 138 ARG L NH2 5289 N N . GLU C 139 ? 2.2963 1.9896 1.5476 -0.3709 -0.0384 0.1780 139 GLU L N 5290 C CA . GLU C 139 ? 2.1419 1.9922 1.4899 -0.3820 -0.0214 0.1959 139 GLU L CA 5291 C C . GLU C 139 ? 1.9614 1.8841 1.3853 -0.3177 -0.0052 0.1991 139 GLU L C 5292 O O . GLU C 139 ? 2.0101 1.9008 1.3996 -0.2984 -0.0100 0.1883 139 GLU L O 5293 C CB . GLU C 139 ? 2.2798 2.1867 1.6051 -0.4545 -0.0361 0.2009 139 GLU L CB 5294 C CG . GLU C 139 ? 2.5083 2.3639 1.7634 -0.5333 -0.0488 0.2022 139 GLU L CG 5295 C CD . GLU C 139 ? 2.7569 2.4217 1.8811 -0.5476 -0.0736 0.1886 139 GLU L CD 5296 O OE1 . GLU C 139 ? 2.8362 2.4203 1.9172 -0.5079 -0.0827 0.1717 139 GLU L OE1 5297 O OE2 . GLU C 139 ? 2.8308 2.4231 1.8943 -0.5955 -0.0836 0.1938 139 GLU L OE2 5298 N N . ALA C 140 ? 1.7926 1.8075 1.3118 -0.2892 0.0144 0.2128 140 ALA L N 5299 C CA . ALA C 140 ? 1.6075 1.6867 1.1977 -0.2340 0.0279 0.2213 140 ALA L CA 5300 C C . ALA C 140 ? 1.5043 1.6850 1.1915 -0.2217 0.0438 0.2360 140 ALA L C 5301 O O . ALA C 140 ? 1.6522 1.8387 1.3476 -0.2452 0.0518 0.2338 140 ALA L O 5302 C CB . ALA C 140 ? 1.4946 1.5001 1.0711 -0.1817 0.0371 0.2106 140 ALA L CB 5303 N N . LYS C 141 ? 1.2991 1.5558 1.0531 -0.1886 0.0474 0.2500 141 LYS L N 5304 C CA . LYS C 141 ? 1.2254 1.5676 1.0717 -0.1688 0.0610 0.2601 141 LYS L CA 5305 C C . LYS C 141 ? 1.3484 1.6846 1.2361 -0.1137 0.0727 0.2690 141 LYS L C 5306 O O . LYS C 141 ? 1.5216 1.8497 1.3977 -0.0944 0.0653 0.2783 141 LYS L O 5307 C CB . LYS C 141 ? 1.2594 1.7087 1.1598 -0.1822 0.0465 0.2729 141 LYS L CB 5308 C CG . LYS C 141 ? 1.3069 1.8529 1.3117 -0.1561 0.0580 0.2787 141 LYS L CG 5309 C CD . LYS C 141 ? 1.4221 2.0775 1.4787 -0.1722 0.0348 0.2907 141 LYS L CD 5310 C CE . LYS C 141 ? 1.4473 2.2097 1.6207 -0.1368 0.0421 0.2935 141 LYS L CE 5311 N NZ . LYS C 141 ? 1.4451 2.3257 1.6770 -0.1529 0.0137 0.3052 141 LYS L NZ 5312 N N . VAL C 142 ? 1.2658 1.6072 1.1962 -0.0947 0.0914 0.2662 142 VAL L N 5313 C CA . VAL C 142 ? 1.2030 1.5368 1.1722 -0.0497 0.1018 0.2750 142 VAL L CA 5314 C C . VAL C 142 ? 1.0889 1.4949 1.1393 -0.0289 0.1079 0.2818 142 VAL L C 5315 O O . VAL C 142 ? 1.0458 1.5047 1.1280 -0.0461 0.1156 0.2712 142 VAL L O 5316 C CB . VAL C 142 ? 1.1798 1.4425 1.1221 -0.0410 0.1144 0.2650 142 VAL L CB 5317 C CG1 . VAL C 142 ? 0.9775 1.2371 0.9578 -0.0036 0.1234 0.2753 142 VAL L CG1 5318 C CG2 . VAL C 142 ? 1.2922 1.4874 1.1650 -0.0493 0.1042 0.2566 142 VAL L CG2 5319 N N . GLN C 143 ? 1.1615 1.5759 1.2447 0.0058 0.1017 0.2995 143 GLN L N 5320 C CA . GLN C 143 ? 1.2570 1.7288 1.4165 0.0340 0.1003 0.3064 143 GLN L CA 5321 C C . GLN C 143 ? 1.2260 1.6490 1.3977 0.0687 0.1077 0.3148 143 GLN L C 5322 O O . GLN C 143 ? 1.3098 1.7042 1.4609 0.0790 0.0945 0.3359 143 GLN L O 5323 C CB . GLN C 143 ? 1.3888 1.9203 1.5733 0.0368 0.0700 0.3276 143 GLN L CB 5324 C CG . GLN C 143 ? 1.4259 2.0375 1.7026 0.0658 0.0621 0.3307 143 GLN L CG 5325 C CD . GLN C 143 ? 1.4691 2.1560 1.7860 0.0434 0.0800 0.3042 143 GLN L CD 5326 O OE1 . GLN C 143 ? 1.5379 2.1986 1.8356 0.0276 0.1106 0.2803 143 GLN L OE1 5327 N NE2 . GLN C 143 ? 1.4440 2.2307 1.8165 0.0377 0.0595 0.3097 143 GLN L NE2 5328 N N . TRP C 144 ? 1.1969 1.6048 1.3910 0.0795 0.1298 0.2978 144 TRP L N 5329 C CA . TRP C 144 ? 1.1955 1.5502 1.3941 0.1063 0.1339 0.3059 144 TRP L CA 5330 C C . TRP C 144 ? 1.2683 1.6478 1.5268 0.1443 0.1208 0.3179 144 TRP L C 5331 O O . TRP C 144 ? 1.3044 1.7454 1.6216 0.1592 0.1245 0.3038 144 TRP L O 5332 C CB . TRP C 144 ? 1.1570 1.4732 1.3453 0.1009 0.1595 0.2829 144 TRP L CB 5333 C CG . TRP C 144 ? 1.1359 1.4055 1.2658 0.0743 0.1636 0.2786 144 TRP L CG 5334 C CD1 . TRP C 144 ? 1.1993 1.4642 1.2958 0.0438 0.1708 0.2619 144 TRP L CD1 5335 C CD2 . TRP C 144 ? 1.0795 1.2993 1.1790 0.0759 0.1588 0.2908 144 TRP L CD2 5336 N NE1 . TRP C 144 ? 1.2245 1.4343 1.2742 0.0336 0.1661 0.2638 144 TRP L NE1 5337 C CE2 . TRP C 144 ? 1.1355 1.3273 1.1932 0.0540 0.1610 0.2795 144 TRP L CE2 5338 C CE3 . TRP C 144 ? 1.0987 1.2975 1.2018 0.0908 0.1515 0.3112 144 TRP L CE3 5339 C CZ2 . TRP C 144 ? 1.1480 1.3055 1.1822 0.0539 0.1569 0.2848 144 TRP L CZ2 5340 C CZ3 . TRP C 144 ? 1.1477 1.3169 1.2217 0.0815 0.1519 0.3164 144 TRP L CZ3 5341 C CH2 . TRP C 144 ? 1.1883 1.3441 1.2355 0.0668 0.1550 0.3016 144 TRP L CH2 5342 N N . LYS C 145 ? 1.2629 1.5943 1.5066 0.1598 0.1044 0.3437 145 LYS L N 5343 C CA . LYS C 145 ? 1.2936 1.6192 1.5816 0.1987 0.0843 0.3604 145 LYS L CA 5344 C C . LYS C 145 ? 1.3676 1.6051 1.6241 0.2048 0.0869 0.3707 145 LYS L C 5345 O O . LYS C 145 ? 1.2386 1.4399 1.4412 0.1789 0.0868 0.3854 145 LYS L O 5346 C CB . LYS C 145 ? 1.3222 1.6790 1.6130 0.2020 0.0462 0.3937 145 LYS L CB 5347 C CG . LYS C 145 ? 1.3791 1.8225 1.6889 0.1841 0.0388 0.3870 145 LYS L CG 5348 C CD . LYS C 145 ? 1.5163 1.9809 1.8178 0.1835 -0.0040 0.4234 145 LYS L CD 5349 C CE . LYS C 145 ? 1.6042 2.1703 1.9625 0.1831 -0.0230 0.4200 145 LYS L CE 5350 N NZ . LYS C 145 ? 1.7365 2.3188 2.0866 0.1846 -0.0737 0.4608 145 LYS L NZ 5351 N N . VAL C 146 ? 1.5159 1.7224 1.8077 0.2378 0.0919 0.3585 146 VAL L N 5352 C CA . VAL C 146 ? 1.5305 1.6430 1.7904 0.2417 0.0921 0.3663 146 VAL L CA 5353 C C . VAL C 146 ? 1.5706 1.6425 1.8564 0.2828 0.0604 0.3884 146 VAL L C 5354 O O . VAL C 146 ? 1.5029 1.5859 1.8482 0.3272 0.0622 0.3670 146 VAL L O 5355 C CB . VAL C 146 ? 1.4823 1.5628 1.7407 0.2406 0.1258 0.3284 146 VAL L CB 5356 C CG1 . VAL C 146 ? 1.5346 1.5118 1.7524 0.2379 0.1211 0.3387 146 VAL L CG1 5357 C CG2 . VAL C 146 ? 1.3501 1.4639 1.5798 0.2006 0.1500 0.3094 146 VAL L CG2 5358 N N . ASP C 147 ? 1.7156 1.7428 1.9562 0.2681 0.0305 0.4308 147 ASP L N 5359 C CA . ASP C 147 ? 1.8778 1.8609 2.1307 0.3020 -0.0122 0.4629 147 ASP L CA 5360 C C . ASP C 147 ? 1.8572 1.9292 2.1851 0.3397 -0.0336 0.4616 147 ASP L C 5361 O O . ASP C 147 ? 1.9065 1.9738 2.2974 0.3944 -0.0484 0.4525 147 ASP L O 5362 C CB . ASP C 147 ? 2.0035 1.8902 2.2622 0.3344 -0.0099 0.4488 147 ASP L CB 5363 C CG . ASP C 147 ? 2.2574 2.0559 2.5012 0.3610 -0.0588 0.4885 147 ASP L CG 5364 O OD1 . ASP C 147 ? 2.3702 2.1053 2.5375 0.3192 -0.0777 0.5285 147 ASP L OD1 5365 O OD2 . ASP C 147 ? 2.3777 2.1712 2.6859 0.4232 -0.0789 0.4795 147 ASP L OD2 5366 N N . ASN C 148 ? 1.8100 1.9655 2.1325 0.3099 -0.0344 0.4671 148 ASN L N 5367 C CA . ASN C 148 ? 1.8179 2.0712 2.2033 0.3299 -0.0584 0.4704 148 ASN L CA 5368 C C . ASN C 148 ? 1.7390 2.0714 2.2160 0.3643 -0.0338 0.4260 148 ASN L C 5369 O O . ASN C 148 ? 1.7612 2.1850 2.3095 0.3875 -0.0546 0.4260 148 ASN L O 5370 C CB . ASN C 148 ? 1.9982 2.2203 2.3975 0.3638 -0.1174 0.5142 148 ASN L CB 5371 C CG . ASN C 148 ? 2.1404 2.3374 2.4560 0.3188 -0.1494 0.5617 148 ASN L CG 5372 O OD1 . ASN C 148 ? 2.1683 2.3968 2.4322 0.2688 -0.1274 0.5565 148 ASN L OD1 5373 N ND2 . ASN C 148 ? 2.2387 2.3740 2.5357 0.3364 -0.2027 0.6073 148 ASN L ND2 5374 N N . ALA C 149 ? 1.6568 1.9609 2.1302 0.3624 0.0108 0.3877 149 ALA L N 5375 C CA . ALA C 149 ? 1.5694 1.9502 2.1155 0.3833 0.0444 0.3403 149 ALA L CA 5376 C C . ALA C 149 ? 1.5505 1.9919 2.0679 0.3282 0.0763 0.3201 149 ALA L C 5377 O O . ALA C 149 ? 1.5405 1.9254 1.9859 0.2894 0.0967 0.3169 149 ALA L O 5378 C CB . ALA C 149 ? 1.5677 1.8760 2.1173 0.4110 0.0734 0.3080 149 ALA L CB 5379 N N . LEU C 150 ? 1.5384 2.0944 2.1137 0.3244 0.0777 0.3067 150 LEU L N 5380 C CA . LEU C 150 ? 1.5069 2.1125 2.0501 0.2690 0.1031 0.2889 150 LEU L CA 5381 C C . LEU C 150 ? 1.4997 2.0853 2.0255 0.2531 0.1517 0.2481 150 LEU L C 5382 O O . LEU C 150 ? 1.4507 2.0671 2.0346 0.2842 0.1755 0.2161 150 LEU L O 5383 C CB . LEU C 150 ? 1.5019 2.2379 2.1122 0.2630 0.0911 0.2851 150 LEU L CB 5384 C CG . LEU C 150 ? 1.5066 2.2933 2.0841 0.2013 0.1166 0.2644 150 LEU L CG 5385 C CD1 . LEU C 150 ? 1.4623 2.1722 1.9366 0.1568 0.1056 0.2858 150 LEU L CD1 5386 C CD2 . LEU C 150 ? 1.5490 2.4729 2.1989 0.1915 0.1020 0.2621 150 LEU L CD2 5387 N N . GLN C 151 ? 1.5221 2.0527 1.9650 0.2058 0.1649 0.2484 151 GLN L N 5388 C CA . GLN C 151 ? 1.5039 2.0047 1.9138 0.1824 0.2034 0.2160 151 GLN L CA 5389 C C . GLN C 151 ? 1.4623 2.0301 1.8609 0.1339 0.2226 0.1960 151 GLN L C 5390 O O . GLN C 151 ? 1.4905 2.0335 1.8261 0.0921 0.2127 0.2087 151 GLN L O 5391 C CB . GLN C 151 ? 1.4861 1.8823 1.8147 0.1620 0.2011 0.2298 151 GLN L CB 5392 C CG . GLN C 151 ? 1.5252 1.8499 1.8525 0.1961 0.1842 0.2505 151 GLN L CG 5393 C CD . GLN C 151 ? 1.5511 1.8561 1.9200 0.2356 0.2000 0.2266 151 GLN L CD 5394 O OE1 . GLN C 151 ? 1.6058 1.8649 1.9451 0.2243 0.2264 0.2013 151 GLN L OE1 5395 N NE2 . GLN C 151 ? 1.5212 1.8571 1.9566 0.2833 0.1816 0.2333 151 GLN L NE2 5396 N N . SER C 152 ? 1.4023 2.0516 1.8581 0.1378 0.2507 0.1631 152 SER L N 5397 C CA . SER C 152 ? 1.3773 2.0951 1.8181 0.0816 0.2708 0.1446 152 SER L CA 5398 C C . SER C 152 ? 1.6536 2.3321 2.0429 0.0499 0.3118 0.1123 152 SER L C 5399 O O . SER C 152 ? 1.6065 2.3145 2.0389 0.0742 0.3447 0.0787 152 SER L O 5400 C CB . SER C 152 ? 1.3582 2.2213 1.8995 0.0935 0.2740 0.1313 152 SER L CB 5401 O OG . SER C 152 ? 1.3508 2.2817 1.8691 0.0267 0.2877 0.1204 152 SER L OG 5402 N N . GLY C 153 ? 1.6920 2.2974 1.9852 -0.0021 0.3076 0.1219 153 GLY L N 5403 C CA . GLY C 153 ? 1.6924 2.2549 1.9207 -0.0432 0.3375 0.0984 153 GLY L CA 5404 C C . GLY C 153 ? 1.6595 2.1137 1.8402 -0.0277 0.3390 0.0982 153 GLY L C 5405 O O . GLY C 153 ? 1.6964 2.1222 1.8337 -0.0540 0.3663 0.0738 153 GLY L O 5406 N N . ASN C 154 ? 1.5964 1.9936 1.7815 0.0091 0.3097 0.1256 154 ASN L N 5407 C CA . ASN C 154 ? 1.6450 1.9468 1.7902 0.0204 0.3060 0.1299 154 ASN L CA 5408 C C . ASN C 154 ? 1.6464 1.8816 1.7258 -0.0050 0.2771 0.1576 154 ASN L C 5409 O O . ASN C 154 ? 1.7384 1.9064 1.7917 0.0028 0.2659 0.1685 154 ASN L O 5410 C CB . ASN C 154 ? 1.7529 2.0379 1.9509 0.0777 0.2962 0.1388 154 ASN L CB 5411 C CG . ASN C 154 ? 1.9068 2.2390 2.1705 0.1143 0.3232 0.1062 154 ASN L CG 5412 O OD1 . ASN C 154 ? 1.9822 2.3993 2.2788 0.1027 0.3485 0.0798 154 ASN L OD1 5413 N ND2 . ASN C 154 ? 1.9659 2.2438 2.2498 0.1585 0.3183 0.1063 154 ASN L ND2 5414 N N . SER C 155 ? 1.5559 1.8111 1.6101 -0.0353 0.2643 0.1672 155 SER L N 5415 C CA . SER C 155 ? 1.4901 1.6849 1.4903 -0.0494 0.2354 0.1895 155 SER L CA 5416 C C . SER C 155 ? 1.4954 1.6656 1.4280 -0.1001 0.2279 0.1878 155 SER L C 5417 O O . SER C 155 ? 1.5107 1.7235 1.4361 -0.1343 0.2445 0.1733 155 SER L O 5418 C CB . SER C 155 ? 1.4196 1.6387 1.4499 -0.0238 0.2141 0.2104 155 SER L CB 5419 O OG . SER C 155 ? 1.3607 1.6488 1.4141 -0.0375 0.2166 0.2056 155 SER L OG 5420 N N . GLN C 156 ? 1.5042 1.6055 1.3882 -0.1049 0.2009 0.2034 156 GLN L N 5421 C CA . GLN C 156 ? 1.5359 1.5874 1.3464 -0.1473 0.1826 0.2069 156 GLN L CA 5422 C C . GLN C 156 ? 1.5272 1.5440 1.3203 -0.1330 0.1521 0.2214 156 GLN L C 5423 O O . GLN C 156 ? 1.4514 1.4547 1.2676 -0.0953 0.1408 0.2302 156 GLN L O 5424 C CB . GLN C 156 ? 1.6987 1.6830 1.4514 -0.1718 0.1770 0.2058 156 GLN L CB 5425 C CG . GLN C 156 ? 1.8009 1.8170 1.5455 -0.2041 0.2125 0.1838 156 GLN L CG 5426 C CD . GLN C 156 ? 1.8754 1.8312 1.5679 -0.2245 0.2115 0.1803 156 GLN L CD 5427 O OE1 . GLN C 156 ? 1.9190 1.8351 1.5340 -0.2781 0.2089 0.1781 156 GLN L OE1 5428 N NE2 . GLN C 156 ? 1.8766 1.8231 1.6042 -0.1885 0.2125 0.1809 156 GLN L NE2 5429 N N . GLU C 157 ? 1.6903 1.6887 1.4357 -0.1676 0.1399 0.2215 157 GLU L N 5430 C CA . GLU C 157 ? 1.7873 1.7414 1.5048 -0.1562 0.1126 0.2286 157 GLU L CA 5431 C C . GLU C 157 ? 1.7786 1.6277 1.4144 -0.1771 0.0814 0.2333 157 GLU L C 5432 O O . GLU C 157 ? 1.9394 1.7499 1.5205 -0.2212 0.0780 0.2344 157 GLU L O 5433 C CB . GLU C 157 ? 1.9915 1.9904 1.7095 -0.1788 0.1148 0.2257 157 GLU L CB 5434 C CG . GLU C 157 ? 2.1164 2.2109 1.9149 -0.1493 0.1319 0.2261 157 GLU L CG 5435 C CD . GLU C 157 ? 2.3165 2.4612 2.1147 -0.1775 0.1279 0.2252 157 GLU L CD 5436 O OE1 . GLU C 157 ? 2.4635 2.5813 2.2032 -0.2300 0.1207 0.2214 157 GLU L OE1 5437 O OE2 . GLU C 157 ? 2.3293 2.5357 2.1791 -0.1523 0.1280 0.2307 157 GLU L OE2 5438 N N . SER C 158 ? 1.6686 1.4696 1.2933 -0.1449 0.0576 0.2351 158 SER L N 5439 C CA . SER C 158 ? 1.7115 1.4029 1.2622 -0.1532 0.0205 0.2386 158 SER L CA 5440 C C . SER C 158 ? 1.7387 1.3932 1.2742 -0.1261 0.0039 0.2302 158 SER L C 5441 O O . SER C 158 ? 1.7419 1.4453 1.3335 -0.0807 0.0160 0.2237 158 SER L O 5442 C CB . SER C 158 ? 1.6989 1.3559 1.2590 -0.1269 0.0035 0.2459 158 SER L CB 5443 O OG . SER C 158 ? 1.9038 1.4540 1.4012 -0.1235 -0.0396 0.2503 158 SER L OG 5444 N N . VAL C 159 ? 1.6625 1.2246 1.1139 -0.1574 -0.0232 0.2292 159 VAL L N 5445 C CA . VAL C 159 ? 1.6273 1.1407 1.0517 -0.1344 -0.0379 0.2156 159 VAL L CA 5446 C C . VAL C 159 ? 1.8733 1.2552 1.2355 -0.1148 -0.0807 0.2134 159 VAL L C 5447 O O . VAL C 159 ? 2.1865 1.4841 1.4797 -0.1532 -0.1085 0.2272 159 VAL L O 5448 C CB . VAL C 159 ? 1.6824 1.1937 1.0558 -0.1892 -0.0355 0.2125 159 VAL L CB 5449 C CG1 . VAL C 159 ? 1.7513 1.2164 1.0951 -0.1652 -0.0463 0.1944 159 VAL L CG1 5450 C CG2 . VAL C 159 ? 1.6435 1.2886 1.0839 -0.2085 0.0005 0.2165 159 VAL L CG2 5451 N N . THR C 160 ? 1.8538 1.2168 1.2378 -0.0550 -0.0869 0.1950 160 THR L N 5452 C CA . THR C 160 ? 2.0545 1.2907 1.3885 -0.0221 -0.1299 0.1869 160 THR L CA 5453 C C . THR C 160 ? 2.2016 1.3147 1.4220 -0.0680 -0.1566 0.1830 160 THR L C 5454 O O . THR C 160 ? 2.1024 1.2501 1.2986 -0.1155 -0.1366 0.1805 160 THR L O 5455 C CB . THR C 160 ? 2.0188 1.2820 1.4128 0.0566 -0.1214 0.1596 160 THR L CB 5456 O OG1 . THR C 160 ? 2.0302 1.3318 1.4186 0.0521 -0.0927 0.1394 160 THR L OG1 5457 C CG2 . THR C 160 ? 1.8732 1.2528 1.3737 0.0950 -0.0991 0.1654 160 THR L CG2 5458 N N . GLU C 161 ? 2.4257 1.3916 1.5728 -0.0580 -0.2057 0.1841 161 GLU L N 5459 C CA . GLU C 161 ? 2.6945 1.5338 1.7291 -0.0984 -0.2303 0.1760 161 GLU L CA 5460 C C . GLU C 161 ? 2.7372 1.5820 1.7907 -0.0459 -0.2142 0.1388 161 GLU L C 5461 O O . GLU C 161 ? 2.6654 1.5839 1.8088 0.0272 -0.1948 0.1209 161 GLU L O 5462 C CB . GLU C 161 ? 2.9781 1.6362 1.9134 -0.1061 -0.2930 0.1897 161 GLU L CB 5463 C CG . GLU C 161 ? 3.1168 1.7698 2.0145 -0.1743 -0.3056 0.2271 161 GLU L CG 5464 C CD . GLU C 161 ? 3.2137 1.9110 2.0615 -0.2724 -0.2785 0.2366 161 GLU L CD 5465 O OE1 . GLU C 161 ? 3.3421 1.9207 2.0760 -0.3299 -0.3054 0.2391 161 GLU L OE1 5466 O OE2 . GLU C 161 ? 3.1638 2.0184 2.0906 -0.2899 -0.2304 0.2395 161 GLU L OE2 5467 N N . GLN C 162 ? 2.8697 1.6391 1.8341 -0.0884 -0.2209 0.1259 162 GLN L N 5468 C CA . GLN C 162 ? 2.8919 1.6623 1.8584 -0.0476 -0.2029 0.0871 162 GLN L CA 5469 C C . GLN C 162 ? 2.9953 1.6950 1.9847 0.0459 -0.2212 0.0590 162 GLN L C 5470 O O . GLN C 162 ? 3.1618 1.7167 2.0916 0.0586 -0.2709 0.0646 162 GLN L O 5471 C CB . GLN C 162 ? 2.9487 1.6066 1.7904 -0.1113 -0.2211 0.0768 162 GLN L CB 5472 C CG . GLN C 162 ? 2.8449 1.4946 1.6688 -0.0805 -0.2019 0.0337 162 GLN L CG 5473 C CD . GLN C 162 ? 2.8951 1.4329 1.5882 -0.1547 -0.2225 0.0254 162 GLN L CD 5474 O OE1 . GLN C 162 ? 3.0903 1.4835 1.6817 -0.2035 -0.2654 0.0398 162 GLN L OE1 5475 N NE2 . GLN C 162 ? 2.8046 1.4087 1.4935 -0.1718 -0.1945 0.0052 162 GLN L NE2 5476 N N . ASP C 163 ? 2.9304 1.7380 2.0115 0.1114 -0.1835 0.0318 163 ASP L N 5477 C CA . ASP C 163 ? 3.0776 1.8391 2.1962 0.2040 -0.1974 0.0009 163 ASP L CA 5478 C C . ASP C 163 ? 3.4666 2.0458 2.4658 0.2071 -0.2284 -0.0310 163 ASP L C 5479 O O . ASP C 163 ? 3.5666 2.1310 2.5006 0.1633 -0.2104 -0.0470 163 ASP L O 5480 C CB . ASP C 163 ? 2.8607 1.7749 2.0893 0.2641 -0.1456 -0.0278 163 ASP L CB 5481 C CG . ASP C 163 ? 2.8413 1.7385 2.1322 0.3626 -0.1571 -0.0605 163 ASP L CG 5482 O OD1 . ASP C 163 ? 2.9420 1.7239 2.2104 0.3895 -0.2105 -0.0513 163 ASP L OD1 5483 O OD2 . ASP C 163 ? 2.7371 1.7410 2.1011 0.4120 -0.1139 -0.0948 163 ASP L OD2 5484 N N . SER C 164 ? 3.6824 2.1146 2.6454 0.2541 -0.2796 -0.0382 164 SER L N 5485 C CA . SER C 164 ? 3.9348 2.1633 2.7713 0.2572 -0.3172 -0.0672 164 SER L CA 5486 C C . SER C 164 ? 3.9192 2.1558 2.7684 0.3242 -0.2809 -0.1339 164 SER L C 5487 O O . SER C 164 ? 4.0949 2.1951 2.8299 0.3047 -0.2914 -0.1643 164 SER L O 5488 C CB . SER C 164 ? 4.1012 2.1543 2.8874 0.2864 -0.3911 -0.0498 164 SER L CB 5489 O OG . SER C 164 ? 4.0798 2.1810 2.9789 0.3882 -0.4015 -0.0619 164 SER L OG 5490 N N . LYS C 165 ? 3.6762 2.0725 2.6582 0.3965 -0.2373 -0.1572 165 LYS L N 5491 C CA . LYS C 165 ? 3.6128 2.0468 2.6271 0.4681 -0.1948 -0.2238 165 LYS L CA 5492 C C . LYS C 165 ? 3.4003 1.9349 2.3931 0.4178 -0.1360 -0.2413 165 LYS L C 5493 O O . LYS C 165 ? 3.5862 2.0364 2.4969 0.4244 -0.1243 -0.2905 165 LYS L O 5494 C CB . LYS C 165 ? 3.5313 2.1036 2.7013 0.5628 -0.1748 -0.2398 165 LYS L CB 5495 C CG . LYS C 165 ? 3.3144 2.1188 2.6004 0.5503 -0.1141 -0.2263 165 LYS L CG 5496 C CD . LYS C 165 ? 3.2620 2.1824 2.6914 0.6389 -0.1042 -0.2423 165 LYS L CD 5497 C CE . LYS C 165 ? 3.2770 2.1518 2.7404 0.6507 -0.1660 -0.1959 165 LYS L CE 5498 N NZ . LYS C 165 ? 3.2355 2.2310 2.8446 0.7331 -0.1641 -0.2075 165 LYS L NZ 5499 N N . ASP C 166 ? 3.0026 1.7069 2.0618 0.3699 -0.1015 -0.2039 166 ASP L N 5500 C CA . ASP C 166 ? 2.8878 1.6841 1.9275 0.3279 -0.0528 -0.2181 166 ASP L CA 5501 C C . ASP C 166 ? 2.7668 1.5485 1.7363 0.2243 -0.0700 -0.1712 166 ASP L C 5502 O O . ASP C 166 ? 2.7514 1.6061 1.6978 0.1722 -0.0426 -0.1682 166 ASP L O 5503 C CB . ASP C 166 ? 2.7905 1.7911 1.9558 0.3566 0.0013 -0.2176 166 ASP L CB 5504 C CG . ASP C 166 ? 2.7160 1.8305 1.9722 0.3318 -0.0028 -0.1575 166 ASP L CG 5505 O OD1 . ASP C 166 ? 2.7595 1.8345 1.9787 0.2712 -0.0327 -0.1132 166 ASP L OD1 5506 O OD2 . ASP C 166 ? 2.5868 1.8368 1.9512 0.3702 0.0275 -0.1570 166 ASP L OD2 5507 N N . SER C 167 ? 2.6830 1.3801 1.6244 0.1945 -0.1164 -0.1332 167 SER L N 5508 C CA . SER C 167 ? 2.7041 1.3786 1.5772 0.0950 -0.1362 -0.0915 167 SER L CA 5509 C C . SER C 167 ? 2.4387 1.2958 1.3937 0.0528 -0.1036 -0.0536 167 SER L C 5510 O O . SER C 167 ? 2.3483 1.2254 1.2632 -0.0265 -0.1087 -0.0271 167 SER L O 5511 C CB . SER C 167 ? 2.9937 1.5531 1.7336 0.0418 -0.1474 -0.1162 167 SER L CB 5512 O OG . SER C 167 ? 3.2822 1.6558 1.9405 0.0887 -0.1774 -0.1577 167 SER L OG 5513 N N . THR C 168 ? 2.3531 1.3415 1.4249 0.1047 -0.0735 -0.0496 168 THR L N 5514 C CA . THR C 168 ? 2.3094 1.4557 1.4569 0.0707 -0.0460 -0.0139 168 THR L CA 5515 C C . THR C 168 ? 2.2973 1.4715 1.4936 0.0554 -0.0617 0.0276 168 THR L C 5516 O O . THR C 168 ? 2.4803 1.5607 1.6576 0.0720 -0.0950 0.0331 168 THR L O 5517 C CB . THR C 168 ? 2.2206 1.5008 1.4583 0.1194 -0.0016 -0.0281 168 THR L CB 5518 O OG1 . THR C 168 ? 2.1817 1.4718 1.4915 0.1892 -0.0021 -0.0382 168 THR L OG1 5519 C CG2 . THR C 168 ? 2.3133 1.5785 1.4965 0.1276 0.0208 -0.0711 168 THR L CG2 5520 N N . TYR C 169 ? 2.0843 1.3864 1.3403 0.0236 -0.0384 0.0564 169 TYR L N 5521 C CA . TYR C 169 ? 2.0013 1.3495 1.3076 0.0070 -0.0429 0.0912 169 TYR L CA 5522 C C . TYR C 169 ? 1.9010 1.3793 1.3134 0.0459 -0.0106 0.0981 169 TYR L C 5523 O O . TYR C 169 ? 1.9413 1.4864 1.3799 0.0650 0.0163 0.0839 169 TYR L O 5524 C CB . TYR C 169 ? 1.9620 1.3382 1.2395 -0.0704 -0.0453 0.1166 169 TYR L CB 5525 C CG . TYR C 169 ? 2.0149 1.2621 1.1799 -0.1234 -0.0787 0.1137 169 TYR L CG 5526 C CD1 . TYR C 169 ? 2.0895 1.2897 1.1822 -0.1496 -0.0838 0.0939 169 TYR L CD1 5527 C CD2 . TYR C 169 ? 2.0705 1.2363 1.1912 -0.1535 -0.1069 0.1316 169 TYR L CD2 5528 C CE1 . TYR C 169 ? 2.2688 1.3416 1.2496 -0.2050 -0.1166 0.0917 169 TYR L CE1 5529 C CE2 . TYR C 169 ? 2.2566 1.2963 1.2637 -0.2106 -0.1395 0.1321 169 TYR L CE2 5530 C CZ . TYR C 169 ? 2.3474 1.3386 1.2852 -0.2364 -0.1446 0.1120 169 TYR L CZ 5531 O OH . TYR C 169 ? 2.4934 1.3472 1.3080 -0.3009 -0.1801 0.1135 169 TYR L OH 5532 N N . SER C 170 ? 1.8202 1.3263 1.2840 0.0534 -0.0150 0.1198 170 SER L N 5533 C CA . SER C 170 ? 1.6503 1.2724 1.2070 0.0780 0.0126 0.1309 170 SER L CA 5534 C C . SER C 170 ? 1.5563 1.2077 1.1296 0.0381 0.0108 0.1609 170 SER L C 5535 O O . SER C 170 ? 1.7052 1.2829 1.2300 0.0098 -0.0140 0.1697 170 SER L O 5536 C CB . SER C 170 ? 1.6366 1.2609 1.2440 0.1388 0.0092 0.1179 170 SER L CB 5537 O OG . SER C 170 ? 1.7523 1.3646 1.3512 0.1791 0.0193 0.0828 170 SER L OG 5538 N N . LEU C 171 ? 1.4332 1.1862 1.0658 0.0318 0.0372 0.1752 171 LEU L N 5539 C CA . LEU C 171 ? 1.4540 1.2445 1.1068 -0.0027 0.0427 0.1967 171 LEU L CA 5540 C C . LEU C 171 ? 1.4403 1.3020 1.1679 0.0187 0.0609 0.2093 171 LEU L C 5541 O O . LEU C 171 ? 1.4151 1.3284 1.1857 0.0485 0.0763 0.2073 171 LEU L O 5542 C CB . LEU C 171 ? 1.4315 1.2683 1.0747 -0.0418 0.0524 0.2019 171 LEU L CB 5543 C CG . LEU C 171 ? 1.3319 1.2281 1.0073 -0.0735 0.0645 0.2169 171 LEU L CG 5544 C CD1 . LEU C 171 ? 1.3772 1.2918 1.0218 -0.1217 0.0607 0.2170 171 LEU L CD1 5545 C CD2 . LEU C 171 ? 1.1256 1.1092 0.8792 -0.0479 0.0865 0.2275 171 LEU L CD2 5546 N N . SER C 172 ? 1.4318 1.2877 1.1652 0.0001 0.0585 0.2207 172 SER L N 5547 C CA . SER C 172 ? 1.4021 1.3118 1.1945 0.0141 0.0740 0.2308 172 SER L CA 5548 C C . SER C 172 ? 1.3702 1.3155 1.1754 -0.0153 0.0901 0.2382 172 SER L C 5549 O O . SER C 172 ? 1.4287 1.3433 1.1956 -0.0497 0.0853 0.2372 172 SER L O 5550 C CB . SER C 172 ? 1.5677 1.4367 1.3601 0.0271 0.0554 0.2331 172 SER L CB 5551 O OG . SER C 172 ? 1.6044 1.5227 1.4496 0.0380 0.0687 0.2416 172 SER L OG 5552 N N . SER C 173 ? 1.3275 1.3361 1.1851 -0.0018 0.1096 0.2446 173 SER L N 5553 C CA . SER C 173 ? 1.3079 1.3556 1.1909 -0.0169 0.1266 0.2468 173 SER L CA 5554 C C . SER C 173 ? 1.3127 1.3701 1.2325 -0.0004 0.1371 0.2523 173 SER L C 5555 O O . SER C 173 ? 1.3175 1.3896 1.2635 0.0227 0.1376 0.2607 173 SER L O 5556 C CB . SER C 173 ? 1.3264 1.4331 1.2365 -0.0159 0.1338 0.2500 173 SER L CB 5557 O OG . SER C 173 ? 1.3221 1.4700 1.2637 -0.0255 0.1493 0.2467 173 SER L OG 5558 N N . THR C 174 ? 1.3278 1.3726 1.2411 -0.0177 0.1460 0.2464 174 THR L N 5559 C CA . THR C 174 ? 1.2602 1.2988 1.1953 -0.0075 0.1535 0.2492 174 THR L CA 5560 C C . THR C 174 ? 1.2280 1.2929 1.1902 -0.0070 0.1765 0.2403 174 THR L C 5561 O O . THR C 174 ? 1.2264 1.2969 1.1724 -0.0299 0.1892 0.2253 174 THR L O 5562 C CB . THR C 174 ? 1.3718 1.3601 1.2703 -0.0244 0.1406 0.2480 174 THR L CB 5563 O OG1 . THR C 174 ? 1.5495 1.5163 1.4341 -0.0141 0.1162 0.2540 174 THR L OG1 5564 C CG2 . THR C 174 ? 1.2297 1.2126 1.1483 -0.0187 0.1470 0.2511 174 THR L CG2 5565 N N . LEU C 175 ? 1.3147 1.3964 1.3173 0.0189 0.1817 0.2485 175 LEU L N 5566 C CA . LEU C 175 ? 1.3424 1.4374 1.3756 0.0306 0.2003 0.2378 175 LEU L CA 5567 C C . LEU C 175 ? 1.3682 1.4133 1.3879 0.0281 0.2057 0.2333 175 LEU L C 5568 O O . LEU C 175 ? 1.3001 1.3219 1.3197 0.0338 0.1940 0.2497 175 LEU L O 5569 C CB . LEU C 175 ? 1.3132 1.4434 1.3926 0.0613 0.1956 0.2518 175 LEU L CB 5570 C CG . LEU C 175 ? 1.3285 1.4648 1.4483 0.0868 0.2081 0.2419 175 LEU L CG 5571 C CD1 . LEU C 175 ? 1.3724 1.5762 1.5297 0.0915 0.2194 0.2253 175 LEU L CD1 5572 C CD2 . LEU C 175 ? 1.2814 1.4051 1.4226 0.1136 0.1911 0.2675 175 LEU L CD2 5573 N N . THR C 176 ? 1.4852 1.5157 1.4871 0.0127 0.2247 0.2095 176 THR L N 5574 C CA . THR C 176 ? 1.6364 1.6111 1.6102 0.0016 0.2304 0.2001 176 THR L CA 5575 C C . THR C 176 ? 1.6918 1.6556 1.6894 0.0240 0.2536 0.1786 176 THR L C 5576 O O . THR C 176 ? 1.7236 1.7315 1.7507 0.0367 0.2751 0.1570 176 THR L O 5577 C CB . THR C 176 ? 1.7449 1.6918 1.6581 -0.0406 0.2323 0.1869 176 THR L CB 5578 O OG1 . THR C 176 ? 1.7315 1.6734 1.6229 -0.0540 0.2042 0.2072 176 THR L OG1 5579 C CG2 . THR C 176 ? 1.8274 1.7144 1.7024 -0.0585 0.2347 0.1776 176 THR L CG2 5580 N N . LEU C 177 ? 1.6570 1.5622 1.6421 0.0282 0.2486 0.1824 177 LEU L N 5581 C CA . LEU C 177 ? 1.6486 1.5203 1.6487 0.0543 0.2663 0.1608 177 LEU L CA 5582 C C . LEU C 177 ? 1.6139 1.4024 1.5601 0.0301 0.2651 0.1536 177 LEU L C 5583 O O . LEU C 177 ? 1.5477 1.3151 1.4627 0.0000 0.2431 0.1758 177 LEU L O 5584 C CB . LEU C 177 ? 1.7248 1.5979 1.7730 0.0960 0.2510 0.1828 177 LEU L CB 5585 C CG . LEU C 177 ? 1.7129 1.6608 1.8183 0.1254 0.2440 0.1956 177 LEU L CG 5586 C CD1 . LEU C 177 ? 1.6255 1.5457 1.7564 0.1586 0.2208 0.2231 177 LEU L CD1 5587 C CD2 . LEU C 177 ? 1.7821 1.7888 1.9265 0.1424 0.2713 0.1603 177 LEU L CD2 5588 N N . SER C 178 ? 1.6666 1.4113 1.6042 0.0438 0.2886 0.1197 178 SER L N 5589 C CA . SER C 178 ? 1.7014 1.3524 1.5825 0.0225 0.2870 0.1096 178 SER L CA 5590 C C . SER C 178 ? 1.7500 1.3577 1.6389 0.0309 0.2571 0.1459 178 SER L C 5591 O O . SER C 178 ? 1.8038 1.4361 1.7426 0.0685 0.2474 0.1649 178 SER L O 5592 C CB . SER C 178 ? 1.7254 1.3336 1.5973 0.0440 0.3215 0.0598 178 SER L CB 5593 O OG . SER C 178 ? 1.7332 1.3488 1.6703 0.1051 0.3241 0.0559 178 SER L OG 5594 N N . LYS C 179 ? 1.7534 1.3017 1.5903 -0.0096 0.2403 0.1580 179 LYS L N 5595 C CA . LYS C 179 ? 1.7527 1.2579 1.5874 -0.0142 0.2141 0.1922 179 LYS L CA 5596 C C . LYS C 179 ? 1.8248 1.2611 1.6710 0.0292 0.2167 0.1844 179 LYS L C 5597 O O . LYS C 179 ? 1.7124 1.1406 1.5792 0.0448 0.1956 0.2178 179 LYS L O 5598 C CB . LYS C 179 ? 1.7894 1.2391 1.5642 -0.0700 0.1982 0.1995 179 LYS L CB 5599 C CG . LYS C 179 ? 1.7756 1.1857 1.5433 -0.0860 0.1733 0.2352 179 LYS L CG 5600 C CD . LYS C 179 ? 1.9122 1.2662 1.6202 -0.1463 0.1576 0.2390 179 LYS L CD 5601 C CE . LYS C 179 ? 2.0359 1.3535 1.7327 -0.1714 0.1346 0.2756 179 LYS L CE 5602 N NZ . LYS C 179 ? 2.1472 1.4233 1.7902 -0.2390 0.1162 0.2829 179 LYS L NZ 5603 N N . ALA C 180 ? 1.9953 1.3799 1.8252 0.0493 0.2419 0.1391 180 ALA L N 5604 C CA . ALA C 180 ? 2.1526 1.4650 1.9984 0.1012 0.2431 0.1250 180 ALA L CA 5605 C C . ALA C 180 ? 2.1499 1.5398 2.0789 0.1586 0.2387 0.1384 180 ALA L C 5606 O O . ALA C 180 ? 2.2425 1.5867 2.1883 0.1904 0.2136 0.1630 180 ALA L O 5607 C CB . ALA C 180 ? 2.2143 1.4707 2.0326 0.1161 0.2782 0.0638 180 ALA L CB 5608 N N . ASP C 181 ? 2.0670 1.5694 2.0415 0.1664 0.2585 0.1253 181 ASP L N 5609 C CA . ASP C 181 ? 2.0396 1.6268 2.0916 0.2118 0.2512 0.1396 181 ASP L CA 5610 C C . ASP C 181 ? 1.9347 1.5398 1.9868 0.1949 0.2153 0.1963 181 ASP L C 5611 O O . ASP C 181 ? 1.9069 1.5175 1.9945 0.2289 0.1922 0.2220 181 ASP L O 5612 C CB . ASP C 181 ? 2.0421 1.7450 2.1333 0.2110 0.2796 0.1142 181 ASP L CB 5613 C CG . ASP C 181 ? 2.1542 1.8612 2.2575 0.2328 0.3211 0.0545 181 ASP L CG 5614 O OD1 . ASP C 181 ? 2.1882 1.8261 2.3019 0.2761 0.3250 0.0316 181 ASP L OD1 5615 O OD2 . ASP C 181 ? 2.1959 1.9719 2.2939 0.2050 0.3502 0.0292 181 ASP L OD2 5616 N N . TYR C 182 ? 1.8857 1.5042 1.8977 0.1419 0.2106 0.2141 182 TYR L N 5617 C CA . TYR C 182 ? 1.8690 1.5175 1.8794 0.1208 0.1851 0.2600 182 TYR L CA 5618 C C . TYR C 182 ? 1.9705 1.5408 1.9572 0.1197 0.1578 0.2941 182 TYR L C 5619 O O . TYR C 182 ? 1.9719 1.5720 1.9707 0.1217 0.1381 0.3298 182 TYR L O 5620 C CB . TYR C 182 ? 1.8003 1.4734 1.7775 0.0694 0.1860 0.2656 182 TYR L CB 5621 C CG . TYR C 182 ? 1.7651 1.4761 1.7434 0.0479 0.1664 0.3049 182 TYR L CG 5622 C CD1 . TYR C 182 ? 1.7134 1.5019 1.7250 0.0627 0.1630 0.3187 182 TYR L CD1 5623 C CD2 . TYR C 182 ? 1.7932 1.4650 1.7375 0.0099 0.1530 0.3261 182 TYR L CD2 5624 C CE1 . TYR C 182 ? 1.6369 1.4628 1.6460 0.0435 0.1510 0.3483 182 TYR L CE1 5625 C CE2 . TYR C 182 ? 1.7608 1.4817 1.7101 -0.0113 0.1416 0.3574 182 TYR L CE2 5626 C CZ . TYR C 182 ? 1.6660 1.4631 1.6470 0.0075 0.1426 0.3665 182 TYR L CZ 5627 O OH . TYR C 182 ? 1.6132 1.4611 1.5951 -0.0137 0.1371 0.3912 182 TYR L OH 5628 N N . GLU C 183 ? 2.0951 1.5587 2.0381 0.1111 0.1558 0.2834 183 GLU L N 5629 C CA . GLU C 183 ? 2.2223 1.5925 2.1265 0.0991 0.1269 0.3178 183 GLU L CA 5630 C C . GLU C 183 ? 2.2316 1.5399 2.1574 0.1579 0.1090 0.3221 183 GLU L C 5631 O O . GLU C 183 ? 2.2984 1.5129 2.1860 0.1522 0.0788 0.3540 183 GLU L O 5632 C CB . GLU C 183 ? 2.4431 1.7133 2.2794 0.0548 0.1270 0.3074 183 GLU L CB 5633 C CG . GLU C 183 ? 2.5003 1.8279 2.3154 -0.0093 0.1291 0.3192 183 GLU L CG 5634 C CD . GLU C 183 ? 2.6848 1.9209 2.4317 -0.0633 0.1211 0.3173 183 GLU L CD 5635 O OE1 . GLU C 183 ? 2.8005 1.9355 2.5103 -0.0522 0.1283 0.2848 183 GLU L OE1 5636 O OE2 . GLU C 183 ? 2.6942 1.9597 2.4248 -0.1173 0.1072 0.3479 183 GLU L OE2 5637 N N . LYS C 184 ? 2.1626 1.5304 2.1515 0.2121 0.1248 0.2922 184 LYS L N 5638 C CA . LYS C 184 ? 2.1221 1.4666 2.1579 0.2796 0.1073 0.2918 184 LYS L CA 5639 C C . LYS C 184 ? 2.0108 1.4154 2.0787 0.2924 0.0756 0.3381 184 LYS L C 5640 O O . LYS C 184 ? 2.1039 1.4529 2.1845 0.3336 0.0420 0.3588 184 LYS L O 5641 C CB . LYS C 184 ? 2.1080 1.5157 2.2091 0.3295 0.1414 0.2361 184 LYS L CB 5642 C CG . LYS C 184 ? 2.2399 1.5456 2.3447 0.3824 0.1472 0.1965 184 LYS L CG 5643 C CD . LYS C 184 ? 2.3148 1.5101 2.3351 0.3402 0.1646 0.1715 184 LYS L CD 5644 C CE . LYS C 184 ? 2.4287 1.5456 2.4573 0.3953 0.1861 0.1130 184 LYS L CE 5645 N NZ . LYS C 184 ? 2.3661 1.6047 2.4673 0.4299 0.2323 0.0583 184 LYS L NZ 5646 N N . HIS C 185 ? 1.8688 1.3798 1.9453 0.2582 0.0833 0.3534 185 HIS L N 5647 C CA . HIS C 185 ? 1.8325 1.4137 1.9368 0.2673 0.0588 0.3891 185 HIS L CA 5648 C C . HIS C 185 ? 1.8015 1.4040 1.8569 0.2108 0.0469 0.4312 185 HIS L C 5649 O O . HIS C 185 ? 1.8864 1.4980 1.9087 0.1646 0.0661 0.4262 185 HIS L O 5650 C CB . HIS C 185 ? 1.7374 1.4470 1.9017 0.2803 0.0831 0.3618 185 HIS L CB 5651 C CG . HIS C 185 ? 1.7239 1.4547 1.9492 0.3316 0.1028 0.3162 185 HIS L CG 5652 N ND1 . HIS C 185 ? 1.7334 1.4881 2.0253 0.3916 0.0828 0.3160 185 HIS L ND1 5653 C CD2 . HIS C 185 ? 1.6935 1.4287 1.9228 0.3305 0.1419 0.2673 185 HIS L CD2 5654 C CE1 . HIS C 185 ? 1.7304 1.5149 2.0736 0.4278 0.1135 0.2651 185 HIS L CE1 5655 N NE2 . HIS C 185 ? 1.6924 1.4619 1.9922 0.3885 0.1513 0.2346 185 HIS L NE2 5656 N N . LYS C 186 ? 1.6678 1.2807 1.7176 0.2132 0.0151 0.4718 186 LYS L N 5657 C CA . LYS C 186 ? 1.6510 1.2728 1.6436 0.1558 0.0080 0.5089 186 LYS L CA 5658 C C . LYS C 186 ? 1.7258 1.4638 1.7303 0.1358 0.0214 0.5101 186 LYS L C 5659 O O . LYS C 186 ? 1.7232 1.4977 1.7047 0.0943 0.0434 0.5054 186 LYS L O 5660 C CB . LYS C 186 ? 1.7594 1.2949 1.7113 0.1581 -0.0379 0.5571 186 LYS L CB 5661 C CG . LYS C 186 ? 1.7576 1.3180 1.7541 0.2099 -0.0708 0.5709 186 LYS L CG 5662 C CD . LYS C 186 ? 1.8586 1.3259 1.8004 0.2041 -0.1239 0.6266 186 LYS L CD 5663 C CE . LYS C 186 ? 1.9354 1.3039 1.9068 0.2704 -0.1578 0.6248 186 LYS L CE 5664 N NZ . LYS C 186 ? 1.8678 1.3240 1.9409 0.3409 -0.1619 0.5987 186 LYS L NZ 5665 N N . VAL C 187 ? 1.7628 1.5598 1.8053 0.1661 0.0080 0.5127 187 VAL L N 5666 C CA . VAL C 187 ? 1.6922 1.5820 1.7324 0.1446 0.0161 0.5147 187 VAL L CA 5667 C C . VAL C 187 ? 1.6414 1.6077 1.7255 0.1546 0.0467 0.4720 187 VAL L C 5668 O O . VAL C 187 ? 1.6301 1.6280 1.7668 0.1901 0.0457 0.4530 187 VAL L O 5669 C CB . VAL C 187 ? 1.7226 1.6346 1.7658 0.1593 -0.0208 0.5457 187 VAL L CB 5670 C CG1 . VAL C 187 ? 1.6669 1.6588 1.6879 0.1283 -0.0118 0.5467 187 VAL L CG1 5671 C CG2 . VAL C 187 ? 1.8357 1.6576 1.8265 0.1486 -0.0589 0.5930 187 VAL L CG2 5672 N N . TYR C 188 ? 1.5954 1.5908 1.6586 0.1227 0.0726 0.4567 188 TYR L N 5673 C CA . TYR C 188 ? 1.4420 1.4935 1.5306 0.1254 0.0958 0.4214 188 TYR L CA 5674 C C . TYR C 188 ? 1.4157 1.5257 1.4876 0.1091 0.0947 0.4255 188 TYR L C 5675 O O . TYR C 188 ? 1.4545 1.5726 1.4916 0.0830 0.1018 0.4323 188 TYR L O 5676 C CB . TYR C 188 ? 1.3888 1.4216 1.4645 0.1058 0.1183 0.4008 188 TYR L CB 5677 C CG . TYR C 188 ? 1.4989 1.4686 1.5805 0.1164 0.1222 0.3899 188 TYR L CG 5678 C CD1 . TYR C 188 ? 1.6128 1.5141 1.6665 0.1053 0.1107 0.4115 188 TYR L CD1 5679 C CD2 . TYR C 188 ? 1.4718 1.4449 1.5769 0.1313 0.1388 0.3566 188 TYR L CD2 5680 C CE1 . TYR C 188 ? 1.6675 1.4969 1.7164 0.1136 0.1131 0.3988 188 TYR L CE1 5681 C CE2 . TYR C 188 ? 1.5332 1.4434 1.6349 0.1397 0.1457 0.3412 188 TYR L CE2 5682 C CZ . TYR C 188 ? 1.5948 1.4289 1.6681 0.1329 0.1319 0.3616 188 TYR L CZ 5683 O OH . TYR C 188 ? 1.6603 1.4164 1.7202 0.1399 0.1372 0.3443 188 TYR L OH 5684 N N . ALA C 189 ? 1.4715 1.6258 1.5701 0.1242 0.0872 0.4177 189 ALA L N 5685 C CA . ALA C 189 ? 1.4970 1.6997 1.5764 0.1096 0.0809 0.4203 189 ALA L CA 5686 C C . ALA C 189 ? 1.4498 1.6889 1.5402 0.1047 0.0956 0.3892 189 ALA L C 5687 O O . ALA C 189 ? 1.4266 1.6772 1.5539 0.1171 0.1033 0.3705 189 ALA L O 5688 C CB . ALA C 189 ? 1.5250 1.7469 1.6152 0.1212 0.0484 0.4470 189 ALA L CB 5689 N N . CYS C 190 ? 1.4237 1.6776 1.4753 0.0840 0.0993 0.3832 190 CYS L N 5690 C CA . CYS C 190 ? 1.3582 1.6305 1.4004 0.0726 0.1063 0.3583 190 CYS L CA 5691 C C . CYS C 190 ? 1.3178 1.6210 1.3325 0.0573 0.0902 0.3640 190 CYS L C 5692 O O . CYS C 190 ? 1.3737 1.6703 1.3447 0.0456 0.0889 0.3712 190 CYS L O 5693 C CB . CYS C 190 ? 1.3364 1.5796 1.3505 0.0649 0.1235 0.3409 190 CYS L CB 5694 S SG . CYS C 190 ? 1.6482 1.8848 1.6313 0.0502 0.1256 0.3138 190 CYS L SG 5695 N N . GLU C 191 ? 1.2264 1.5684 1.2651 0.0531 0.0789 0.3596 191 GLU L N 5696 C CA . GLU C 191 ? 1.2290 1.6040 1.2419 0.0328 0.0580 0.3667 191 GLU L CA 5697 C C . GLU C 191 ? 1.2589 1.6331 1.2370 0.0042 0.0623 0.3414 191 GLU L C 5698 O O . GLU C 191 ? 1.1497 1.5498 1.1570 -0.0039 0.0649 0.3295 191 GLU L O 5699 C CB . GLU C 191 ? 1.2157 1.6466 1.2859 0.0461 0.0326 0.3865 191 GLU L CB 5700 C CG . GLU C 191 ? 1.3783 1.8531 1.4284 0.0217 0.0041 0.3976 191 GLU L CG 5701 C CD . GLU C 191 ? 1.5148 2.0642 1.6427 0.0380 -0.0218 0.4113 191 GLU L CD 5702 O OE1 . GLU C 191 ? 1.5414 2.0979 1.7351 0.0749 -0.0153 0.4112 191 GLU L OE1 5703 O OE2 . GLU C 191 ? 1.5824 2.1830 1.7063 0.0163 -0.0510 0.4223 191 GLU L OE2 5704 N N . VAL C 192 ? 1.3831 1.7312 1.2946 -0.0154 0.0601 0.3341 192 VAL L N 5705 C CA . VAL C 192 ? 1.3472 1.6665 1.2083 -0.0422 0.0616 0.3088 192 VAL L CA 5706 C C . VAL C 192 ? 1.3116 1.6571 1.1363 -0.0757 0.0380 0.3125 192 VAL L C 5707 O O . VAL C 192 ? 1.3938 1.7445 1.1843 -0.0811 0.0270 0.3246 192 VAL L O 5708 C CB . VAL C 192 ? 1.3397 1.5954 1.1461 -0.0352 0.0780 0.2882 192 VAL L CB 5709 C CG1 . VAL C 192 ? 1.3551 1.5610 1.0976 -0.0598 0.0729 0.2623 192 VAL L CG1 5710 C CG2 . VAL C 192 ? 1.3143 1.5483 1.1558 -0.0077 0.0966 0.2845 192 VAL L CG2 5711 N N . THR C 193 ? 1.1956 1.5575 1.0192 -0.1054 0.0293 0.3028 193 THR L N 5712 C CA . THR C 193 ? 1.3040 1.6866 1.0838 -0.1459 0.0043 0.3048 193 THR L CA 5713 C C . THR C 193 ? 1.3562 1.6610 1.0534 -0.1781 0.0078 0.2760 193 THR L C 5714 O O . THR C 193 ? 1.3559 1.6263 1.0554 -0.1804 0.0198 0.2626 193 THR L O 5715 C CB . THR C 193 ? 1.4105 1.8906 1.2564 -0.1653 -0.0161 0.3193 193 THR L CB 5716 O OG1 . THR C 193 ? 1.4558 1.9425 1.3198 -0.1849 -0.0028 0.3026 193 THR L OG1 5717 C CG2 . THR C 193 ? 1.3544 1.9045 1.2904 -0.1254 -0.0243 0.3455 193 THR L CG2 5718 N N . HIS C 194 ? 1.4980 1.7639 1.1136 -0.2034 -0.0042 0.2662 194 HIS L N 5719 C CA . HIS C 194 ? 1.5173 1.6884 1.0443 -0.2296 -0.0040 0.2364 194 HIS L CA 5720 C C . HIS C 194 ? 1.6382 1.7887 1.0791 -0.2723 -0.0250 0.2286 194 HIS L C 5721 O O . HIS C 194 ? 1.7309 1.9299 1.1710 -0.2742 -0.0351 0.2447 194 HIS L O 5722 C CB . HIS C 194 ? 1.4536 1.5470 0.9602 -0.1854 0.0205 0.2149 194 HIS L CB 5723 C CG . HIS C 194 ? 1.5933 1.5740 1.0151 -0.1963 0.0183 0.1827 194 HIS L CG 5724 N ND1 . HIS C 194 ? 1.6446 1.5564 1.0049 -0.1742 0.0287 0.1537 194 HIS L ND1 5725 C CD2 . HIS C 194 ? 1.6671 1.5858 1.0535 -0.2252 0.0060 0.1742 194 HIS L CD2 5726 C CE1 . HIS C 194 ? 1.7724 1.5776 1.0662 -0.1821 0.0197 0.1280 194 HIS L CE1 5727 N NE2 . HIS C 194 ? 1.7353 1.5370 1.0379 -0.2166 0.0036 0.1428 194 HIS L NE2 5728 N N . GLN C 195 ? 1.7368 1.8014 1.0931 -0.3079 -0.0332 0.2037 195 GLN L N 5729 C CA . GLN C 195 ? 1.8868 1.9177 1.1480 -0.3569 -0.0547 0.1921 195 GLN L CA 5730 C C . GLN C 195 ? 1.9265 1.9184 1.1248 -0.3366 -0.0428 0.1744 195 GLN L C 5731 O O . GLN C 195 ? 1.9653 1.9715 1.1062 -0.3742 -0.0608 0.1770 195 GLN L O 5732 C CB . GLN C 195 ? 2.0158 1.9389 1.1903 -0.3986 -0.0660 0.1671 195 GLN L CB 5733 C CG . GLN C 195 ? 2.2114 2.0761 1.2713 -0.4553 -0.0891 0.1498 195 GLN L CG 5734 C CD . GLN C 195 ? 2.4422 2.1834 1.4099 -0.4994 -0.1037 0.1274 195 GLN L CD 5735 O OE1 . GLN C 195 ? 2.4696 2.1963 1.4675 -0.5031 -0.1025 0.1346 195 GLN L OE1 5736 N NE2 . GLN C 195 ? 2.6531 2.2961 1.4979 -0.5376 -0.1190 0.1004 195 GLN L NE2 5737 N N . GLY C 196 ? 1.9081 1.8616 1.1199 -0.2805 -0.0119 0.1570 196 GLY L N 5738 C CA . GLY C 196 ? 1.9274 1.8531 1.0844 -0.2601 0.0089 0.1339 196 GLY L CA 5739 C C . GLY C 196 ? 1.9015 1.9232 1.1072 -0.2496 0.0138 0.1661 196 GLY L C 5740 O O . GLY C 196 ? 2.0309 2.0486 1.1852 -0.2474 0.0298 0.1537 196 GLY L O 5741 N N . LEU C 197 ? 1.7930 1.8959 1.0936 -0.2439 0.0004 0.2061 197 LEU L N 5742 C CA . LEU C 197 ? 1.7313 1.9142 1.0831 -0.2322 -0.0037 0.2435 197 LEU L CA 5743 C C . LEU C 197 ? 1.7118 1.9581 1.0604 -0.2748 -0.0458 0.2765 197 LEU L C 5744 O O . LEU C 197 ? 1.6097 1.8990 1.0078 -0.2918 -0.0691 0.2899 197 LEU L O 5745 C CB . LEU C 197 ? 1.5952 1.8195 1.0562 -0.1901 0.0068 0.2647 197 LEU L CB 5746 C CG . LEU C 197 ? 1.4538 1.6330 0.9335 -0.1476 0.0420 0.2408 197 LEU L CG 5747 C CD1 . LEU C 197 ? 1.3870 1.6029 0.9642 -0.1194 0.0452 0.2619 197 LEU L CD1 5748 C CD2 . LEU C 197 ? 1.4227 1.5950 0.8697 -0.1309 0.0683 0.2301 197 LEU L CD2 5749 N N . SER C 198 ? 1.8491 2.1061 1.1383 -0.2954 -0.0566 0.2887 198 SER L N 5750 C CA . SER C 198 ? 2.0005 2.3206 1.2881 -0.3342 -0.1045 0.3252 198 SER L CA 5751 C C . SER C 198 ? 1.8889 2.2956 1.2987 -0.3058 -0.1281 0.3701 198 SER L C 5752 O O . SER C 198 ? 1.9414 2.4168 1.3894 -0.3273 -0.1705 0.3968 198 SER L O 5753 C CB . SER C 198 ? 2.1694 2.4775 1.3617 -0.3617 -0.1121 0.3339 198 SER L CB 5754 O OG . SER C 198 ? 2.1948 2.5012 1.4028 -0.3273 -0.0841 0.3440 198 SER L OG 5755 N N . SER C 199 ? 1.7377 2.1418 1.2113 -0.2561 -0.1012 0.3757 199 SER L N 5756 C CA . SER C 199 ? 1.7074 2.1753 1.2956 -0.2209 -0.1171 0.4092 199 SER L CA 5757 C C . SER C 199 ? 1.7132 2.1538 1.3573 -0.1747 -0.0769 0.3948 199 SER L C 5758 O O . SER C 199 ? 1.7716 2.1560 1.3693 -0.1656 -0.0430 0.3731 199 SER L O 5759 C CB . SER C 199 ? 1.7191 2.2146 1.3077 -0.2176 -0.1501 0.4549 199 SER L CB 5760 O OG . SER C 199 ? 1.7493 2.1929 1.2869 -0.2078 -0.1215 0.4542 199 SER L OG 5761 N N . PRO C 200 ? 1.5855 2.0711 1.3306 -0.1459 -0.0802 0.4050 200 PRO L N 5762 C CA . PRO C 200 ? 1.4405 1.8979 1.2325 -0.1082 -0.0448 0.3907 200 PRO L CA 5763 C C . PRO C 200 ? 1.4076 1.8263 1.1784 -0.0872 -0.0281 0.4018 200 PRO L C 5764 O O . PRO C 200 ? 1.4071 1.8378 1.1675 -0.0886 -0.0508 0.4344 200 PRO L O 5765 C CB . PRO C 200 ? 1.3958 1.9180 1.2936 -0.0826 -0.0579 0.4062 200 PRO L CB 5766 C CG . PRO C 200 ? 1.4402 2.0309 1.3501 -0.1144 -0.0918 0.4133 200 PRO L CG 5767 C CD . PRO C 200 ? 1.5584 2.1294 1.3805 -0.1471 -0.1161 0.4268 200 PRO L CD 5768 N N . VAL C 201 ? 1.4337 1.8076 1.1966 -0.0717 0.0081 0.3765 201 VAL L N 5769 C CA . VAL C 201 ? 1.4763 1.8231 1.2224 -0.0578 0.0302 0.3808 201 VAL L CA 5770 C C . VAL C 201 ? 1.5032 1.8452 1.3187 -0.0250 0.0429 0.3886 201 VAL L C 5771 O O . VAL C 201 ? 1.5596 1.8945 1.4126 -0.0116 0.0555 0.3689 201 VAL L O 5772 C CB . VAL C 201 ? 1.4690 1.7770 1.1541 -0.0642 0.0615 0.3436 201 VAL L CB 5773 C CG1 . VAL C 201 ? 1.6418 1.9427 1.2422 -0.0987 0.0519 0.3329 201 VAL L CG1 5774 C CG2 . VAL C 201 ? 1.3755 1.6547 1.0821 -0.0495 0.0767 0.3123 201 VAL L CG2 5775 N N . THR C 202 ? 1.4581 1.7977 1.2833 -0.0171 0.0363 0.4188 202 THR L N 5776 C CA . THR C 202 ? 1.3548 1.6791 1.2372 0.0102 0.0449 0.4266 202 THR L CA 5777 C C . THR C 202 ? 1.3126 1.6111 1.1715 0.0065 0.0710 0.4251 202 THR L C 5778 O O . THR C 202 ? 1.3851 1.6784 1.2041 -0.0114 0.0661 0.4489 202 THR L O 5779 C CB . THR C 202 ? 1.4110 1.7417 1.3343 0.0272 0.0119 0.4635 202 THR L CB 5780 O OG1 . THR C 202 ? 1.4077 1.7839 1.3688 0.0325 -0.0125 0.4637 202 THR L OG1 5781 C CG2 . THR C 202 ? 1.3565 1.6605 1.3336 0.0560 0.0229 0.4627 202 THR L CG2 5782 N N . LYS C 203 ? 1.3024 1.5893 1.1834 0.0184 0.0969 0.3981 203 LYS L N 5783 C CA . LYS C 203 ? 1.3533 1.6306 1.2320 0.0162 0.1192 0.3970 203 LYS L CA 5784 C C . LYS C 203 ? 1.3202 1.5734 1.2448 0.0314 0.1126 0.4126 203 LYS L C 5785 O O . LYS C 203 ? 1.2871 1.5337 1.2500 0.0491 0.1096 0.4009 203 LYS L O 5786 C CB . LYS C 203 ? 1.3073 1.5880 1.1863 0.0228 0.1450 0.3597 203 LYS L CB 5787 C CG . LYS C 203 ? 1.4290 1.7222 1.2576 0.0133 0.1563 0.3349 203 LYS L CG 5788 C CD . LYS C 203 ? 2.6144 2.9342 2.4017 -0.0093 0.1721 0.3436 203 LYS L CD 5789 C CE . LYS C 203 ? 1.4653 1.7997 1.1996 -0.0166 0.1933 0.3090 203 LYS L CE 5790 N NZ . LYS C 203 ? 1.4353 1.7438 1.1658 0.0050 0.1959 0.2687 203 LYS L NZ 5791 N N . SER C 204 ? 1.3634 1.6000 1.2777 0.0200 0.1129 0.4362 204 SER L N 5792 C CA . SER C 204 ? 1.3930 1.5901 1.3387 0.0327 0.1029 0.4517 204 SER L CA 5793 C C . SER C 204 ? 1.4602 1.6364 1.3909 0.0114 0.1140 0.4644 204 SER L C 5794 O O . SER C 204 ? 1.4797 1.6875 1.3821 -0.0140 0.1318 0.4617 204 SER L O 5795 C CB . SER C 204 ? 1.4603 1.6374 1.4077 0.0434 0.0690 0.4831 204 SER L CB 5796 O OG . SER C 204 ? 1.5499 1.7216 1.4418 0.0159 0.0538 0.5155 204 SER L OG 5797 N N . PHE C 205 ? 1.4897 1.6143 1.4374 0.0194 0.1036 0.4772 205 PHE L N 5798 C CA . PHE C 205 ? 1.5198 1.6128 1.4478 -0.0083 0.1085 0.4932 205 PHE L CA 5799 C C . PHE C 205 ? 1.6698 1.6827 1.6037 0.0037 0.0889 0.5091 205 PHE L C 5800 O O . PHE C 205 ? 1.7178 1.7099 1.6866 0.0401 0.0810 0.4960 205 PHE L O 5801 C CB . PHE C 205 ? 1.3544 1.4805 1.3036 -0.0178 0.1347 0.4659 205 PHE L CB 5802 C CG . PHE C 205 ? 1.4480 1.5480 1.4335 0.0058 0.1362 0.4428 205 PHE L CG 5803 C CD1 . PHE C 205 ? 1.5716 1.6951 1.5811 0.0305 0.1412 0.4154 205 PHE L CD1 5804 C CD2 . PHE C 205 ? 1.5309 1.5766 1.5157 -0.0038 0.1324 0.4483 205 PHE L CD2 5805 C CE1 . PHE C 205 ? 1.5745 1.6734 1.6058 0.0436 0.1442 0.3950 205 PHE L CE1 5806 C CE2 . PHE C 205 ? 1.5629 1.5820 1.5697 0.0125 0.1358 0.4247 205 PHE L CE2 5807 C CZ . PHE C 205 ? 1.5472 1.5960 1.5768 0.0353 0.1427 0.3985 205 PHE L CZ 5808 N N . ASN C 206 ? 1.7566 1.7253 1.6514 -0.0307 0.0827 0.5361 206 ASN L N 5809 C CA . ASN C 206 ? 1.7721 1.6447 1.6521 -0.0311 0.0637 0.5534 206 ASN L CA 5810 C C . ASN C 206 ? 1.7686 1.6239 1.6528 -0.0532 0.0808 0.5370 206 ASN L C 5811 O O . ASN C 206 ? 1.6889 1.5989 1.5661 -0.0912 0.0996 0.5348 206 ASN L O 5812 C CB . ASN C 206 ? 1.8897 1.7091 1.7062 -0.0650 0.0380 0.6007 206 ASN L CB 5813 C CG . ASN C 206 ? 1.9539 1.7772 1.7620 -0.0428 0.0105 0.6219 206 ASN L CG 5814 O OD1 . ASN C 206 ? 1.9009 1.7670 1.7579 -0.0001 0.0104 0.6001 206 ASN L OD1 5815 N ND2 . ASN C 206 ? 2.0742 1.8577 1.8156 -0.0786 -0.0145 0.6664 206 ASN L ND2 5816 N N . ARG C 207 ? 1.9141 1.6995 1.8111 -0.0298 0.0747 0.5232 207 ARG L N 5817 C CA . ARG C 207 ? 2.1228 1.8829 2.0148 -0.0550 0.0864 0.5079 207 ARG L CA 5818 C C . ARG C 207 ? 2.4190 2.1636 2.2633 -0.1179 0.0827 0.5376 207 ARG L C 5819 O O . ARG C 207 ? 2.4704 2.2576 2.3218 -0.1522 0.0974 0.5275 207 ARG L O 5820 C CB . ARG C 207 ? 2.2071 1.8692 2.0980 -0.0270 0.0776 0.4926 207 ARG L CB 5821 C CG . ARG C 207 ? 2.2705 1.9077 2.1511 -0.0548 0.0896 0.4714 207 ARG L CG 5822 C CD . ARG C 207 ? 2.3891 1.9062 2.2448 -0.0399 0.0809 0.4582 207 ARG L CD 5823 N NE . ARG C 207 ? 2.3786 1.8850 2.2714 0.0220 0.0859 0.4303 207 ARG L NE 5824 C CZ . ARG C 207 ? 2.4027 1.8457 2.2992 0.0635 0.0670 0.4391 207 ARG L CZ 5825 N NH1 . ARG C 207 ? 2.4127 1.7807 2.2656 0.0476 0.0373 0.4793 207 ARG L NH1 5826 N NH2 . ARG C 207 ? 2.4010 1.8592 2.3458 0.1200 0.0758 0.4086 207 ARG L NH2 5827 N N . GLY C 208 ? 2.7401 2.4299 2.5357 -0.1368 0.0608 0.5762 208 GLY L N # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 VAL 1 44 44 VAL VAL G . n A 1 2 TRP 2 45 45 TRP TRP G . n A 1 3 LYS 3 46 46 LYS LYS G . n A 1 4 ASP 4 47 47 ASP ASP G . n A 1 5 ALA 5 48 48 ALA ALA G . n A 1 6 ASP 6 49 49 ASP ASP G . n A 1 7 THR 7 50 50 THR THR G . n A 1 8 THR 8 51 51 THR THR G . n A 1 9 LEU 9 52 52 LEU LEU G . n A 1 10 PHE 10 53 53 PHE PHE G . n A 1 11 CYS 11 54 54 CYS CYS G . n A 1 12 ALA 12 55 55 ALA ALA G . n A 1 13 SER 13 56 56 SER SER G . n A 1 14 ASP 14 57 57 ASP ASP G . n A 1 15 ALA 15 58 58 ALA ALA G . n A 1 16 LYS 16 59 59 LYS LYS G . n A 1 17 ALA 17 60 60 ALA ALA G . n A 1 18 HIS 18 61 61 HIS HIS G . n A 1 19 GLU 19 62 62 GLU GLU G . n A 1 20 THR 20 63 63 THR THR G . n A 1 21 GLU 21 64 64 GLU GLU G . n A 1 22 CYS 22 65 65 CYS CYS G . n A 1 23 HIS 23 66 66 HIS HIS G . n A 1 24 ASN 24 67 67 ASN ASN G . n A 1 25 VAL 25 68 68 VAL VAL G . n A 1 26 TRP 26 69 69 TRP TRP G . n A 1 27 ALA 27 70 70 ALA ALA G . n A 1 28 THR 28 71 71 THR THR G . n A 1 29 HIS 29 72 72 HIS HIS G . n A 1 30 ALA 30 73 73 ALA ALA G . n A 1 31 CYS 31 74 74 CYS CYS G . n A 1 32 VAL 32 75 75 VAL VAL G . n A 1 33 PRO 33 76 76 PRO PRO G . n A 1 34 THR 34 77 77 THR THR G . n A 1 35 ASP 35 78 78 ASP ASP G . n A 1 36 PRO 36 79 79 PRO PRO G . n A 1 37 ASN 37 80 80 ASN ASN G . n A 1 38 PRO 38 81 81 PRO PRO G . n A 1 39 GLN 39 82 82 GLN GLN G . n A 1 40 GLU 40 83 83 GLU GLU G . n A 1 41 ILE 41 84 84 ILE ILE G . n A 1 42 HIS 42 85 85 HIS HIS G . n A 1 43 LEU 43 86 86 LEU LEU G . n A 1 44 GLU 44 87 87 GLU GLU G . n A 1 45 ASN 45 88 88 ASN ASN G . n A 1 46 VAL 46 89 89 VAL VAL G . n A 1 47 THR 47 90 90 THR THR G . n A 1 48 GLU 48 91 91 GLU GLU G . n A 1 49 ASN 49 92 92 ASN ASN G . n A 1 50 PHE 50 93 93 PHE PHE G . n A 1 51 ASN 51 94 94 ASN ASN G . n A 1 52 MET 52 95 95 MET MET G . n A 1 53 TRP 53 96 96 TRP TRP G . n A 1 54 LYS 54 97 97 LYS LYS G . n A 1 55 ASN 55 98 98 ASN ASN G . n A 1 56 ASN 56 99 99 ASN ASN G . n A 1 57 MET 57 100 100 MET MET G . n A 1 58 VAL 58 101 101 VAL VAL G . n A 1 59 GLU 59 102 102 GLU GLU G . n A 1 60 GLN 60 103 103 GLN GLN G . n A 1 61 MET 61 104 104 MET MET G . n A 1 62 GLN 62 105 105 GLN GLN G . n A 1 63 GLU 63 106 106 GLU GLU G . n A 1 64 ASP 64 107 107 ASP ASP G . n A 1 65 VAL 65 108 108 VAL VAL G . n A 1 66 ILE 66 109 109 ILE ILE G . n A 1 67 SER 67 110 110 SER SER G . n A 1 68 LEU 68 111 111 LEU LEU G . n A 1 69 TRP 69 112 112 TRP TRP G . n A 1 70 ASP 70 113 113 ASP ASP G . n A 1 71 GLN 71 114 114 GLN GLN G . n A 1 72 CYS 72 115 115 CYS CYS G . n A 1 73 LEU 73 116 116 LEU LEU G . n A 1 74 GLN 74 117 117 GLN GLN G . n A 1 75 PRO 75 118 118 PRO PRO G . n A 1 76 CYS 76 119 119 CYS CYS G . n A 1 77 VAL 77 120 120 VAL VAL G . n A 1 78 LYS 78 121 121 LYS LYS G . n A 1 79 LEU 79 122 122 LEU LEU G . n A 1 80 THR 80 123 123 THR THR G . n A 1 81 GLY 81 124 124 GLY GLY G . n A 1 82 GLY 82 198 198 GLY GLY G . n A 1 83 SER 83 199 199 SER SER G . n A 1 84 VAL 84 200 200 VAL VAL G . n A 1 85 ILE 85 201 201 ILE ILE G . n A 1 86 LYS 86 202 202 LYS LYS G . n A 1 87 GLN 87 203 203 GLN GLN G . n A 1 88 ALA 88 204 204 ALA ALA G . n A 1 89 CYS 89 205 205 CYS CYS G . n A 1 90 PRO 90 206 206 PRO PRO G . n A 1 91 LYS 91 207 207 LYS LYS G . n A 1 92 ILE 92 208 208 ILE ILE G . n A 1 93 SER 93 209 209 SER SER G . n A 1 94 PHE 94 210 210 PHE PHE G . n A 1 95 ASP 95 211 211 ASP ASP G . n A 1 96 PRO 96 212 212 PRO PRO G . n A 1 97 ILE 97 213 213 ILE ILE G . n A 1 98 PRO 98 214 214 PRO PRO G . n A 1 99 ILE 99 215 215 ILE ILE G . n A 1 100 HIS 100 216 216 HIS HIS G . n A 1 101 TYR 101 217 217 TYR TYR G . n A 1 102 CYS 102 218 218 CYS CYS G . n A 1 103 THR 103 219 219 THR THR G . n A 1 104 PRO 104 220 220 PRO PRO G . n A 1 105 ALA 105 221 221 ALA ALA G . n A 1 106 GLY 106 222 222 GLY GLY G . n A 1 107 TYR 107 223 223 TYR TYR G . n A 1 108 VAL 108 224 224 VAL VAL G . n A 1 109 ILE 109 225 225 ILE ILE G . n A 1 110 LEU 110 226 226 LEU LEU G . n A 1 111 LYS 111 227 227 LYS LYS G . n A 1 112 CYS 112 228 228 CYS CYS G . n A 1 113 ASN 113 229 229 ASN ASN G . n A 1 114 ASP 114 230 230 ASP ASP G . n A 1 115 LYS 115 231 231 LYS LYS G . n A 1 116 ASN 116 232 232 ASN ASN G . n A 1 117 PHE 117 233 233 PHE PHE G . n A 1 118 ASN 118 234 234 ASN ASN G . n A 1 119 GLY 119 235 235 GLY GLY G . n A 1 120 THR 120 236 236 THR THR G . n A 1 121 GLY 121 237 237 GLY GLY G . n A 1 122 PRO 122 238 238 PRO PRO G . n A 1 123 CYS 123 239 239 CYS CYS G . n A 1 124 LYS 124 240 240 LYS LYS G . n A 1 125 ASN 125 241 241 ASN ASN G . n A 1 126 VAL 126 242 242 VAL VAL G . n A 1 127 SER 127 243 243 SER SER G . n A 1 128 SER 128 244 244 SER SER G . n A 1 129 VAL 129 245 245 VAL VAL G . n A 1 130 GLN 130 246 246 GLN GLN G . n A 1 131 CYS 131 247 247 CYS CYS G . n A 1 132 THR 132 248 248 THR THR G . n A 1 133 HIS 133 249 249 HIS HIS G . n A 1 134 GLY 134 250 250 GLY GLY G . n A 1 135 ILE 135 251 251 ILE ILE G . n A 1 136 LYS 136 252 252 LYS LYS G . n A 1 137 PRO 137 253 253 PRO PRO G . n A 1 138 VAL 138 254 254 VAL VAL G . n A 1 139 VAL 139 255 255 VAL VAL G . n A 1 140 SER 140 256 256 SER SER G . n A 1 141 THR 141 257 257 THR THR G . n A 1 142 GLN 142 258 258 GLN GLN G . n A 1 143 LEU 143 259 259 LEU LEU G . n A 1 144 LEU 144 260 260 LEU LEU G . n A 1 145 LEU 145 261 261 LEU LEU G . n A 1 146 ASN 146 262 262 ASN ASN G . n A 1 147 GLY 147 263 263 GLY GLY G . n A 1 148 SER 148 264 264 SER SER G . n A 1 149 LEU 149 265 265 LEU LEU G . n A 1 150 ALA 150 266 266 ALA ALA G . n A 1 151 GLU 151 267 267 GLU GLU G . n A 1 152 GLU 152 268 268 GLU GLU G . n A 1 153 GLU 153 269 269 GLU GLU G . n A 1 154 ILE 154 270 270 ILE ILE G . n A 1 155 ILE 155 271 271 ILE ILE G . n A 1 156 ILE 156 272 272 ILE ILE G . n A 1 157 ARG 157 273 273 ARG ARG G . n A 1 158 SER 158 274 274 SER SER G . n A 1 159 GLU 159 275 275 GLU GLU G . n A 1 160 ASN 160 276 276 ASN ASN G . n A 1 161 LEU 161 277 277 LEU LEU G . n A 1 162 THR 162 278 278 THR THR G . n A 1 163 ASN 163 279 279 ASN ASN G . n A 1 164 ASN 164 280 280 ASN ASN G . n A 1 165 ALA 165 281 281 ALA ALA G . n A 1 166 LYS 166 282 282 LYS LYS G . n A 1 167 THR 167 283 283 THR THR G . n A 1 168 ILE 168 284 284 ILE ILE G . n A 1 169 ILE 169 285 285 ILE ILE G . n A 1 170 VAL 170 286 286 VAL VAL G . n A 1 171 HIS 171 287 287 HIS HIS G . n A 1 172 LEU 172 288 288 LEU LEU G . n A 1 173 ASN 173 289 289 ASN ASN G . n A 1 174 LYS 174 290 290 LYS LYS G . n A 1 175 SER 175 291 291 SER SER G . n A 1 176 VAL 176 292 292 VAL VAL G . n A 1 177 GLU 177 293 293 GLU GLU G . n A 1 178 ILE 178 294 294 ILE ILE G . n A 1 179 ASN 179 295 295 ASN ASN G . n A 1 180 CYS 180 296 296 CYS CYS G . n A 1 181 THR 181 297 297 THR THR G . n A 1 182 ARG 182 298 298 ARG ARG G . n A 1 183 PRO 183 299 299 PRO PRO G . n A 1 184 SER 184 300 300 SER SER G . n A 1 185 ASN 185 301 301 ASN ASN G . n A 1 186 GLY 186 318 ? ? ? G . n A 1 187 GLY 187 319 ? ? ? G . n A 1 188 SER 188 320 ? ? ? G . n A 1 189 GLY 189 321 ? ? ? G . n A 1 190 SER 190 322 ? ? ? G . n A 1 191 GLY 191 323 ? ? ? G . n A 1 192 GLY 192 324 ? ? ? G . n A 1 193 ASP 193 325 ? ? ? G . n A 1 194 ILE 194 326 326 ILE ILE G . n A 1 195 ARG 195 327 327 ARG ARG G . n A 1 196 LYS 196 328 328 LYS LYS G . n A 1 197 ALA 197 329 329 ALA ALA G . n A 1 198 TYR 198 330 330 TYR TYR G . n A 1 199 CYS 199 331 331 CYS CYS G . n A 1 200 GLU 200 332 332 GLU GLU G . n A 1 201 ILE 201 333 333 ILE ILE G . n A 1 202 ASN 202 334 334 ASN ASN G . n A 1 203 GLY 203 335 335 GLY GLY G . n A 1 204 THR 204 336 336 THR THR G . n A 1 205 LYS 205 337 337 LYS LYS G . n A 1 206 TRP 206 338 338 TRP TRP G . n A 1 207 ASN 207 339 339 ASN ASN G . n A 1 208 LYS 208 340 340 LYS LYS G . n A 1 209 VAL 209 341 341 VAL VAL G . n A 1 210 LEU 210 342 342 LEU LEU G . n A 1 211 LYS 211 343 343 LYS LYS G . n A 1 212 GLN 212 344 344 GLN GLN G . n A 1 213 VAL 213 345 345 VAL VAL G . n A 1 214 THR 214 346 346 THR THR G . n A 1 215 GLU 215 347 347 GLU GLU G . n A 1 216 LYS 216 348 348 LYS LYS G . n A 1 217 LEU 217 349 349 LEU LEU G . n A 1 218 LYS 218 350 350 LYS LYS G . n A 1 219 GLU 219 351 351 GLU GLU G . n A 1 220 HIS 220 352 352 HIS HIS G . n A 1 221 PHE 221 353 353 PHE PHE G . n A 1 222 ASN 222 354 354 ASN ASN G . n A 1 223 ASN 223 355 355 ASN ASN G . n A 1 224 LYS 224 357 357 LYS LYS G . n A 1 225 THR 225 358 358 THR THR G . n A 1 226 ILE 226 359 359 ILE ILE G . n A 1 227 ILE 227 360 360 ILE ILE G . n A 1 228 PHE 228 361 361 PHE PHE G . n A 1 229 GLN 229 362 362 GLN GLN G . n A 1 230 PRO 230 363 363 PRO PRO G . n A 1 231 PRO 231 364 364 PRO PRO G . n A 1 232 SER 232 365 365 SER SER G . n A 1 233 GLY 233 366 366 GLY GLY G . n A 1 234 GLY 234 367 367 GLY GLY G . n A 1 235 ASP 235 368 368 ASP ASP G . n A 1 236 LEU 236 369 369 LEU LEU G . n A 1 237 GLU 237 370 370 GLU GLU G . n A 1 238 ILE 238 371 371 ILE ILE G . n A 1 239 THR 239 372 372 THR THR G . n A 1 240 MET 240 373 373 MET MET G . n A 1 241 HIS 241 374 374 HIS HIS G . n A 1 242 HIS 242 375 375 HIS HIS G . n A 1 243 PHE 243 376 376 PHE PHE G . n A 1 244 ASN 244 377 377 ASN ASN G . n A 1 245 CYS 245 378 378 CYS CYS G . n A 1 246 ARG 246 379 379 ARG ARG G . n A 1 247 GLY 247 380 380 GLY GLY G . n A 1 248 GLU 248 381 381 GLU GLU G . n A 1 249 PHE 249 382 382 PHE PHE G . n A 1 250 PHE 250 383 383 PHE PHE G . n A 1 251 TYR 251 384 384 TYR TYR G . n A 1 252 CYS 252 385 385 CYS CYS G . n A 1 253 ASN 253 386 386 ASN ASN G . n A 1 254 THR 254 387 387 THR THR G . n A 1 255 THR 255 388 388 THR THR G . n A 1 256 GLN 256 389 389 GLN GLN G . n A 1 257 LEU 257 390 390 LEU LEU G . n A 1 258 PHE 258 391 391 PHE PHE G . n A 1 259 ASN 259 392 392 ASN ASN G . n A 1 260 ASN 260 393 393 ASN ASN G . n A 1 261 THR 261 394 394 THR THR G . n A 1 262 CYS 262 395 395 CYS CYS G . n A 1 263 ILE 263 396 396 ILE ILE G . n A 1 264 GLY 264 403 ? ? ? G . n A 1 265 ASN 265 404 ? ? ? G . n A 1 266 GLU 266 405 ? ? ? G . n A 1 267 THR 267 406 ? ? ? G . n A 1 268 MET 268 407 ? ? ? G . n A 1 269 LYS 269 408 ? ? ? G . n A 1 270 GLY 270 409 ? ? ? G . n A 1 271 CYS 271 410 ? ? ? G . n A 1 272 ASN 272 411 411 ASN ASN G . n A 1 273 GLY 273 412 412 GLY GLY G . n A 1 274 THR 274 413 413 THR THR G . n A 1 275 ILE 275 414 414 ILE ILE G . n A 1 276 THR 276 415 415 THR THR G . n A 1 277 LEU 277 416 416 LEU LEU G . n A 1 278 PRO 278 417 417 PRO PRO G . n A 1 279 CYS 279 418 418 CYS CYS G . n A 1 280 LYS 280 419 419 LYS LYS G . n A 1 281 ILE 281 420 420 ILE ILE G . n A 1 282 LYS 282 421 421 LYS LYS G . n A 1 283 GLN 283 422 422 GLN GLN G . n A 1 284 ILE 284 423 423 ILE ILE G . n A 1 285 ILE 285 424 424 ILE ILE G . n A 1 286 ASN 286 425 425 ASN ASN G . n A 1 287 MET 287 426 426 MET MET G . n A 1 288 TRP 288 427 427 TRP TRP G . n A 1 289 GLN 289 428 428 GLN GLN G . n A 1 290 GLY 290 429 429 GLY GLY G . n A 1 291 THR 291 430 430 THR THR G . n A 1 292 GLY 292 431 431 GLY GLY G . n A 1 293 GLN 293 432 432 GLN GLN G . n A 1 294 ALA 294 433 433 ALA ALA G . n A 1 295 MET 295 434 434 MET MET G . n A 1 296 TYR 296 435 435 TYR TYR G . n A 1 297 ALA 297 436 436 ALA ALA G . n A 1 298 PRO 298 437 437 PRO PRO G . n A 1 299 PRO 299 438 438 PRO PRO G . n A 1 300 ILE 300 439 439 ILE ILE G . n A 1 301 ASP 301 440 440 ASP ASP G . n A 1 302 GLY 302 441 441 GLY GLY G . n A 1 303 LYS 303 442 442 LYS LYS G . n A 1 304 ILE 304 443 443 ILE ILE G . n A 1 305 ASN 305 444 444 ASN ASN G . n A 1 306 CYS 306 445 445 CYS CYS G . n A 1 307 VAL 307 446 446 VAL VAL G . n A 1 308 SER 308 447 447 SER SER G . n A 1 309 ASN 309 448 448 ASN ASN G . n A 1 310 ILE 310 449 449 ILE ILE G . n A 1 311 THR 311 450 450 THR THR G . n A 1 312 GLY 312 451 451 GLY GLY G . n A 1 313 ILE 313 452 452 ILE ILE G . n A 1 314 LEU 314 453 453 LEU LEU G . n A 1 315 LEU 315 454 454 LEU LEU G . n A 1 316 THR 316 455 455 THR THR G . n A 1 317 ARG 317 456 456 ARG ARG G . n A 1 318 ASP 318 457 457 ASP ASP G . n A 1 319 GLY 319 458 458 GLY GLY G . n A 1 320 GLY 320 459 459 GLY GLY G . n A 1 321 ALA 321 460 460 ALA ALA G . n A 1 322 ASN 322 461 461 ASN ASN G . n A 1 323 ASN 323 462 462 ASN ASN G . n A 1 324 THR 324 463 463 THR THR G . n A 1 325 SER 325 464 464 SER SER G . n A 1 326 ASN 326 465 465 ASN ASN G . n A 1 327 GLU 327 466 466 GLU GLU G . n A 1 328 THR 328 467 467 THR THR G . n A 1 329 PHE 329 468 468 PHE PHE G . n A 1 330 ARG 330 469 469 ARG ARG G . n A 1 331 PRO 331 470 470 PRO PRO G . n A 1 332 GLY 332 471 471 GLY GLY G . n A 1 333 GLY 333 472 472 GLY GLY G . n A 1 334 GLY 334 473 473 GLY GLY G . n A 1 335 ASN 335 474 474 ASN ASN G . n A 1 336 ILE 336 475 475 ILE ILE G . n A 1 337 LYS 337 476 476 LYS LYS G . n A 1 338 ASP 338 477 477 ASP ASP G . n A 1 339 ASN 339 478 478 ASN ASN G . n A 1 340 TRP 340 479 479 TRP TRP G . n A 1 341 ARG 341 480 480 ARG ARG G . n A 1 342 SER 342 481 481 SER SER G . n A 1 343 GLU 343 482 482 GLU GLU G . n A 1 344 LEU 344 483 483 LEU LEU G . n A 1 345 TYR 345 484 484 TYR TYR G . n A 1 346 LYS 346 485 485 LYS LYS G . n A 1 347 TYR 347 486 486 TYR TYR G . n A 1 348 LYS 348 487 487 LYS LYS G . n A 1 349 VAL 349 488 488 VAL VAL G . n A 1 350 VAL 350 489 489 VAL VAL G . n A 1 351 GLN 351 490 490 GLN GLN G . n A 1 352 ILE 352 491 491 ILE ILE G . n A 1 353 GLU 353 492 ? ? ? G . n A 1 354 GLY 354 493 ? ? ? G . n A 1 355 SER 355 494 ? ? ? G . n A 1 356 HIS 356 495 ? ? ? G . n A 1 357 HIS 357 496 ? ? ? G . n A 1 358 HIS 358 497 ? ? ? G . n A 1 359 HIS 359 498 ? ? ? G . n A 1 360 HIS 360 499 ? ? ? G . n A 1 361 HIS 361 500 ? ? ? G . n B 2 1 GLN 1 1 ? ? ? H . n B 2 2 VAL 2 2 2 VAL VAL H . n B 2 3 GLN 3 3 3 GLN GLN H . n B 2 4 LEU 4 4 4 LEU LEU H . n B 2 5 VAL 5 5 5 VAL VAL H . n B 2 6 GLN 6 6 6 GLN GLN H . n B 2 7 SER 7 7 7 SER SER H . n B 2 8 GLY 8 8 8 GLY GLY H . n B 2 9 ALA 9 9 9 ALA ALA H . n B 2 10 GLU 10 10 10 GLU GLU H . n B 2 11 VAL 11 11 11 VAL VAL H . n B 2 12 LYS 12 12 12 LYS LYS H . n B 2 13 LYS 13 13 13 LYS LYS H . n B 2 14 PRO 14 14 14 PRO PRO H . n B 2 15 GLY 15 15 15 GLY GLY H . n B 2 16 ALA 16 16 16 ALA ALA H . n B 2 17 SER 17 17 17 SER SER H . n B 2 18 VAL 18 18 18 VAL VAL H . n B 2 19 LYS 19 19 19 LYS LYS H . n B 2 20 VAL 20 20 20 VAL VAL H . n B 2 21 SER 21 21 21 SER SER H . n B 2 22 CYS 22 22 22 CYS CYS H . n B 2 23 LYS 23 23 23 LYS LYS H . n B 2 24 ALA 24 24 24 ALA ALA H . n B 2 25 SER 25 25 25 SER SER H . n B 2 26 GLY 26 26 26 GLY GLY H . n B 2 27 TYR 27 27 27 TYR TYR H . n B 2 28 THR 28 28 28 THR THR H . n B 2 29 PHE 29 29 29 PHE PHE H . n B 2 30 THR 30 30 30 THR THR H . n B 2 31 GLY 31 31 31 GLY GLY H . n B 2 32 TYR 32 32 32 TYR TYR H . n B 2 33 TYR 33 33 33 TYR TYR H . n B 2 34 MET 34 34 34 MET MET H . n B 2 35 HIS 35 35 35 HIS HIS H . n B 2 36 TRP 36 36 36 TRP TRP H . n B 2 37 VAL 37 37 37 VAL VAL H . n B 2 38 ARG 38 38 38 ARG ARG H . n B 2 39 GLN 39 39 39 GLN GLN H . n B 2 40 ALA 40 40 40 ALA ALA H . n B 2 41 PRO 41 41 41 PRO PRO H . n B 2 42 GLY 42 42 42 GLY GLY H . n B 2 43 GLN 43 43 43 GLN GLN H . n B 2 44 GLY 44 44 44 GLY GLY H . n B 2 45 LEU 45 45 45 LEU LEU H . n B 2 46 GLU 46 46 46 GLU GLU H . n B 2 47 TRP 47 47 47 TRP TRP H . n B 2 48 MET 48 48 48 MET MET H . n B 2 49 GLY 49 49 49 GLY GLY H . n B 2 50 TRP 50 50 50 TRP TRP H . n B 2 51 ILE 51 51 51 ILE ILE H . n B 2 52 ASN 52 52 52 ASN ASN H . n B 2 53 PRO 53 52 52 PRO PRO H A n B 2 54 ASN 54 53 53 ASN ASN H . n B 2 55 SER 55 54 54 SER SER H . n B 2 56 GLY 56 55 55 GLY GLY H . n B 2 57 GLY 57 56 56 GLY GLY H . n B 2 58 THR 58 57 57 THR THR H . n B 2 59 ASN 59 58 58 ASN ASN H . n B 2 60 TYR 60 59 59 TYR TYR H . n B 2 61 ALA 61 60 60 ALA ALA H . n B 2 62 GLN 62 61 61 GLN GLN H . n B 2 63 LYS 63 62 62 LYS LYS H . n B 2 64 PHE 64 63 63 PHE PHE H . n B 2 65 GLN 65 64 64 GLN GLN H . n B 2 66 GLY 66 65 65 GLY GLY H . n B 2 67 ARG 67 66 66 ARG ARG H . n B 2 68 VAL 68 67 67 VAL VAL H . n B 2 69 THR 69 68 68 THR THR H . n B 2 70 MET 70 69 69 MET MET H . n B 2 71 THR 71 70 70 THR THR H . n B 2 72 ARG 72 71 71 ARG ARG H . n B 2 73 ASP 73 72 72 ASP ASP H . n B 2 74 THR 74 73 73 THR THR H . n B 2 75 SER 75 74 74 SER SER H . n B 2 76 ILE 76 75 75 ILE ILE H . n B 2 77 SER 77 76 76 SER SER H . n B 2 78 THR 78 77 77 THR THR H . n B 2 79 ALA 79 78 78 ALA ALA H . n B 2 80 TYR 80 79 79 TYR TYR H . n B 2 81 MET 81 80 80 MET MET H . n B 2 82 GLU 82 81 81 GLU GLU H . n B 2 83 LEU 83 82 82 LEU LEU H . n B 2 84 SER 84 82 82 SER SER H A n B 2 85 ARG 85 82 82 ARG ARG H B n B 2 86 LEU 86 82 82 LEU LEU H C n B 2 87 ARG 87 83 83 ARG ARG H . n B 2 88 SER 88 84 84 SER SER H . n B 2 89 ASP 89 85 85 ASP ASP H . n B 2 90 ASP 90 86 86 ASP ASP H . n B 2 91 THR 91 87 87 THR THR H . n B 2 92 ALA 92 88 88 ALA ALA H . n B 2 93 VAL 93 89 89 VAL VAL H . n B 2 94 TYR 94 90 90 TYR TYR H . n B 2 95 TYR 95 91 91 TYR TYR H . n B 2 96 CYS 96 92 92 CYS CYS H . n B 2 97 ALA 97 93 93 ALA ALA H . n B 2 98 ARG 98 94 94 ARG ARG H . n B 2 99 GLY 99 95 95 GLY GLY H . n B 2 100 LYS 100 96 96 LYS LYS H . n B 2 101 TYR 101 97 97 TYR TYR H . n B 2 102 CYS 102 98 98 CYS CYS H . n B 2 103 THR 103 99 ? ? ? H . n B 2 104 ALA 104 99 ? ? ? H A n B 2 105 ARG 105 99 ? ? ? H B n B 2 106 ASP 106 99 ? ? ? H C n B 2 107 TYR 107 99 99 TYR TYR H D n B 2 108 TYR 108 100 100 TYR TYR H . n B 2 109 ASN 109 101 101 ASN ASN H . n B 2 110 TRP 110 102 102 TRP TRP H . n B 2 111 ASP 111 103 103 ASP ASP H . n B 2 112 PHE 112 104 104 PHE PHE H . n B 2 113 GLN 113 105 105 GLN GLN H . n B 2 114 HIS 114 106 106 HIS HIS H . n B 2 115 TRP 115 107 107 TRP TRP H . n B 2 116 GLY 116 108 108 GLY GLY H . n B 2 117 GLN 117 109 109 GLN GLN H . n B 2 118 GLY 118 110 110 GLY GLY H . n B 2 119 THR 119 111 111 THR THR H . n B 2 120 LEU 120 112 112 LEU LEU H . n B 2 121 VAL 121 113 113 VAL VAL H . n B 2 122 THR 122 114 114 THR THR H . n B 2 123 VAL 123 115 115 VAL VAL H . n B 2 124 SER 124 116 116 SER SER H . n B 2 125 SER 125 117 117 SER SER H . n B 2 126 ALA 126 118 118 ALA ALA H . n B 2 127 SER 127 119 119 SER SER H . n B 2 128 THR 128 120 120 THR THR H . n B 2 129 LYS 129 121 121 LYS LYS H . n B 2 130 GLY 130 122 122 GLY GLY H . n B 2 131 PRO 131 123 123 PRO PRO H . n B 2 132 SER 132 124 124 SER SER H . n B 2 133 VAL 133 125 125 VAL VAL H . n B 2 134 PHE 134 126 126 PHE PHE H . n B 2 135 PRO 135 127 127 PRO PRO H . n B 2 136 LEU 136 128 128 LEU LEU H . n B 2 137 ALA 137 129 129 ALA ALA H . n B 2 138 PRO 138 130 130 PRO PRO H . n B 2 139 SER 139 131 ? ? ? H . n B 2 140 SER 140 132 ? ? ? H . n B 2 141 LYS 141 133 ? ? ? H . n B 2 142 SER 142 134 ? ? ? H . n B 2 143 THR 143 135 ? ? ? H . n B 2 144 SER 144 136 ? ? ? H . n B 2 145 GLY 145 137 ? ? ? H . n B 2 146 GLY 146 138 ? ? ? H . n B 2 147 THR 147 139 139 THR THR H . n B 2 148 ALA 148 140 140 ALA ALA H . n B 2 149 ALA 149 141 141 ALA ALA H . n B 2 150 LEU 150 142 142 LEU LEU H . n B 2 151 GLY 151 143 143 GLY GLY H . n B 2 152 CYS 152 144 144 CYS CYS H . n B 2 153 LEU 153 145 145 LEU LEU H . n B 2 154 VAL 154 146 146 VAL VAL H . n B 2 155 LYS 155 147 147 LYS LYS H . n B 2 156 ASP 156 148 148 ASP ASP H . n B 2 157 TYR 157 149 149 TYR TYR H . n B 2 158 PHE 158 150 150 PHE PHE H . n B 2 159 PRO 159 151 151 PRO PRO H . n B 2 160 GLU 160 152 152 GLU GLU H . n B 2 161 PRO 161 153 153 PRO PRO H . n B 2 162 VAL 162 154 154 VAL VAL H . n B 2 163 THR 163 155 155 THR THR H . n B 2 164 VAL 164 156 156 VAL VAL H . n B 2 165 SER 165 157 157 SER SER H . n B 2 166 TRP 166 158 158 TRP TRP H . n B 2 167 ASN 167 159 159 ASN ASN H . n B 2 168 SER 168 160 160 SER SER H . n B 2 169 GLY 169 161 161 GLY GLY H . n B 2 170 ALA 170 162 162 ALA ALA H . n B 2 171 LEU 171 163 163 LEU LEU H . n B 2 172 THR 172 164 164 THR THR H . n B 2 173 SER 173 165 165 SER SER H . n B 2 174 GLY 174 166 166 GLY GLY H . n B 2 175 VAL 175 167 167 VAL VAL H . n B 2 176 HIS 176 168 168 HIS HIS H . n B 2 177 THR 177 169 169 THR THR H . n B 2 178 PHE 178 170 170 PHE PHE H . n B 2 179 PRO 179 171 171 PRO PRO H . n B 2 180 ALA 180 172 172 ALA ALA H . n B 2 181 VAL 181 173 173 VAL VAL H . n B 2 182 LEU 182 174 174 LEU LEU H . n B 2 183 GLN 183 175 175 GLN GLN H . n B 2 184 SER 184 176 176 SER SER H . n B 2 185 SER 185 177 177 SER SER H . n B 2 186 GLY 186 178 178 GLY GLY H . n B 2 187 LEU 187 179 179 LEU LEU H . n B 2 188 TYR 188 180 180 TYR TYR H . n B 2 189 SER 189 181 181 SER SER H . n B 2 190 LEU 190 182 182 LEU LEU H . n B 2 191 SER 191 183 183 SER SER H . n B 2 192 SER 192 184 184 SER SER H . n B 2 193 VAL 193 185 185 VAL VAL H . n B 2 194 VAL 194 186 186 VAL VAL H . n B 2 195 THR 195 187 187 THR THR H . n B 2 196 VAL 196 188 188 VAL VAL H . n B 2 197 PRO 197 189 189 PRO PRO H . n B 2 198 SER 198 190 190 SER SER H . n B 2 199 SER 199 191 191 SER SER H . n B 2 200 SER 200 192 192 SER SER H . n B 2 201 LEU 201 193 193 LEU LEU H . n B 2 202 GLY 202 194 ? ? ? H . n B 2 203 THR 203 195 ? ? ? H . n B 2 204 GLN 204 196 196 GLN GLN H . n B 2 205 THR 205 197 197 THR THR H . n B 2 206 TYR 206 198 198 TYR TYR H . n B 2 207 ILE 207 199 199 ILE ILE H . n B 2 208 CYS 208 200 200 CYS CYS H . n B 2 209 ASN 209 201 201 ASN ASN H . n B 2 210 VAL 210 202 202 VAL VAL H . n B 2 211 ASN 211 203 203 ASN ASN H . n B 2 212 HIS 212 204 204 HIS HIS H . n B 2 213 LYS 213 205 205 LYS LYS H . n B 2 214 PRO 214 206 206 PRO PRO H . n B 2 215 SER 215 207 207 SER SER H . n B 2 216 ASN 216 208 208 ASN ASN H . n B 2 217 THR 217 209 209 THR THR H . n B 2 218 LYS 218 210 210 LYS LYS H . n B 2 219 VAL 219 211 211 VAL VAL H . n B 2 220 ASP 220 212 212 ASP ASP H . n B 2 221 LYS 221 213 213 LYS LYS H . n B 2 222 ARG 222 214 214 ARG ARG H . n B 2 223 VAL 223 215 215 VAL VAL H . n B 2 224 GLU 224 216 216 GLU GLU H . n B 2 225 PRO 225 217 ? ? ? H . n B 2 226 LYS 226 218 ? ? ? H . n B 2 227 SER 227 219 ? ? ? H . n B 2 228 CYS 228 220 ? ? ? H . n B 2 229 ASP 229 221 ? ? ? H . n B 2 230 LYS 230 222 ? ? ? H . n B 2 231 THR 231 223 ? ? ? H . n B 2 232 HIS 232 224 ? ? ? H . n C 3 1 GLU 1 1 ? ? ? L . n C 3 2 ILE 2 2 ? ? ? L . n C 3 3 VAL 3 3 3 VAL VAL L . n C 3 4 LEU 4 4 4 LEU LEU L . n C 3 5 THR 5 5 5 THR THR L . n C 3 6 GLN 6 6 6 GLN GLN L . n C 3 7 SER 7 7 7 SER SER L . n C 3 8 PRO 8 8 8 PRO PRO L . n C 3 9 ALA 9 9 9 ALA ALA L . n C 3 10 THR 10 10 10 THR THR L . n C 3 11 LEU 11 11 11 LEU LEU L . n C 3 12 SER 12 12 12 SER SER L . n C 3 13 LEU 13 13 13 LEU LEU L . n C 3 14 SER 14 14 14 SER SER L . n C 3 15 PRO 15 15 15 PRO PRO L . n C 3 16 GLY 16 16 16 GLY GLY L . n C 3 17 GLU 17 17 17 GLU GLU L . n C 3 18 THR 18 18 18 THR THR L . n C 3 19 ALA 19 19 19 ALA ALA L . n C 3 20 ILE 20 20 20 ILE ILE L . n C 3 21 ILE 21 21 21 ILE ILE L . n C 3 22 SER 22 22 22 SER SER L . n C 3 23 CYS 23 23 23 CYS CYS L . n C 3 24 ARG 24 24 24 ARG ARG L . n C 3 25 THR 25 25 25 THR THR L . n C 3 26 SER 26 26 26 SER SER L . n C 3 27 GLN 27 27 27 GLN GLN L . n C 3 28 SER 28 28 28 SER SER L . n C 3 29 GLY 29 29 29 GLY GLY L . n C 3 30 SER 30 30 30 SER SER L . n C 3 31 LEU 31 31 31 LEU LEU L . n C 3 32 ALA 32 32 32 ALA ALA L . n C 3 33 TRP 33 33 33 TRP TRP L . n C 3 34 TYR 34 34 34 TYR TYR L . n C 3 35 GLN 35 35 35 GLN GLN L . n C 3 36 GLN 36 36 36 GLN GLN L . n C 3 37 ARG 37 37 37 ARG ARG L . n C 3 38 PRO 38 38 38 PRO PRO L . n C 3 39 GLY 39 39 39 GLY GLY L . n C 3 40 GLN 40 40 40 GLN GLN L . n C 3 41 ALA 41 41 41 ALA ALA L . n C 3 42 PRO 42 42 42 PRO PRO L . n C 3 43 ARG 43 43 43 ARG ARG L . n C 3 44 LEU 44 44 44 LEU LEU L . n C 3 45 VAL 45 45 45 VAL VAL L . n C 3 46 ILE 46 46 46 ILE ILE L . n C 3 47 TYR 47 47 47 TYR TYR L . n C 3 48 SER 48 48 48 SER SER L . n C 3 49 GLY 49 49 49 GLY GLY L . n C 3 50 SER 50 50 50 SER SER L . n C 3 51 THR 51 51 51 THR THR L . n C 3 52 ARG 52 52 52 ARG ARG L . n C 3 53 ALA 53 53 53 ALA ALA L . n C 3 54 ALA 54 54 54 ALA ALA L . n C 3 55 GLY 55 55 55 GLY GLY L . n C 3 56 ILE 56 56 56 ILE ILE L . n C 3 57 PRO 57 57 57 PRO PRO L . n C 3 58 ASP 58 58 58 ASP ASP L . n C 3 59 ARG 59 59 59 ARG ARG L . n C 3 60 PHE 60 60 60 PHE PHE L . n C 3 61 SER 61 61 61 SER SER L . n C 3 62 GLY 62 62 62 GLY GLY L . n C 3 63 SER 63 63 63 SER SER L . n C 3 64 ARG 64 64 64 ARG ARG L . n C 3 65 TRP 65 65 65 TRP TRP L . n C 3 66 GLY 66 66 66 GLY GLY L . n C 3 67 ALA 67 67 67 ALA ALA L . n C 3 68 ASP 68 68 68 ASP ASP L . n C 3 69 TYR 69 69 69 TYR TYR L . n C 3 70 ASN 70 70 70 ASN ASN L . n C 3 71 LEU 71 71 71 LEU LEU L . n C 3 72 SER 72 72 72 SER SER L . n C 3 73 ILE 73 73 73 ILE ILE L . n C 3 74 SER 74 74 74 SER SER L . n C 3 75 ASN 75 75 75 ASN ASN L . n C 3 76 LEU 76 76 76 LEU LEU L . n C 3 77 GLU 77 77 77 GLU GLU L . n C 3 78 SER 78 78 78 SER SER L . n C 3 79 GLY 79 79 79 GLY GLY L . n C 3 80 ASP 80 80 80 ASP ASP L . n C 3 81 PHE 81 81 81 PHE PHE L . n C 3 82 GLY 82 82 82 GLY GLY L . n C 3 83 VAL 83 83 83 VAL VAL L . n C 3 84 TYR 84 84 84 TYR TYR L . n C 3 85 TYR 85 85 85 TYR TYR L . n C 3 86 CYS 86 86 86 CYS CYS L . n C 3 87 GLN 87 87 87 GLN GLN L . n C 3 88 GLN 88 88 88 GLN GLN L . n C 3 89 TYR 89 89 89 TYR TYR L . n C 3 90 GLU 90 90 90 GLU GLU L . n C 3 91 PHE 91 91 91 PHE PHE L . n C 3 92 PHE 92 92 92 PHE PHE L . n C 3 93 GLY 93 93 93 GLY GLY L . n C 3 94 GLN 94 94 94 GLN GLN L . n C 3 95 GLY 95 95 95 GLY GLY L . n C 3 96 THR 96 96 96 THR THR L . n C 3 97 LYS 97 97 97 LYS LYS L . n C 3 98 VAL 98 98 98 VAL VAL L . n C 3 99 GLN 99 99 99 GLN GLN L . n C 3 100 VAL 100 100 100 VAL VAL L . n C 3 101 ASP 101 101 101 ASP ASP L . n C 3 102 ILE 102 102 102 ILE ILE L . n C 3 103 LYS 103 103 103 LYS LYS L . n C 3 104 ARG 104 104 104 ARG ARG L . n C 3 105 THR 105 105 105 THR THR L . n C 3 106 VAL 106 106 106 VAL VAL L . n C 3 107 ALA 107 107 107 ALA ALA L . n C 3 108 ALA 108 108 108 ALA ALA L . n C 3 109 PRO 109 109 109 PRO PRO L . n C 3 110 SER 110 110 110 SER SER L . n C 3 111 VAL 111 111 111 VAL VAL L . n C 3 112 PHE 112 112 112 PHE PHE L . n C 3 113 ILE 113 113 113 ILE ILE L . n C 3 114 PHE 114 114 114 PHE PHE L . n C 3 115 PRO 115 115 115 PRO PRO L . n C 3 116 PRO 116 116 116 PRO PRO L . n C 3 117 SER 117 117 117 SER SER L . n C 3 118 ASP 118 118 118 ASP ASP L . n C 3 119 GLU 119 119 119 GLU GLU L . n C 3 120 GLN 120 120 120 GLN GLN L . n C 3 121 LEU 121 121 121 LEU LEU L . n C 3 122 LYS 122 122 122 LYS LYS L . n C 3 123 SER 123 123 123 SER SER L . n C 3 124 GLY 124 124 124 GLY GLY L . n C 3 125 THR 125 125 125 THR THR L . n C 3 126 ALA 126 126 126 ALA ALA L . n C 3 127 SER 127 127 127 SER SER L . n C 3 128 VAL 128 128 128 VAL VAL L . n C 3 129 VAL 129 129 129 VAL VAL L . n C 3 130 CYS 130 130 130 CYS CYS L . n C 3 131 LEU 131 131 131 LEU LEU L . n C 3 132 LEU 132 132 132 LEU LEU L . n C 3 133 ASN 133 133 133 ASN ASN L . n C 3 134 ASN 134 134 134 ASN ASN L . n C 3 135 PHE 135 135 135 PHE PHE L . n C 3 136 TYR 136 136 136 TYR TYR L . n C 3 137 PRO 137 137 137 PRO PRO L . n C 3 138 ARG 138 138 138 ARG ARG L . n C 3 139 GLU 139 139 139 GLU GLU L . n C 3 140 ALA 140 140 140 ALA ALA L . n C 3 141 LYS 141 141 141 LYS LYS L . n C 3 142 VAL 142 142 142 VAL VAL L . n C 3 143 GLN 143 143 143 GLN GLN L . n C 3 144 TRP 144 144 144 TRP TRP L . n C 3 145 LYS 145 145 145 LYS LYS L . n C 3 146 VAL 146 146 146 VAL VAL L . n C 3 147 ASP 147 147 147 ASP ASP L . n C 3 148 ASN 148 148 148 ASN ASN L . n C 3 149 ALA 149 149 149 ALA ALA L . n C 3 150 LEU 150 150 150 LEU LEU L . n C 3 151 GLN 151 151 151 GLN GLN L . n C 3 152 SER 152 152 152 SER SER L . n C 3 153 GLY 153 153 153 GLY GLY L . n C 3 154 ASN 154 154 154 ASN ASN L . n C 3 155 SER 155 155 155 SER SER L . n C 3 156 GLN 156 156 156 GLN GLN L . n C 3 157 GLU 157 157 157 GLU GLU L . n C 3 158 SER 158 158 158 SER SER L . n C 3 159 VAL 159 159 159 VAL VAL L . n C 3 160 THR 160 160 160 THR THR L . n C 3 161 GLU 161 161 161 GLU GLU L . n C 3 162 GLN 162 162 162 GLN GLN L . n C 3 163 ASP 163 163 163 ASP ASP L . n C 3 164 SER 164 164 164 SER SER L . n C 3 165 LYS 165 165 165 LYS LYS L . n C 3 166 ASP 166 166 166 ASP ASP L . n C 3 167 SER 167 167 167 SER SER L . n C 3 168 THR 168 168 168 THR THR L . n C 3 169 TYR 169 169 169 TYR TYR L . n C 3 170 SER 170 170 170 SER SER L . n C 3 171 LEU 171 171 171 LEU LEU L . n C 3 172 SER 172 172 172 SER SER L . n C 3 173 SER 173 173 173 SER SER L . n C 3 174 THR 174 174 174 THR THR L . n C 3 175 LEU 175 175 175 LEU LEU L . n C 3 176 THR 176 176 176 THR THR L . n C 3 177 LEU 177 177 177 LEU LEU L . n C 3 178 SER 178 178 178 SER SER L . n C 3 179 LYS 179 179 179 LYS LYS L . n C 3 180 ALA 180 180 180 ALA ALA L . n C 3 181 ASP 181 181 181 ASP ASP L . n C 3 182 TYR 182 182 182 TYR TYR L . n C 3 183 GLU 183 183 183 GLU GLU L . n C 3 184 LYS 184 184 184 LYS LYS L . n C 3 185 HIS 185 185 185 HIS HIS L . n C 3 186 LYS 186 186 186 LYS LYS L . n C 3 187 VAL 187 187 187 VAL VAL L . n C 3 188 TYR 188 188 188 TYR TYR L . n C 3 189 ALA 189 189 189 ALA ALA L . n C 3 190 CYS 190 190 190 CYS CYS L . n C 3 191 GLU 191 191 191 GLU GLU L . n C 3 192 VAL 192 192 192 VAL VAL L . n C 3 193 THR 193 193 193 THR THR L . n C 3 194 HIS 194 194 194 HIS HIS L . n C 3 195 GLN 195 195 195 GLN GLN L . n C 3 196 GLY 196 196 196 GLY GLY L . n C 3 197 LEU 197 197 197 LEU LEU L . n C 3 198 SER 198 198 198 SER SER L . n C 3 199 SER 199 199 199 SER SER L . n C 3 200 PRO 200 200 200 PRO PRO L . n C 3 201 VAL 201 201 201 VAL VAL L . n C 3 202 THR 202 202 202 THR THR L . n C 3 203 LYS 203 203 203 LYS LYS L . n C 3 204 SER 204 204 204 SER SER L . n C 3 205 PHE 205 205 205 PHE PHE L . n C 3 206 ASN 206 206 206 ASN ASN L . n C 3 207 ARG 207 207 207 ARG ARG L . n C 3 208 GLY 208 208 208 GLY GLY L . n C 3 209 GLU 209 209 ? ? ? L . n C 3 210 CYS 210 210 ? ? ? L . n # _pdbx_struct_mod_residue.id 1 _pdbx_struct_mod_residue.label_asym_id A _pdbx_struct_mod_residue.label_comp_id ASN _pdbx_struct_mod_residue.label_seq_id 146 _pdbx_struct_mod_residue.auth_asym_id G _pdbx_struct_mod_residue.auth_comp_id ASN _pdbx_struct_mod_residue.auth_seq_id 262 _pdbx_struct_mod_residue.PDB_ins_code ? _pdbx_struct_mod_residue.parent_comp_id ASN _pdbx_struct_mod_residue.details 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details trimeric _pdbx_struct_assembly.oligomeric_count 3 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2013-03-20 2 'Structure model' 1 1 2013-05-08 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined 12.0196 10.0278 -50.5350 1.9752 1.1496 0.9487 -0.0481 -0.2098 0.2521 3.6464 3.8186 7.5708 0.7791 1.5032 0.7638 -0.1141 0.6846 0.4232 -1.0834 -0.5464 -0.2357 0.7860 1.3774 0.7137 'X-RAY DIFFRACTION' 2 ? refined 13.2721 3.7611 -38.3274 1.2614 1.2341 0.8303 -0.0244 0.0618 0.1965 6.6721 8.0432 6.4790 0.6778 2.0081 -0.4539 0.4984 -0.2528 0.5854 -0.0091 -1.4190 -0.4042 0.4983 1.1362 0.9464 'X-RAY DIFFRACTION' 3 ? refined -4.3332 -6.5491 -55.5350 2.5531 1.4449 1.0337 0.3874 -0.3728 0.1519 9.5746 3.4031 0.0163 5.2084 -0.9731 0.2269 0.8593 0.0370 0.5410 -0.8254 -0.3381 0.7668 -0.6232 -0.4748 0.0475 'X-RAY DIFFRACTION' 4 ? refined 20.1838 -0.9141 -38.7511 1.4069 1.3557 1.3152 -0.1182 -0.2317 0.4887 3.3677 6.0662 7.0960 2.3937 -1.4378 -1.4288 0.1000 -0.7757 -0.5352 0.2872 -1.0157 -1.8984 -0.9262 1.6511 0.8306 'X-RAY DIFFRACTION' 5 ? refined 15.8938 -18.1987 -55.4896 2.4095 0.9737 1.5339 -0.1333 0.4902 0.4795 7.9823 4.2728 6.8065 2.5101 2.2278 -0.5463 -0.8366 1.9683 -2.8641 -2.4589 0.6524 -2.9326 -1.7189 1.6401 1.8151 'X-RAY DIFFRACTION' 6 ? refined 13.4674 -19.4078 -47.6627 1.8769 0.9975 1.1358 0.2214 0.4639 0.3031 5.4038 5.1605 5.1215 2.4801 -2.2248 0.8378 -0.6564 0.1605 -0.8853 -1.1480 -0.2574 -1.0420 0.6751 0.8490 1.0533 'X-RAY DIFFRACTION' 7 ? refined 15.0860 -10.4031 -34.9854 1.0582 1.3387 1.3885 0.0980 0.0376 0.6851 1.5007 3.0017 5.1590 0.8757 -1.9394 1.6989 -1.0190 -0.3143 -1.3767 0.1943 -0.3229 -1.0234 0.1672 0.8870 1.1885 'X-RAY DIFFRACTION' 8 ? refined -2.5187 -25.7134 -27.0053 1.1214 0.9435 0.4999 0.1153 0.0886 0.0135 4.9104 8.0527 7.0446 3.3554 0.8050 1.0048 0.1586 0.1096 -0.0928 -1.4920 -0.6628 -0.2650 0.0284 -0.6198 0.5743 'X-RAY DIFFRACTION' 9 ? refined -2.1566 -18.2695 -19.9403 1.8210 1.1759 0.8503 0.2279 -0.1361 -0.1082 5.4194 8.8799 5.6471 1.9232 0.7281 3.3723 0.4629 -1.1892 1.3599 0.0845 -1.5367 -0.0264 -2.0186 -1.3245 0.5189 'X-RAY DIFFRACTION' 10 ? refined -19.5368 -43.6386 -1.0651 0.8282 0.9632 0.6405 0.0213 -0.0304 0.1281 5.8329 7.1937 9.5558 1.1823 -5.1504 2.9235 -0.2941 0.7798 0.4038 -0.5480 0.4223 0.4181 -0.3686 -0.5175 -0.1026 'X-RAY DIFFRACTION' 11 ? refined -28.0000 -46.4566 -4.5089 0.9387 1.6273 1.0339 -0.4088 0.0560 0.3712 3.2591 2.6332 3.4631 0.5406 -3.0416 -0.0345 -0.1679 1.2381 4.3303 -0.2510 0.0082 1.7714 -3.2033 -2.1213 0.3535 'X-RAY DIFFRACTION' 12 ? refined 4.6740 -16.7885 -5.5575 1.7139 1.2217 0.8716 -0.4914 -0.3021 0.0962 7.5231 6.7730 3.2193 0.2477 2.0998 -3.2365 -0.3110 -0.8921 0.3760 2.0502 -0.7909 -1.0032 -0.9207 0.2238 0.8028 'X-RAY DIFFRACTION' 13 ? refined 12.1465 -12.6091 -3.4288 2.4126 1.9737 1.5116 -0.5357 -0.8399 0.4066 4.7679 8.0220 7.5354 -5.4409 -3.6586 1.4914 0.3734 1.2520 0.0786 2.0537 -1.1154 -1.5817 -0.0057 1.7950 0.5847 'X-RAY DIFFRACTION' 14 ? refined 1.0732 -22.3603 -0.5173 1.6690 1.3366 0.9873 -0.3228 -0.2673 -0.0916 1.7053 4.3085 6.6151 0.2934 -0.7434 -8.6897 0.0597 0.8292 0.6748 2.3798 -0.4971 -0.8252 -1.5133 -1.3016 0.5216 'X-RAY DIFFRACTION' 15 ? refined -7.9816 -49.3557 8.6456 0.9139 1.0815 0.9022 0.0485 0.1415 0.2848 5.0866 6.6817 10.0144 3.6434 2.1645 0.7820 -0.1714 -0.5769 -0.3971 0.0623 0.0862 -0.1706 -0.3507 0.4749 0.0827 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 44 through 83 ) ; 'X-RAY DIFFRACTION' 2 2 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 84 through 115 ) ; 'X-RAY DIFFRACTION' 3 3 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 116 through 215 ) ; 'X-RAY DIFFRACTION' 4 4 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 216 through 283 ) ; 'X-RAY DIFFRACTION' 5 5 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 284 through 334 ) ; 'X-RAY DIFFRACTION' 6 6 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 335 through 456 ) ; 'X-RAY DIFFRACTION' 7 7 ? ? ? ? ? ? ? ? ? ;chain 'G' and (resid 457 through 491 ) ; 'X-RAY DIFFRACTION' 8 8 ? ? ? ? ? ? ? ? ? ;chain 'H' and (resid 2 through 87 ) ; 'X-RAY DIFFRACTION' 9 9 ? ? ? ? ? ? ? ? ? ;chain 'H' and (resid 88 through 115 ) ; 'X-RAY DIFFRACTION' 10 10 ? ? ? ? ? ? ? ? ? ;chain 'H' and (resid 116 through 207 ) ; 'X-RAY DIFFRACTION' 11 11 ? ? ? ? ? ? ? ? ? ;chain 'H' and (resid 208 through 216 ) ; 'X-RAY DIFFRACTION' 12 12 ? ? ? ? ? ? ? ? ? ;chain 'L' and (resid 3 through 59 ) ; 'X-RAY DIFFRACTION' 13 13 ? ? ? ? ? ? ? ? ? ;chain 'L' and (resid 60 through 73 ) ; 'X-RAY DIFFRACTION' 14 14 ? ? ? ? ? ? ? ? ? ;chain 'L' and (resid 74 through 109 ) ; 'X-RAY DIFFRACTION' 15 15 ? ? ? ? ? ? ? ? ? ;chain 'L' and (resid 110 through 208 ) ; # _pdbx_phasing_MR.entry_id 4JDT _pdbx_phasing_MR.method_rotation ? _pdbx_phasing_MR.method_translation ? _pdbx_phasing_MR.model_details ? _pdbx_phasing_MR.R_factor ? _pdbx_phasing_MR.R_rigid_body ? _pdbx_phasing_MR.correlation_coeff_Fo_to_Fc ? _pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? _pdbx_phasing_MR.d_res_high_rotation 7.430 _pdbx_phasing_MR.d_res_low_rotation 29.710 _pdbx_phasing_MR.d_res_high_translation 7.430 _pdbx_phasing_MR.d_res_low_translation 29.710 _pdbx_phasing_MR.packing ? _pdbx_phasing_MR.reflns_percent_rotation ? _pdbx_phasing_MR.reflns_percent_translation ? _pdbx_phasing_MR.sigma_F_rotation ? _pdbx_phasing_MR.sigma_F_translation ? _pdbx_phasing_MR.sigma_I_rotation ? _pdbx_phasing_MR.sigma_I_translation ? # _phasing.method MR # loop_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 XSCALE . ? package 'Wolfgang Kabsch' ? 'data scaling' http://www.mpimf-heidelberg.mpg.de/~kabsch/xds/html_doc/xscale_program.html ? ? 2 PHASER 2.5.2 'Thu Sep 27 05:35:48 2012 (svn )' program 'Randy J. Read' cimr-phaser@lists.cam.ac.uk phasing http://www-structmed.cimr.cam.ac.uk/phaser/ ? ? 3 PHENIX 1.8_1069 ? package 'Paul D. Adams' PDAdams@lbl.gov refinement http://www.phenix-online.org/ C++ ? 4 PDB_EXTRACT 3.11 'April 22, 2011' package PDB deposit@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 GLN G 258 ? ? 72.92 -58.03 2 1 ASN G 461 ? ? 57.79 -123.23 3 1 TYR L 89 ? ? 54.59 -123.87 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 0 G LYS 46 ? CB ? A LYS 3 CB 2 1 Y 0 G LYS 46 ? CG ? A LYS 3 CG 3 1 Y 0 G LYS 46 ? CD ? A LYS 3 CD 4 1 Y 0 G LYS 46 ? CE ? A LYS 3 CE 5 1 Y 0 G LYS 46 ? NZ ? A LYS 3 NZ 6 1 Y 0 G GLN 82 ? CB ? A GLN 39 CB 7 1 Y 0 G GLN 82 ? CG ? A GLN 39 CG 8 1 Y 0 G GLN 82 ? CD ? A GLN 39 CD 9 1 Y 0 G GLN 82 ? OE1 ? A GLN 39 OE1 10 1 Y 0 G GLN 82 ? NE2 ? A GLN 39 NE2 11 1 Y 0 G GLU 83 ? CB ? A GLU 40 CB 12 1 Y 0 G GLU 83 ? CG ? A GLU 40 CG 13 1 Y 0 G GLU 83 ? CD ? A GLU 40 CD 14 1 Y 0 G GLU 83 ? OE1 ? A GLU 40 OE1 15 1 Y 0 G GLU 83 ? OE2 ? A GLU 40 OE2 16 1 Y 0 G GLU 87 ? CB ? A GLU 44 CB 17 1 Y 0 G GLU 87 ? CG ? A GLU 44 CG 18 1 Y 0 G GLU 87 ? CD ? A GLU 44 CD 19 1 Y 0 G GLU 87 ? OE1 ? A GLU 44 OE1 20 1 Y 0 G GLU 87 ? OE2 ? A GLU 44 OE2 21 1 Y 0 G LYS 97 ? CB ? A LYS 54 CB 22 1 Y 0 G LYS 97 ? CG ? A LYS 54 CG 23 1 Y 0 G LYS 97 ? CD ? A LYS 54 CD 24 1 Y 0 G LYS 97 ? CE ? A LYS 54 CE 25 1 Y 0 G LYS 97 ? NZ ? A LYS 54 NZ 26 1 Y 0 G LYS 121 ? CB ? A LYS 78 CB 27 1 Y 0 G LYS 121 ? CG ? A LYS 78 CG 28 1 Y 0 G LYS 121 ? CD ? A LYS 78 CD 29 1 Y 0 G LYS 121 ? CE ? A LYS 78 CE 30 1 Y 0 G LYS 121 ? NZ ? A LYS 78 NZ 31 1 Y 0 G LYS 231 ? CB ? A LYS 115 CB 32 1 Y 0 G LYS 231 ? CG ? A LYS 115 CG 33 1 Y 0 G LYS 231 ? CD ? A LYS 115 CD 34 1 Y 0 G LYS 231 ? CE ? A LYS 115 CE 35 1 Y 0 G LYS 231 ? NZ ? A LYS 115 NZ 36 1 Y 0 G LYS 240 ? CB ? A LYS 124 CB 37 1 Y 0 G LYS 240 ? CG ? A LYS 124 CG 38 1 Y 0 G LYS 240 ? CD ? A LYS 124 CD 39 1 Y 0 G LYS 240 ? CE ? A LYS 124 CE 40 1 Y 0 G LYS 240 ? NZ ? A LYS 124 NZ 41 1 Y 0 G GLU 267 ? CB ? A GLU 151 CB 42 1 Y 0 G GLU 267 ? CG ? A GLU 151 CG 43 1 Y 0 G GLU 267 ? CD ? A GLU 151 CD 44 1 Y 0 G GLU 267 ? OE1 ? A GLU 151 OE1 45 1 Y 0 G GLU 267 ? OE2 ? A GLU 151 OE2 46 1 Y 0 G LYS 290 ? CB ? A LYS 174 CB 47 1 Y 0 G LYS 290 ? CG ? A LYS 174 CG 48 1 Y 0 G LYS 290 ? CD ? A LYS 174 CD 49 1 Y 0 G LYS 290 ? CE ? A LYS 174 CE 50 1 Y 0 G LYS 290 ? NZ ? A LYS 174 NZ 51 1 Y 0 G ARG 327 ? CB ? A ARG 195 CB 52 1 Y 0 G ARG 327 ? CG ? A ARG 195 CG 53 1 Y 0 G ARG 327 ? CD ? A ARG 195 CD 54 1 Y 0 G ARG 327 ? NE ? A ARG 195 NE 55 1 Y 0 G ARG 327 ? CZ ? A ARG 195 CZ 56 1 Y 0 G ARG 327 ? NH1 ? A ARG 195 NH1 57 1 Y 0 G ARG 327 ? NH2 ? A ARG 195 NH2 58 1 Y 0 G LYS 328 ? CB ? A LYS 196 CB 59 1 Y 0 G LYS 328 ? CG ? A LYS 196 CG 60 1 Y 0 G LYS 328 ? CD ? A LYS 196 CD 61 1 Y 0 G LYS 328 ? CE ? A LYS 196 CE 62 1 Y 0 G LYS 328 ? NZ ? A LYS 196 NZ 63 1 Y 0 G LYS 337 ? CB ? A LYS 205 CB 64 1 Y 0 G LYS 337 ? CG ? A LYS 205 CG 65 1 Y 0 G LYS 337 ? CD ? A LYS 205 CD 66 1 Y 0 G LYS 337 ? CE ? A LYS 205 CE 67 1 Y 0 G LYS 337 ? NZ ? A LYS 205 NZ 68 1 Y 0 G LYS 340 ? CB ? A LYS 208 CB 69 1 Y 0 G LYS 340 ? CG ? A LYS 208 CG 70 1 Y 0 G LYS 340 ? CD ? A LYS 208 CD 71 1 Y 0 G LYS 340 ? CE ? A LYS 208 CE 72 1 Y 0 G LYS 340 ? NZ ? A LYS 208 NZ 73 1 Y 0 G ARG 379 ? CB ? A ARG 246 CB 74 1 Y 0 G ARG 379 ? CG ? A ARG 246 CG 75 1 Y 0 G ARG 379 ? CD ? A ARG 246 CD 76 1 Y 0 G ARG 379 ? NE ? A ARG 246 NE 77 1 Y 0 G ARG 379 ? CZ ? A ARG 246 CZ 78 1 Y 0 G ARG 379 ? NH1 ? A ARG 246 NH1 79 1 Y 0 G ARG 379 ? NH2 ? A ARG 246 NH2 80 1 Y 0 G LYS 419 ? CB ? A LYS 280 CB 81 1 Y 0 G LYS 419 ? CG ? A LYS 280 CG 82 1 Y 0 G LYS 419 ? CD ? A LYS 280 CD 83 1 Y 0 G LYS 419 ? CE ? A LYS 280 CE 84 1 Y 0 G LYS 419 ? NZ ? A LYS 280 NZ 85 1 Y 0 H LYS 19 ? CB ? B LYS 19 CB 86 1 Y 0 H LYS 19 ? CG ? B LYS 19 CG 87 1 Y 0 H LYS 19 ? CD ? B LYS 19 CD 88 1 Y 0 H LYS 19 ? CE ? B LYS 19 CE 89 1 Y 0 H LYS 19 ? NZ ? B LYS 19 NZ 90 1 Y 0 H ARG 83 ? CB ? B ARG 87 CB 91 1 Y 0 H ARG 83 ? CG ? B ARG 87 CG 92 1 Y 0 H ARG 83 ? CD ? B ARG 87 CD 93 1 Y 0 H ARG 83 ? NE ? B ARG 87 NE 94 1 Y 0 H ARG 83 ? CZ ? B ARG 87 CZ 95 1 Y 0 H ARG 83 ? NH1 ? B ARG 87 NH1 96 1 Y 0 H ARG 83 ? NH2 ? B ARG 87 NH2 97 1 Y 0 L ARG 24 ? CB ? C ARG 24 CB 98 1 Y 0 L ARG 24 ? CG ? C ARG 24 CG 99 1 Y 0 L ARG 24 ? CD ? C ARG 24 CD 100 1 Y 0 L ARG 24 ? NE ? C ARG 24 NE 101 1 Y 0 L ARG 24 ? CZ ? C ARG 24 CZ 102 1 Y 0 L ARG 24 ? NH1 ? C ARG 24 NH1 103 1 Y 0 L ARG 24 ? NH2 ? C ARG 24 NH2 104 1 Y 0 L GLN 40 ? CB ? C GLN 40 CB 105 1 Y 0 L GLN 40 ? CG ? C GLN 40 CG 106 1 Y 0 L GLN 40 ? CD ? C GLN 40 CD 107 1 Y 0 L GLN 40 ? OE1 ? C GLN 40 OE1 108 1 Y 0 L GLN 40 ? NE2 ? C GLN 40 NE2 109 1 Y 0 L LYS 97 ? CB ? C LYS 97 CB 110 1 Y 0 L LYS 97 ? CG ? C LYS 97 CG 111 1 Y 0 L LYS 97 ? CD ? C LYS 97 CD 112 1 Y 0 L LYS 97 ? CE ? C LYS 97 CE 113 1 Y 0 L LYS 97 ? NZ ? C LYS 97 NZ 114 1 Y 0 L LYS 103 ? CB ? C LYS 103 CB 115 1 Y 0 L LYS 103 ? CG ? C LYS 103 CG 116 1 Y 0 L LYS 103 ? CD ? C LYS 103 CD 117 1 Y 0 L LYS 103 ? CE ? C LYS 103 CE 118 1 Y 0 L LYS 103 ? NZ ? C LYS 103 NZ 119 1 Y 0 L LYS 122 ? CB ? C LYS 122 CB 120 1 Y 0 L LYS 122 ? CG ? C LYS 122 CG 121 1 Y 0 L LYS 122 ? CD ? C LYS 122 CD 122 1 Y 0 L LYS 122 ? CE ? C LYS 122 CE 123 1 Y 0 L LYS 122 ? NZ ? C LYS 122 NZ 124 1 Y 0 L ARG 138 ? CB ? C ARG 138 CB 125 1 Y 0 L ARG 138 ? CG ? C ARG 138 CG 126 1 Y 0 L ARG 138 ? CD ? C ARG 138 CD 127 1 Y 0 L ARG 138 ? NE ? C ARG 138 NE 128 1 Y 0 L ARG 138 ? CZ ? C ARG 138 CZ 129 1 Y 0 L ARG 138 ? NH1 ? C ARG 138 NH1 130 1 Y 0 L ARG 138 ? NH2 ? C ARG 138 NH2 131 1 Y 0 L LYS 184 ? CB ? C LYS 184 CB 132 1 Y 0 L LYS 184 ? CG ? C LYS 184 CG 133 1 Y 0 L LYS 184 ? CD ? C LYS 184 CD 134 1 Y 0 L LYS 184 ? CE ? C LYS 184 CE 135 1 Y 0 L LYS 184 ? NZ ? C LYS 184 NZ 136 1 Y 0 L LYS 186 ? CB ? C LYS 186 CB 137 1 Y 0 L LYS 186 ? CG ? C LYS 186 CG 138 1 Y 0 L LYS 186 ? CD ? C LYS 186 CD 139 1 Y 0 L LYS 186 ? CE ? C LYS 186 CE 140 1 Y 0 L LYS 186 ? NZ ? C LYS 186 NZ 141 1 Y 0 L VAL 187 ? CB ? C VAL 187 CB 142 1 Y 0 L VAL 187 ? CG1 ? C VAL 187 CG1 143 1 Y 0 L VAL 187 ? CG2 ? C VAL 187 CG2 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 G GLY 318 ? A GLY 186 2 1 Y 1 G GLY 319 ? A GLY 187 3 1 Y 1 G SER 320 ? A SER 188 4 1 Y 1 G GLY 321 ? A GLY 189 5 1 Y 1 G SER 322 ? A SER 190 6 1 Y 1 G GLY 323 ? A GLY 191 7 1 Y 1 G GLY 324 ? A GLY 192 8 1 Y 1 G ASP 325 ? A ASP 193 9 1 Y 1 G GLY 403 ? A GLY 264 10 1 Y 1 G ASN 404 ? A ASN 265 11 1 Y 1 G GLU 405 ? A GLU 266 12 1 Y 1 G THR 406 ? A THR 267 13 1 Y 1 G MET 407 ? A MET 268 14 1 Y 1 G LYS 408 ? A LYS 269 15 1 Y 1 G GLY 409 ? A GLY 270 16 1 Y 1 G CYS 410 ? A CYS 271 17 1 Y 1 G GLU 492 ? A GLU 353 18 1 Y 1 G GLY 493 ? A GLY 354 19 1 Y 1 G SER 494 ? A SER 355 20 1 Y 1 G HIS 495 ? A HIS 356 21 1 Y 1 G HIS 496 ? A HIS 357 22 1 Y 1 G HIS 497 ? A HIS 358 23 1 Y 1 G HIS 498 ? A HIS 359 24 1 Y 1 G HIS 499 ? A HIS 360 25 1 Y 1 G HIS 500 ? A HIS 361 26 1 Y 1 H GLN 1 ? B GLN 1 27 1 Y 1 H THR 99 ? B THR 103 28 1 Y 1 H ALA 99 A B ALA 104 29 1 Y 1 H ARG 99 B B ARG 105 30 1 Y 1 H ASP 99 C B ASP 106 31 1 Y 1 H SER 131 ? B SER 139 32 1 Y 1 H SER 132 ? B SER 140 33 1 Y 1 H LYS 133 ? B LYS 141 34 1 Y 1 H SER 134 ? B SER 142 35 1 Y 1 H THR 135 ? B THR 143 36 1 Y 1 H SER 136 ? B SER 144 37 1 Y 1 H GLY 137 ? B GLY 145 38 1 Y 1 H GLY 138 ? B GLY 146 39 1 Y 1 H GLY 194 ? B GLY 202 40 1 Y 1 H THR 195 ? B THR 203 41 1 Y 1 H PRO 217 ? B PRO 225 42 1 Y 1 H LYS 218 ? B LYS 226 43 1 Y 1 H SER 219 ? B SER 227 44 1 Y 1 H CYS 220 ? B CYS 228 45 1 Y 1 H ASP 221 ? B ASP 229 46 1 Y 1 H LYS 222 ? B LYS 230 47 1 Y 1 H THR 223 ? B THR 231 48 1 Y 1 H HIS 224 ? B HIS 232 49 1 Y 1 L GLU 1 ? C GLU 1 50 1 Y 1 L ILE 2 ? C ILE 2 51 1 Y 1 L GLU 209 ? C GLU 209 52 1 Y 1 L CYS 210 ? C CYS 210 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 4 'SULFATE ION' SO4 5 N-ACETYL-D-GLUCOSAMINE NAG # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code D 4 SO4 1 601 1 SO4 SO4 G . E 5 NAG 1 602 1 NAG NAG G . #