data_5HU8 # _entry.id 5HU8 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 5HU8 WWPDB D_1000217767 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 5HU8 _pdbx_database_status.recvd_initial_deposition_date 2016-01-27 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _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 'Yang, H.' 1 'Carney, P.J.' 2 'Guo, Z.' 3 'Chang, J.C.' 4 'Stevens, J.' 5 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country US _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev J.Virol. _citation.journal_id_ASTM JOVIAM _citation.journal_id_CSD 0825 _citation.journal_id_ISSN 1098-5514 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 90 _citation.language ? _citation.page_first 5770 _citation.page_last 5784 _citation.title 'Molecular Characterizations of Surface Proteins Hemagglutinin and Neuraminidase from Recent H5Nx Avian Influenza Viruses.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1128/JVI.00180-16 _citation.pdbx_database_id_PubMed 27053557 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Yang, H.' 1 primary 'Carney, P.J.' 2 primary 'Mishin, V.P.' 3 primary 'Guo, Z.' 4 primary 'Chang, J.C.' 5 primary 'Wentworth, D.E.' 6 primary 'Gubareva, L.V.' 7 primary 'Stevens, J.' 8 # _cell.angle_alpha 90.00 _cell.angle_alpha_esd ? _cell.angle_beta 90.00 _cell.angle_beta_esd ? _cell.angle_gamma 90.00 _cell.angle_gamma_esd ? _cell.entry_id 5HU8 _cell.details ? _cell.formula_units_Z ? _cell.length_a 89.505 _cell.length_a_esd ? _cell.length_b 104.418 _cell.length_b_esd ? _cell.length_c 215.692 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 12 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? # _symmetry.entry_id 5HU8 _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? # 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 'hemagglutinin HA1' 37828.008 3 ? ? ? ? 2 polymer man 'hemagglutinin HA2' 20881.170 3 ? ? ? ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 12 ? ? ? ? 4 non-polymer man ALPHA-L-FUCOSE 164.156 6 ? ? ? ? 5 water nat water 18.015 698 ? ? ? ? # 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 ;ADLGSDQICIGYHANNSTEQVDTIMEKNVTVTHAQDILEKTHNGKLCDLNGVKPLILKDCSVAGWLLGNPMCDEFIRVPE WSYIVERANPANDLCYPGNLNDYEELKHLLSRINHFEKILIIPKSSWTNHETSLGVSAACPYQGTPSFFRNVVWLIKKND AYPTIKISYNNTNQEDLLILWGVHHSNNAAEQTNLYKNPTTYISVGTSTLNQRLVPKIATRSQVNGQRGRMDFFWTILKP NDAIHFESNGNFIAPEYAYKIVKKGDSTIMKSEMEYGHCNTKCQTPIGAINSSMPFHNIHPLTIGECPKYVKSNKLVLAT GLRNSPLREKRRKR ; ;ADLGSDQICIGYHANNSTEQVDTIMEKNVTVTHAQDILEKTHNGKLCDLNGVKPLILKDCSVAGWLLGNPMCDEFIRVPE WSYIVERANPANDLCYPGNLNDYEELKHLLSRINHFEKILIIPKSSWTNHETSLGVSAACPYQGTPSFFRNVVWLIKKND AYPTIKISYNNTNQEDLLILWGVHHSNNAAEQTNLYKNPTTYISVGTSTLNQRLVPKIATRSQVNGQRGRMDFFWTILKP NDAIHFESNGNFIAPEYAYKIVKKGDSTIMKSEMEYGHCNTKCQTPIGAINSSMPFHNIHPLTIGECPKYVKSNKLVLAT GLRNSPLREKRRKR ; A,C,E ? 2 'polypeptide(L)' no no ;GLFGAIAGFIEGGWQGMVDGWYGYHHSNEQGSGYAADKESTQKAIDGVTNKVNSIIDKMNTQFEAVGREFNNLERRIENL NKKMEDGFLDVWTYNAELLVLMENERTLDFHDSNVKNLYDKVRLQLRDNAKELGNGCFEFYHKCDNKCMESVRNGTYDYP QYSEEARLKREEISSGRLVPR ; ;GLFGAIAGFIEGGWQGMVDGWYGYHHSNEQGSGYAADKESTQKAIDGVTNKVNSIIDKMNTQFEAVGREFNNLERRIENL NKKMEDGFLDVWTYNAELLVLMENERTLDFHDSNVKNLYDKVRLQLRDNAKELGNGCFEFYHKCDNKCMESVRNGTYDYP QYSEEARLKREEISSGRLVPR ; B,D,F ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 ALA n 1 2 ASP n 1 3 LEU n 1 4 GLY n 1 5 SER n 1 6 ASP n 1 7 GLN n 1 8 ILE n 1 9 CYS n 1 10 ILE n 1 11 GLY n 1 12 TYR n 1 13 HIS n 1 14 ALA n 1 15 ASN n 1 16 ASN n 1 17 SER n 1 18 THR n 1 19 GLU n 1 20 GLN n 1 21 VAL n 1 22 ASP n 1 23 THR n 1 24 ILE n 1 25 MET n 1 26 GLU n 1 27 LYS n 1 28 ASN n 1 29 VAL n 1 30 THR n 1 31 VAL n 1 32 THR n 1 33 HIS n 1 34 ALA n 1 35 GLN n 1 36 ASP n 1 37 ILE n 1 38 LEU n 1 39 GLU n 1 40 LYS n 1 41 THR n 1 42 HIS n 1 43 ASN n 1 44 GLY n 1 45 LYS n 1 46 LEU n 1 47 CYS n 1 48 ASP n 1 49 LEU n 1 50 ASN n 1 51 GLY n 1 52 VAL n 1 53 LYS n 1 54 PRO n 1 55 LEU n 1 56 ILE n 1 57 LEU n 1 58 LYS n 1 59 ASP n 1 60 CYS n 1 61 SER n 1 62 VAL n 1 63 ALA n 1 64 GLY n 1 65 TRP n 1 66 LEU n 1 67 LEU n 1 68 GLY n 1 69 ASN n 1 70 PRO n 1 71 MET n 1 72 CYS n 1 73 ASP n 1 74 GLU n 1 75 PHE n 1 76 ILE n 1 77 ARG n 1 78 VAL n 1 79 PRO n 1 80 GLU n 1 81 TRP n 1 82 SER n 1 83 TYR n 1 84 ILE n 1 85 VAL n 1 86 GLU n 1 87 ARG n 1 88 ALA n 1 89 ASN n 1 90 PRO n 1 91 ALA n 1 92 ASN n 1 93 ASP n 1 94 LEU n 1 95 CYS n 1 96 TYR n 1 97 PRO n 1 98 GLY n 1 99 ASN n 1 100 LEU n 1 101 ASN n 1 102 ASP n 1 103 TYR n 1 104 GLU n 1 105 GLU n 1 106 LEU n 1 107 LYS n 1 108 HIS n 1 109 LEU n 1 110 LEU n 1 111 SER n 1 112 ARG n 1 113 ILE n 1 114 ASN n 1 115 HIS n 1 116 PHE n 1 117 GLU n 1 118 LYS n 1 119 ILE n 1 120 LEU n 1 121 ILE n 1 122 ILE n 1 123 PRO n 1 124 LYS n 1 125 SER n 1 126 SER n 1 127 TRP n 1 128 THR n 1 129 ASN n 1 130 HIS n 1 131 GLU n 1 132 THR n 1 133 SER n 1 134 LEU n 1 135 GLY n 1 136 VAL n 1 137 SER n 1 138 ALA n 1 139 ALA n 1 140 CYS n 1 141 PRO n 1 142 TYR n 1 143 GLN n 1 144 GLY n 1 145 THR n 1 146 PRO n 1 147 SER n 1 148 PHE n 1 149 PHE n 1 150 ARG n 1 151 ASN n 1 152 VAL n 1 153 VAL n 1 154 TRP n 1 155 LEU n 1 156 ILE n 1 157 LYS n 1 158 LYS n 1 159 ASN n 1 160 ASP n 1 161 ALA n 1 162 TYR n 1 163 PRO n 1 164 THR n 1 165 ILE n 1 166 LYS n 1 167 ILE n 1 168 SER n 1 169 TYR n 1 170 ASN n 1 171 ASN n 1 172 THR n 1 173 ASN n 1 174 GLN n 1 175 GLU n 1 176 ASP n 1 177 LEU n 1 178 LEU n 1 179 ILE n 1 180 LEU n 1 181 TRP n 1 182 GLY n 1 183 VAL n 1 184 HIS n 1 185 HIS n 1 186 SER n 1 187 ASN n 1 188 ASN n 1 189 ALA n 1 190 ALA n 1 191 GLU n 1 192 GLN n 1 193 THR n 1 194 ASN n 1 195 LEU n 1 196 TYR n 1 197 LYS n 1 198 ASN n 1 199 PRO n 1 200 THR n 1 201 THR n 1 202 TYR n 1 203 ILE n 1 204 SER n 1 205 VAL n 1 206 GLY n 1 207 THR n 1 208 SER n 1 209 THR n 1 210 LEU n 1 211 ASN n 1 212 GLN n 1 213 ARG n 1 214 LEU n 1 215 VAL n 1 216 PRO n 1 217 LYS n 1 218 ILE n 1 219 ALA n 1 220 THR n 1 221 ARG n 1 222 SER n 1 223 GLN n 1 224 VAL n 1 225 ASN n 1 226 GLY n 1 227 GLN n 1 228 ARG n 1 229 GLY n 1 230 ARG n 1 231 MET n 1 232 ASP n 1 233 PHE n 1 234 PHE n 1 235 TRP n 1 236 THR n 1 237 ILE n 1 238 LEU n 1 239 LYS n 1 240 PRO n 1 241 ASN n 1 242 ASP n 1 243 ALA n 1 244 ILE n 1 245 HIS n 1 246 PHE n 1 247 GLU n 1 248 SER n 1 249 ASN n 1 250 GLY n 1 251 ASN n 1 252 PHE n 1 253 ILE n 1 254 ALA n 1 255 PRO n 1 256 GLU n 1 257 TYR n 1 258 ALA n 1 259 TYR n 1 260 LYS n 1 261 ILE n 1 262 VAL n 1 263 LYS n 1 264 LYS n 1 265 GLY n 1 266 ASP n 1 267 SER n 1 268 THR n 1 269 ILE n 1 270 MET n 1 271 LYS n 1 272 SER n 1 273 GLU n 1 274 MET n 1 275 GLU n 1 276 TYR n 1 277 GLY n 1 278 HIS n 1 279 CYS n 1 280 ASN n 1 281 THR n 1 282 LYS n 1 283 CYS n 1 284 GLN n 1 285 THR n 1 286 PRO n 1 287 ILE n 1 288 GLY n 1 289 ALA n 1 290 ILE n 1 291 ASN n 1 292 SER n 1 293 SER n 1 294 MET n 1 295 PRO n 1 296 PHE n 1 297 HIS n 1 298 ASN n 1 299 ILE n 1 300 HIS n 1 301 PRO n 1 302 LEU n 1 303 THR n 1 304 ILE n 1 305 GLY n 1 306 GLU n 1 307 CYS n 1 308 PRO n 1 309 LYS n 1 310 TYR n 1 311 VAL n 1 312 LYS n 1 313 SER n 1 314 ASN n 1 315 LYS n 1 316 LEU n 1 317 VAL n 1 318 LEU n 1 319 ALA n 1 320 THR n 1 321 GLY n 1 322 LEU n 1 323 ARG n 1 324 ASN n 1 325 SER n 1 326 PRO n 1 327 LEU n 1 328 ARG n 1 329 GLU n 1 330 LYS n 1 331 ARG n 1 332 ARG n 1 333 LYS n 1 334 ARG n 2 1 GLY n 2 2 LEU n 2 3 PHE n 2 4 GLY n 2 5 ALA n 2 6 ILE n 2 7 ALA n 2 8 GLY n 2 9 PHE n 2 10 ILE n 2 11 GLU n 2 12 GLY n 2 13 GLY n 2 14 TRP n 2 15 GLN n 2 16 GLY n 2 17 MET n 2 18 VAL n 2 19 ASP n 2 20 GLY n 2 21 TRP n 2 22 TYR n 2 23 GLY n 2 24 TYR n 2 25 HIS n 2 26 HIS n 2 27 SER n 2 28 ASN n 2 29 GLU n 2 30 GLN n 2 31 GLY n 2 32 SER n 2 33 GLY n 2 34 TYR n 2 35 ALA n 2 36 ALA n 2 37 ASP n 2 38 LYS n 2 39 GLU n 2 40 SER n 2 41 THR n 2 42 GLN n 2 43 LYS n 2 44 ALA n 2 45 ILE n 2 46 ASP n 2 47 GLY n 2 48 VAL n 2 49 THR n 2 50 ASN n 2 51 LYS n 2 52 VAL n 2 53 ASN n 2 54 SER n 2 55 ILE n 2 56 ILE n 2 57 ASP n 2 58 LYS n 2 59 MET n 2 60 ASN n 2 61 THR n 2 62 GLN n 2 63 PHE n 2 64 GLU n 2 65 ALA n 2 66 VAL n 2 67 GLY n 2 68 ARG n 2 69 GLU n 2 70 PHE n 2 71 ASN n 2 72 ASN n 2 73 LEU n 2 74 GLU n 2 75 ARG n 2 76 ARG n 2 77 ILE n 2 78 GLU n 2 79 ASN n 2 80 LEU n 2 81 ASN n 2 82 LYS n 2 83 LYS n 2 84 MET n 2 85 GLU n 2 86 ASP n 2 87 GLY n 2 88 PHE n 2 89 LEU n 2 90 ASP n 2 91 VAL n 2 92 TRP n 2 93 THR n 2 94 TYR n 2 95 ASN n 2 96 ALA n 2 97 GLU n 2 98 LEU n 2 99 LEU n 2 100 VAL n 2 101 LEU n 2 102 MET n 2 103 GLU n 2 104 ASN n 2 105 GLU n 2 106 ARG n 2 107 THR n 2 108 LEU n 2 109 ASP n 2 110 PHE n 2 111 HIS n 2 112 ASP n 2 113 SER n 2 114 ASN n 2 115 VAL n 2 116 LYS n 2 117 ASN n 2 118 LEU n 2 119 TYR n 2 120 ASP n 2 121 LYS n 2 122 VAL n 2 123 ARG n 2 124 LEU n 2 125 GLN n 2 126 LEU n 2 127 ARG n 2 128 ASP n 2 129 ASN n 2 130 ALA n 2 131 LYS n 2 132 GLU n 2 133 LEU n 2 134 GLY n 2 135 ASN n 2 136 GLY n 2 137 CYS n 2 138 PHE n 2 139 GLU n 2 140 PHE n 2 141 TYR n 2 142 HIS n 2 143 LYS n 2 144 CYS n 2 145 ASP n 2 146 ASN n 2 147 LYS n 2 148 CYS n 2 149 MET n 2 150 GLU n 2 151 SER n 2 152 VAL n 2 153 ARG n 2 154 ASN n 2 155 GLY n 2 156 THR n 2 157 TYR n 2 158 ASP n 2 159 TYR n 2 160 PRO n 2 161 GLN n 2 162 TYR n 2 163 SER n 2 164 GLU n 2 165 GLU n 2 166 ALA n 2 167 ARG n 2 168 LEU n 2 169 LYS n 2 170 ARG n 2 171 GLU n 2 172 GLU n 2 173 ILE n 2 174 SER n 2 175 SER n 2 176 GLY n 2 177 ARG n 2 178 LEU n 2 179 VAL n 2 180 PRO n 2 181 ARG 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 'Biological sequence' 1 334 ? ? ? ? 'A/Sichuan/26221/2014 (H5N6)' ? ? ? ? 'unidentified influenza virus' 11309 ? ? ? ? ? ? ? ? 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample 'Biological sequence' 1 181 ? ? ? ? ? ? ? ? ? 'unidentified influenza virus' 11309 ? ? ? ? ? ? ? ? 'Trichoplusia ni' 7111 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.pdbx_db_isoform _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin 1 PDB 5HU8 5HU8 ? 1 ? 1 2 PDB 5HU8 5HU8 ? 2 ? 1 # 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 5HU8 A 1 ? 334 ? 5HU8 -4 ? 329 ? -4 329 2 1 5HU8 C 1 ? 334 ? 5HU8 -4 ? 329 ? -4 329 3 1 5HU8 E 1 ? 334 ? 5HU8 -4 ? 329 ? -4 329 4 2 5HU8 B 1 ? 181 ? 5HU8 1 ? 181 ? 1 181 5 2 5HU8 D 1 ? 181 ? 5HU8 1 ? 181 ? 1 181 6 2 5HU8 F 1 ? 181 ? 5HU8 1 ? 181 ? 1 181 # 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 FUC saccharide . ALPHA-L-FUCOSE ? 'C6 H12 O5' 164.156 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 HOH non-polymer . WATER ? 'H2 O' 18.015 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 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.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 5HU8 _exptl.crystals_number ? _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.86 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 57.01 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method MICROBATCH _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 7.0 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details '0.1M Imidazole, pH7, 22.5% PolyPure PEG 0.3-10KDa' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details ? _diffrn_detector.detector CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'MARMOSAIC 325 mm CCD' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2014-10-22 # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.0 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source SYNCHROTRON _diffrn_source.target ? _diffrn_source.type 'APS BEAMLINE 22-ID' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 1.0 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline 22-ID _diffrn_source.pdbx_synchrotron_site APS # _reflns.B_iso_Wilson_estimate ? _reflns.entry_id 5HU8 _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.45 _reflns.d_resolution_low 50 _reflns.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.number_all ? _reflns.number_obs 74754 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 100 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 7.3 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 25.8 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? # _refine.aniso_B[1][1] 0.63 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][2] -0.53 _refine.aniso_B[2][3] 0.00 _refine.aniso_B[3][3] -0.10 _refine.B_iso_max ? _refine.B_iso_mean 58.397 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc 0.949 _refine.correlation_coeff_Fo_to_Fc_free 0.927 _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 5HU8 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.45 _refine.ls_d_res_low 49.39 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 70912 _refine.ls_number_reflns_R_free 3763 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.62 _refine.ls_percent_reflns_R_free 5.0 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.19303 _refine.ls_R_factor_R_free 0.22740 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.19118 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details MASK _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_method_to_determine_struct ? _refine.pdbx_starting_model ? _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R 0.372 _refine.pdbx_overall_ESU_R_Free 0.239 _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B 15.347 _refine.overall_SU_ML 0.183 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id 1 _refine_hist.pdbx_number_atoms_protein 11598 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 228 _refine_hist.number_atoms_solvent 698 _refine_hist.number_atoms_total 12524 _refine_hist.d_res_high 2.45 _refine_hist.d_res_low 49.39 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.014 0.019 12123 ? r_bond_refined_d ? ? 'X-RAY DIFFRACTION' ? 0.006 0.020 11181 ? r_bond_other_d ? ? 'X-RAY DIFFRACTION' ? 1.713 1.959 16452 ? r_angle_refined_deg ? ? 'X-RAY DIFFRACTION' ? 1.166 3.000 25695 ? r_angle_other_deg ? ? 'X-RAY DIFFRACTION' ? 6.953 5.000 1440 ? r_dihedral_angle_1_deg ? ? 'X-RAY DIFFRACTION' ? 39.328 25.149 606 ? r_dihedral_angle_2_deg ? ? 'X-RAY DIFFRACTION' ? 19.151 15.000 2064 ? r_dihedral_angle_3_deg ? ? 'X-RAY DIFFRACTION' ? 19.821 15.000 54 ? r_dihedral_angle_4_deg ? ? 'X-RAY DIFFRACTION' ? 0.099 0.200 1800 ? r_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.008 0.020 13734 ? r_gen_planes_refined ? ? 'X-RAY DIFFRACTION' ? 0.006 0.020 2826 ? r_gen_planes_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? 3.945 4.321 5778 ? r_mcbond_it ? ? 'X-RAY DIFFRACTION' ? 3.942 4.320 5777 ? r_mcbond_other ? ? 'X-RAY DIFFRACTION' ? 6.018 6.470 7212 ? r_mcangle_it ? ? 'X-RAY DIFFRACTION' ? 6.019 6.471 7213 ? r_mcangle_other ? ? 'X-RAY DIFFRACTION' ? 4.995 4.981 6345 ? r_scbond_it ? ? 'X-RAY DIFFRACTION' ? 4.995 4.982 6346 ? r_scbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_scangle_it ? ? 'X-RAY DIFFRACTION' ? 7.719 7.259 9241 ? r_scangle_other ? ? 'X-RAY DIFFRACTION' ? 10.503 35.592 13772 ? r_long_range_B_refined ? ? 'X-RAY DIFFRACTION' ? 10.544 35.417 13451 ? r_long_range_B_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_rigid_bond_restr ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_free ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_bonded ? ? # loop_ _refine_ls_restr_ncs.pdbx_refine_id _refine_ls_restr_ncs.dom_id _refine_ls_restr_ncs.pdbx_ens_id _refine_ls_restr_ncs.pdbx_ordinal _refine_ls_restr_ncs.ncs_model_details _refine_ls_restr_ncs.rms_dev_position _refine_ls_restr_ncs.weight_position _refine_ls_restr_ncs.rms_dev_B_iso _refine_ls_restr_ncs.weight_B_iso _refine_ls_restr_ncs.pdbx_auth_asym_id _refine_ls_restr_ncs.pdbx_number _refine_ls_restr_ncs.pdbx_type 'X-RAY DIFFRACTION' 1 1 1 ? 0.07 0.05 ? ? A 19405 'interatomic distance' 'X-RAY DIFFRACTION' 2 1 2 ? 0.07 0.05 ? ? C 19405 'interatomic distance' 'X-RAY DIFFRACTION' 1 2 3 ? 0.07 0.05 ? ? A 19422 'interatomic distance' 'X-RAY DIFFRACTION' 2 2 4 ? 0.07 0.05 ? ? E 19422 'interatomic distance' 'X-RAY DIFFRACTION' 1 3 5 ? 0.07 0.05 ? ? C 19376 'interatomic distance' 'X-RAY DIFFRACTION' 2 3 6 ? 0.07 0.05 ? ? E 19376 'interatomic distance' 'X-RAY DIFFRACTION' 1 4 7 ? 0.10 0.05 ? ? B 8292 'interatomic distance' 'X-RAY DIFFRACTION' 2 4 8 ? 0.10 0.05 ? ? D 8292 'interatomic distance' 'X-RAY DIFFRACTION' 1 5 9 ? 0.09 0.05 ? ? B 8384 'interatomic distance' 'X-RAY DIFFRACTION' 2 5 10 ? 0.09 0.05 ? ? F 8384 'interatomic distance' 'X-RAY DIFFRACTION' 1 6 11 ? 0.10 0.05 ? ? D 8313 'interatomic distance' 'X-RAY DIFFRACTION' 2 6 12 ? 0.10 0.05 ? ? F 8313 'interatomic distance' # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.d_res_high 2.451 _refine_ls_shell.d_res_low 2.515 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.number_reflns_R_free 236 _refine_ls_shell.number_reflns_R_work 4967 _refine_ls_shell.percent_reflns_obs 95.54 _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.R_factor_obs ? _refine_ls_shell.R_factor_R_free 0.364 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.R_factor_R_work 0.312 _refine_ls_shell.redundancy_reflns_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.wR_factor_all ? _refine_ls_shell.wR_factor_obs ? _refine_ls_shell.wR_factor_R_free ? _refine_ls_shell.wR_factor_R_work ? _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.pdbx_phase_error ? _refine_ls_shell.pdbx_fsc_work ? _refine_ls_shell.pdbx_fsc_free ? # loop_ _struct_ncs_dom.id _struct_ncs_dom.details _struct_ncs_dom.pdbx_ens_id 1 A 1 2 C 1 1 A 2 2 E 2 1 C 3 2 E 3 1 B 4 2 D 4 1 B 5 2 F 5 1 D 6 2 F 6 # loop_ _struct_ncs_dom_lim.dom_id _struct_ncs_dom_lim.beg_auth_asym_id _struct_ncs_dom_lim.beg_auth_seq_id _struct_ncs_dom_lim.end_auth_asym_id _struct_ncs_dom_lim.end_auth_seq_id _struct_ncs_dom_lim.pdbx_component_id _struct_ncs_dom_lim.pdbx_refine_code _struct_ncs_dom_lim.beg_label_asym_id _struct_ncs_dom_lim.beg_label_comp_id _struct_ncs_dom_lim.beg_label_seq_id _struct_ncs_dom_lim.beg_label_alt_id _struct_ncs_dom_lim.end_label_asym_id _struct_ncs_dom_lim.end_label_comp_id _struct_ncs_dom_lim.end_label_seq_id _struct_ncs_dom_lim.end_label_alt_id _struct_ncs_dom_lim.pdbx_ens_id _struct_ncs_dom_lim.selection_details 1 A 0 A 319 0 0 ? ? ? ? ? ? ? ? 1 ? 2 C 0 C 319 0 0 ? ? ? ? ? ? ? ? 1 ? 1 A 0 A 319 0 0 ? ? ? ? ? ? ? ? 2 ? 2 E 0 E 319 0 0 ? ? ? ? ? ? ? ? 2 ? 1 C 0 C 319 0 0 ? ? ? ? ? ? ? ? 3 ? 2 E 0 E 319 0 0 ? ? ? ? ? ? ? ? 3 ? 1 B 12 B 173 0 0 ? ? ? ? ? ? ? ? 4 ? 2 D 12 D 173 0 0 ? ? ? ? ? ? ? ? 4 ? 1 B 12 B 173 0 0 ? ? ? ? ? ? ? ? 5 ? 2 F 12 F 173 0 0 ? ? ? ? ? ? ? ? 5 ? 1 D 12 D 173 0 0 ? ? ? ? ? ? ? ? 6 ? 2 F 12 F 173 0 0 ? ? ? ? ? ? ? ? 6 ? # loop_ _struct_ncs_ens.id _struct_ncs_ens.details 1 ? 2 ? 3 ? 4 ? 5 ? 6 ? # _struct.entry_id 5HU8 _struct.title 'The crystal structure of hemagglutinin from A/Sichuan/26221/2014 (H5N6) influenza virus' _struct.pdbx_descriptor 'hemagglutinin HA1, hemagglutinin HA2' _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag ? # _struct_keywords.entry_id 5HU8 _struct_keywords.text 'hemagglutinin, influenza virus, H5N6, VIRAL PROTEIN' _struct_keywords.pdbx_keywords 'VIRAL PROTEIN' # 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 1 ? C N N 1 ? D N N 2 ? E N N 2 ? F N N 2 ? G N N 3 ? H N N 4 ? I N N 3 ? J N N 3 ? K N N 4 ? L N N 3 ? M N N 3 ? N N N 4 ? O N N 3 ? P N N 3 ? Q N N 4 ? R N N 3 ? S N N 3 ? T N N 4 ? U N N 3 ? V N N 3 ? W N N 4 ? X N N 3 ? Y N N 5 ? Z N N 5 ? AA N N 5 ? BA N N 5 ? CA N N 5 ? DA N N 5 ? # 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 AA1 SER A 61 ? GLY A 68 ? SER A 56 GLY A 63 1 ? 8 HELX_P HELX_P2 AA2 ASN A 69 ? ASP A 73 ? ASN A 64 ASP A 68 5 ? 5 HELX_P HELX_P3 AA3 ASP A 102 ? LEU A 110 ? ASP A 97 LEU A 105 1 ? 9 HELX_P HELX_P4 AA4 PRO A 123 ? TRP A 127 ? PRO A 118 TRP A 122 5 ? 5 HELX_P HELX_P5 AA5 ASN A 188 ? LYS A 197 ? ASN A 183 LYS A 192 1 ? 10 HELX_P HELX_P6 AA6 SER B 61 ? GLY B 68 ? SER C 56 GLY C 63 1 ? 8 HELX_P HELX_P7 AA7 ASN B 69 ? ASP B 73 ? ASN C 64 ASP C 68 5 ? 5 HELX_P HELX_P8 AA8 ASP B 102 ? LEU B 110 ? ASP C 97 LEU C 105 1 ? 9 HELX_P HELX_P9 AA9 PRO B 123 ? TRP B 127 ? PRO C 118 TRP C 122 5 ? 5 HELX_P HELX_P10 AB1 ASN B 188 ? LYS B 197 ? ASN C 183 LYS C 192 1 ? 10 HELX_P HELX_P11 AB2 SER C 61 ? GLY C 68 ? SER E 56 GLY E 63 1 ? 8 HELX_P HELX_P12 AB3 ASN C 69 ? ASP C 73 ? ASN E 64 ASP E 68 5 ? 5 HELX_P HELX_P13 AB4 ASP C 102 ? SER C 111 ? ASP E 97 SER E 106 1 ? 10 HELX_P HELX_P14 AB5 PRO C 123 ? TRP C 127 ? PRO E 118 TRP E 122 5 ? 5 HELX_P HELX_P15 AB6 ASN C 188 ? LYS C 197 ? ASN E 183 LYS E 192 1 ? 10 HELX_P HELX_P16 AB7 ASP D 37 ? LYS D 58 ? ASP B 37 LYS B 58 1 ? 22 HELX_P HELX_P17 AB8 GLU D 74 ? ARG D 127 ? GLU B 74 ARG B 127 1 ? 54 HELX_P HELX_P18 AB9 ASP D 145 ? ASN D 154 ? ASP B 145 ASN B 154 1 ? 10 HELX_P HELX_P19 AC1 ASP D 158 ? GLU D 172 ? ASP B 158 GLU B 172 1 ? 15 HELX_P HELX_P20 AC2 ASP E 37 ? LYS E 58 ? ASP D 37 LYS D 58 1 ? 22 HELX_P HELX_P21 AC3 GLU E 74 ? ARG E 127 ? GLU D 74 ARG D 127 1 ? 54 HELX_P HELX_P22 AC4 ASP E 145 ? ASN E 154 ? ASP D 145 ASN D 154 1 ? 10 HELX_P HELX_P23 AC5 TYR E 159 ? GLU E 171 ? TYR D 159 GLU D 171 1 ? 13 HELX_P HELX_P24 AC6 ASP F 37 ? LYS F 58 ? ASP F 37 LYS F 58 1 ? 22 HELX_P HELX_P25 AC7 GLU F 74 ? ARG F 127 ? GLU F 74 ARG F 127 1 ? 54 HELX_P HELX_P26 AC8 ASP F 145 ? ASN F 154 ? ASP F 145 ASN F 154 1 ? 10 HELX_P HELX_P27 AC9 TYR F 159 ? GLU F 171 ? TYR F 159 GLU F 171 1 ? 13 # _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 9 SG ? ? ? 1_555 D CYS 137 SG ? ? A CYS 4 B CYS 137 1_555 ? ? ? ? ? ? ? 2.060 ? disulf2 disulf ? ? A CYS 47 SG ? ? ? 1_555 A CYS 279 SG ? ? A CYS 42 A CYS 274 1_555 ? ? ? ? ? ? ? 2.071 ? disulf3 disulf ? ? A CYS 60 SG ? ? ? 1_555 A CYS 72 SG ? ? A CYS 55 A CYS 67 1_555 ? ? ? ? ? ? ? 2.064 ? disulf4 disulf ? ? A CYS 95 SG ? ? ? 1_555 A CYS 140 SG ? ? A CYS 90 A CYS 135 1_555 ? ? ? ? ? ? ? 2.160 ? disulf5 disulf ? ? A CYS 283 SG ? ? ? 1_555 A CYS 307 SG ? ? A CYS 278 A CYS 302 1_555 ? ? ? ? ? ? ? 2.062 ? disulf6 disulf ? ? B CYS 9 SG ? ? ? 1_555 E CYS 137 SG ? ? C CYS 4 D CYS 137 1_555 ? ? ? ? ? ? ? 2.036 ? disulf7 disulf ? ? B CYS 47 SG ? ? ? 1_555 B CYS 279 SG ? ? C CYS 42 C CYS 274 1_555 ? ? ? ? ? ? ? 2.041 ? disulf8 disulf ? ? B CYS 60 SG ? ? ? 1_555 B CYS 72 SG ? ? C CYS 55 C CYS 67 1_555 ? ? ? ? ? ? ? 2.030 ? disulf9 disulf ? ? B CYS 95 SG ? ? ? 1_555 B CYS 140 SG ? ? C CYS 90 C CYS 135 1_555 ? ? ? ? ? ? ? 2.137 ? disulf10 disulf ? ? B CYS 283 SG ? ? ? 1_555 B CYS 307 SG ? ? C CYS 278 C CYS 302 1_555 ? ? ? ? ? ? ? 2.077 ? disulf11 disulf ? ? C CYS 9 SG ? ? ? 1_555 F CYS 137 SG ? ? E CYS 4 F CYS 137 1_555 ? ? ? ? ? ? ? 2.045 ? disulf12 disulf ? ? C CYS 47 SG ? ? ? 1_555 C CYS 279 SG ? ? E CYS 42 E CYS 274 1_555 ? ? ? ? ? ? ? 2.057 ? disulf13 disulf ? ? C CYS 60 SG ? ? ? 1_555 C CYS 72 SG ? ? E CYS 55 E CYS 67 1_555 ? ? ? ? ? ? ? 2.028 ? disulf14 disulf ? ? C CYS 95 SG ? ? ? 1_555 C CYS 140 SG ? ? E CYS 90 E CYS 135 1_555 ? ? ? ? ? ? ? 2.129 ? disulf15 disulf ? ? C CYS 283 SG ? ? ? 1_555 C CYS 307 SG ? ? E CYS 278 E CYS 302 1_555 ? ? ? ? ? ? ? 2.098 ? disulf16 disulf ? ? D CYS 144 SG ? ? ? 1_555 D CYS 148 SG ? ? B CYS 144 B CYS 148 1_555 ? ? ? ? ? ? ? 2.085 ? disulf17 disulf ? ? E CYS 144 SG ? ? ? 1_555 E CYS 148 SG ? ? D CYS 144 D CYS 148 1_555 ? ? ? ? ? ? ? 2.048 ? disulf18 disulf ? ? F CYS 144 SG ? ? ? 1_555 F CYS 148 SG ? ? F CYS 144 F CYS 148 1_555 ? ? ? ? ? ? ? 2.044 ? covale1 covale one ? A ASN 28 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 23 A NAG 401 1_555 ? ? ? ? ? ? ? 1.451 ? covale2 covale one ? A ASN 170 ND2 ? ? ? 1_555 I NAG . C1 ? ? A ASN 165 A NAG 403 1_555 ? ? ? ? ? ? ? 1.426 ? covale3 covale one ? A ASN 291 ND2 ? ? ? 1_555 L NAG . C1 ? ? A ASN 286 A NAG 406 1_555 ? ? ? ? ? ? ? 1.459 ? covale4 covale one ? B ASN 28 ND2 ? ? ? 1_555 M NAG . C1 ? ? C ASN 23 C NAG 401 1_555 ? ? ? ? ? ? ? 1.453 ? covale5 covale one ? B ASN 170 ND2 ? ? ? 1_555 O NAG . C1 ? ? C ASN 165 C NAG 403 1_555 ? ? ? ? ? ? ? 1.421 ? covale6 covale one ? B ASN 291 ND2 ? ? ? 1_555 R NAG . C1 ? ? C ASN 286 C NAG 406 1_555 ? ? ? ? ? ? ? 1.459 ? covale7 covale one ? C ASN 28 ND2 ? ? ? 1_555 S NAG . C1 ? ? E ASN 23 E NAG 401 1_555 ? ? ? ? ? ? ? 1.487 ? covale8 covale one ? C ASN 170 ND2 ? ? ? 1_555 U NAG . C1 ? ? E ASN 165 E NAG 403 1_555 ? ? ? ? ? ? ? 1.415 ? covale9 covale one ? C ASN 291 ND2 ? ? ? 1_555 X NAG . C1 ? ? E ASN 286 E NAG 406 1_555 ? ? ? ? ? ? ? 1.462 ? covale10 covale one ? G NAG . O6 ? ? ? 1_555 H FUC . C1 ? ? A NAG 401 A FUC 402 1_555 ? ? ? ? ? ? ? 1.456 ? covale11 covale both ? I NAG . O4 ? ? ? 1_555 J NAG . C1 ? ? A NAG 403 A NAG 404 1_555 ? ? ? ? ? ? ? 1.423 ? covale12 covale one ? I NAG . O6 ? ? ? 1_555 K FUC . C1 ? ? A NAG 403 A FUC 405 1_555 ? ? ? ? ? ? ? 1.456 ? covale13 covale one ? M NAG . O6 ? ? ? 1_555 N FUC . C1 ? ? C NAG 401 C FUC 402 1_555 ? ? ? ? ? ? ? 1.467 ? covale14 covale both ? O NAG . O4 ? ? ? 1_555 P NAG . C1 ? ? C NAG 403 C NAG 404 1_555 ? ? ? ? ? ? ? 1.446 ? covale15 covale one ? O NAG . O6 ? ? ? 1_555 Q FUC . C1 ? ? C NAG 403 C FUC 405 1_555 ? ? ? ? ? ? ? 1.446 ? covale16 covale one ? S NAG . O6 ? ? ? 1_555 T FUC . C1 ? ? E NAG 401 E FUC 402 1_555 ? ? ? ? ? ? ? 1.441 ? covale17 covale both ? U NAG . O4 ? ? ? 1_555 V NAG . C1 ? ? E NAG 403 E NAG 404 1_555 ? ? ? ? ? ? ? 1.422 ? covale18 covale one ? U NAG . O6 ? ? ? 1_555 W FUC . C1 ? ? E NAG 403 E FUC 405 1_555 ? ? ? ? ? ? ? 1.485 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 5 ? AA2 ? 2 ? AA3 ? 2 ? AA4 ? 3 ? AA5 ? 2 ? AA6 ? 3 ? AA7 ? 5 ? AA8 ? 5 ? AA9 ? 2 ? AB1 ? 4 ? AB2 ? 4 ? AB3 ? 5 ? AB4 ? 2 ? AB5 ? 2 ? AB6 ? 3 ? AB7 ? 2 ? AB8 ? 3 ? AB9 ? 5 ? AC1 ? 5 ? AC2 ? 2 ? AC3 ? 4 ? AC4 ? 4 ? AC5 ? 5 ? AC6 ? 2 ? AC7 ? 2 ? AC8 ? 3 ? AC9 ? 2 ? AD1 ? 3 ? AD2 ? 5 ? AD3 ? 5 ? AD4 ? 2 ? AD5 ? 4 ? AD6 ? 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 AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA2 1 2 ? anti-parallel AA3 1 2 ? anti-parallel AA4 1 2 ? parallel AA4 2 3 ? parallel AA5 1 2 ? parallel AA6 1 2 ? parallel AA6 2 3 ? parallel AA7 1 2 ? parallel AA7 2 3 ? anti-parallel AA7 3 4 ? anti-parallel AA7 4 5 ? anti-parallel AA8 1 2 ? parallel AA8 2 3 ? anti-parallel AA8 3 4 ? anti-parallel AA8 4 5 ? anti-parallel AA9 1 2 ? anti-parallel AB1 1 2 ? anti-parallel AB1 2 3 ? anti-parallel AB1 3 4 ? anti-parallel AB2 1 2 ? anti-parallel AB2 2 3 ? anti-parallel AB2 3 4 ? anti-parallel AB3 1 2 ? anti-parallel AB3 2 3 ? anti-parallel AB3 3 4 ? anti-parallel AB3 4 5 ? anti-parallel AB4 1 2 ? anti-parallel AB5 1 2 ? anti-parallel AB6 1 2 ? parallel AB6 2 3 ? parallel AB7 1 2 ? parallel AB8 1 2 ? parallel AB8 2 3 ? parallel AB9 1 2 ? parallel AB9 2 3 ? anti-parallel AB9 3 4 ? anti-parallel AB9 4 5 ? anti-parallel AC1 1 2 ? parallel AC1 2 3 ? anti-parallel AC1 3 4 ? anti-parallel AC1 4 5 ? anti-parallel AC2 1 2 ? anti-parallel AC3 1 2 ? anti-parallel AC3 2 3 ? anti-parallel AC3 3 4 ? anti-parallel AC4 1 2 ? anti-parallel AC4 2 3 ? anti-parallel AC4 3 4 ? anti-parallel AC5 1 2 ? anti-parallel AC5 2 3 ? anti-parallel AC5 3 4 ? anti-parallel AC5 4 5 ? anti-parallel AC6 1 2 ? anti-parallel AC7 1 2 ? anti-parallel AC8 1 2 ? parallel AC8 2 3 ? parallel AC9 1 2 ? parallel AD1 1 2 ? parallel AD1 2 3 ? parallel AD2 1 2 ? parallel AD2 2 3 ? anti-parallel AD2 3 4 ? anti-parallel AD2 4 5 ? anti-parallel AD3 1 2 ? parallel AD3 2 3 ? anti-parallel AD3 3 4 ? anti-parallel AD3 4 5 ? anti-parallel AD4 1 2 ? anti-parallel AD5 1 2 ? anti-parallel AD5 2 3 ? anti-parallel AD5 3 4 ? anti-parallel AD6 1 2 ? anti-parallel AD6 2 3 ? anti-parallel AD6 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 AA1 1 GLY D 31 ? ALA D 36 ? GLY B 31 ALA B 36 AA1 2 TYR D 22 ? ASN D 28 ? TYR B 22 ASN B 28 AA1 3 GLN A 7 ? TYR A 12 ? GLN A 2 TYR A 7 AA1 4 CYS D 137 ? PHE D 140 ? CYS B 137 PHE B 140 AA1 5 ALA D 130 ? GLU D 132 ? ALA B 130 GLU B 132 AA2 1 GLN A 20 ? VAL A 21 ? GLN A 15 VAL A 16 AA2 2 VAL A 29 ? THR A 30 ? VAL A 24 THR A 25 AA3 1 ALA A 34 ? ASP A 36 ? ALA A 29 ASP A 31 AA3 2 VAL A 317 ? ALA A 319 ? VAL A 312 ALA A 314 AA4 1 LEU A 38 ? GLU A 39 ? LEU A 33 GLU A 34 AA4 2 PHE A 296 ? HIS A 297 ? PHE A 291 HIS A 292 AA4 3 LYS A 309 ? TYR A 310 ? LYS A 304 TYR A 305 AA5 1 LEU A 46 ? LEU A 49 ? LEU A 41 LEU A 44 AA5 2 TYR A 276 ? THR A 281 ? TYR A 271 THR A 276 AA6 1 LEU A 55 ? ILE A 56 ? LEU A 50 ILE A 51 AA6 2 ILE A 84 ? GLU A 86 ? ILE A 79 GLU A 81 AA6 3 ILE A 269 ? LYS A 271 ? ILE A 264 LYS A 266 AA7 1 GLY A 98 ? LEU A 100 ? GLY A 93 LEU A 95 AA7 2 ARG A 230 ? LEU A 238 ? ARG A 225 LEU A 233 AA7 3 ASP A 176 ? HIS A 185 ? ASP A 171 HIS A 180 AA7 4 TYR A 257 ? VAL A 262 ? TYR A 252 VAL A 257 AA7 5 HIS A 115 ? LEU A 120 ? HIS A 110 LEU A 115 AA8 1 GLY A 98 ? LEU A 100 ? GLY A 93 LEU A 95 AA8 2 ARG A 230 ? LEU A 238 ? ARG A 225 LEU A 233 AA8 3 ASP A 176 ? HIS A 185 ? ASP A 171 HIS A 180 AA8 4 PHE A 252 ? PRO A 255 ? PHE A 247 PRO A 250 AA8 5 VAL A 152 ? TRP A 154 ? VAL A 147 TRP A 149 AA9 1 SER A 137 ? TYR A 142 ? SER A 132 TYR A 137 AA9 2 THR A 145 ? SER A 147 ? THR A 140 SER A 142 AB1 1 ILE A 165 ? ASN A 170 ? ILE A 160 ASN A 165 AB1 2 ALA A 243 ? SER A 248 ? ALA A 238 SER A 243 AB1 3 ILE A 203 ? GLY A 206 ? ILE A 198 GLY A 201 AB1 4 ASN A 211 ? LEU A 214 ? ASN A 206 LEU A 209 AB2 1 GLY A 288 ? ILE A 290 ? GLY A 283 ILE A 285 AB2 2 CYS A 283 ? THR A 285 ? CYS A 278 THR A 280 AB2 3 ILE A 304 ? GLU A 306 ? ILE A 299 GLU A 301 AB2 4 PHE D 63 ? ALA D 65 ? PHE B 63 ALA B 65 AB3 1 GLY E 31 ? ALA E 36 ? GLY D 31 ALA D 36 AB3 2 TYR E 22 ? ASN E 28 ? TYR D 22 ASN D 28 AB3 3 GLN B 7 ? TYR B 12 ? GLN C 2 TYR C 7 AB3 4 CYS E 137 ? PHE E 140 ? CYS D 137 PHE D 140 AB3 5 ALA E 130 ? GLU E 132 ? ALA D 130 GLU D 132 AB4 1 GLN B 20 ? VAL B 21 ? GLN C 15 VAL C 16 AB4 2 VAL B 29 ? THR B 30 ? VAL C 24 THR C 25 AB5 1 ALA B 34 ? ASP B 36 ? ALA C 29 ASP C 31 AB5 2 VAL B 317 ? ALA B 319 ? VAL C 312 ALA C 314 AB6 1 LEU B 38 ? GLU B 39 ? LEU C 33 GLU C 34 AB6 2 PHE B 296 ? HIS B 297 ? PHE C 291 HIS C 292 AB6 3 LYS B 309 ? TYR B 310 ? LYS C 304 TYR C 305 AB7 1 LEU B 46 ? LEU B 49 ? LEU C 41 LEU C 44 AB7 2 TYR B 276 ? THR B 281 ? TYR C 271 THR C 276 AB8 1 LEU B 55 ? ILE B 56 ? LEU C 50 ILE C 51 AB8 2 ILE B 84 ? GLU B 86 ? ILE C 79 GLU C 81 AB8 3 ILE B 269 ? LYS B 271 ? ILE C 264 LYS C 266 AB9 1 GLY B 98 ? LEU B 100 ? GLY C 93 LEU C 95 AB9 2 ARG B 230 ? LEU B 238 ? ARG C 225 LEU C 233 AB9 3 ASP B 176 ? HIS B 185 ? ASP C 171 HIS C 180 AB9 4 TYR B 257 ? VAL B 262 ? TYR C 252 VAL C 257 AB9 5 HIS B 115 ? LEU B 120 ? HIS C 110 LEU C 115 AC1 1 GLY B 98 ? LEU B 100 ? GLY C 93 LEU C 95 AC1 2 ARG B 230 ? LEU B 238 ? ARG C 225 LEU C 233 AC1 3 ASP B 176 ? HIS B 185 ? ASP C 171 HIS C 180 AC1 4 PHE B 252 ? PRO B 255 ? PHE C 247 PRO C 250 AC1 5 VAL B 152 ? TRP B 154 ? VAL C 147 TRP C 149 AC2 1 SER B 137 ? TYR B 142 ? SER C 132 TYR C 137 AC2 2 THR B 145 ? SER B 147 ? THR C 140 SER C 142 AC3 1 ILE B 165 ? ASN B 170 ? ILE C 160 ASN C 165 AC3 2 ALA B 243 ? SER B 248 ? ALA C 238 SER C 243 AC3 3 ILE B 203 ? GLY B 206 ? ILE C 198 GLY C 201 AC3 4 ASN B 211 ? LEU B 214 ? ASN C 206 LEU C 209 AC4 1 GLY B 288 ? ILE B 290 ? GLY C 283 ILE C 285 AC4 2 CYS B 283 ? THR B 285 ? CYS C 278 THR C 280 AC4 3 ILE B 304 ? GLU B 306 ? ILE C 299 GLU C 301 AC4 4 PHE E 63 ? ALA E 65 ? PHE D 63 ALA D 65 AC5 1 GLY F 31 ? ALA F 36 ? GLY F 31 ALA F 36 AC5 2 TYR F 22 ? ASN F 28 ? TYR F 22 ASN F 28 AC5 3 GLN C 7 ? TYR C 12 ? GLN E 2 TYR E 7 AC5 4 CYS F 137 ? PHE F 140 ? CYS F 137 PHE F 140 AC5 5 ALA F 130 ? GLU F 132 ? ALA F 130 GLU F 132 AC6 1 GLN C 20 ? VAL C 21 ? GLN E 15 VAL E 16 AC6 2 VAL C 29 ? THR C 30 ? VAL E 24 THR E 25 AC7 1 ALA C 34 ? ASP C 36 ? ALA E 29 ASP E 31 AC7 2 VAL C 317 ? ALA C 319 ? VAL E 312 ALA E 314 AC8 1 LEU C 38 ? GLU C 39 ? LEU E 33 GLU E 34 AC8 2 PHE C 296 ? HIS C 297 ? PHE E 291 HIS E 292 AC8 3 LYS C 309 ? TYR C 310 ? LYS E 304 TYR E 305 AC9 1 LEU C 46 ? LEU C 49 ? LEU E 41 LEU E 44 AC9 2 TYR C 276 ? THR C 281 ? TYR E 271 THR E 276 AD1 1 LEU C 55 ? ILE C 56 ? LEU E 50 ILE E 51 AD1 2 ILE C 84 ? GLU C 86 ? ILE E 79 GLU E 81 AD1 3 ILE C 269 ? LYS C 271 ? ILE E 264 LYS E 266 AD2 1 GLY C 98 ? LEU C 100 ? GLY E 93 LEU E 95 AD2 2 ARG C 230 ? LEU C 238 ? ARG E 225 LEU E 233 AD2 3 ASP C 176 ? HIS C 185 ? ASP E 171 HIS E 180 AD2 4 TYR C 257 ? VAL C 262 ? TYR E 252 VAL E 257 AD2 5 HIS C 115 ? LEU C 120 ? HIS E 110 LEU E 115 AD3 1 GLY C 98 ? LEU C 100 ? GLY E 93 LEU E 95 AD3 2 ARG C 230 ? LEU C 238 ? ARG E 225 LEU E 233 AD3 3 ASP C 176 ? HIS C 185 ? ASP E 171 HIS E 180 AD3 4 PHE C 252 ? PRO C 255 ? PHE E 247 PRO E 250 AD3 5 VAL C 152 ? TRP C 154 ? VAL E 147 TRP E 149 AD4 1 SER C 137 ? TYR C 142 ? SER E 132 TYR E 137 AD4 2 THR C 145 ? SER C 147 ? THR E 140 SER E 142 AD5 1 ILE C 165 ? ASN C 170 ? ILE E 160 ASN E 165 AD5 2 ALA C 243 ? SER C 248 ? ALA E 238 SER E 243 AD5 3 ILE C 203 ? GLY C 206 ? ILE E 198 GLY E 201 AD5 4 ASN C 211 ? LEU C 214 ? ASN E 206 LEU E 209 AD6 1 GLY C 288 ? ILE C 290 ? GLY E 283 ILE E 285 AD6 2 CYS C 283 ? THR C 285 ? CYS E 278 THR E 280 AD6 3 ILE C 304 ? GLU C 306 ? ILE E 299 GLU E 301 AD6 4 PHE F 63 ? ALA F 65 ? PHE F 63 ALA F 65 # 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 AA1 1 2 O ALA D 35 ? O ALA B 35 N TYR D 24 ? N TYR B 24 AA1 2 3 O SER D 27 ? O SER B 27 N GLN A 7 ? N GLN A 2 AA1 3 4 N ILE A 8 ? N ILE A 3 O PHE D 138 ? O PHE B 138 AA1 4 5 O GLU D 139 ? O GLU B 139 N LYS D 131 ? N LYS B 131 AA2 1 2 N VAL A 21 ? N VAL A 16 O VAL A 29 ? O VAL A 24 AA3 1 2 N GLN A 35 ? N GLN A 30 O LEU A 318 ? O LEU A 313 AA4 1 2 N GLU A 39 ? N GLU A 34 O PHE A 296 ? O PHE A 291 AA4 2 3 N HIS A 297 ? N HIS A 292 O LYS A 309 ? O LYS A 304 AA5 1 2 N LEU A 46 ? N LEU A 41 O GLY A 277 ? O GLY A 272 AA6 1 2 N LEU A 55 ? N LEU A 50 O VAL A 85 ? O VAL A 80 AA6 2 3 N ILE A 84 ? N ILE A 79 O MET A 270 ? O MET A 265 AA7 1 2 N ASN A 99 ? N ASN A 94 O PHE A 233 ? O PHE A 228 AA7 2 3 O ARG A 230 ? O ARG A 225 N HIS A 185 ? N HIS A 180 AA7 3 4 N LEU A 178 ? N LEU A 173 O TYR A 259 ? O TYR A 254 AA7 4 5 O LYS A 260 ? O LYS A 255 N GLU A 117 ? N GLU A 112 AA8 1 2 N ASN A 99 ? N ASN A 94 O PHE A 233 ? O PHE A 228 AA8 2 3 O ARG A 230 ? O ARG A 225 N HIS A 185 ? N HIS A 180 AA8 3 4 N GLY A 182 ? N GLY A 177 O ILE A 253 ? O ILE A 248 AA8 4 5 O ALA A 254 ? O ALA A 249 N VAL A 153 ? N VAL A 148 AA9 1 2 N SER A 137 ? N SER A 132 O SER A 147 ? O SER A 142 AB1 1 2 N ILE A 165 ? N ILE A 160 O SER A 248 ? O SER A 243 AB1 2 3 O HIS A 245 ? O HIS A 240 N GLY A 206 ? N GLY A 201 AB1 3 4 N VAL A 205 ? N VAL A 200 O GLN A 212 ? O GLN A 207 AB2 1 2 O ILE A 290 ? O ILE A 285 N CYS A 283 ? N CYS A 278 AB2 2 3 N GLN A 284 ? N GLN A 279 O ILE A 304 ? O ILE A 299 AB2 3 4 N GLY A 305 ? N GLY A 300 O GLU D 64 ? O GLU B 64 AB3 1 2 O ALA E 35 ? O ALA D 35 N TYR E 24 ? N TYR D 24 AB3 2 3 O SER E 27 ? O SER D 27 N GLN B 7 ? N GLN C 2 AB3 3 4 N ILE B 8 ? N ILE C 3 O PHE E 138 ? O PHE D 138 AB3 4 5 O GLU E 139 ? O GLU D 139 N LYS E 131 ? N LYS D 131 AB4 1 2 N VAL B 21 ? N VAL C 16 O VAL B 29 ? O VAL C 24 AB5 1 2 N GLN B 35 ? N GLN C 30 O LEU B 318 ? O LEU C 313 AB6 1 2 N GLU B 39 ? N GLU C 34 O PHE B 296 ? O PHE C 291 AB6 2 3 N HIS B 297 ? N HIS C 292 O LYS B 309 ? O LYS C 304 AB7 1 2 N LEU B 46 ? N LEU C 41 O GLY B 277 ? O GLY C 272 AB8 1 2 N LEU B 55 ? N LEU C 50 O VAL B 85 ? O VAL C 80 AB8 2 3 N ILE B 84 ? N ILE C 79 O MET B 270 ? O MET C 265 AB9 1 2 N ASN B 99 ? N ASN C 94 O PHE B 233 ? O PHE C 228 AB9 2 3 O ARG B 230 ? O ARG C 225 N HIS B 185 ? N HIS C 180 AB9 3 4 N LEU B 178 ? N LEU C 173 O TYR B 259 ? O TYR C 254 AB9 4 5 O LYS B 260 ? O LYS C 255 N GLU B 117 ? N GLU C 112 AC1 1 2 N ASN B 99 ? N ASN C 94 O PHE B 233 ? O PHE C 228 AC1 2 3 O ARG B 230 ? O ARG C 225 N HIS B 185 ? N HIS C 180 AC1 3 4 N GLY B 182 ? N GLY C 177 O ILE B 253 ? O ILE C 248 AC1 4 5 O ALA B 254 ? O ALA C 249 N VAL B 153 ? N VAL C 148 AC2 1 2 N SER B 137 ? N SER C 132 O SER B 147 ? O SER C 142 AC3 1 2 N ILE B 165 ? N ILE C 160 O SER B 248 ? O SER C 243 AC3 2 3 O HIS B 245 ? O HIS C 240 N GLY B 206 ? N GLY C 201 AC3 3 4 N ILE B 203 ? N ILE C 198 O LEU B 214 ? O LEU C 209 AC4 1 2 O ILE B 290 ? O ILE C 285 N CYS B 283 ? N CYS C 278 AC4 2 3 N GLN B 284 ? N GLN C 279 O ILE B 304 ? O ILE C 299 AC4 3 4 N GLY B 305 ? N GLY C 300 O GLU E 64 ? O GLU D 64 AC5 1 2 O ALA F 35 ? O ALA F 35 N TYR F 24 ? N TYR F 24 AC5 2 3 O SER F 27 ? O SER F 27 N GLN C 7 ? N GLN E 2 AC5 3 4 N ILE C 8 ? N ILE E 3 O PHE F 138 ? O PHE F 138 AC5 4 5 O GLU F 139 ? O GLU F 139 N LYS F 131 ? N LYS F 131 AC6 1 2 N VAL C 21 ? N VAL E 16 O VAL C 29 ? O VAL E 24 AC7 1 2 N GLN C 35 ? N GLN E 30 O LEU C 318 ? O LEU E 313 AC8 1 2 N GLU C 39 ? N GLU E 34 O PHE C 296 ? O PHE E 291 AC8 2 3 N HIS C 297 ? N HIS E 292 O LYS C 309 ? O LYS E 304 AC9 1 2 N LEU C 46 ? N LEU E 41 O GLY C 277 ? O GLY E 272 AD1 1 2 N LEU C 55 ? N LEU E 50 O VAL C 85 ? O VAL E 80 AD1 2 3 N ILE C 84 ? N ILE E 79 O MET C 270 ? O MET E 265 AD2 1 2 N ASN C 99 ? N ASN E 94 O PHE C 233 ? O PHE E 228 AD2 2 3 O ARG C 230 ? O ARG E 225 N HIS C 185 ? N HIS E 180 AD2 3 4 N LEU C 178 ? N LEU E 173 O TYR C 259 ? O TYR E 254 AD2 4 5 O LYS C 260 ? O LYS E 255 N GLU C 117 ? N GLU E 112 AD3 1 2 N ASN C 99 ? N ASN E 94 O PHE C 233 ? O PHE E 228 AD3 2 3 O ARG C 230 ? O ARG E 225 N HIS C 185 ? N HIS E 180 AD3 3 4 N GLY C 182 ? N GLY E 177 O ILE C 253 ? O ILE E 248 AD3 4 5 O ALA C 254 ? O ALA E 249 N VAL C 153 ? N VAL E 148 AD4 1 2 N SER C 137 ? N SER E 132 O SER C 147 ? O SER E 142 AD5 1 2 N ILE C 165 ? N ILE E 160 O SER C 248 ? O SER E 243 AD5 2 3 O HIS C 245 ? O HIS E 240 N GLY C 206 ? N GLY E 201 AD5 3 4 N ILE C 203 ? N ILE E 198 O LEU C 214 ? O LEU E 209 AD6 1 2 O ILE C 290 ? O ILE E 285 N CYS C 283 ? N CYS E 278 AD6 2 3 N GLN C 284 ? N GLN E 279 O ILE C 304 ? O ILE E 299 AD6 3 4 N GLY C 305 ? N GLY E 300 O GLU F 64 ? O GLU F 64 # 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 A ASN 23 ? 2 'binding site for Poly-Saccharide residues NAG A 401 through FUC A 402 bound to ASN A 23' AC2 Software A ASN 165 ? 2 'binding site for Poly-Saccharide residues NAG A 403 through FUC A 405 bound to ASN A 165' AC3 Software A NAG 406 ? 1 'binding site for Mono-Saccharide NAG A 406 bound to ASN A 286' AC4 Software C ASN 23 ? 1 'binding site for Poly-Saccharide residues NAG C 401 through FUC C 402 bound to ASN C 23' AC5 Software C ASN 165 ? 3 'binding site for Poly-Saccharide residues NAG C 403 through FUC C 405 bound to ASN C 165' AC6 Software C NAG 406 ? 1 'binding site for Mono-Saccharide NAG C 406 bound to ASN C 286' AC7 Software E ASN 23 ? 2 'binding site for Poly-Saccharide residues NAG E 401 through FUC E 402 bound to ASN E 23' AC8 Software E ASN 165 ? 2 'binding site for Poly-Saccharide residues NAG E 403 through FUC E 405 bound to ASN E 165' AC9 Software E NAG 406 ? 1 'binding site for Mono-Saccharide NAG E 406 bound to ASN E 286' # 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 2 GLN A 20 ? GLN A 15 . ? 1_555 ? 2 AC1 2 ASN A 28 ? ASN A 23 . ? 1_555 ? 3 AC2 2 ASN A 170 ? ASN A 165 . ? 1_555 ? 4 AC2 2 ASN A 241 ? ASN A 236 . ? 1_555 ? 5 AC3 1 ASN A 291 ? ASN A 286 . ? 1_555 ? 6 AC4 1 ASN B 28 ? ASN C 23 . ? 1_555 ? 7 AC5 3 ASN B 170 ? ASN C 165 . ? 1_555 ? 8 AC5 3 ASN B 241 ? ASN C 236 . ? 1_555 ? 9 AC5 3 HOH Z . ? HOH C 515 . ? 1_555 ? 10 AC6 1 ASN B 291 ? ASN C 286 . ? 1_555 ? 11 AC7 2 GLN C 20 ? GLN E 15 . ? 1_555 ? 12 AC7 2 ASN C 28 ? ASN E 23 . ? 1_555 ? 13 AC8 2 ASN C 170 ? ASN E 165 . ? 1_555 ? 14 AC8 2 ASN C 241 ? ASN E 236 . ? 1_555 ? 15 AC9 1 ASN C 291 ? ASN E 286 . ? 1_555 ? # _atom_sites.entry_id 5HU8 _atom_sites.fract_transf_matrix[1][1] 0.011173 _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] 0.009577 _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] 0.004636 _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 . SER A 1 5 ? 27.545 31.947 20.189 1.00 65.69 ? 0 SER A N 1 ATOM 2 C CA . SER A 1 5 ? 26.575 33.050 20.472 1.00 73.04 ? 0 SER A CA 1 ATOM 3 C C . SER A 1 5 ? 25.336 33.012 19.557 1.00 74.05 ? 0 SER A C 1 ATOM 4 O O . SER A 1 5 ? 25.459 33.004 18.332 1.00 70.23 ? 0 SER A O 1 ATOM 5 C CB . SER A 1 5 ? 27.254 34.409 20.313 1.00 74.98 ? 0 SER A CB 1 ATOM 6 O OG . SER A 1 5 ? 26.397 35.452 20.736 1.00 76.08 ? 0 SER A OG 1 ATOM 7 N N . ASP A 1 6 ? 24.161 33.036 20.180 1.00 76.32 ? 1 ASP A N 1 ATOM 8 C CA . ASP A 1 6 ? 22.883 32.800 19.502 1.00 76.40 ? 1 ASP A CA 1 ATOM 9 C C . ASP A 1 6 ? 22.533 33.859 18.447 1.00 73.05 ? 1 ASP A C 1 ATOM 10 O O . ASP A 1 6 ? 22.789 35.056 18.650 1.00 72.07 ? 1 ASP A O 1 ATOM 11 C CB . ASP A 1 6 ? 21.758 32.706 20.550 1.00 78.66 ? 1 ASP A CB 1 ATOM 12 C CG . ASP A 1 6 ? 21.894 31.485 21.467 1.00 79.34 ? 1 ASP A CG 1 ATOM 13 O OD1 . ASP A 1 6 ? 22.754 30.612 21.188 1.00 88.44 ? 1 ASP A OD1 1 ATOM 14 O OD2 . ASP A 1 6 ? 21.142 31.394 22.466 1.00 73.20 ? 1 ASP A OD2 1 ATOM 15 N N . GLN A 1 7 ? 21.930 33.404 17.343 1.00 71.10 ? 2 GLN A N 1 ATOM 16 C CA . GLN A 1 7 ? 21.584 34.262 16.187 1.00 71.87 ? 2 GLN A CA 1 ATOM 17 C C . GLN A 1 7 ? 20.202 33.968 15.630 1.00 70.89 ? 2 GLN A C 1 ATOM 18 O O . GLN A 1 7 ? 19.834 32.795 15.433 1.00 69.47 ? 2 GLN A O 1 ATOM 19 C CB . GLN A 1 7 ? 22.581 34.060 15.012 1.00 73.66 ? 2 GLN A CB 1 ATOM 20 C CG . GLN A 1 7 ? 23.701 35.092 14.901 1.00 80.48 ? 2 GLN A CG 1 ATOM 21 C CD . GLN A 1 7 ? 24.633 34.862 13.711 1.00 89.25 ? 2 GLN A CD 1 ATOM 22 O OE1 . GLN A 1 7 ? 24.193 34.512 12.610 1.00 92.21 ? 2 GLN A OE1 1 ATOM 23 N NE2 . GLN A 1 7 ? 25.940 35.054 13.930 1.00 91.84 ? 2 GLN A NE2 1 ATOM 24 N N . ILE A 1 8 ? 19.468 35.021 15.281 1.00 67.49 ? 3 ILE A N 1 ATOM 25 C CA . ILE A 1 8 ? 18.285 34.863 14.408 1.00 64.64 ? 3 ILE A CA 1 ATOM 26 C C . ILE A 1 8 ? 18.434 35.690 13.126 1.00 65.89 ? 3 ILE A C 1 ATOM 27 O O . ILE A 1 8 ? 18.917 36.833 13.159 1.00 67.35 ? 3 ILE A O 1 ATOM 28 C CB . ILE A 1 8 ? 16.970 35.167 15.155 1.00 62.90 ? 3 ILE A CB 1 ATOM 29 C CG1 . ILE A 1 8 ? 15.787 34.600 14.363 1.00 65.19 ? 3 ILE A CG1 1 ATOM 30 C CG2 . ILE A 1 8 ? 16.805 36.660 15.430 1.00 60.81 ? 3 ILE A CG2 1 ATOM 31 C CD1 . ILE A 1 8 ? 14.468 34.566 15.134 1.00 66.64 ? 3 ILE A CD1 1 ATOM 32 N N . CYS A 1 9 ? 18.074 35.101 11.988 1.00 66.23 ? 4 CYS A N 1 ATOM 33 C CA . CYS A 1 9 ? 18.266 35.756 10.685 1.00 67.47 ? 4 CYS A CA 1 ATOM 34 C C . CYS A 1 9 ? 16.955 35.887 9.930 1.00 68.16 ? 4 CYS A C 1 ATOM 35 O O . CYS A 1 9 ? 16.081 35.009 10.002 1.00 62.73 ? 4 CYS A O 1 ATOM 36 C CB . CYS A 1 9 ? 19.255 34.971 9.808 1.00 71.90 ? 4 CYS A CB 1 ATOM 37 S SG . CYS A 1 9 ? 20.888 34.729 10.536 1.00 77.95 ? 4 CYS A SG 1 ATOM 38 N N . ILE A 1 10 ? 16.838 36.984 9.193 1.00 67.08 ? 5 ILE A N 1 ATOM 39 C CA . ILE A 1 10 ? 15.712 37.216 8.329 1.00 69.07 ? 5 ILE A CA 1 ATOM 40 C C . ILE A 1 10 ? 16.159 37.069 6.878 1.00 69.80 ? 5 ILE A C 1 ATOM 41 O O . ILE A 1 10 ? 17.155 37.633 6.461 1.00 66.65 ? 5 ILE A O 1 ATOM 42 C CB . ILE A 1 10 ? 15.086 38.601 8.557 1.00 69.43 ? 5 ILE A CB 1 ATOM 43 C CG1 . ILE A 1 10 ? 14.163 38.566 9.769 1.00 66.33 ? 5 ILE A CG1 1 ATOM 44 C CG2 . ILE A 1 10 ? 14.266 39.028 7.344 1.00 71.33 ? 5 ILE A CG2 1 ATOM 45 C CD1 . ILE A 1 10 ? 14.897 38.660 11.054 1.00 62.62 ? 5 ILE A CD1 1 ATOM 46 N N . GLY A 1 11 ? 15.382 36.329 6.111 1.00 76.87 ? 6 GLY A N 1 ATOM 47 C CA . GLY A 1 11 ? 15.748 35.979 4.741 1.00 81.50 ? 6 GLY A CA 1 ATOM 48 C C . GLY A 1 11 ? 14.534 35.546 3.944 1.00 80.05 ? 6 GLY A C 1 ATOM 49 O O . GLY A 1 11 ? 13.384 35.739 4.373 1.00 82.35 ? 6 GLY A O 1 ATOM 50 N N . TYR A 1 12 ? 14.784 34.934 2.791 1.00 78.65 ? 7 TYR A N 1 ATOM 51 C CA . TYR A 1 12 ? 13.699 34.574 1.907 1.00 72.03 ? 7 TYR A CA 1 ATOM 52 C C . TYR A 1 12 ? 13.936 33.289 1.110 1.00 68.72 ? 7 TYR A C 1 ATOM 53 O O . TYR A 1 12 ? 15.055 32.775 1.027 1.00 67.18 ? 7 TYR A O 1 ATOM 54 C CB . TYR A 1 12 ? 13.377 35.760 0.997 1.00 72.22 ? 7 TYR A CB 1 ATOM 55 C CG . TYR A 1 12 ? 14.526 36.216 0.167 1.00 75.84 ? 7 TYR A CG 1 ATOM 56 C CD1 . TYR A 1 12 ? 15.422 37.154 0.644 1.00 75.47 ? 7 TYR A CD1 1 ATOM 57 C CD2 . TYR A 1 12 ? 14.741 35.686 -1.107 1.00 80.21 ? 7 TYR A CD2 1 ATOM 58 C CE1 . TYR A 1 12 ? 16.504 37.552 -0.128 1.00 80.09 ? 7 TYR A CE1 1 ATOM 59 C CE2 . TYR A 1 12 ? 15.814 36.086 -1.881 1.00 78.39 ? 7 TYR A CE2 1 ATOM 60 C CZ . TYR A 1 12 ? 16.688 37.017 -1.392 1.00 80.02 ? 7 TYR A CZ 1 ATOM 61 O OH . TYR A 1 12 ? 17.760 37.399 -2.156 1.00 88.14 ? 7 TYR A OH 1 ATOM 62 N N . HIS A 1 13 ? 12.832 32.785 0.554 1.00 68.60 ? 8 HIS A N 1 ATOM 63 C CA . HIS A 1 13 ? 12.756 31.487 -0.108 1.00 68.62 ? 8 HIS A CA 1 ATOM 64 C C . HIS A 1 13 ? 13.667 31.386 -1.318 1.00 65.13 ? 8 HIS A C 1 ATOM 65 O O . HIS A 1 13 ? 14.002 32.378 -1.954 1.00 61.22 ? 8 HIS A O 1 ATOM 66 C CB . HIS A 1 13 ? 11.306 31.229 -0.515 1.00 73.05 ? 8 HIS A CB 1 ATOM 67 C CG . HIS A 1 13 ? 11.063 29.914 -1.202 1.00 82.57 ? 8 HIS A CG 1 ATOM 68 N ND1 . HIS A 1 13 ? 10.907 28.727 -0.516 1.00 83.32 ? 8 HIS A ND1 1 ATOM 69 C CD2 . HIS A 1 13 ? 10.875 29.617 -2.513 1.00 84.26 ? 8 HIS A CD2 1 ATOM 70 C CE1 . HIS A 1 13 ? 10.674 27.751 -1.375 1.00 84.56 ? 8 HIS A CE1 1 ATOM 71 N NE2 . HIS A 1 13 ? 10.642 28.265 -2.594 1.00 87.55 ? 8 HIS A NE2 1 ATOM 72 N N . ALA A 1 14 ? 14.072 30.160 -1.603 1.00 65.08 ? 9 ALA A N 1 ATOM 73 C CA . ALA A 1 14 ? 14.832 29.827 -2.807 1.00 66.01 ? 9 ALA A CA 1 ATOM 74 C C . ALA A 1 14 ? 14.554 28.369 -3.201 1.00 69.25 ? 9 ALA A C 1 ATOM 75 O O . ALA A 1 14 ? 14.129 27.570 -2.361 1.00 74.88 ? 9 ALA A O 1 ATOM 76 C CB . ALA A 1 14 ? 16.315 30.061 -2.607 1.00 63.56 ? 9 ALA A CB 1 ATOM 77 N N . ASN A 1 15 ? 14.762 28.035 -4.472 1.00 67.33 ? 10 ASN A N 1 ATOM 78 C CA . ASN A 1 15 ? 14.458 26.693 -4.973 1.00 68.93 ? 10 ASN A CA 1 ATOM 79 C C . ASN A 1 15 ? 15.280 26.388 -6.220 1.00 78.44 ? 10 ASN A C 1 ATOM 80 O O . ASN A 1 15 ? 16.202 27.140 -6.507 1.00 79.13 ? 10 ASN A O 1 ATOM 81 C CB . ASN A 1 15 ? 12.954 26.517 -5.192 1.00 65.10 ? 10 ASN A CB 1 ATOM 82 C CG . ASN A 1 15 ? 12.383 27.434 -6.268 1.00 60.94 ? 10 ASN A CG 1 ATOM 83 O OD1 . ASN A 1 15 ? 13.099 28.093 -7.006 1.00 56.08 ? 10 ASN A OD1 1 ATOM 84 N ND2 . ASN A 1 15 ? 11.072 27.471 -6.342 1.00 59.79 ? 10 ASN A ND2 1 ATOM 85 N N . ASN A 1 16 ? 14.997 25.295 -6.939 1.00 85.08 ? 11 ASN A N 1 ATOM 86 C CA . ASN A 1 16 ? 15.805 24.983 -8.128 1.00 94.88 ? 11 ASN A CA 1 ATOM 87 C C . ASN A 1 16 ? 15.054 25.254 -9.435 1.00 93.48 ? 11 ASN A C 1 ATOM 88 O O . ASN A 1 16 ? 15.337 24.647 -10.469 1.00 102.13 ? 11 ASN A O 1 ATOM 89 C CB . ASN A 1 16 ? 16.484 23.582 -8.076 1.00 103.31 ? 11 ASN A CB 1 ATOM 90 C CG . ASN A 1 16 ? 15.603 22.488 -7.486 1.00 105.63 ? 11 ASN A CG 1 ATOM 91 O OD1 . ASN A 1 16 ? 14.382 22.483 -7.663 1.00 101.99 ? 11 ASN A OD1 1 ATOM 92 N ND2 . ASN A 1 16 ? 16.237 21.531 -6.799 1.00 102.36 ? 11 ASN A ND2 1 ATOM 93 N N . SER A 1 17 ? 14.100 26.177 -9.380 1.00 85.19 ? 12 SER A N 1 ATOM 94 C CA . SER A 1 17 ? 13.517 26.759 -10.588 1.00 80.65 ? 12 SER A CA 1 ATOM 95 C C . SER A 1 17 ? 14.567 27.503 -11.423 1.00 74.25 ? 12 SER A C 1 ATOM 96 O O . SER A 1 17 ? 15.407 28.215 -10.892 1.00 71.25 ? 12 SER A O 1 ATOM 97 C CB . SER A 1 17 ? 12.389 27.731 -10.236 1.00 82.17 ? 12 SER A CB 1 ATOM 98 O OG . SER A 1 17 ? 12.259 28.753 -11.208 1.00 76.48 ? 12 SER A OG 1 ATOM 99 N N . THR A 1 18 ? 14.512 27.297 -12.737 1.00 76.32 ? 13 THR A N 1 ATOM 100 C CA . THR A 1 18 ? 15.356 28.025 -13.696 1.00 72.72 ? 13 THR A CA 1 ATOM 101 C C . THR A 1 18 ? 14.587 29.100 -14.458 1.00 67.02 ? 13 THR A C 1 ATOM 102 O O . THR A 1 18 ? 15.196 29.823 -15.230 1.00 64.75 ? 13 THR A O 1 ATOM 103 C CB . THR A 1 18 ? 15.980 27.079 -14.736 1.00 74.74 ? 13 THR A CB 1 ATOM 104 O OG1 . THR A 1 18 ? 15.038 26.051 -15.064 1.00 75.48 ? 13 THR A OG1 1 ATOM 105 C CG2 . THR A 1 18 ? 17.282 26.463 -14.197 1.00 75.62 ? 13 THR A CG2 1 ATOM 106 N N . GLU A 1 19 ? 13.269 29.189 -14.239 1.00 65.57 ? 14 GLU A N 1 ATOM 107 C CA . GLU A 1 19 ? 12.415 30.233 -14.816 1.00 69.09 ? 14 GLU A CA 1 ATOM 108 C C . GLU A 1 19 ? 13.074 31.604 -14.769 1.00 64.24 ? 14 GLU A C 1 ATOM 109 O O . GLU A 1 19 ? 13.672 31.983 -13.791 1.00 64.73 ? 14 GLU A O 1 ATOM 110 C CB . GLU A 1 19 ? 11.084 30.323 -14.082 1.00 79.36 ? 14 GLU A CB 1 ATOM 111 C CG . GLU A 1 19 ? 10.100 29.175 -14.321 1.00 90.74 ? 14 GLU A CG 1 ATOM 112 C CD . GLU A 1 19 ? 9.612 29.054 -15.777 1.00 102.87 ? 14 GLU A CD 1 ATOM 113 O OE1 . GLU A 1 19 ? 9.110 30.051 -16.360 1.00 98.98 ? 14 GLU A OE1 1 ATOM 114 O OE2 . GLU A 1 19 ? 9.707 27.935 -16.327 1.00 104.76 ? 14 GLU A OE2 1 ATOM 115 N N . GLN A 1 20 ? 13.030 32.290 -15.891 1.00 64.70 ? 15 GLN A N 1 ATOM 116 C CA . GLN A 1 20 ? 13.696 33.558 -16.072 1.00 63.46 ? 15 GLN A CA 1 ATOM 117 C C . GLN A 1 20 ? 12.663 34.576 -16.518 1.00 59.76 ? 15 GLN A C 1 ATOM 118 O O . GLN A 1 20 ? 11.671 34.237 -17.133 1.00 58.24 ? 15 GLN A O 1 ATOM 119 C CB . GLN A 1 20 ? 14.804 33.445 -17.137 1.00 68.14 ? 15 GLN A CB 1 ATOM 120 C CG . GLN A 1 20 ? 16.152 33.061 -16.580 1.00 76.45 ? 15 GLN A CG 1 ATOM 121 C CD . GLN A 1 20 ? 17.246 33.073 -17.630 1.00 76.53 ? 15 GLN A CD 1 ATOM 122 O OE1 . GLN A 1 20 ? 17.146 33.734 -18.658 1.00 75.59 ? 15 GLN A OE1 1 ATOM 123 N NE2 . GLN A 1 20 ? 18.329 32.396 -17.328 1.00 86.28 ? 15 GLN A NE2 1 ATOM 124 N N . VAL A 1 21 ? 12.978 35.835 -16.303 1.00 54.99 ? 16 VAL A N 1 ATOM 125 C CA . VAL A 1 21 ? 12.018 36.899 -16.424 1.00 47.76 ? 16 VAL A CA 1 ATOM 126 C C . VAL A 1 21 ? 12.836 38.145 -16.733 1.00 44.00 ? 16 VAL A C 1 ATOM 127 O O . VAL A 1 21 ? 13.970 38.248 -16.291 1.00 40.11 ? 16 VAL A O 1 ATOM 128 C CB . VAL A 1 21 ? 11.263 36.983 -15.072 1.00 50.56 ? 16 VAL A CB 1 ATOM 129 C CG1 . VAL A 1 21 ? 11.353 38.363 -14.455 1.00 52.34 ? 16 VAL A CG1 1 ATOM 130 C CG2 . VAL A 1 21 ? 9.842 36.456 -15.160 1.00 45.21 ? 16 VAL A CG2 1 ATOM 131 N N . ASP A 1 22 ? 12.289 39.072 -17.507 1.00 45.16 ? 17 ASP A N 1 ATOM 132 C CA . ASP A 1 22 ? 12.949 40.347 -17.718 1.00 46.38 ? 17 ASP A CA 1 ATOM 133 C C . ASP A 1 22 ? 12.215 41.412 -16.916 1.00 44.50 ? 17 ASP A C 1 ATOM 134 O O . ASP A 1 22 ? 11.067 41.261 -16.543 1.00 42.21 ? 17 ASP A O 1 ATOM 135 C CB . ASP A 1 22 ? 13.003 40.749 -19.198 1.00 51.00 ? 17 ASP A CB 1 ATOM 136 C CG . ASP A 1 22 ? 13.964 39.875 -20.032 1.00 61.62 ? 17 ASP A CG 1 ATOM 137 O OD1 . ASP A 1 22 ? 14.586 38.919 -19.477 1.00 65.39 ? 17 ASP A OD1 1 ATOM 138 O OD2 . ASP A 1 22 ? 14.055 40.133 -21.278 1.00 63.08 ? 17 ASP A OD2 1 ATOM 139 N N . THR A 1 23 ? 12.916 42.509 -16.716 1.00 45.84 ? 18 THR A N 1 ATOM 140 C CA . THR A 1 23 ? 12.489 43.633 -15.945 1.00 49.87 ? 18 THR A CA 1 ATOM 141 C C . THR A 1 23 ? 12.834 44.817 -16.835 1.00 48.24 ? 18 THR A C 1 ATOM 142 O O . THR A 1 23 ? 13.607 44.679 -17.759 1.00 49.25 ? 18 THR A O 1 ATOM 143 C CB . THR A 1 23 ? 13.295 43.613 -14.616 1.00 57.20 ? 18 THR A CB 1 ATOM 144 O OG1 . THR A 1 23 ? 12.602 42.818 -13.637 1.00 65.13 ? 18 THR A OG1 1 ATOM 145 C CG2 . THR A 1 23 ? 13.554 44.965 -14.048 1.00 58.72 ? 18 THR A CG2 1 ATOM 146 N N . ILE A 1 24 ? 12.317 46.001 -16.553 1.00 51.09 ? 19 ILE A N 1 ATOM 147 C CA . ILE A 1 24 ? 12.693 47.159 -17.361 1.00 52.12 ? 19 ILE A CA 1 ATOM 148 C C . ILE A 1 24 ? 14.178 47.552 -17.223 1.00 50.76 ? 19 ILE A C 1 ATOM 149 O O . ILE A 1 24 ? 14.781 48.094 -18.137 1.00 53.76 ? 19 ILE A O 1 ATOM 150 C CB . ILE A 1 24 ? 11.726 48.329 -17.121 1.00 54.52 ? 19 ILE A CB 1 ATOM 151 C CG1 . ILE A 1 24 ? 11.579 49.176 -18.375 1.00 62.49 ? 19 ILE A CG1 1 ATOM 152 C CG2 . ILE A 1 24 ? 12.190 49.182 -15.990 1.00 57.78 ? 19 ILE A CG2 1 ATOM 153 C CD1 . ILE A 1 24 ? 10.367 50.081 -18.348 1.00 68.25 ? 19 ILE A CD1 1 ATOM 154 N N . MET A 1 25 ? 14.769 47.267 -16.078 1.00 57.77 ? 20 MET A N 1 ATOM 155 C CA . MET A 1 25 ? 16.217 47.524 -15.845 1.00 61.59 ? 20 MET A CA 1 ATOM 156 C C . MET A 1 25 ? 17.142 46.314 -15.867 1.00 59.68 ? 20 MET A C 1 ATOM 157 O O . MET A 1 25 ? 18.336 46.493 -15.868 1.00 57.98 ? 20 MET A O 1 ATOM 158 C CB . MET A 1 25 ? 16.388 48.248 -14.526 1.00 61.17 ? 20 MET A CB 1 ATOM 159 C CG . MET A 1 25 ? 15.748 49.620 -14.579 1.00 63.59 ? 20 MET A CG 1 ATOM 160 S SD . MET A 1 25 ? 16.456 50.754 -13.428 1.00 65.40 ? 20 MET A SD 1 ATOM 161 C CE . MET A 1 25 ? 16.026 49.867 -11.937 1.00 68.52 ? 20 MET A CE 1 ATOM 162 N N . GLU A 1 26 ? 16.581 45.109 -15.885 1.00 59.78 ? 21 GLU A N 1 ATOM 163 C CA . GLU A 1 26 ? 17.382 43.899 -15.863 1.00 61.80 ? 21 GLU A CA 1 ATOM 164 C C . GLU A 1 26 ? 16.790 42.814 -16.743 1.00 57.78 ? 21 GLU A C 1 ATOM 165 O O . GLU A 1 26 ? 15.596 42.609 -16.755 1.00 52.15 ? 21 GLU A O 1 ATOM 166 C CB . GLU A 1 26 ? 17.462 43.316 -14.460 1.00 61.56 ? 21 GLU A CB 1 ATOM 167 C CG . GLU A 1 26 ? 18.131 44.188 -13.435 1.00 69.26 ? 21 GLU A CG 1 ATOM 168 C CD . GLU A 1 26 ? 18.209 43.473 -12.093 1.00 75.77 ? 21 GLU A CD 1 ATOM 169 O OE1 . GLU A 1 26 ? 19.033 42.522 -11.976 1.00 73.95 ? 21 GLU A OE1 1 ATOM 170 O OE2 . GLU A 1 26 ? 17.431 43.847 -11.177 1.00 72.96 ? 21 GLU A OE2 1 ATOM 171 N N . LYS A 1 27 ? 17.662 42.074 -17.398 1.00 55.17 ? 22 LYS A N 1 ATOM 172 C CA . LYS A 1 27 ? 17.277 40.929 -18.172 1.00 57.59 ? 22 LYS A CA 1 ATOM 173 C C . LYS A 1 27 ? 17.698 39.604 -17.531 1.00 56.81 ? 22 LYS A C 1 ATOM 174 O O . LYS A 1 27 ? 18.656 39.527 -16.766 1.00 53.59 ? 22 LYS A O 1 ATOM 175 C CB . LYS A 1 27 ? 17.900 41.040 -19.558 1.00 63.09 ? 22 LYS A CB 1 ATOM 176 C CG . LYS A 1 27 ? 17.542 42.308 -20.303 1.00 68.55 ? 22 LYS A CG 1 ATOM 177 C CD . LYS A 1 27 ? 17.880 42.149 -21.789 1.00 76.04 ? 22 LYS A CD 1 ATOM 178 C CE . LYS A 1 27 ? 18.041 43.495 -22.546 1.00 77.18 ? 22 LYS A CE 1 ATOM 179 N NZ . LYS A 1 27 ? 17.037 43.730 -23.629 1.00 75.04 ? 22 LYS A NZ 1 ATOM 180 N N . ASN A 1 28 ? 17.002 38.542 -17.910 1.00 56.40 ? 23 ASN A N 1 ATOM 181 C CA . ASN A 1 28 ? 17.430 37.187 -17.581 1.00 59.18 ? 23 ASN A CA 1 ATOM 182 C C . ASN A 1 28 ? 17.660 37.053 -16.072 1.00 58.62 ? 23 ASN A C 1 ATOM 183 O O . ASN A 1 28 ? 18.692 36.600 -15.606 1.00 61.07 ? 23 ASN A O 1 ATOM 184 C CB . ASN A 1 28 ? 18.659 36.767 -18.431 1.00 62.46 ? 23 ASN A CB 1 ATOM 185 C CG . ASN A 1 28 ? 18.289 36.439 -19.877 1.00 71.76 ? 23 ASN A CG 1 ATOM 186 O OD1 . ASN A 1 28 ? 17.176 36.736 -20.330 1.00 72.07 ? 23 ASN A OD1 1 ATOM 187 N ND2 . ASN A 1 28 ? 19.227 35.807 -20.610 1.00 87.10 ? 23 ASN A ND2 1 ATOM 188 N N . VAL A 1 29 ? 16.643 37.458 -15.329 1.00 57.03 ? 24 VAL A N 1 ATOM 189 C CA . VAL A 1 29 ? 16.615 37.331 -13.888 1.00 51.29 ? 24 VAL A CA 1 ATOM 190 C C . VAL A 1 29 ? 15.896 36.063 -13.505 1.00 51.74 ? 24 VAL A C 1 ATOM 191 O O . VAL A 1 29 ? 14.708 35.905 -13.744 1.00 61.01 ? 24 VAL A O 1 ATOM 192 C CB . VAL A 1 29 ? 15.892 38.520 -13.246 1.00 49.23 ? 24 VAL A CB 1 ATOM 193 C CG1 . VAL A 1 29 ? 15.750 38.316 -11.751 1.00 50.80 ? 24 VAL A CG1 1 ATOM 194 C CG2 . VAL A 1 29 ? 16.639 39.810 -13.532 1.00 49.78 ? 24 VAL A CG2 1 ATOM 195 N N . THR A 1 30 ? 16.612 35.161 -12.869 1.00 53.36 ? 25 THR A N 1 ATOM 196 C CA . THR A 1 30 ? 16.046 33.895 -12.465 1.00 50.30 ? 25 THR A CA 1 ATOM 197 C C . THR A 1 30 ? 15.158 34.130 -11.264 1.00 51.64 ? 25 THR A C 1 ATOM 198 O O . THR A 1 30 ? 15.517 34.857 -10.327 1.00 49.13 ? 25 THR A O 1 ATOM 199 C CB . THR A 1 30 ? 17.151 32.863 -12.109 1.00 47.66 ? 25 THR A CB 1 ATOM 200 O OG1 . THR A 1 30 ? 18.095 32.804 -13.193 1.00 51.20 ? 25 THR A OG1 1 ATOM 201 C CG2 . THR A 1 30 ? 16.545 31.461 -11.914 1.00 43.20 ? 25 THR A CG2 1 ATOM 202 N N . VAL A 1 31 ? 13.988 33.514 -11.301 1.00 51.82 ? 26 VAL A N 1 ATOM 203 C CA . VAL A 1 31 ? 13.032 33.645 -10.237 1.00 52.03 ? 26 VAL A CA 1 ATOM 204 C C . VAL A 1 31 ? 12.488 32.292 -9.786 1.00 53.85 ? 26 VAL A C 1 ATOM 205 O O . VAL A 1 31 ? 12.724 31.248 -10.376 1.00 56.16 ? 26 VAL A O 1 ATOM 206 C CB . VAL A 1 31 ? 11.866 34.590 -10.614 1.00 52.58 ? 26 VAL A CB 1 ATOM 207 C CG1 . VAL A 1 31 ? 12.388 35.970 -10.954 1.00 53.29 ? 26 VAL A CG1 1 ATOM 208 C CG2 . VAL A 1 31 ? 11.017 34.012 -11.745 1.00 53.70 ? 26 VAL A CG2 1 ATOM 209 N N . THR A 1 32 ? 11.737 32.368 -8.711 1.00 53.42 ? 27 THR A N 1 ATOM 210 C CA . THR A 1 32 ? 11.316 31.241 -7.928 1.00 55.60 ? 27 THR A CA 1 ATOM 211 C C . THR A 1 32 ? 10.083 30.604 -8.586 1.00 56.42 ? 27 THR A C 1 ATOM 212 O O . THR A 1 32 ? 9.971 29.380 -8.709 1.00 53.62 ? 27 THR A O 1 ATOM 213 C CB . THR A 1 32 ? 11.093 31.785 -6.477 1.00 55.73 ? 27 THR A CB 1 ATOM 214 O OG1 . THR A 1 32 ? 12.151 31.336 -5.630 1.00 61.54 ? 27 THR A OG1 1 ATOM 215 C CG2 . THR A 1 32 ? 9.779 31.422 -5.888 1.00 52.87 ? 27 THR A CG2 1 ATOM 216 N N . HIS A 1 33 ? 9.158 31.466 -8.989 1.00 60.40 ? 28 HIS A N 1 ATOM 217 C CA . HIS A 1 33 ? 7.914 31.088 -9.666 1.00 60.82 ? 28 HIS A CA 1 ATOM 218 C C . HIS A 1 33 ? 7.605 32.157 -10.717 1.00 57.68 ? 28 HIS A C 1 ATOM 219 O O . HIS A 1 33 ? 7.977 33.325 -10.565 1.00 52.93 ? 28 HIS A O 1 ATOM 220 C CB . HIS A 1 33 ? 6.728 30.991 -8.685 1.00 65.37 ? 28 HIS A CB 1 ATOM 221 C CG . HIS A 1 33 ? 6.982 30.130 -7.482 1.00 74.37 ? 28 HIS A CG 1 ATOM 222 N ND1 . HIS A 1 33 ? 6.993 30.628 -6.197 1.00 81.36 ? 28 HIS A ND1 1 ATOM 223 C CD2 . HIS A 1 33 ? 7.237 28.805 -7.364 1.00 81.27 ? 28 HIS A CD2 1 ATOM 224 C CE1 . HIS A 1 33 ? 7.242 29.653 -5.341 1.00 73.28 ? 28 HIS A CE1 1 ATOM 225 N NE2 . HIS A 1 33 ? 7.391 28.535 -6.024 1.00 77.47 ? 28 HIS A NE2 1 ATOM 226 N N . ALA A 1 34 ? 6.902 31.765 -11.773 1.00 56.72 ? 29 ALA A N 1 ATOM 227 C CA . ALA A 1 34 ? 6.551 32.702 -12.846 1.00 54.90 ? 29 ALA A CA 1 ATOM 228 C C . ALA A 1 34 ? 5.330 32.224 -13.550 1.00 59.13 ? 29 ALA A C 1 ATOM 229 O O . ALA A 1 34 ? 5.029 31.030 -13.534 1.00 60.77 ? 29 ALA A O 1 ATOM 230 C CB . ALA A 1 34 ? 7.685 32.840 -13.837 1.00 52.13 ? 29 ALA A CB 1 ATOM 231 N N . GLN A 1 35 ? 4.646 33.167 -14.183 1.00 61.22 ? 30 GLN A N 1 ATOM 232 C CA . GLN A 1 35 ? 3.457 32.863 -14.934 1.00 62.80 ? 30 GLN A CA 1 ATOM 233 C C . GLN A 1 35 ? 3.426 33.559 -16.300 1.00 58.36 ? 30 GLN A C 1 ATOM 234 O O . GLN A 1 35 ? 3.527 34.800 -16.386 1.00 47.69 ? 30 GLN A O 1 ATOM 235 C CB . GLN A 1 35 ? 2.236 33.242 -14.133 1.00 68.00 ? 30 GLN A CB 1 ATOM 236 C CG . GLN A 1 35 ? 1.232 32.131 -14.223 1.00 78.71 ? 30 GLN A CG 1 ATOM 237 C CD . GLN A 1 35 ? -0.145 32.608 -13.965 1.00 87.60 ? 30 GLN A CD 1 ATOM 238 O OE1 . GLN A 1 35 ? -0.455 33.074 -12.864 1.00 102.70 ? 30 GLN A OE1 1 ATOM 239 N NE2 . GLN A 1 35 ? -1.009 32.481 -14.972 1.00 102.18 ? 30 GLN A NE2 1 ATOM 240 N N . ASP A 1 36 ? 3.297 32.738 -17.359 1.00 54.59 ? 31 ASP A N 1 ATOM 241 C CA . ASP A 1 36 ? 3.212 33.224 -18.758 1.00 49.23 ? 31 ASP A CA 1 ATOM 242 C C . ASP A 1 36 ? 1.757 33.580 -19.094 1.00 45.26 ? 31 ASP A C 1 ATOM 243 O O . ASP A 1 36 ? 0.887 32.744 -18.928 1.00 47.76 ? 31 ASP A O 1 ATOM 244 C CB . ASP A 1 36 ? 3.714 32.165 -19.745 1.00 50.17 ? 31 ASP A CB 1 ATOM 245 C CG . ASP A 1 36 ? 4.152 32.761 -21.089 1.00 48.21 ? 31 ASP A CG 1 ATOM 246 O OD1 . ASP A 1 36 ? 3.585 33.787 -21.517 1.00 47.62 ? 31 ASP A OD1 1 ATOM 247 O OD2 . ASP A 1 36 ? 5.130 32.262 -21.656 1.00 50.24 ? 31 ASP A OD2 1 ATOM 248 N N . ILE A 1 37 ? 1.508 34.810 -19.523 1.00 37.73 ? 32 ILE A N 1 ATOM 249 C CA . ILE A 1 37 ? 0.155 35.251 -19.868 1.00 38.61 ? 32 ILE A CA 1 ATOM 250 C C . ILE A 1 37 ? -0.110 35.259 -21.386 1.00 40.95 ? 32 ILE A C 1 ATOM 251 O O . ILE A 1 37 ? -1.103 35.812 -21.836 1.00 41.96 ? 32 ILE A O 1 ATOM 252 C CB . ILE A 1 37 ? -0.208 36.618 -19.290 1.00 36.49 ? 32 ILE A CB 1 ATOM 253 C CG1 . ILE A 1 37 ? 0.748 37.709 -19.757 1.00 38.44 ? 32 ILE A CG1 1 ATOM 254 C CG2 . ILE A 1 37 ? -0.230 36.538 -17.766 1.00 38.76 ? 32 ILE A CG2 1 ATOM 255 C CD1 . ILE A 1 37 ? 0.369 39.117 -19.297 1.00 37.16 ? 32 ILE A CD1 1 ATOM 256 N N . LEU A 1 38 ? 0.773 34.632 -22.155 1.00 42.64 ? 33 LEU A N 1 ATOM 257 C CA . LEU A 1 38 ? 0.613 34.501 -23.605 1.00 44.18 ? 33 LEU A CA 1 ATOM 258 C C . LEU A 1 38 ? 0.112 33.117 -23.950 1.00 45.98 ? 33 LEU A C 1 ATOM 259 O O . LEU A 1 38 ? 0.762 32.114 -23.619 1.00 42.83 ? 33 LEU A O 1 ATOM 260 C CB . LEU A 1 38 ? 1.943 34.729 -24.318 1.00 43.51 ? 33 LEU A CB 1 ATOM 261 C CG . LEU A 1 38 ? 1.889 34.675 -25.836 1.00 44.77 ? 33 LEU A CG 1 ATOM 262 C CD1 . LEU A 1 38 ? 0.944 35.721 -26.414 1.00 47.19 ? 33 LEU A CD1 1 ATOM 263 C CD2 . LEU A 1 38 ? 3.280 34.885 -26.370 1.00 43.95 ? 33 LEU A CD2 1 ATOM 264 N N . GLU A 1 39 ? -1.070 33.058 -24.572 1.00 45.79 ? 34 GLU A N 1 ATOM 265 C CA . GLU A 1 39 ? -1.617 31.786 -25.072 1.00 47.16 ? 34 GLU A CA 1 ATOM 266 C C . GLU A 1 39 ? -0.908 31.374 -26.364 1.00 44.52 ? 34 GLU A C 1 ATOM 267 O O . GLU A 1 39 ? -0.865 32.143 -27.326 1.00 38.90 ? 34 GLU A O 1 ATOM 268 C CB . GLU A 1 39 ? -3.120 31.912 -25.315 1.00 47.84 ? 34 GLU A CB 1 ATOM 269 C CG . GLU A 1 39 ? -3.756 30.580 -25.667 1.00 52.50 ? 34 GLU A CG 1 ATOM 270 C CD . GLU A 1 39 ? -3.411 29.485 -24.660 1.00 55.63 ? 34 GLU A CD 1 ATOM 271 O OE1 . GLU A 1 39 ? -2.693 28.512 -25.032 1.00 57.02 ? 34 GLU A OE1 1 ATOM 272 O OE2 . GLU A 1 39 ? -3.831 29.611 -23.487 1.00 58.49 ? 34 GLU A OE2 1 ATOM 273 N N . LYS A 1 40 ? -0.289 30.200 -26.338 1.00 45.81 ? 35 LYS A N 1 ATOM 274 C CA . LYS A 1 40 ? 0.555 29.707 -27.445 1.00 51.97 ? 35 LYS A CA 1 ATOM 275 C C . LYS A 1 40 ? 0.020 28.445 -28.084 1.00 47.36 ? 35 LYS A C 1 ATOM 276 O O . LYS A 1 40 ? 0.532 28.013 -29.112 1.00 49.28 ? 35 LYS A O 1 ATOM 277 C CB . LYS A 1 40 ? 1.977 29.385 -26.944 1.00 58.66 ? 35 LYS A CB 1 ATOM 278 C CG . LYS A 1 40 ? 2.935 30.562 -26.836 1.00 62.45 ? 35 LYS A CG 1 ATOM 279 C CD . LYS A 1 40 ? 4.149 30.300 -25.909 1.00 67.07 ? 35 LYS A CD 1 ATOM 280 C CE . LYS A 1 40 ? 4.118 30.999 -24.529 1.00 70.58 ? 35 LYS A CE 1 ATOM 281 N NZ . LYS A 1 40 ? 3.593 30.163 -23.432 1.00 72.38 ? 35 LYS A NZ 1 ATOM 282 N N . THR A 1 41 ? -1.005 27.850 -27.491 1.00 43.89 ? 36 THR A N 1 ATOM 283 C CA . THR A 1 41 ? -1.450 26.559 -27.969 1.00 44.42 ? 36 THR A CA 1 ATOM 284 C C . THR A 1 41 ? -2.873 26.591 -28.474 1.00 42.36 ? 36 THR A C 1 ATOM 285 O O . THR A 1 41 ? -3.708 27.363 -28.019 1.00 41.51 ? 36 THR A O 1 ATOM 286 C CB . THR A 1 41 ? -1.380 25.471 -26.890 1.00 50.96 ? 36 THR A CB 1 ATOM 287 O OG1 . THR A 1 41 ? -2.562 25.475 -26.103 1.00 52.16 ? 36 THR A OG1 1 ATOM 288 C CG2 . THR A 1 41 ? -0.164 25.679 -25.990 1.00 55.01 ? 36 THR A CG2 1 ATOM 289 N N . HIS A 1 42 ? -3.136 25.668 -29.380 1.00 41.45 ? 37 HIS A N 1 ATOM 290 C CA . HIS A 1 42 ? -4.445 25.401 -29.916 1.00 41.30 ? 37 HIS A CA 1 ATOM 291 C C . HIS A 1 42 ? -4.618 23.901 -30.177 1.00 42.10 ? 37 HIS A C 1 ATOM 292 O O . HIS A 1 42 ? -3.635 23.146 -30.271 1.00 41.21 ? 37 HIS A O 1 ATOM 293 C CB . HIS A 1 42 ? -4.595 26.129 -31.246 1.00 40.17 ? 37 HIS A CB 1 ATOM 294 C CG . HIS A 1 42 ? -3.582 25.718 -32.253 1.00 39.33 ? 37 HIS A CG 1 ATOM 295 N ND1 . HIS A 1 42 ? -3.783 24.664 -33.119 1.00 40.62 ? 37 HIS A ND1 1 ATOM 296 C CD2 . HIS A 1 42 ? -2.345 26.198 -32.520 1.00 43.01 ? 37 HIS A CD2 1 ATOM 297 C CE1 . HIS A 1 42 ? -2.737 24.543 -33.910 1.00 43.80 ? 37 HIS A CE1 1 ATOM 298 N NE2 . HIS A 1 42 ? -1.833 25.447 -33.547 1.00 43.03 ? 37 HIS A NE2 1 ATOM 299 N N . ASN A 1 43 ? -5.877 23.505 -30.352 1.00 39.34 ? 38 ASN A N 1 ATOM 300 C CA . ASN A 1 43 ? -6.260 22.090 -30.395 1.00 40.24 ? 38 ASN A CA 1 ATOM 301 C C . ASN A 1 43 ? -6.186 21.444 -31.778 1.00 41.63 ? 38 ASN A C 1 ATOM 302 O O . ASN A 1 43 ? -6.642 20.330 -31.958 1.00 46.62 ? 38 ASN A O 1 ATOM 303 C CB . ASN A 1 43 ? -7.698 21.942 -29.855 1.00 41.83 ? 38 ASN A CB 1 ATOM 304 C CG . ASN A 1 43 ? -8.743 22.408 -30.833 1.00 36.46 ? 38 ASN A CG 1 ATOM 305 O OD1 . ASN A 1 43 ? -8.430 22.806 -31.947 1.00 35.06 ? 38 ASN A OD1 1 ATOM 306 N ND2 . ASN A 1 43 ? -9.998 22.295 -30.444 1.00 37.01 ? 38 ASN A ND2 1 ATOM 307 N N . GLY A 1 44 ? -5.683 22.173 -32.755 1.00 35.60 ? 39 GLY A N 1 ATOM 308 C CA . GLY A 1 44 ? -5.473 21.634 -34.049 1.00 38.00 ? 39 GLY A CA 1 ATOM 309 C C . GLY A 1 44 ? -6.687 21.304 -34.897 1.00 39.36 ? 39 GLY A C 1 ATOM 310 O O . GLY A 1 44 ? -6.539 20.762 -36.000 1.00 46.05 ? 39 GLY A O 1 ATOM 311 N N . LYS A 1 45 ? -7.865 21.701 -34.452 1.00 42.07 ? 40 LYS A N 1 ATOM 312 C CA . LYS A 1 45 ? -9.123 21.302 -35.107 1.00 44.40 ? 40 LYS A CA 1 ATOM 313 C C . LYS A 1 45 ? -10.141 22.433 -35.382 1.00 45.04 ? 40 LYS A C 1 ATOM 314 O O . LYS A 1 45 ? -9.996 23.537 -34.837 1.00 42.41 ? 40 LYS A O 1 ATOM 315 C CB . LYS A 1 45 ? -9.757 20.243 -34.245 1.00 52.69 ? 40 LYS A CB 1 ATOM 316 C CG . LYS A 1 45 ? -8.922 18.968 -34.240 1.00 60.18 ? 40 LYS A CG 1 ATOM 317 C CD . LYS A 1 45 ? -9.598 17.809 -33.505 1.00 71.87 ? 40 LYS A CD 1 ATOM 318 C CE . LYS A 1 45 ? -9.496 17.969 -32.001 1.00 76.32 ? 40 LYS A CE 1 ATOM 319 N NZ . LYS A 1 45 ? -10.107 16.812 -31.305 1.00 76.70 ? 40 LYS A NZ 1 ATOM 320 N N . LEU A 1 46 ? -11.103 22.186 -36.295 1.00 41.41 ? 41 LEU A N 1 ATOM 321 C CA . LEU A 1 46 ? -12.217 23.087 -36.558 1.00 38.67 ? 41 LEU A CA 1 ATOM 322 C C . LEU A 1 46 ? -13.402 22.648 -35.737 1.00 38.41 ? 41 LEU A C 1 ATOM 323 O O . LEU A 1 46 ? -13.910 21.545 -35.892 1.00 38.22 ? 41 LEU A O 1 ATOM 324 C CB . LEU A 1 46 ? -12.702 23.079 -38.012 1.00 42.04 ? 41 LEU A CB 1 ATOM 325 C CG . LEU A 1 46 ? -11.803 23.573 -39.140 1.00 51.19 ? 41 LEU A CG 1 ATOM 326 C CD1 . LEU A 1 46 ? -12.595 23.540 -40.444 1.00 52.74 ? 41 LEU A CD1 1 ATOM 327 C CD2 . LEU A 1 46 ? -11.274 24.984 -38.920 1.00 52.12 ? 41 LEU A CD2 1 ATOM 328 N N . CYS A 1 47 ? -13.943 23.595 -35.003 1.00 36.29 ? 42 CYS A N 1 ATOM 329 C CA . CYS A 1 47 ? -14.963 23.348 -34.047 1.00 37.84 ? 42 CYS A CA 1 ATOM 330 C C . CYS A 1 47 ? -16.210 24.181 -34.238 1.00 38.56 ? 42 CYS A C 1 ATOM 331 O O . CYS A 1 47 ? -16.214 25.182 -34.949 1.00 39.44 ? 42 CYS A O 1 ATOM 332 C CB . CYS A 1 47 ? -14.392 23.702 -32.665 1.00 40.81 ? 42 CYS A CB 1 ATOM 333 S SG . CYS A 1 47 ? -12.841 22.845 -32.254 1.00 41.60 ? 42 CYS A SG 1 ATOM 334 N N . ASP A 1 48 ? -17.261 23.753 -33.549 1.00 39.18 ? 43 ASP A N 1 ATOM 335 C CA . ASP A 1 48 ? -18.456 24.520 -33.396 1.00 40.33 ? 43 ASP A CA 1 ATOM 336 C C . ASP A 1 48 ? -18.054 25.779 -32.669 1.00 38.12 ? 43 ASP A C 1 ATOM 337 O O . ASP A 1 48 ? -17.079 25.816 -31.919 1.00 40.54 ? 43 ASP A O 1 ATOM 338 C CB . ASP A 1 48 ? -19.518 23.822 -32.526 1.00 43.15 ? 43 ASP A CB 1 ATOM 339 C CG . ASP A 1 48 ? -20.003 22.497 -33.076 1.00 47.32 ? 43 ASP A CG 1 ATOM 340 O OD1 . ASP A 1 48 ? -19.623 22.134 -34.209 1.00 52.85 ? 43 ASP A OD1 1 ATOM 341 O OD2 . ASP A 1 48 ? -20.766 21.793 -32.356 1.00 43.11 ? 43 ASP A OD2 1 ATOM 342 N N . LEU A 1 49 ? -18.860 26.793 -32.847 1.00 35.14 ? 44 LEU A N 1 ATOM 343 C CA . LEU A 1 49 ? -18.616 28.060 -32.235 1.00 39.86 ? 44 LEU A CA 1 ATOM 344 C C . LEU A 1 49 ? -19.815 28.304 -31.339 1.00 37.98 ? 44 LEU A C 1 ATOM 345 O O . LEU A 1 49 ? -20.901 28.531 -31.843 1.00 33.39 ? 44 LEU A O 1 ATOM 346 C CB . LEU A 1 49 ? -18.564 29.169 -33.294 1.00 39.84 ? 44 LEU A CB 1 ATOM 347 C CG . LEU A 1 49 ? -17.423 30.156 -33.378 1.00 43.42 ? 44 LEU A CG 1 ATOM 348 C CD1 . LEU A 1 49 ? -17.973 31.419 -34.042 1.00 42.43 ? 44 LEU A CD1 1 ATOM 349 C CD2 . LEU A 1 49 ? -16.743 30.487 -32.048 1.00 43.63 ? 44 LEU A CD2 1 ATOM 350 N N . ASN A 1 50 ? -19.617 28.244 -30.015 1.00 40.20 ? 45 ASN A N 1 ATOM 351 C CA . ASN A 1 50 ? -20.723 28.404 -29.048 1.00 40.34 ? 45 ASN A CA 1 ATOM 352 C C . ASN A 1 50 ? -21.895 27.476 -29.331 1.00 41.78 ? 45 ASN A C 1 ATOM 353 O O . ASN A 1 50 ? -23.050 27.875 -29.392 1.00 46.38 ? 45 ASN A O 1 ATOM 354 C CB . ASN A 1 50 ? -21.184 29.857 -28.981 1.00 41.15 ? 45 ASN A CB 1 ATOM 355 C CG . ASN A 1 50 ? -20.044 30.815 -28.642 1.00 43.92 ? 45 ASN A CG 1 ATOM 356 O OD1 . ASN A 1 50 ? -19.303 30.652 -27.659 1.00 53.49 ? 45 ASN A OD1 1 ATOM 357 N ND2 . ASN A 1 50 ? -19.873 31.781 -29.472 1.00 45.93 ? 45 ASN A ND2 1 ATOM 358 N N . GLY A 1 51 ? -21.567 26.227 -29.582 1.00 43.93 ? 46 GLY A N 1 ATOM 359 C CA . GLY A 1 51 ? -22.596 25.244 -29.806 1.00 47.62 ? 46 GLY A CA 1 ATOM 360 C C . GLY A 1 51 ? -23.122 25.091 -31.204 1.00 47.83 ? 46 GLY A C 1 ATOM 361 O O . GLY A 1 51 ? -23.813 24.133 -31.468 1.00 52.72 ? 46 GLY A O 1 ATOM 362 N N . VAL A 1 52 ? -22.785 25.981 -32.128 1.00 48.13 ? 47 VAL A N 1 ATOM 363 C CA . VAL A 1 52 ? -23.231 25.750 -33.504 1.00 42.22 ? 47 VAL A CA 1 ATOM 364 C C . VAL A 1 52 ? -22.119 25.444 -34.507 1.00 42.95 ? 47 VAL A C 1 ATOM 365 O O . VAL A 1 52 ? -21.101 26.129 -34.598 1.00 45.09 ? 47 VAL A O 1 ATOM 366 C CB . VAL A 1 52 ? -24.391 26.696 -33.982 1.00 42.83 ? 47 VAL A CB 1 ATOM 367 C CG1 . VAL A 1 52 ? -24.795 27.743 -32.945 1.00 40.12 ? 47 VAL A CG1 1 ATOM 368 C CG2 . VAL A 1 52 ? -24.175 27.262 -35.362 1.00 41.81 ? 47 VAL A CG2 1 ATOM 369 N N . LYS A 1 53 ? -22.388 24.431 -35.300 1.00 41.35 ? 48 LYS A N 1 ATOM 370 C CA . LYS A 1 53 ? -21.450 23.896 -36.242 1.00 44.40 ? 48 LYS A CA 1 ATOM 371 C C . LYS A 1 53 ? -21.209 24.857 -37.436 1.00 41.17 ? 48 LYS A C 1 ATOM 372 O O . LYS A 1 53 ? -22.114 25.583 -37.849 1.00 39.25 ? 48 LYS A O 1 ATOM 373 C CB . LYS A 1 53 ? -21.995 22.555 -36.742 1.00 48.84 ? 48 LYS A CB 1 ATOM 374 C CG . LYS A 1 53 ? -20.965 21.721 -37.468 1.00 55.78 ? 48 LYS A CG 1 ATOM 375 C CD . LYS A 1 53 ? -21.549 20.397 -37.977 1.00 63.30 ? 48 LYS A CD 1 ATOM 376 C CE . LYS A 1 53 ? -20.937 20.002 -39.337 1.00 68.01 ? 48 LYS A CE 1 ATOM 377 N NZ . LYS A 1 53 ? -20.462 18.600 -39.411 1.00 69.03 ? 48 LYS A NZ 1 ATOM 378 N N . PRO A 1 54 ? -19.976 24.915 -37.949 1.00 33.05 ? 49 PRO A N 1 ATOM 379 C CA . PRO A 1 54 ? -19.757 25.633 -39.166 1.00 33.68 ? 49 PRO A CA 1 ATOM 380 C C . PRO A 1 54 ? -20.318 24.906 -40.383 1.00 34.61 ? 49 PRO A C 1 ATOM 381 O O . PRO A 1 54 ? -20.639 23.721 -40.317 1.00 38.78 ? 49 PRO A O 1 ATOM 382 C CB . PRO A 1 54 ? -18.236 25.696 -39.277 1.00 32.45 ? 49 PRO A CB 1 ATOM 383 C CG . PRO A 1 54 ? -17.735 24.531 -38.526 1.00 33.19 ? 49 PRO A CG 1 ATOM 384 C CD . PRO A 1 54 ? -18.735 24.362 -37.409 1.00 35.55 ? 49 PRO A CD 1 ATOM 385 N N . LEU A 1 55 ? -20.413 25.642 -41.475 1.00 34.05 ? 50 LEU A N 1 ATOM 386 C CA . LEU A 1 55 ? -20.757 25.105 -42.763 1.00 33.61 ? 50 LEU A CA 1 ATOM 387 C C . LEU A 1 55 ? -19.448 24.868 -43.446 1.00 34.47 ? 50 LEU A C 1 ATOM 388 O O . LEU A 1 55 ? -18.725 25.811 -43.723 1.00 38.70 ? 50 LEU A O 1 ATOM 389 C CB . LEU A 1 55 ? -21.612 26.107 -43.561 1.00 32.82 ? 50 LEU A CB 1 ATOM 390 C CG . LEU A 1 55 ? -21.967 25.689 -44.999 1.00 33.18 ? 50 LEU A CG 1 ATOM 391 C CD1 . LEU A 1 55 ? -22.724 24.366 -44.991 1.00 35.74 ? 50 LEU A CD1 1 ATOM 392 C CD2 . LEU A 1 55 ? -22.812 26.743 -45.652 1.00 31.40 ? 50 LEU A CD2 1 ATOM 393 N N . ILE A 1 56 ? -19.117 23.609 -43.657 1.00 34.81 ? 51 ILE A N 1 ATOM 394 C CA . ILE A 1 56 ? -17.825 23.242 -44.173 1.00 35.64 ? 51 ILE A CA 1 ATOM 395 C C . ILE A 1 56 ? -18.033 22.818 -45.598 1.00 37.18 ? 51 ILE A C 1 ATOM 396 O O . ILE A 1 56 ? -18.610 21.751 -45.846 1.00 37.67 ? 51 ILE A O 1 ATOM 397 C CB . ILE A 1 56 ? -17.170 22.115 -43.356 1.00 36.32 ? 51 ILE A CB 1 ATOM 398 C CG1 . ILE A 1 56 ? -16.904 22.640 -41.964 1.00 42.35 ? 51 ILE A CG1 1 ATOM 399 C CG2 . ILE A 1 56 ? -15.826 21.718 -43.967 1.00 39.61 ? 51 ILE A CG2 1 ATOM 400 C CD1 . ILE A 1 56 ? -16.186 21.670 -41.051 1.00 47.59 ? 51 ILE A CD1 1 ATOM 401 N N . LEU A 1 57 ? -17.519 23.617 -46.537 1.00 35.32 ? 52 LEU A N 1 ATOM 402 C CA . LEU A 1 57 ? -17.883 23.446 -47.924 1.00 34.51 ? 52 LEU A CA 1 ATOM 403 C C . LEU A 1 57 ? -16.993 22.511 -48.714 1.00 37.96 ? 52 LEU A C 1 ATOM 404 O O . LEU A 1 57 ? -17.398 22.042 -49.771 1.00 45.80 ? 52 LEU A O 1 ATOM 405 C CB . LEU A 1 57 ? -18.007 24.781 -48.621 1.00 35.37 ? 52 LEU A CB 1 ATOM 406 C CG . LEU A 1 57 ? -19.261 25.527 -48.221 1.00 34.16 ? 52 LEU A CG 1 ATOM 407 C CD1 . LEU A 1 57 ? -19.284 26.850 -48.947 1.00 38.58 ? 52 LEU A CD1 1 ATOM 408 C CD2 . LEU A 1 57 ? -20.498 24.769 -48.534 1.00 33.73 ? 52 LEU A CD2 1 ATOM 409 N N . LYS A 1 58 ? -15.818 22.203 -48.218 1.00 39.59 ? 53 LYS A N 1 ATOM 410 C CA . LYS A 1 58 ? -14.992 21.158 -48.838 1.00 45.16 ? 53 LYS A CA 1 ATOM 411 C C . LYS A 1 58 ? -14.477 21.575 -50.228 1.00 45.82 ? 53 LYS A C 1 ATOM 412 O O . LYS A 1 58 ? -13.751 22.552 -50.335 1.00 50.19 ? 53 LYS A O 1 ATOM 413 C CB . LYS A 1 58 ? -15.744 19.829 -48.907 1.00 50.65 ? 53 LYS A CB 1 ATOM 414 C CG . LYS A 1 58 ? -16.365 19.379 -47.606 1.00 63.09 ? 53 LYS A CG 1 ATOM 415 C CD . LYS A 1 58 ? -16.220 17.867 -47.456 1.00 70.86 ? 53 LYS A CD 1 ATOM 416 C CE . LYS A 1 58 ? -17.152 17.237 -46.425 1.00 83.69 ? 53 LYS A CE 1 ATOM 417 N NZ . LYS A 1 58 ? -17.454 15.808 -46.765 1.00 92.19 ? 53 LYS A NZ 1 ATOM 418 N N . ASP A 1 59 ? -14.844 20.856 -51.292 1.00 45.35 ? 54 ASP A N 1 ATOM 419 C CA . ASP A 1 59 ? -14.348 21.185 -52.637 1.00 43.29 ? 54 ASP A CA 1 ATOM 420 C C . ASP A 1 59 ? -15.289 22.158 -53.398 1.00 40.51 ? 54 ASP A C 1 ATOM 421 O O . ASP A 1 59 ? -15.118 22.354 -54.596 1.00 39.43 ? 54 ASP A O 1 ATOM 422 C CB . ASP A 1 59 ? -14.121 19.903 -53.464 1.00 47.04 ? 54 ASP A CB 1 ATOM 423 C CG . ASP A 1 59 ? -15.356 18.972 -53.496 1.00 56.09 ? 54 ASP A CG 1 ATOM 424 O OD1 . ASP A 1 59 ? -16.379 19.245 -52.808 1.00 57.14 ? 54 ASP A OD1 1 ATOM 425 O OD2 . ASP A 1 59 ? -15.283 17.905 -54.155 1.00 63.27 ? 54 ASP A OD2 1 ATOM 426 N N . CYS A 1 60 ? -16.300 22.716 -52.719 1.00 38.52 ? 55 CYS A N 1 ATOM 427 C CA . CYS A 1 60 ? -17.200 23.704 -53.332 1.00 41.28 ? 55 CYS A CA 1 ATOM 428 C C . CYS A 1 60 ? -17.033 25.103 -52.781 1.00 38.85 ? 55 CYS A C 1 ATOM 429 O O . CYS A 1 60 ? -16.696 25.327 -51.619 1.00 41.82 ? 55 CYS A O 1 ATOM 430 C CB . CYS A 1 60 ? -18.655 23.337 -53.195 1.00 41.98 ? 55 CYS A CB 1 ATOM 431 S SG . CYS A 1 60 ? -18.942 21.786 -54.012 1.00 59.80 ? 55 CYS A SG 1 ATOM 432 N N . SER A 1 61 ? -17.195 26.036 -53.677 1.00 33.82 ? 56 SER A N 1 ATOM 433 C CA . SER A 1 61 ? -17.280 27.418 -53.292 1.00 35.13 ? 56 SER A CA 1 ATOM 434 C C . SER A 1 61 ? -18.699 27.697 -52.826 1.00 32.78 ? 56 SER A C 1 ATOM 435 O O . SER A 1 61 ? -19.607 26.934 -53.129 1.00 31.91 ? 56 SER A O 1 ATOM 436 C CB . SER A 1 61 ? -16.930 28.308 -54.498 1.00 33.11 ? 56 SER A CB 1 ATOM 437 O OG . SER A 1 61 ? -18.001 28.242 -55.403 1.00 32.06 ? 56 SER A OG 1 ATOM 438 N N . VAL A 1 62 ? -18.903 28.832 -52.141 1.00 32.53 ? 57 VAL A N 1 ATOM 439 C CA . VAL A 1 62 ? -20.267 29.251 -51.774 1.00 30.23 ? 57 VAL A CA 1 ATOM 440 C C . VAL A 1 62 ? -21.142 29.345 -53.043 1.00 31.03 ? 57 VAL A C 1 ATOM 441 O O . VAL A 1 62 ? -22.298 28.937 -53.052 1.00 30.82 ? 57 VAL A O 1 ATOM 442 C CB . VAL A 1 62 ? -20.262 30.587 -51.059 1.00 28.66 ? 57 VAL A CB 1 ATOM 443 C CG1 . VAL A 1 62 ? -21.677 31.123 -50.857 1.00 27.05 ? 57 VAL A CG1 1 ATOM 444 C CG2 . VAL A 1 62 ? -19.560 30.430 -49.703 1.00 28.21 ? 57 VAL A CG2 1 ATOM 445 N N . ALA A 1 63 ? -20.579 29.854 -54.121 1.00 31.32 ? 58 ALA A N 1 ATOM 446 C CA . ALA A 1 63 ? -21.386 29.962 -55.349 1.00 32.56 ? 58 ALA A CA 1 ATOM 447 C C . ALA A 1 63 ? -21.861 28.599 -55.905 1.00 31.53 ? 58 ALA A C 1 ATOM 448 O O . ALA A 1 63 ? -23.017 28.444 -56.313 1.00 27.23 ? 58 ALA A O 1 ATOM 449 C CB . ALA A 1 63 ? -20.631 30.719 -56.390 1.00 32.25 ? 58 ALA A CB 1 ATOM 450 N N . GLY A 1 64 ? -20.963 27.625 -55.897 1.00 29.28 ? 59 GLY A N 1 ATOM 451 C CA . GLY A 1 64 ? -21.250 26.331 -56.483 1.00 28.55 ? 59 GLY A CA 1 ATOM 452 C C . GLY A 1 64 ? -22.282 25.643 -55.643 1.00 28.78 ? 59 GLY A C 1 ATOM 453 O O . GLY A 1 64 ? -23.167 24.995 -56.152 1.00 28.29 ? 59 GLY A O 1 ATOM 454 N N . TRP A 1 65 ? -22.112 25.756 -54.326 1.00 30.96 ? 60 TRP A N 1 ATOM 455 C CA . TRP A 1 65 ? -23.041 25.198 -53.353 1.00 29.89 ? 60 TRP A CA 1 ATOM 456 C C . TRP A 1 65 ? -24.423 25.812 -53.507 1.00 32.07 ? 60 TRP A C 1 ATOM 457 O O . TRP A 1 65 ? -25.407 25.104 -53.702 1.00 34.07 ? 60 TRP A O 1 ATOM 458 C CB . TRP A 1 65 ? -22.469 25.403 -51.962 1.00 30.06 ? 60 TRP A CB 1 ATOM 459 C CG . TRP A 1 65 ? -23.427 25.166 -50.906 1.00 33.13 ? 60 TRP A CG 1 ATOM 460 C CD1 . TRP A 1 65 ? -23.958 23.960 -50.535 1.00 34.39 ? 60 TRP A CD1 1 ATOM 461 C CD2 . TRP A 1 65 ? -23.974 26.131 -50.043 1.00 32.41 ? 60 TRP A CD2 1 ATOM 462 N NE1 . TRP A 1 65 ? -24.800 24.126 -49.485 1.00 36.78 ? 60 TRP A NE1 1 ATOM 463 C CE2 . TRP A 1 65 ? -24.827 25.461 -49.164 1.00 35.91 ? 60 TRP A CE2 1 ATOM 464 C CE3 . TRP A 1 65 ? -23.800 27.499 -49.903 1.00 35.65 ? 60 TRP A CE3 1 ATOM 465 C CZ2 . TRP A 1 65 ? -25.537 26.123 -48.175 1.00 37.31 ? 60 TRP A CZ2 1 ATOM 466 C CZ3 . TRP A 1 65 ? -24.493 28.169 -48.883 1.00 36.80 ? 60 TRP A CZ3 1 ATOM 467 C CH2 . TRP A 1 65 ? -25.355 27.488 -48.056 1.00 36.09 ? 60 TRP A CH2 1 ATOM 468 N N . LEU A 1 66 ? -24.479 27.133 -53.569 1.00 32.47 ? 61 LEU A N 1 ATOM 469 C CA . LEU A 1 66 ? -25.744 27.814 -53.685 1.00 32.24 ? 61 LEU A CA 1 ATOM 470 C C . LEU A 1 66 ? -26.471 27.484 -54.972 1.00 33.29 ? 61 LEU A C 1 ATOM 471 O O . LEU A 1 66 ? -27.687 27.244 -54.961 1.00 37.17 ? 61 LEU A O 1 ATOM 472 C CB . LEU A 1 66 ? -25.569 29.324 -53.663 1.00 32.99 ? 61 LEU A CB 1 ATOM 473 C CG . LEU A 1 66 ? -25.618 30.127 -52.410 1.00 34.18 ? 61 LEU A CG 1 ATOM 474 C CD1 . LEU A 1 66 ? -25.611 31.593 -52.822 1.00 34.16 ? 61 LEU A CD1 1 ATOM 475 C CD2 . LEU A 1 66 ? -26.837 29.832 -51.585 1.00 35.27 ? 61 LEU A CD2 1 ATOM 476 N N . LEU A 1 67 ? -25.774 27.619 -56.092 1.00 31.33 ? 62 LEU A N 1 ATOM 477 C CA . LEU A 1 67 ? -26.404 27.393 -57.412 1.00 30.44 ? 62 LEU A CA 1 ATOM 478 C C . LEU A 1 67 ? -26.639 25.919 -57.693 1.00 31.53 ? 62 LEU A C 1 ATOM 479 O O . LEU A 1 67 ? -27.431 25.577 -58.582 1.00 30.65 ? 62 LEU A O 1 ATOM 480 C CB . LEU A 1 67 ? -25.567 27.991 -58.512 1.00 30.28 ? 62 LEU A CB 1 ATOM 481 C CG . LEU A 1 67 ? -25.579 29.510 -58.520 1.00 31.53 ? 62 LEU A CG 1 ATOM 482 C CD1 . LEU A 1 67 ? -24.427 30.061 -59.353 1.00 34.30 ? 62 LEU A CD1 1 ATOM 483 C CD2 . LEU A 1 67 ? -26.907 30.032 -59.038 1.00 33.39 ? 62 LEU A CD2 1 ATOM 484 N N . GLY A 1 68 ? -25.953 25.049 -56.945 1.00 31.76 ? 63 GLY A N 1 ATOM 485 C CA . GLY A 1 68 ? -26.044 23.599 -57.142 1.00 32.34 ? 63 GLY A CA 1 ATOM 486 C C . GLY A 1 68 ? -25.244 23.021 -58.277 1.00 31.74 ? 63 GLY A C 1 ATOM 487 O O . GLY A 1 68 ? -25.729 22.189 -59.041 1.00 34.55 ? 63 GLY A O 1 ATOM 488 N N . ASN A 1 69 ? -24.032 23.504 -58.425 1.00 33.60 ? 64 ASN A N 1 ATOM 489 C CA . ASN A 1 69 ? -23.035 22.868 -59.288 1.00 33.49 ? 64 ASN A CA 1 ATOM 490 C C . ASN A 1 69 ? -23.156 21.358 -59.093 1.00 33.06 ? 64 ASN A C 1 ATOM 491 O O . ASN A 1 69 ? -23.074 20.862 -57.946 1.00 28.21 ? 64 ASN A O 1 ATOM 492 C CB . ASN A 1 69 ? -21.627 23.357 -58.894 1.00 33.47 ? 64 ASN A CB 1 ATOM 493 C CG . ASN A 1 69 ? -20.522 22.754 -59.765 1.00 33.51 ? 64 ASN A CG 1 ATOM 494 O OD1 . ASN A 1 69 ? -20.608 21.626 -60.166 1.00 29.44 ? 64 ASN A OD1 1 ATOM 495 N ND2 . ASN A 1 69 ? -19.463 23.533 -60.027 1.00 33.66 ? 64 ASN A ND2 1 ATOM 496 N N . PRO A 1 70 ? -23.323 20.607 -60.199 1.00 35.85 ? 65 PRO A N 1 ATOM 497 C CA . PRO A 1 70 ? -23.633 19.188 -59.966 1.00 38.39 ? 65 PRO A CA 1 ATOM 498 C C . PRO A 1 70 ? -22.486 18.406 -59.323 1.00 41.56 ? 65 PRO A C 1 ATOM 499 O O . PRO A 1 70 ? -22.741 17.347 -58.786 1.00 46.16 ? 65 PRO A O 1 ATOM 500 C CB . PRO A 1 70 ? -24.021 18.645 -61.339 1.00 35.08 ? 65 PRO A CB 1 ATOM 501 C CG . PRO A 1 70 ? -23.602 19.653 -62.316 1.00 36.57 ? 65 PRO A CG 1 ATOM 502 C CD . PRO A 1 70 ? -23.449 20.978 -61.614 1.00 35.81 ? 65 PRO A CD 1 ATOM 503 N N . MET A 1 71 ? -21.267 18.928 -59.313 1.00 43.64 ? 66 MET A N 1 ATOM 504 C CA . MET A 1 71 ? -20.203 18.335 -58.472 1.00 53.06 ? 66 MET A CA 1 ATOM 505 C C . MET A 1 71 ? -20.299 18.642 -56.971 1.00 50.01 ? 66 MET A C 1 ATOM 506 O O . MET A 1 71 ? -19.519 18.200 -56.199 1.00 50.65 ? 66 MET A O 1 ATOM 507 C CB . MET A 1 71 ? -18.800 18.683 -58.960 1.00 56.55 ? 66 MET A CB 1 ATOM 508 C CG . MET A 1 71 ? -18.048 17.470 -59.469 1.00 65.20 ? 66 MET A CG 1 ATOM 509 S SD . MET A 1 71 ? -18.618 17.093 -61.116 1.00 73.96 ? 66 MET A SD 1 ATOM 510 C CE . MET A 1 71 ? -17.331 17.876 -62.118 1.00 73.66 ? 66 MET A CE 1 ATOM 511 N N . CYS A 1 72 ? -21.298 19.372 -56.560 1.00 55.51 ? 67 CYS A N 1 ATOM 512 C CA . CYS A 1 72 ? -21.477 19.647 -55.153 1.00 55.25 ? 67 CYS A CA 1 ATOM 513 C C . CYS A 1 72 ? -22.726 18.822 -54.739 1.00 73.65 ? 67 CYS A C 1 ATOM 514 O O . CYS A 1 72 ? -23.335 19.101 -53.713 1.00 61.67 ? 67 CYS A O 1 ATOM 515 C CB . CYS A 1 72 ? -21.671 21.166 -54.947 1.00 50.30 ? 67 CYS A CB 1 ATOM 516 S SG . CYS A 1 72 ? -20.284 22.224 -55.518 1.00 42.59 ? 67 CYS A SG 1 ATOM 517 N N . ASP A 1 73 ? -23.073 17.793 -55.534 1.00 102.19 ? 68 ASP A N 1 ATOM 518 C CA . ASP A 1 73 ? -24.441 17.175 -55.581 1.00 130.09 ? 68 ASP A CA 1 ATOM 519 C C . ASP A 1 73 ? -24.896 16.607 -54.250 1.00 128.93 ? 68 ASP A C 1 ATOM 520 O O . ASP A 1 73 ? -25.702 15.687 -54.187 1.00 121.32 ? 68 ASP A O 1 ATOM 521 C CB . ASP A 1 73 ? -24.534 16.037 -56.639 1.00 142.40 ? 68 ASP A CB 1 ATOM 522 C CG . ASP A 1 73 ? -25.776 16.167 -57.547 1.00 145.38 ? 68 ASP A CG 1 ATOM 523 O OD1 . ASP A 1 73 ? -25.724 16.919 -58.541 1.00 126.82 ? 68 ASP A OD1 1 ATOM 524 O OD2 . ASP A 1 73 ? -26.803 15.505 -57.272 1.00 152.07 ? 68 ASP A OD2 1 ATOM 525 N N . GLU A 1 74 ? -24.407 17.196 -53.184 1.00 126.80 ? 69 GLU A N 1 ATOM 526 C CA . GLU A 1 74 ? -24.484 16.586 -51.905 1.00 125.25 ? 69 GLU A CA 1 ATOM 527 C C . GLU A 1 74 ? -25.500 17.327 -51.056 1.00 117.79 ? 69 GLU A C 1 ATOM 528 O O . GLU A 1 74 ? -25.331 17.330 -49.838 1.00 127.60 ? 69 GLU A O 1 ATOM 529 C CB . GLU A 1 74 ? -23.062 16.578 -51.302 1.00 119.84 ? 69 GLU A CB 1 ATOM 530 C CG . GLU A 1 74 ? -22.002 16.497 -52.399 1.00 114.20 ? 69 GLU A CG 1 ATOM 531 C CD . GLU A 1 74 ? -20.573 16.442 -51.925 1.00 118.82 ? 69 GLU A CD 1 ATOM 532 O OE1 . GLU A 1 74 ? -20.293 16.333 -50.707 1.00 113.99 ? 69 GLU A OE1 1 ATOM 533 O OE2 . GLU A 1 74 ? -19.717 16.510 -52.828 1.00 121.10 ? 69 GLU A OE2 1 ATOM 534 N N . PHE A 1 75 ? -26.567 17.916 -51.646 1.00 95.39 ? 70 PHE A N 1 ATOM 535 C CA . PHE A 1 75 ? -27.382 18.831 -50.836 1.00 91.30 ? 70 PHE A CA 1 ATOM 536 C C . PHE A 1 75 ? -28.045 18.222 -49.614 1.00 94.67 ? 70 PHE A C 1 ATOM 537 O O . PHE A 1 75 ? -29.202 17.800 -49.657 1.00 104.99 ? 70 PHE A O 1 ATOM 538 C CB . PHE A 1 75 ? -28.426 19.689 -51.535 1.00 83.79 ? 70 PHE A CB 1 ATOM 539 C CG . PHE A 1 75 ? -28.964 20.754 -50.579 1.00 81.93 ? 70 PHE A CG 1 ATOM 540 C CD1 . PHE A 1 75 ? -28.167 21.875 -50.275 1.00 78.85 ? 70 PHE A CD1 1 ATOM 541 C CD2 . PHE A 1 75 ? -30.160 20.574 -49.858 1.00 74.81 ? 70 PHE A CD2 1 ATOM 542 C CE1 . PHE A 1 75 ? -28.582 22.824 -49.350 1.00 67.81 ? 70 PHE A CE1 1 ATOM 543 C CE2 . PHE A 1 75 ? -30.585 21.529 -48.936 1.00 68.73 ? 70 PHE A CE2 1 ATOM 544 C CZ . PHE A 1 75 ? -29.794 22.649 -48.682 1.00 69.17 ? 70 PHE A CZ 1 ATOM 545 N N . ILE A 1 76 ? -27.259 18.198 -48.535 1.00 94.59 ? 71 ILE A N 1 ATOM 546 C CA . ILE A 1 76 ? -27.712 17.915 -47.182 1.00 89.69 ? 71 ILE A CA 1 ATOM 547 C C . ILE A 1 76 ? -28.213 19.225 -46.562 1.00 89.19 ? 71 ILE A C 1 ATOM 548 O O . ILE A 1 76 ? -27.685 20.305 -46.824 1.00 88.09 ? 71 ILE A O 1 ATOM 549 C CB . ILE A 1 76 ? -26.570 17.262 -46.327 1.00 85.50 ? 71 ILE A CB 1 ATOM 550 C CG1 . ILE A 1 76 ? -26.229 15.845 -46.852 1.00 87.80 ? 71 ILE A CG1 1 ATOM 551 C CG2 . ILE A 1 76 ? -26.909 17.200 -44.837 1.00 80.36 ? 71 ILE A CG2 1 ATOM 552 C CD1 . ILE A 1 76 ? -27.337 14.802 -46.705 1.00 84.70 ? 71 ILE A CD1 1 ATOM 553 N N . ARG A 1 77 ? -29.250 19.117 -45.748 1.00 85.33 ? 72 ARG A N 1 ATOM 554 C CA . ARG A 1 77 ? -29.637 20.210 -44.869 1.00 82.17 ? 72 ARG A CA 1 ATOM 555 C C . ARG A 1 77 ? -28.652 20.338 -43.689 1.00 78.19 ? 72 ARG A C 1 ATOM 556 O O . ARG A 1 77 ? -28.499 19.404 -42.882 1.00 69.56 ? 72 ARG A O 1 ATOM 557 C CB . ARG A 1 77 ? -31.049 19.973 -44.327 1.00 89.50 ? 72 ARG A CB 1 ATOM 558 C CG . ARG A 1 77 ? -32.147 19.685 -45.340 1.00 99.72 ? 72 ARG A CG 1 ATOM 559 C CD . ARG A 1 77 ? -33.277 18.883 -44.659 1.00 111.05 ? 72 ARG A CD 1 ATOM 560 N NE . ARG A 1 77 ? -34.622 19.392 -44.967 1.00 118.06 ? 72 ARG A NE 1 ATOM 561 C CZ . ARG A 1 77 ? -35.288 20.292 -44.234 1.00 132.58 ? 72 ARG A CZ 1 ATOM 562 N NH1 . ARG A 1 77 ? -34.764 20.808 -43.118 1.00 133.31 ? 72 ARG A NH1 1 ATOM 563 N NH2 . ARG A 1 77 ? -36.496 20.695 -44.625 1.00 136.33 ? 72 ARG A NH2 1 ATOM 564 N N . VAL A 1 78 ? -27.942 21.468 -43.642 1.00 70.89 ? 73 VAL A N 1 ATOM 565 C CA . VAL A 1 78 ? -27.507 22.088 -42.390 1.00 66.74 ? 73 VAL A CA 1 ATOM 566 C C . VAL A 1 78 ? -28.476 23.278 -42.320 1.00 57.09 ? 73 VAL A C 1 ATOM 567 O O . VAL A 1 78 ? -28.399 24.136 -43.163 1.00 60.63 ? 73 VAL A O 1 ATOM 568 C CB . VAL A 1 78 ? -26.038 22.591 -42.447 1.00 55.67 ? 73 VAL A CB 1 ATOM 569 N N . PRO A 1 79 ? -29.424 23.299 -41.368 1.00 45.22 ? 74 PRO A N 1 ATOM 570 C CA . PRO A 1 79 ? -30.386 24.391 -41.330 1.00 40.97 ? 74 PRO A CA 1 ATOM 571 C C . PRO A 1 79 ? -29.922 25.647 -40.617 1.00 41.76 ? 74 PRO A C 1 ATOM 572 O O . PRO A 1 79 ? -30.583 26.674 -40.720 1.00 38.64 ? 74 PRO A O 1 ATOM 573 C CB . PRO A 1 79 ? -31.556 23.786 -40.566 1.00 46.27 ? 74 PRO A CB 1 ATOM 574 C CG . PRO A 1 79 ? -30.928 22.777 -39.670 1.00 45.39 ? 74 PRO A CG 1 ATOM 575 C CD . PRO A 1 79 ? -29.760 22.225 -40.428 1.00 44.63 ? 74 PRO A CD 1 ATOM 576 N N . GLU A 1 80 ? -28.799 25.566 -39.897 1.00 41.91 ? 75 GLU A N 1 ATOM 577 C CA . GLU A 1 80 ? -28.152 26.737 -39.341 1.00 42.13 ? 75 GLU A CA 1 ATOM 578 C C . GLU A 1 80 ? -26.648 26.508 -39.217 1.00 37.26 ? 75 GLU A C 1 ATOM 579 O O . GLU A 1 80 ? -26.194 25.387 -39.169 1.00 35.07 ? 75 GLU A O 1 ATOM 580 C CB . GLU A 1 80 ? -28.750 27.112 -37.977 1.00 48.44 ? 75 GLU A CB 1 ATOM 581 C CG . GLU A 1 80 ? -28.389 26.200 -36.801 1.00 54.22 ? 75 GLU A CG 1 ATOM 582 C CD . GLU A 1 80 ? -28.628 26.843 -35.394 1.00 68.41 ? 75 GLU A CD 1 ATOM 583 O OE1 . GLU A 1 80 ? -28.801 26.020 -34.437 1.00 60.40 ? 75 GLU A OE1 1 ATOM 584 O OE2 . GLU A 1 80 ? -28.650 28.133 -35.245 1.00 67.32 ? 75 GLU A OE2 1 ATOM 585 N N . TRP A 1 81 ? -25.889 27.597 -39.147 1.00 32.90 ? 76 TRP A N 1 ATOM 586 C CA . TRP A 1 81 ? -24.431 27.523 -38.986 1.00 32.11 ? 76 TRP A CA 1 ATOM 587 C C . TRP A 1 81 ? -23.864 28.852 -38.450 1.00 32.67 ? 76 TRP A C 1 ATOM 588 O O . TRP A 1 81 ? -24.530 29.884 -38.532 1.00 33.69 ? 76 TRP A O 1 ATOM 589 C CB . TRP A 1 81 ? -23.722 27.148 -40.290 1.00 29.81 ? 76 TRP A CB 1 ATOM 590 C CG . TRP A 1 81 ? -23.928 28.096 -41.423 1.00 29.35 ? 76 TRP A CG 1 ATOM 591 C CD1 . TRP A 1 81 ? -23.178 29.211 -41.705 1.00 30.66 ? 76 TRP A CD1 1 ATOM 592 C CD2 . TRP A 1 81 ? -24.916 28.013 -42.441 1.00 28.01 ? 76 TRP A CD2 1 ATOM 593 N NE1 . TRP A 1 81 ? -23.652 29.825 -42.845 1.00 30.68 ? 76 TRP A NE1 1 ATOM 594 C CE2 . TRP A 1 81 ? -24.708 29.098 -43.322 1.00 28.15 ? 76 TRP A CE2 1 ATOM 595 C CE3 . TRP A 1 81 ? -25.953 27.119 -42.709 1.00 29.01 ? 76 TRP A CE3 1 ATOM 596 C CZ2 . TRP A 1 81 ? -25.486 29.300 -44.449 1.00 28.69 ? 76 TRP A CZ2 1 ATOM 597 C CZ3 . TRP A 1 81 ? -26.769 27.345 -43.817 1.00 29.88 ? 76 TRP A CZ3 1 ATOM 598 C CH2 . TRP A 1 81 ? -26.538 28.427 -44.670 1.00 29.86 ? 76 TRP A CH2 1 ATOM 599 N N . SER A 1 82 ? -22.659 28.799 -37.883 1.00 30.25 ? 77 SER A N 1 ATOM 600 C CA . SER A 1 82 ? -22.097 29.948 -37.208 1.00 30.39 ? 77 SER A CA 1 ATOM 601 C C . SER A 1 82 ? -21.017 30.662 -38.023 1.00 32.58 ? 77 SER A C 1 ATOM 602 O O . SER A 1 82 ? -20.766 31.851 -37.845 1.00 33.48 ? 77 SER A O 1 ATOM 603 C CB . SER A 1 82 ? -21.445 29.456 -35.912 1.00 30.45 ? 77 SER A CB 1 ATOM 604 O OG . SER A 1 82 ? -20.532 28.386 -36.185 1.00 27.46 ? 77 SER A OG 1 ATOM 605 N N . TYR A 1 83 ? -20.321 29.897 -38.864 1.00 33.00 ? 78 TYR A N 1 ATOM 606 C CA . TYR A 1 83 ? -19.390 30.477 -39.858 1.00 29.94 ? 78 TYR A CA 1 ATOM 607 C C . TYR A 1 83 ? -19.300 29.570 -41.040 1.00 28.41 ? 78 TYR A C 1 ATOM 608 O O . TYR A 1 83 ? -19.755 28.411 -40.969 1.00 32.63 ? 78 TYR A O 1 ATOM 609 C CB . TYR A 1 83 ? -18.001 30.738 -39.229 1.00 30.55 ? 78 TYR A CB 1 ATOM 610 C CG . TYR A 1 83 ? -17.236 29.567 -38.636 1.00 27.30 ? 78 TYR A CG 1 ATOM 611 C CD1 . TYR A 1 83 ? -17.619 28.979 -37.446 1.00 27.83 ? 78 TYR A CD1 1 ATOM 612 C CD2 . TYR A 1 83 ? -16.080 29.147 -39.208 1.00 28.32 ? 78 TYR A CD2 1 ATOM 613 C CE1 . TYR A 1 83 ? -16.883 27.942 -36.875 1.00 28.26 ? 78 TYR A CE1 1 ATOM 614 C CE2 . TYR A 1 83 ? -15.345 28.098 -38.688 1.00 29.74 ? 78 TYR A CE2 1 ATOM 615 C CZ . TYR A 1 83 ? -15.745 27.489 -37.514 1.00 29.77 ? 78 TYR A CZ 1 ATOM 616 O OH . TYR A 1 83 ? -14.961 26.440 -37.021 1.00 30.68 ? 78 TYR A OH 1 ATOM 617 N N . ILE A 1 84 ? -18.727 30.040 -42.127 1.00 27.17 ? 79 ILE A N 1 ATOM 618 C CA . ILE A 1 84 ? -18.465 29.187 -43.293 1.00 26.77 ? 79 ILE A CA 1 ATOM 619 C C . ILE A 1 84 ? -16.958 28.933 -43.437 1.00 27.08 ? 79 ILE A C 1 ATOM 620 O O . ILE A 1 84 ? -16.174 29.848 -43.310 1.00 29.06 ? 79 ILE A O 1 ATOM 621 C CB . ILE A 1 84 ? -18.995 29.828 -44.592 1.00 26.54 ? 79 ILE A CB 1 ATOM 622 C CG1 . ILE A 1 84 ? -20.503 30.067 -44.510 1.00 27.99 ? 79 ILE A CG1 1 ATOM 623 C CG2 . ILE A 1 84 ? -18.661 28.963 -45.787 1.00 28.43 ? 79 ILE A CG2 1 ATOM 624 C CD1 . ILE A 1 84 ? -21.148 30.534 -45.804 1.00 27.40 ? 79 ILE A CD1 1 ATOM 625 N N . VAL A 1 85 ? -16.585 27.695 -43.721 1.00 27.03 ? 80 VAL A N 1 ATOM 626 C CA . VAL A 1 85 ? -15.238 27.337 -44.009 1.00 28.84 ? 80 VAL A CA 1 ATOM 627 C C . VAL A 1 85 ? -15.173 26.952 -45.492 1.00 30.64 ? 80 VAL A C 1 ATOM 628 O O . VAL A 1 85 ? -15.843 26.023 -45.906 1.00 28.53 ? 80 VAL A O 1 ATOM 629 C CB . VAL A 1 85 ? -14.797 26.123 -43.177 1.00 31.81 ? 80 VAL A CB 1 ATOM 630 C CG1 . VAL A 1 85 ? -13.376 25.682 -43.542 1.00 34.21 ? 80 VAL A CG1 1 ATOM 631 C CG2 . VAL A 1 85 ? -14.854 26.461 -41.702 1.00 32.48 ? 80 VAL A CG2 1 ATOM 632 N N . GLU A 1 86 ? -14.312 27.651 -46.246 1.00 32.49 ? 81 GLU A N 1 ATOM 633 C CA . GLU A 1 86 ? -13.977 27.371 -47.640 1.00 34.95 ? 81 GLU A CA 1 ATOM 634 C C . GLU A 1 86 ? -12.494 27.038 -47.731 1.00 35.33 ? 81 GLU A C 1 ATOM 635 O O . GLU A 1 86 ? -11.700 27.520 -46.966 1.00 35.58 ? 81 GLU A O 1 ATOM 636 C CB . GLU A 1 86 ? -14.174 28.611 -48.497 1.00 37.21 ? 81 GLU A CB 1 ATOM 637 C CG . GLU A 1 86 ? -15.331 28.628 -49.452 1.00 36.95 ? 81 GLU A CG 1 ATOM 638 C CD . GLU A 1 86 ? -15.471 29.896 -50.259 1.00 37.66 ? 81 GLU A CD 1 ATOM 639 O OE1 . GLU A 1 86 ? -14.635 30.841 -50.169 1.00 42.27 ? 81 GLU A OE1 1 ATOM 640 O OE2 . GLU A 1 86 ? -16.382 29.869 -51.114 1.00 37.00 ? 81 GLU A OE2 1 ATOM 641 N N . ARG A 1 87 ? -12.147 26.138 -48.633 1.00 37.20 ? 82 ARG A N 1 ATOM 642 C CA . ARG A 1 87 ? -10.776 25.906 -48.942 1.00 36.37 ? 82 ARG A CA 1 ATOM 643 C C . ARG A 1 87 ? -10.220 27.099 -49.671 1.00 37.10 ? 82 ARG A C 1 ATOM 644 O O . ARG A 1 87 ? -10.969 27.905 -50.250 1.00 37.95 ? 82 ARG A O 1 ATOM 645 C CB . ARG A 1 87 ? -10.626 24.673 -49.809 1.00 38.57 ? 82 ARG A CB 1 ATOM 646 C CG . ARG A 1 87 ? -10.830 23.442 -48.989 1.00 40.98 ? 82 ARG A CG 1 ATOM 647 C CD . ARG A 1 87 ? -10.691 22.226 -49.849 1.00 42.14 ? 82 ARG A CD 1 ATOM 648 N NE . ARG A 1 87 ? -11.137 21.052 -49.108 1.00 49.35 ? 82 ARG A NE 1 ATOM 649 C CZ . ARG A 1 87 ? -11.217 19.823 -49.626 1.00 52.94 ? 82 ARG A CZ 1 ATOM 650 N NH1 . ARG A 1 87 ? -10.895 19.583 -50.907 1.00 48.06 ? 82 ARG A NH1 1 ATOM 651 N NH2 . ARG A 1 87 ? -11.640 18.830 -48.848 1.00 53.36 ? 82 ARG A NH2 1 ATOM 652 N N . ALA A 1 88 ? -8.901 27.217 -49.651 1.00 36.48 ? 83 ALA A N 1 ATOM 653 C CA . ALA A 1 88 ? -8.262 28.322 -50.354 1.00 38.01 ? 83 ALA A CA 1 ATOM 654 C C . ALA A 1 88 ? -8.714 28.359 -51.814 1.00 36.66 ? 83 ALA A C 1 ATOM 655 O O . ALA A 1 88 ? -9.027 29.417 -52.321 1.00 37.56 ? 83 ALA A O 1 ATOM 656 C CB . ALA A 1 88 ? -6.744 28.225 -50.259 1.00 35.51 ? 83 ALA A CB 1 ATOM 657 N N . ASN A 1 89 ? -8.749 27.196 -52.458 1.00 38.74 ? 84 ASN A N 1 ATOM 658 C CA . ASN A 1 89 ? -9.165 27.073 -53.862 1.00 43.88 ? 84 ASN A CA 1 ATOM 659 C C . ASN A 1 89 ? -10.110 25.912 -54.091 1.00 40.45 ? 84 ASN A C 1 ATOM 660 O O . ASN A 1 89 ? -9.693 24.825 -54.488 1.00 44.40 ? 84 ASN A O 1 ATOM 661 C CB . ASN A 1 89 ? -7.939 26.895 -54.744 1.00 53.05 ? 84 ASN A CB 1 ATOM 662 C CG . ASN A 1 89 ? -7.081 28.135 -54.757 1.00 61.10 ? 84 ASN A CG 1 ATOM 663 O OD1 . ASN A 1 89 ? -7.469 29.163 -55.318 1.00 74.64 ? 84 ASN A OD1 1 ATOM 664 N ND2 . ASN A 1 89 ? -5.944 28.078 -54.078 1.00 67.20 ? 84 ASN A ND2 1 ATOM 665 N N . PRO A 1 90 ? -11.397 26.127 -53.807 1.00 38.25 ? 85 PRO A N 1 ATOM 666 C CA . PRO A 1 90 ? -12.380 25.098 -54.099 1.00 36.71 ? 85 PRO A CA 1 ATOM 667 C C . PRO A 1 90 ? -12.312 24.776 -55.611 1.00 41.97 ? 85 PRO A C 1 ATOM 668 O O . PRO A 1 90 ? -12.128 25.684 -56.433 1.00 43.88 ? 85 PRO A O 1 ATOM 669 C CB . PRO A 1 90 ? -13.701 25.760 -53.762 1.00 36.08 ? 85 PRO A CB 1 ATOM 670 C CG . PRO A 1 90 ? -13.371 27.013 -53.013 1.00 36.39 ? 85 PRO A CG 1 ATOM 671 C CD . PRO A 1 90 ? -12.009 27.418 -53.425 1.00 36.38 ? 85 PRO A CD 1 ATOM 672 N N . ALA A 1 91 ? -12.416 23.503 -55.927 1.00 37.72 ? 86 ALA A N 1 ATOM 673 C CA . ALA A 1 91 ? -12.352 23.011 -57.273 1.00 39.81 ? 86 ALA A CA 1 ATOM 674 C C . ALA A 1 91 ? -13.679 23.191 -57.976 1.00 43.19 ? 86 ALA A C 1 ATOM 675 O O . ALA A 1 91 ? -13.711 23.376 -59.194 1.00 45.18 ? 86 ALA A O 1 ATOM 676 C CB . ALA A 1 91 ? -12.003 21.530 -57.263 1.00 42.24 ? 86 ALA A CB 1 ATOM 677 N N . ASN A 1 92 ? -14.775 23.167 -57.214 1.00 40.45 ? 87 ASN A N 1 ATOM 678 C CA . ASN A 1 92 ? -16.094 23.327 -57.806 1.00 38.76 ? 87 ASN A CA 1 ATOM 679 C C . ASN A 1 92 ? -16.781 24.656 -57.518 1.00 40.05 ? 87 ASN A C 1 ATOM 680 O O . ASN A 1 92 ? -17.156 24.979 -56.371 1.00 38.39 ? 87 ASN A O 1 ATOM 681 C CB . ASN A 1 92 ? -16.936 22.176 -57.395 1.00 37.33 ? 87 ASN A CB 1 ATOM 682 C CG . ASN A 1 92 ? -16.262 20.847 -57.695 1.00 38.08 ? 87 ASN A CG 1 ATOM 683 O OD1 . ASN A 1 92 ? -16.084 20.010 -56.789 1.00 45.79 ? 87 ASN A OD1 1 ATOM 684 N ND2 . ASN A 1 92 ? -15.907 20.628 -58.947 1.00 33.63 ? 87 ASN A ND2 1 ATOM 685 N N . ASP A 1 93 ? -16.916 25.454 -58.566 1.00 37.60 ? 88 ASP A N 1 ATOM 686 C CA . ASP A 1 93 ? -17.364 26.838 -58.402 1.00 36.83 ? 88 ASP A CA 1 ATOM 687 C C . ASP A 1 93 ? -18.396 27.120 -59.533 1.00 35.09 ? 88 ASP A C 1 ATOM 688 O O . ASP A 1 93 ? -19.463 26.522 -59.520 1.00 34.07 ? 88 ASP A O 1 ATOM 689 C CB . ASP A 1 93 ? -16.113 27.741 -58.366 1.00 38.15 ? 88 ASP A CB 1 ATOM 690 C CG . ASP A 1 93 ? -16.438 29.208 -58.243 1.00 41.41 ? 88 ASP A CG 1 ATOM 691 O OD1 . ASP A 1 93 ? -17.157 29.606 -57.298 1.00 43.05 ? 88 ASP A OD1 1 ATOM 692 O OD2 . ASP A 1 93 ? -16.020 29.963 -59.161 1.00 45.88 ? 88 ASP A OD2 1 ATOM 693 N N . LEU A 1 94 ? -18.099 27.963 -60.517 1.00 31.81 ? 89 LEU A N 1 ATOM 694 C CA . LEU A 1 94 ? -19.040 28.154 -61.579 1.00 35.80 ? 89 LEU A CA 1 ATOM 695 C C . LEU A 1 94 ? -18.605 27.233 -62.710 1.00 37.00 ? 89 LEU A C 1 ATOM 696 O O . LEU A 1 94 ? -17.755 27.604 -63.511 1.00 37.54 ? 89 LEU A O 1 ATOM 697 C CB . LEU A 1 94 ? -19.079 29.606 -62.017 1.00 38.80 ? 89 LEU A CB 1 ATOM 698 C CG . LEU A 1 94 ? -19.518 30.590 -60.944 1.00 42.80 ? 89 LEU A CG 1 ATOM 699 C CD1 . LEU A 1 94 ? -19.267 32.015 -61.422 1.00 44.43 ? 89 LEU A CD1 1 ATOM 700 C CD2 . LEU A 1 94 ? -20.998 30.421 -60.575 1.00 43.34 ? 89 LEU A CD2 1 ATOM 701 N N . CYS A 1 95 ? -19.217 26.049 -62.766 1.00 35.97 ? 90 CYS A N 1 ATOM 702 C CA . CYS A 1 95 ? -18.870 25.028 -63.731 1.00 34.37 ? 90 CYS A CA 1 ATOM 703 C C . CYS A 1 95 ? -19.052 25.606 -65.129 1.00 34.78 ? 90 CYS A C 1 ATOM 704 O O . CYS A 1 95 ? -18.170 25.510 -65.980 1.00 34.17 ? 90 CYS A O 1 ATOM 705 C CB . CYS A 1 95 ? -19.693 23.743 -63.517 1.00 35.47 ? 90 CYS A CB 1 ATOM 706 S SG . CYS A 1 95 ? -21.520 23.897 -63.471 1.00 42.79 ? 90 CYS A SG 1 ATOM 707 N N . TYR A 1 96 ? -20.185 26.257 -65.347 1.00 33.46 ? 91 TYR A N 1 ATOM 708 C CA . TYR A 1 96 ? -20.366 27.061 -66.553 1.00 33.93 ? 91 TYR A CA 1 ATOM 709 C C . TYR A 1 96 ? -19.826 28.436 -66.180 1.00 30.97 ? 91 TYR A C 1 ATOM 710 O O . TYR A 1 96 ? -20.287 29.048 -65.273 1.00 30.72 ? 91 TYR A O 1 ATOM 711 C CB . TYR A 1 96 ? -21.836 27.143 -67.010 1.00 34.17 ? 91 TYR A CB 1 ATOM 712 C CG . TYR A 1 96 ? -21.951 27.568 -68.453 1.00 35.99 ? 91 TYR A CG 1 ATOM 713 C CD1 . TYR A 1 96 ? -22.159 26.651 -69.465 1.00 37.07 ? 91 TYR A CD1 1 ATOM 714 C CD2 . TYR A 1 96 ? -21.833 28.891 -68.806 1.00 37.70 ? 91 TYR A CD2 1 ATOM 715 C CE1 . TYR A 1 96 ? -22.241 27.040 -70.796 1.00 34.05 ? 91 TYR A CE1 1 ATOM 716 C CE2 . TYR A 1 96 ? -21.922 29.298 -70.118 1.00 37.65 ? 91 TYR A CE2 1 ATOM 717 C CZ . TYR A 1 96 ? -22.127 28.370 -71.114 1.00 37.31 ? 91 TYR A CZ 1 ATOM 718 O OH . TYR A 1 96 ? -22.211 28.824 -72.409 1.00 36.14 ? 91 TYR A OH 1 ATOM 719 N N . PRO A 1 97 ? -18.847 28.923 -66.913 1.00 31.28 ? 92 PRO A N 1 ATOM 720 C CA . PRO A 1 97 ? -18.139 30.130 -66.474 1.00 29.78 ? 92 PRO A CA 1 ATOM 721 C C . PRO A 1 97 ? -18.976 31.382 -66.531 1.00 31.34 ? 92 PRO A C 1 ATOM 722 O O . PRO A 1 97 ? -19.933 31.484 -67.325 1.00 31.58 ? 92 PRO A O 1 ATOM 723 C CB . PRO A 1 97 ? -16.999 30.228 -67.474 1.00 31.04 ? 92 PRO A CB 1 ATOM 724 C CG . PRO A 1 97 ? -17.524 29.557 -68.710 1.00 30.78 ? 92 PRO A CG 1 ATOM 725 C CD . PRO A 1 97 ? -18.379 28.426 -68.226 1.00 29.30 ? 92 PRO A CD 1 ATOM 726 N N . GLY A 1 98 ? -18.611 32.342 -65.694 1.00 32.92 ? 93 GLY A N 1 ATOM 727 C CA . GLY A 1 98 ? -19.327 33.610 -65.642 1.00 35.32 ? 93 GLY A CA 1 ATOM 728 C C . GLY A 1 98 ? -19.101 34.352 -64.354 1.00 35.94 ? 93 GLY A C 1 ATOM 729 O O . GLY A 1 98 ? -17.961 34.509 -63.916 1.00 35.77 ? 93 GLY A O 1 ATOM 730 N N . ASN A 1 99 ? -20.171 34.878 -63.774 1.00 35.16 ? 94 ASN A N 1 ATOM 731 C CA . ASN A 1 99 ? -20.064 35.650 -62.529 1.00 32.41 ? 94 ASN A CA 1 ATOM 732 C C . ASN A 1 99 ? -21.283 35.444 -61.668 1.00 33.50 ? 94 ASN A C 1 ATOM 733 O O . ASN A 1 99 ? -22.366 35.096 -62.144 1.00 32.81 ? 94 ASN A O 1 ATOM 734 C CB . ASN A 1 99 ? -20.011 37.156 -62.821 1.00 36.33 ? 94 ASN A CB 1 ATOM 735 C CG . ASN A 1 99 ? -18.807 37.577 -63.666 1.00 36.83 ? 94 ASN A CG 1 ATOM 736 O OD1 . ASN A 1 99 ? -18.905 37.840 -64.889 1.00 34.12 ? 94 ASN A OD1 1 ATOM 737 N ND2 . ASN A 1 99 ? -17.666 37.612 -63.019 1.00 36.54 ? 94 ASN A ND2 1 ATOM 738 N N . LEU A 1 100 ? -21.115 35.745 -60.386 1.00 34.10 ? 95 LEU A N 1 ATOM 739 C CA . LEU A 1 100 ? -22.204 35.934 -59.463 1.00 31.32 ? 95 LEU A CA 1 ATOM 740 C C . LEU A 1 100 ? -22.085 37.333 -58.961 1.00 31.46 ? 95 LEU A C 1 ATOM 741 O O . LEU A 1 100 ? -21.096 37.700 -58.277 1.00 33.10 ? 95 LEU A O 1 ATOM 742 C CB . LEU A 1 100 ? -22.054 35.006 -58.284 1.00 31.45 ? 95 LEU A CB 1 ATOM 743 C CG . LEU A 1 100 ? -23.299 34.407 -57.678 1.00 34.64 ? 95 LEU A CG 1 ATOM 744 C CD1 . LEU A 1 100 ? -22.958 33.811 -56.335 1.00 34.78 ? 95 LEU A CD1 1 ATOM 745 C CD2 . LEU A 1 100 ? -24.382 35.430 -57.495 1.00 37.58 ? 95 LEU A CD2 1 ATOM 746 N N . ASN A 1 101 ? -23.100 38.130 -59.232 1.00 28.91 ? 96 ASN A N 1 ATOM 747 C CA . ASN A 1 101 ? -23.069 39.525 -58.813 1.00 28.14 ? 96 ASN A CA 1 ATOM 748 C C . ASN A 1 101 ? -23.012 39.712 -57.285 1.00 26.90 ? 96 ASN A C 1 ATOM 749 O O . ASN A 1 101 ? -23.622 39.000 -56.545 1.00 26.30 ? 96 ASN A O 1 ATOM 750 C CB . ASN A 1 101 ? -24.333 40.234 -59.380 1.00 29.98 ? 96 ASN A CB 1 ATOM 751 C CG . ASN A 1 101 ? -24.201 41.752 -59.361 1.00 30.58 ? 96 ASN A CG 1 ATOM 752 O OD1 . ASN A 1 101 ? -23.255 42.325 -59.931 1.00 34.37 ? 96 ASN A OD1 1 ATOM 753 N ND2 . ASN A 1 101 ? -25.119 42.390 -58.730 1.00 29.78 ? 96 ASN A ND2 1 ATOM 754 N N . ASP A 1 102 ? -22.344 40.751 -56.833 1.00 29.59 ? 97 ASP A N 1 ATOM 755 C CA . ASP A 1 102 ? -22.236 41.059 -55.421 1.00 28.87 ? 97 ASP A CA 1 ATOM 756 C C . ASP A 1 102 ? -21.855 39.848 -54.619 1.00 27.77 ? 97 ASP A C 1 ATOM 757 O O . ASP A 1 102 ? -22.346 39.630 -53.512 1.00 27.86 ? 97 ASP A O 1 ATOM 758 C CB . ASP A 1 102 ? -23.540 41.677 -54.885 1.00 33.73 ? 97 ASP A CB 1 ATOM 759 C CG . ASP A 1 102 ? -23.703 43.176 -55.257 1.00 39.70 ? 97 ASP A CG 1 ATOM 760 O OD1 . ASP A 1 102 ? -22.673 43.874 -55.391 1.00 49.32 ? 97 ASP A OD1 1 ATOM 761 O OD2 . ASP A 1 102 ? -24.844 43.644 -55.431 1.00 39.57 ? 97 ASP A OD2 1 ATOM 762 N N . TYR A 1 103 ? -20.922 39.069 -55.139 1.00 27.63 ? 98 TYR A N 1 ATOM 763 C CA . TYR A 1 103 ? -20.648 37.751 -54.546 1.00 27.53 ? 98 TYR A CA 1 ATOM 764 C C . TYR A 1 103 ? -20.134 37.857 -53.141 1.00 26.77 ? 98 TYR A C 1 ATOM 765 O O . TYR A 1 103 ? -20.547 37.127 -52.281 1.00 25.79 ? 98 TYR A O 1 ATOM 766 C CB . TYR A 1 103 ? -19.608 37.050 -55.375 1.00 29.24 ? 98 TYR A CB 1 ATOM 767 C CG . TYR A 1 103 ? -19.254 35.657 -54.957 1.00 27.84 ? 98 TYR A CG 1 ATOM 768 C CD1 . TYR A 1 103 ? -20.201 34.783 -54.467 1.00 28.12 ? 98 TYR A CD1 1 ATOM 769 C CD2 . TYR A 1 103 ? -17.952 35.169 -55.175 1.00 27.39 ? 98 TYR A CD2 1 ATOM 770 C CE1 . TYR A 1 103 ? -19.868 33.459 -54.155 1.00 28.30 ? 98 TYR A CE1 1 ATOM 771 C CE2 . TYR A 1 103 ? -17.619 33.867 -54.859 1.00 28.45 ? 98 TYR A CE2 1 ATOM 772 C CZ . TYR A 1 103 ? -18.579 33.025 -54.320 1.00 27.72 ? 98 TYR A CZ 1 ATOM 773 O OH . TYR A 1 103 ? -18.225 31.740 -54.021 1.00 29.23 ? 98 TYR A OH 1 ATOM 774 N N . GLU A 1 104 ? -19.278 38.849 -52.887 1.00 28.03 ? 99 GLU A N 1 ATOM 775 C CA . GLU A 1 104 ? -18.653 38.945 -51.582 1.00 26.55 ? 99 GLU A CA 1 ATOM 776 C C . GLU A 1 104 ? -19.647 39.364 -50.527 1.00 27.43 ? 99 GLU A C 1 ATOM 777 O O . GLU A 1 104 ? -19.566 38.877 -49.384 1.00 28.56 ? 99 GLU A O 1 ATOM 778 C CB . GLU A 1 104 ? -17.448 39.875 -51.586 1.00 29.08 ? 99 GLU A CB 1 ATOM 779 C CG . GLU A 1 104 ? -16.305 39.431 -52.548 1.00 31.27 ? 99 GLU A CG 1 ATOM 780 C CD . GLU A 1 104 ? -16.539 39.821 -54.012 1.00 33.45 ? 99 GLU A CD 1 ATOM 781 O OE1 . GLU A 1 104 ? -17.455 40.631 -54.327 1.00 41.72 ? 99 GLU A OE1 1 ATOM 782 O OE2 . GLU A 1 104 ? -15.846 39.276 -54.899 1.00 36.42 ? 99 GLU A OE2 1 ATOM 783 N N . GLU A 1 105 ? -20.571 40.266 -50.883 1.00 25.71 ? 100 GLU A N 1 ATOM 784 C CA . GLU A 1 105 ? -21.578 40.723 -49.930 1.00 24.83 ? 100 GLU A CA 1 ATOM 785 C C . GLU A 1 105 ? -22.526 39.570 -49.670 1.00 24.92 ? 100 GLU A C 1 ATOM 786 O O . GLU A 1 105 ? -22.957 39.355 -48.519 1.00 24.26 ? 100 GLU A O 1 ATOM 787 C CB . GLU A 1 105 ? -22.330 41.924 -50.463 1.00 25.92 ? 100 GLU A CB 1 ATOM 788 C CG . GLU A 1 105 ? -21.561 43.224 -50.375 1.00 28.42 ? 100 GLU A CG 1 ATOM 789 C CD . GLU A 1 105 ? -21.375 43.750 -48.944 1.00 29.17 ? 100 GLU A CD 1 ATOM 790 O OE1 . GLU A 1 105 ? -22.368 43.767 -48.111 1.00 26.12 ? 100 GLU A OE1 1 ATOM 791 O OE2 . GLU A 1 105 ? -20.223 44.182 -48.666 1.00 28.22 ? 100 GLU A OE2 1 ATOM 792 N N . LEU A 1 106 ? -22.842 38.802 -50.706 1.00 23.87 ? 101 LEU A N 1 ATOM 793 C CA . LEU A 1 106 ? -23.656 37.589 -50.510 1.00 25.92 ? 101 LEU A CA 1 ATOM 794 C C . LEU A 1 106 ? -22.994 36.592 -49.524 1.00 28.20 ? 101 LEU A C 1 ATOM 795 O O . LEU A 1 106 ? -23.640 36.086 -48.603 1.00 28.87 ? 101 LEU A O 1 ATOM 796 C CB . LEU A 1 106 ? -23.926 36.889 -51.853 1.00 25.84 ? 101 LEU A CB 1 ATOM 797 C CG . LEU A 1 106 ? -24.739 35.601 -51.822 1.00 25.16 ? 101 LEU A CG 1 ATOM 798 C CD1 . LEU A 1 106 ? -26.073 35.883 -51.212 1.00 26.38 ? 101 LEU A CD1 1 ATOM 799 C CD2 . LEU A 1 106 ? -24.943 35.067 -53.211 1.00 25.32 ? 101 LEU A CD2 1 ATOM 800 N N . LYS A 1 107 ? -21.715 36.298 -49.733 1.00 26.61 ? 102 LYS A N 1 ATOM 801 C CA . LYS A 1 107 ? -21.009 35.418 -48.808 1.00 29.67 ? 102 LYS A CA 1 ATOM 802 C C . LYS A 1 107 ? -20.999 35.948 -47.389 1.00 29.34 ? 102 LYS A C 1 ATOM 803 O O . LYS A 1 107 ? -21.126 35.195 -46.440 1.00 30.23 ? 102 LYS A O 1 ATOM 804 C CB . LYS A 1 107 ? -19.569 35.223 -49.248 1.00 33.75 ? 102 LYS A CB 1 ATOM 805 C CG . LYS A 1 107 ? -19.509 34.368 -50.501 1.00 37.40 ? 102 LYS A CG 1 ATOM 806 C CD . LYS A 1 107 ? -18.123 33.808 -50.712 1.00 41.37 ? 102 LYS A CD 1 ATOM 807 C CE . LYS A 1 107 ? -17.212 34.801 -51.360 1.00 40.58 ? 102 LYS A CE 1 ATOM 808 N NZ . LYS A 1 107 ? -15.845 34.156 -51.337 1.00 53.98 ? 102 LYS A NZ 1 ATOM 809 N N . HIS A 1 108 ? -20.851 37.262 -47.254 1.00 29.25 ? 103 HIS A N 1 ATOM 810 C CA . HIS A 1 108 ? -20.884 37.896 -45.971 1.00 28.47 ? 103 HIS A CA 1 ATOM 811 C C . HIS A 1 108 ? -22.256 37.750 -45.317 1.00 30.14 ? 103 HIS A C 1 ATOM 812 O O . HIS A 1 108 ? -22.363 37.512 -44.122 1.00 30.63 ? 103 HIS A O 1 ATOM 813 C CB . HIS A 1 108 ? -20.524 39.359 -46.083 1.00 29.32 ? 103 HIS A CB 1 ATOM 814 C CG . HIS A 1 108 ? -20.116 39.932 -44.781 1.00 29.57 ? 103 HIS A CG 1 ATOM 815 N ND1 . HIS A 1 108 ? -20.969 40.677 -44.014 1.00 31.88 ? 103 HIS A ND1 1 ATOM 816 C CD2 . HIS A 1 108 ? -19.004 39.767 -44.046 1.00 31.94 ? 103 HIS A CD2 1 ATOM 817 C CE1 . HIS A 1 108 ? -20.387 40.986 -42.880 1.00 32.54 ? 103 HIS A CE1 1 ATOM 818 N NE2 . HIS A 1 108 ? -19.195 40.434 -42.868 1.00 34.92 ? 103 HIS A NE2 1 ATOM 819 N N . LEU A 1 109 ? -23.300 37.913 -46.115 1.00 32.06 ? 104 LEU A N 1 ATOM 820 C CA . LEU A 1 109 ? -24.681 37.700 -45.658 1.00 31.14 ? 104 LEU A CA 1 ATOM 821 C C . LEU A 1 109 ? -24.883 36.272 -45.185 1.00 30.89 ? 104 LEU A C 1 ATOM 822 O O . LEU A 1 109 ? -25.474 36.003 -44.151 1.00 30.90 ? 104 LEU A O 1 ATOM 823 C CB . LEU A 1 109 ? -25.626 37.982 -46.831 1.00 33.50 ? 104 LEU A CB 1 ATOM 824 C CG . LEU A 1 109 ? -27.098 38.407 -46.624 1.00 36.07 ? 104 LEU A CG 1 ATOM 825 C CD1 . LEU A 1 109 ? -28.053 37.628 -47.499 1.00 34.64 ? 104 LEU A CD1 1 ATOM 826 C CD2 . LEU A 1 109 ? -27.576 38.374 -45.211 1.00 36.45 ? 104 LEU A CD2 1 ATOM 827 N N . LEU A 1 110 ? -24.364 35.326 -45.944 1.00 30.72 ? 105 LEU A N 1 ATOM 828 C CA . LEU A 1 110 ? -24.547 33.925 -45.603 1.00 29.99 ? 105 LEU A CA 1 ATOM 829 C C . LEU A 1 110 ? -23.536 33.407 -44.567 1.00 31.62 ? 105 LEU A C 1 ATOM 830 O O . LEU A 1 110 ? -23.578 32.229 -44.225 1.00 31.54 ? 105 LEU A O 1 ATOM 831 C CB . LEU A 1 110 ? -24.409 33.077 -46.849 1.00 29.44 ? 105 LEU A CB 1 ATOM 832 C CG . LEU A 1 110 ? -25.466 33.323 -47.947 1.00 29.61 ? 105 LEU A CG 1 ATOM 833 C CD1 . LEU A 1 110 ? -25.129 32.644 -49.267 1.00 28.87 ? 105 LEU A CD1 1 ATOM 834 C CD2 . LEU A 1 110 ? -26.776 32.813 -47.457 1.00 29.24 ? 105 LEU A CD2 1 ATOM 835 N N . SER A 1 111 ? -22.624 34.244 -44.078 1.00 29.45 ? 106 SER A N 1 ATOM 836 C CA . SER A 1 111 ? -21.555 33.728 -43.232 1.00 33.58 ? 106 SER A CA 1 ATOM 837 C C . SER A 1 111 ? -22.103 33.079 -41.964 1.00 31.70 ? 106 SER A C 1 ATOM 838 O O . SER A 1 111 ? -21.663 31.999 -41.540 1.00 32.09 ? 106 SER A O 1 ATOM 839 C CB . SER A 1 111 ? -20.551 34.863 -42.902 1.00 40.01 ? 106 SER A CB 1 ATOM 840 O OG . SER A 1 111 ? -21.157 35.833 -42.080 1.00 38.00 ? 106 SER A OG 1 ATOM 841 N N . ARG A 1 112 ? -23.111 33.706 -41.414 1.00 29.50 ? 107 ARG A N 1 ATOM 842 C CA . ARG A 1 112 ? -23.822 33.144 -40.315 1.00 32.84 ? 107 ARG A CA 1 ATOM 843 C C . ARG A 1 112 ? -25.316 33.242 -40.480 1.00 30.58 ? 107 ARG A C 1 ATOM 844 O O . ARG A 1 112 ? -25.849 34.329 -40.726 1.00 33.19 ? 107 ARG A O 1 ATOM 845 C CB . ARG A 1 112 ? -23.423 33.842 -39.028 1.00 38.06 ? 107 ARG A CB 1 ATOM 846 C CG . ARG A 1 112 ? -24.241 33.364 -37.839 1.00 44.64 ? 107 ARG A CG 1 ATOM 847 C CD . ARG A 1 112 ? -24.082 34.327 -36.697 1.00 49.21 ? 107 ARG A CD 1 ATOM 848 N NE . ARG A 1 112 ? -22.955 33.963 -35.873 1.00 59.52 ? 107 ARG A NE 1 ATOM 849 C CZ . ARG A 1 112 ? -22.407 34.763 -34.959 1.00 72.55 ? 107 ARG A CZ 1 ATOM 850 N NH1 . ARG A 1 112 ? -22.851 36.015 -34.770 1.00 67.11 ? 107 ARG A NH1 1 ATOM 851 N NH2 . ARG A 1 112 ? -21.379 34.303 -34.249 1.00 77.22 ? 107 ARG A NH2 1 ATOM 852 N N . ILE A 1 113 ? -25.996 32.105 -40.315 1.00 31.81 ? 108 ILE A N 1 ATOM 853 C CA . ILE A 1 113 ? -27.415 31.971 -40.700 1.00 32.94 ? 108 ILE A CA 1 ATOM 854 C C . ILE A 1 113 ? -28.124 31.158 -39.640 1.00 34.13 ? 108 ILE A C 1 ATOM 855 O O . ILE A 1 113 ? -27.680 30.103 -39.237 1.00 34.96 ? 108 ILE A O 1 ATOM 856 C CB . ILE A 1 113 ? -27.573 31.337 -42.113 1.00 33.04 ? 108 ILE A CB 1 ATOM 857 C CG1 . ILE A 1 113 ? -27.111 32.326 -43.193 1.00 35.02 ? 108 ILE A CG1 1 ATOM 858 C CG2 . ILE A 1 113 ? -29.010 30.978 -42.436 1.00 34.29 ? 108 ILE A CG2 1 ATOM 859 C CD1 . ILE A 1 113 ? -27.982 33.556 -43.395 1.00 34.45 ? 108 ILE A CD1 1 ATOM 860 N N . ASN A 1 114 ? -29.241 31.700 -39.187 1.00 41.49 ? 109 ASN A N 1 ATOM 861 C CA . ASN A 1 114 ? -30.007 31.138 -38.085 1.00 43.00 ? 109 ASN A CA 1 ATOM 862 C C . ASN A 1 114 ? -30.990 30.056 -38.588 1.00 42.84 ? 109 ASN A C 1 ATOM 863 O O . ASN A 1 114 ? -31.183 29.057 -37.916 1.00 41.55 ? 109 ASN A O 1 ATOM 864 C CB . ASN A 1 114 ? -30.769 32.253 -37.366 1.00 45.85 ? 109 ASN A CB 1 ATOM 865 C CG . ASN A 1 114 ? -31.658 31.726 -36.243 1.00 53.18 ? 109 ASN A CG 1 ATOM 866 O OD1 . ASN A 1 114 ? -32.878 31.851 -36.287 1.00 67.16 ? 109 ASN A OD1 1 ATOM 867 N ND2 . ASN A 1 114 ? -31.049 31.125 -35.250 1.00 54.75 ? 109 ASN A ND2 1 ATOM 868 N N . HIS A 1 115 ? -31.611 30.264 -39.759 1.00 41.95 ? 110 HIS A N 1 ATOM 869 C CA . HIS A 1 115 ? -32.425 29.205 -40.395 1.00 41.54 ? 110 HIS A CA 1 ATOM 870 C C . HIS A 1 115 ? -32.261 29.283 -41.917 1.00 40.04 ? 110 HIS A C 1 ATOM 871 O O . HIS A 1 115 ? -32.369 30.358 -42.512 1.00 36.34 ? 110 HIS A O 1 ATOM 872 C CB . HIS A 1 115 ? -33.909 29.328 -40.062 1.00 47.15 ? 110 HIS A CB 1 ATOM 873 C CG . HIS A 1 115 ? -34.769 28.280 -40.712 1.00 50.08 ? 110 HIS A CG 1 ATOM 874 N ND1 . HIS A 1 115 ? -34.789 26.965 -40.292 1.00 51.54 ? 110 HIS A ND1 1 ATOM 875 C CD2 . HIS A 1 115 ? -35.610 28.347 -41.772 1.00 51.92 ? 110 HIS A CD2 1 ATOM 876 C CE1 . HIS A 1 115 ? -35.587 26.263 -41.070 1.00 50.16 ? 110 HIS A CE1 1 ATOM 877 N NE2 . HIS A 1 115 ? -36.116 27.081 -41.962 1.00 55.41 ? 110 HIS A NE2 1 ATOM 878 N N . PHE A 1 116 ? -32.005 28.137 -42.541 1.00 36.28 ? 111 PHE A N 1 ATOM 879 C CA . PHE A 1 116 ? -31.772 28.077 -43.969 1.00 37.31 ? 111 PHE A CA 1 ATOM 880 C C . PHE A 1 116 ? -32.505 26.869 -44.476 1.00 40.12 ? 111 PHE A C 1 ATOM 881 O O . PHE A 1 116 ? -32.243 25.760 -44.035 1.00 44.12 ? 111 PHE A O 1 ATOM 882 C CB . PHE A 1 116 ? -30.262 27.959 -44.258 1.00 35.18 ? 111 PHE A CB 1 ATOM 883 C CG . PHE A 1 116 ? -29.859 28.255 -45.697 1.00 33.20 ? 111 PHE A CG 1 ATOM 884 C CD1 . PHE A 1 116 ? -29.894 29.553 -46.197 1.00 33.55 ? 111 PHE A CD1 1 ATOM 885 C CD2 . PHE A 1 116 ? -29.366 27.244 -46.520 1.00 34.64 ? 111 PHE A CD2 1 ATOM 886 C CE1 . PHE A 1 116 ? -29.464 29.833 -47.485 1.00 31.65 ? 111 PHE A CE1 1 ATOM 887 C CE2 . PHE A 1 116 ? -28.945 27.491 -47.812 1.00 31.99 ? 111 PHE A CE2 1 ATOM 888 C CZ . PHE A 1 116 ? -29.005 28.792 -48.308 1.00 33.23 ? 111 PHE A CZ 1 ATOM 889 N N . GLU A 1 117 ? -33.379 27.060 -45.457 1.00 41.83 ? 112 GLU A N 1 ATOM 890 C CA . GLU A 1 117 ? -34.106 25.927 -46.011 1.00 41.31 ? 112 GLU A CA 1 ATOM 891 C C . GLU A 1 117 ? -34.351 26.069 -47.486 1.00 36.88 ? 112 GLU A C 1 ATOM 892 O O . GLU A 1 117 ? -35.011 26.994 -47.921 1.00 42.11 ? 112 GLU A O 1 ATOM 893 C CB . GLU A 1 117 ? -35.440 25.776 -45.278 1.00 44.05 ? 112 GLU A CB 1 ATOM 894 C CG . GLU A 1 117 ? -36.188 24.511 -45.616 1.00 48.78 ? 112 GLU A CG 1 ATOM 895 C CD . GLU A 1 117 ? -37.586 24.444 -45.002 1.00 54.44 ? 112 GLU A CD 1 ATOM 896 O OE1 . GLU A 1 117 ? -37.950 25.294 -44.147 1.00 50.47 ? 112 GLU A OE1 1 ATOM 897 O OE2 . GLU A 1 117 ? -38.347 23.524 -45.404 1.00 64.56 ? 112 GLU A OE2 1 ATOM 898 N N . LYS A 1 118 ? -33.855 25.119 -48.239 1.00 33.46 ? 113 LYS A N 1 ATOM 899 C CA . LYS A 1 118 ? -34.106 25.035 -49.664 1.00 35.52 ? 113 LYS A CA 1 ATOM 900 C C . LYS A 1 118 ? -35.536 24.589 -49.958 1.00 33.66 ? 113 LYS A C 1 ATOM 901 O O . LYS A 1 118 ? -35.993 23.586 -49.459 1.00 40.55 ? 113 LYS A O 1 ATOM 902 C CB . LYS A 1 118 ? -33.103 24.076 -50.336 1.00 38.22 ? 113 LYS A CB 1 ATOM 903 C CG . LYS A 1 118 ? -33.234 24.095 -51.853 1.00 43.18 ? 113 LYS A CG 1 ATOM 904 C CD . LYS A 1 118 ? -32.014 23.645 -52.614 1.00 44.77 ? 113 LYS A CD 1 ATOM 905 C CE . LYS A 1 118 ? -32.044 22.149 -52.686 1.00 45.44 ? 113 LYS A CE 1 ATOM 906 N NZ . LYS A 1 118 ? -31.170 21.646 -53.771 1.00 46.39 ? 113 LYS A NZ 1 ATOM 907 N N . ILE A 1 119 ? -36.246 25.355 -50.765 1.00 33.01 ? 114 ILE A N 1 ATOM 908 C CA . ILE A 1 119 ? -37.620 25.022 -51.181 1.00 34.83 ? 114 ILE A CA 1 ATOM 909 C C . ILE A 1 119 ? -37.794 25.192 -52.702 1.00 33.96 ? 114 ILE A C 1 ATOM 910 O O . ILE A 1 119 ? -37.134 26.007 -53.330 1.00 34.35 ? 114 ILE A O 1 ATOM 911 C CB . ILE A 1 119 ? -38.681 25.911 -50.492 1.00 38.61 ? 114 ILE A CB 1 ATOM 912 C CG1 . ILE A 1 119 ? -38.426 27.390 -50.733 1.00 40.52 ? 114 ILE A CG1 1 ATOM 913 C CG2 . ILE A 1 119 ? -38.696 25.689 -49.006 1.00 41.31 ? 114 ILE A CG2 1 ATOM 914 C CD1 . ILE A 1 119 ? -39.669 28.225 -50.460 1.00 41.91 ? 114 ILE A CD1 1 ATOM 915 N N . LEU A 1 120 ? -38.687 24.415 -53.269 1.00 34.01 ? 115 LEU A N 1 ATOM 916 C CA . LEU A 1 120 ? -38.987 24.512 -54.671 1.00 36.48 ? 115 LEU A CA 1 ATOM 917 C C . LEU A 1 120 ? -39.975 25.630 -54.868 1.00 36.46 ? 115 LEU A C 1 ATOM 918 O O . LEU A 1 120 ? -40.970 25.682 -54.159 1.00 36.32 ? 115 LEU A O 1 ATOM 919 C CB . LEU A 1 120 ? -39.578 23.211 -55.150 1.00 36.42 ? 115 LEU A CB 1 ATOM 920 C CG . LEU A 1 120 ? -39.827 23.065 -56.655 1.00 36.52 ? 115 LEU A CG 1 ATOM 921 C CD1 . LEU A 1 120 ? -38.586 23.222 -57.504 1.00 34.07 ? 115 LEU A CD1 1 ATOM 922 C CD2 . LEU A 1 120 ? -40.399 21.671 -56.874 1.00 37.13 ? 115 LEU A CD2 1 ATOM 923 N N . ILE A 1 121 ? -39.643 26.608 -55.722 1.00 35.47 ? 116 ILE A N 1 ATOM 924 C CA . ILE A 1 121 ? -40.563 27.743 -55.938 1.00 38.05 ? 116 ILE A CA 1 ATOM 925 C C . ILE A 1 121 ? -41.203 27.741 -57.325 1.00 39.73 ? 116 ILE A C 1 ATOM 926 O O . ILE A 1 121 ? -42.305 28.267 -57.488 1.00 47.28 ? 116 ILE A O 1 ATOM 927 C CB . ILE A 1 121 ? -39.933 29.107 -55.607 1.00 37.79 ? 116 ILE A CB 1 ATOM 928 C CG1 . ILE A 1 121 ? -38.696 29.405 -56.456 1.00 37.07 ? 116 ILE A CG1 1 ATOM 929 C CG2 . ILE A 1 121 ? -39.563 29.144 -54.148 1.00 40.85 ? 116 ILE A CG2 1 ATOM 930 C CD1 . ILE A 1 121 ? -38.356 30.894 -56.540 1.00 38.12 ? 116 ILE A CD1 1 ATOM 931 N N . ILE A 1 122 ? -40.489 27.231 -58.325 1.00 35.67 ? 117 ILE A N 1 ATOM 932 C CA . ILE A 1 122 ? -40.992 27.198 -59.659 1.00 37.13 ? 117 ILE A CA 1 ATOM 933 C C . ILE A 1 122 ? -40.640 25.827 -60.267 1.00 39.70 ? 117 ILE A C 1 ATOM 934 O O . ILE A 1 122 ? -39.559 25.656 -60.820 1.00 37.15 ? 117 ILE A O 1 ATOM 935 C CB . ILE A 1 122 ? -40.398 28.290 -60.525 1.00 39.79 ? 117 ILE A CB 1 ATOM 936 C CG1 . ILE A 1 122 ? -40.705 29.659 -59.960 1.00 38.16 ? 117 ILE A CG1 1 ATOM 937 C CG2 . ILE A 1 122 ? -40.958 28.176 -61.953 1.00 42.33 ? 117 ILE A CG2 1 ATOM 938 C CD1 . ILE A 1 122 ? -40.021 30.789 -60.713 1.00 39.04 ? 117 ILE A CD1 1 ATOM 939 N N . PRO A 1 123 ? -41.542 24.834 -60.136 1.00 38.72 ? 118 PRO A N 1 ATOM 940 C CA . PRO A 1 123 ? -41.211 23.503 -60.648 1.00 38.56 ? 118 PRO A CA 1 ATOM 941 C C . PRO A 1 123 ? -40.912 23.502 -62.141 1.00 37.86 ? 118 PRO A C 1 ATOM 942 O O . PRO A 1 123 ? -41.490 24.285 -62.884 1.00 42.58 ? 118 PRO A O 1 ATOM 943 C CB . PRO A 1 123 ? -42.451 22.665 -60.342 1.00 38.84 ? 118 PRO A CB 1 ATOM 944 C CG . PRO A 1 123 ? -43.297 23.500 -59.460 1.00 40.16 ? 118 PRO A CG 1 ATOM 945 C CD . PRO A 1 123 ? -42.910 24.926 -59.622 1.00 37.43 ? 118 PRO A CD 1 ATOM 946 N N . LYS A 1 124 ? -39.977 22.662 -62.551 1.00 41.88 ? 119 LYS A N 1 ATOM 947 C CA . LYS A 1 124 ? -39.620 22.509 -63.966 1.00 47.85 ? 119 LYS A CA 1 ATOM 948 C C . LYS A 1 124 ? -40.825 22.271 -64.868 1.00 48.91 ? 119 LYS A C 1 ATOM 949 O O . LYS A 1 124 ? -40.907 22.801 -65.956 1.00 49.41 ? 119 LYS A O 1 ATOM 950 C CB . LYS A 1 124 ? -38.729 21.316 -64.154 1.00 50.44 ? 119 LYS A CB 1 ATOM 951 C CG . LYS A 1 124 ? -37.266 21.600 -64.054 1.00 59.10 ? 119 LYS A CG 1 ATOM 952 C CD . LYS A 1 124 ? -36.449 20.602 -64.852 1.00 64.74 ? 119 LYS A CD 1 ATOM 953 C CE . LYS A 1 124 ? -34.965 20.843 -64.613 1.00 70.20 ? 119 LYS A CE 1 ATOM 954 N NZ . LYS A 1 124 ? -34.154 20.403 -65.779 1.00 82.48 ? 119 LYS A NZ 1 ATOM 955 N N . SER A 1 125 ? -41.766 21.472 -64.389 1.00 54.80 ? 120 SER A N 1 ATOM 956 C CA . SER A 1 125 ? -42.934 21.099 -65.193 1.00 53.44 ? 120 SER A CA 1 ATOM 957 C C . SER A 1 125 ? -43.855 22.264 -65.524 1.00 52.67 ? 120 SER A C 1 ATOM 958 O O . SER A 1 125 ? -44.723 22.158 -66.390 1.00 61.46 ? 120 SER A O 1 ATOM 959 C CB . SER A 1 125 ? -43.739 20.075 -64.427 1.00 56.95 ? 120 SER A CB 1 ATOM 960 O OG . SER A 1 125 ? -44.164 20.645 -63.203 1.00 59.57 ? 120 SER A OG 1 ATOM 961 N N . SER A 1 126 ? -43.665 23.377 -64.831 1.00 49.41 ? 121 SER A N 1 ATOM 962 C CA . SER A 1 126 ? -44.499 24.534 -65.022 1.00 49.46 ? 121 SER A CA 1 ATOM 963 C C . SER A 1 126 ? -44.166 25.308 -66.322 1.00 55.43 ? 121 SER A C 1 ATOM 964 O O . SER A 1 126 ? -44.976 26.118 -66.792 1.00 52.88 ? 121 SER A O 1 ATOM 965 C CB . SER A 1 126 ? -44.405 25.438 -63.813 1.00 46.28 ? 121 SER A CB 1 ATOM 966 O OG . SER A 1 126 ? -43.229 26.164 -63.905 1.00 52.03 ? 121 SER A OG 1 ATOM 967 N N . TRP A 1 127 ? -43.004 25.047 -66.917 1.00 56.06 ? 122 TRP A N 1 ATOM 968 C CA . TRP A 1 127 ? -42.655 25.674 -68.197 1.00 60.42 ? 122 TRP A CA 1 ATOM 969 C C . TRP A 1 127 ? -43.231 24.874 -69.399 1.00 68.92 ? 122 TRP A C 1 ATOM 970 O O . TRP A 1 127 ? -42.555 24.008 -69.983 1.00 78.38 ? 122 TRP A O 1 ATOM 971 C CB . TRP A 1 127 ? -41.141 25.779 -68.334 1.00 56.79 ? 122 TRP A CB 1 ATOM 972 C CG . TRP A 1 127 ? -40.519 26.510 -67.239 1.00 50.50 ? 122 TRP A CG 1 ATOM 973 C CD1 . TRP A 1 127 ? -39.813 25.982 -66.187 1.00 48.34 ? 122 TRP A CD1 1 ATOM 974 C CD2 . TRP A 1 127 ? -40.520 27.908 -67.052 1.00 44.40 ? 122 TRP A CD2 1 ATOM 975 N NE1 . TRP A 1 127 ? -39.399 26.976 -65.354 1.00 42.65 ? 122 TRP A NE1 1 ATOM 976 C CE2 . TRP A 1 127 ? -39.819 28.169 -65.854 1.00 41.35 ? 122 TRP A CE2 1 ATOM 977 C CE3 . TRP A 1 127 ? -41.095 28.966 -67.737 1.00 43.35 ? 122 TRP A CE3 1 ATOM 978 C CZ2 . TRP A 1 127 ? -39.663 29.452 -65.332 1.00 43.68 ? 122 TRP A CZ2 1 ATOM 979 C CZ3 . TRP A 1 127 ? -40.940 30.251 -67.216 1.00 45.51 ? 122 TRP A CZ3 1 ATOM 980 C CH2 . TRP A 1 127 ? -40.204 30.484 -66.035 1.00 43.67 ? 122 TRP A CH2 1 ATOM 981 N N . THR A 1 128 ? -44.479 25.139 -69.765 1.00 63.66 ? 123 THR A N 1 ATOM 982 C CA . THR A 1 128 ? -45.144 24.308 -70.805 1.00 63.84 ? 123 THR A CA 1 ATOM 983 C C . THR A 1 128 ? -44.750 24.687 -72.229 1.00 57.35 ? 123 THR A C 1 ATOM 984 O O . THR A 1 128 ? -44.692 23.818 -73.109 1.00 57.69 ? 123 THR A O 1 ATOM 985 C CB . THR A 1 128 ? -46.657 24.363 -70.683 1.00 64.60 ? 123 THR A CB 1 ATOM 986 O OG1 . THR A 1 128 ? -47.064 25.736 -70.649 1.00 64.65 ? 123 THR A OG1 1 ATOM 987 C CG2 . THR A 1 128 ? -47.093 23.665 -69.390 1.00 70.09 ? 123 THR A CG2 1 ATOM 988 N N . ASN A 1 129 ? -44.385 25.953 -72.430 1.00 51.35 ? 124 ASN A N 1 ATOM 989 C CA . ASN A 1 129 ? -44.019 26.444 -73.761 1.00 51.91 ? 124 ASN A CA 1 ATOM 990 C C . ASN A 1 129 ? -42.538 26.568 -74.058 1.00 51.65 ? 124 ASN A C 1 ATOM 991 O O . ASN A 1 129 ? -42.187 27.127 -75.099 1.00 53.66 ? 124 ASN A O 1 ATOM 992 C CB . ASN A 1 129 ? -44.720 27.775 -74.011 1.00 58.77 ? 124 ASN A CB 1 ATOM 993 C CG . ASN A 1 129 ? -46.230 27.645 -73.903 1.00 60.74 ? 124 ASN A CG 1 ATOM 994 O OD1 . ASN A 1 129 ? -46.802 26.643 -74.309 1.00 61.29 ? 124 ASN A OD1 1 ATOM 995 N ND2 . ASN A 1 129 ? -46.865 28.634 -73.323 1.00 63.48 ? 124 ASN A ND2 1 ATOM 996 N N . HIS A 1 130 ? -41.677 26.090 -73.144 1.00 48.83 ? 125 HIS A N 1 ATOM 997 C CA . HIS A 1 130 ? -40.236 26.144 -73.349 1.00 43.94 ? 125 HIS A CA 1 ATOM 998 C C . HIS A 1 130 ? -39.617 24.813 -73.052 1.00 42.49 ? 125 HIS A C 1 ATOM 999 O O . HIS A 1 130 ? -40.162 24.050 -72.291 1.00 48.30 ? 125 HIS A O 1 ATOM 1000 C CB . HIS A 1 130 ? -39.608 27.227 -72.471 1.00 42.41 ? 125 HIS A CB 1 ATOM 1001 C CG . HIS A 1 130 ? -40.154 28.593 -72.721 1.00 38.64 ? 125 HIS A CG 1 ATOM 1002 N ND1 . HIS A 1 130 ? -41.354 29.007 -72.182 1.00 39.28 ? 125 HIS A ND1 1 ATOM 1003 C CD2 . HIS A 1 130 ? -39.687 29.633 -73.470 1.00 37.56 ? 125 HIS A CD2 1 ATOM 1004 C CE1 . HIS A 1 130 ? -41.592 30.253 -72.563 1.00 39.87 ? 125 HIS A CE1 1 ATOM 1005 N NE2 . HIS A 1 130 ? -40.604 30.648 -73.361 1.00 39.63 ? 125 HIS A NE2 1 ATOM 1006 N N . GLU A 1 131 ? -38.459 24.570 -73.628 1.00 42.57 ? 126 GLU A N 1 ATOM 1007 C CA . GLU A 1 131 ? -37.710 23.334 -73.386 1.00 52.64 ? 126 GLU A CA 1 ATOM 1008 C C . GLU A 1 131 ? -36.973 23.450 -72.040 1.00 50.32 ? 126 GLU A C 1 ATOM 1009 O O . GLU A 1 131 ? -36.215 24.412 -71.826 1.00 48.47 ? 126 GLU A O 1 ATOM 1010 C CB . GLU A 1 131 ? -36.644 23.164 -74.473 1.00 56.38 ? 126 GLU A CB 1 ATOM 1011 C CG . GLU A 1 131 ? -36.581 21.853 -75.202 1.00 61.28 ? 126 GLU A CG 1 ATOM 1012 C CD . GLU A 1 131 ? -37.233 20.699 -74.495 1.00 64.09 ? 126 GLU A CD 1 ATOM 1013 O OE1 . GLU A 1 131 ? -36.699 20.204 -73.467 1.00 65.07 ? 126 GLU A OE1 1 ATOM 1014 O OE2 . GLU A 1 131 ? -38.280 20.275 -75.037 1.00 65.70 ? 126 GLU A OE2 1 ATOM 1015 N N . THR A 1 132 ? -37.153 22.483 -71.157 1.00 51.95 ? 127 THR A N 1 ATOM 1016 C CA . THR A 1 132 ? -36.492 22.508 -69.838 1.00 51.82 ? 127 THR A CA 1 ATOM 1017 C C . THR A 1 132 ? -35.429 21.419 -69.628 1.00 49.51 ? 127 THR A C 1 ATOM 1018 O O . THR A 1 132 ? -34.864 21.312 -68.565 1.00 54.65 ? 127 THR A O 1 ATOM 1019 C CB . THR A 1 132 ? -37.521 22.335 -68.730 1.00 55.44 ? 127 THR A CB 1 ATOM 1020 O OG1 . THR A 1 132 ? -38.090 21.038 -68.821 1.00 53.66 ? 127 THR A OG1 1 ATOM 1021 C CG2 . THR A 1 132 ? -38.620 23.376 -68.842 1.00 58.46 ? 127 THR A CG2 1 ATOM 1022 N N . SER A 1 133 ? -35.157 20.619 -70.642 1.00 49.26 ? 128 SER A N 1 ATOM 1023 C CA . SER A 1 133 ? -34.286 19.466 -70.472 1.00 54.85 ? 128 SER A CA 1 ATOM 1024 C C . SER A 1 133 ? -33.038 19.514 -71.351 1.00 54.57 ? 128 SER A C 1 ATOM 1025 O O . SER A 1 133 ? -32.224 18.600 -71.281 1.00 56.53 ? 128 SER A O 1 ATOM 1026 C CB . SER A 1 133 ? -35.073 18.208 -70.806 1.00 59.86 ? 128 SER A CB 1 ATOM 1027 O OG . SER A 1 133 ? -35.346 18.174 -72.214 1.00 63.25 ? 128 SER A OG 1 ATOM 1028 N N . LEU A 1 134 ? -32.908 20.569 -72.170 1.00 53.38 ? 129 LEU A N 1 ATOM 1029 C CA . LEU A 1 134 ? -31.789 20.753 -73.124 1.00 51.94 ? 129 LEU A CA 1 ATOM 1030 C C . LEU A 1 134 ? -30.735 21.777 -72.717 1.00 46.70 ? 129 LEU A C 1 ATOM 1031 O O . LEU A 1 134 ? -29.729 21.933 -73.409 1.00 43.54 ? 129 LEU A O 1 ATOM 1032 C CB . LEU A 1 134 ? -32.320 21.184 -74.481 1.00 56.82 ? 129 LEU A CB 1 ATOM 1033 C CG . LEU A 1 134 ? -32.584 20.095 -75.540 1.00 63.63 ? 129 LEU A CG 1 ATOM 1034 C CD1 . LEU A 1 134 ? -33.129 18.787 -74.982 1.00 63.68 ? 129 LEU A CD1 1 ATOM 1035 C CD2 . LEU A 1 134 ? -33.523 20.659 -76.610 1.00 62.46 ? 129 LEU A CD2 1 ATOM 1036 N N . GLY A 1 135 ? -30.944 22.440 -71.588 1.00 39.25 ? 130 GLY A N 1 ATOM 1037 C CA . GLY A 1 135 ? -29.969 23.395 -71.097 1.00 41.24 ? 130 GLY A CA 1 ATOM 1038 C C . GLY A 1 135 ? -28.924 22.781 -70.196 1.00 39.31 ? 130 GLY A C 1 ATOM 1039 O O . GLY A 1 135 ? -28.997 22.867 -68.961 1.00 37.45 ? 130 GLY A O 1 ATOM 1040 N N . VAL A 1 136 ? -27.995 22.095 -70.827 1.00 37.47 ? 131 VAL A N 1 ATOM 1041 C CA . VAL A 1 136 ? -27.004 21.323 -70.112 1.00 39.40 ? 131 VAL A CA 1 ATOM 1042 C C . VAL A 1 136 ? -25.739 21.522 -70.884 1.00 39.49 ? 131 VAL A C 1 ATOM 1043 O O . VAL A 1 136 ? -25.787 21.892 -72.044 1.00 39.84 ? 131 VAL A O 1 ATOM 1044 C CB . VAL A 1 136 ? -27.353 19.803 -70.038 1.00 41.79 ? 131 VAL A CB 1 ATOM 1045 C CG1 . VAL A 1 136 ? -28.599 19.559 -69.171 1.00 42.05 ? 131 VAL A CG1 1 ATOM 1046 C CG2 . VAL A 1 136 ? -27.524 19.175 -71.423 1.00 38.28 ? 131 VAL A CG2 1 ATOM 1047 N N . SER A 1 137 ? -24.612 21.232 -70.264 1.00 38.69 ? 132 SER A N 1 ATOM 1048 C CA . SER A 1 137 ? -23.349 21.491 -70.877 1.00 38.24 ? 132 SER A CA 1 ATOM 1049 C C . SER A 1 137 ? -22.309 20.526 -70.381 1.00 41.27 ? 132 SER A C 1 ATOM 1050 O O . SER A 1 137 ? -22.366 20.086 -69.212 1.00 46.45 ? 132 SER A O 1 ATOM 1051 C CB . SER A 1 137 ? -22.945 22.899 -70.487 1.00 41.18 ? 132 SER A CB 1 ATOM 1052 O OG . SER A 1 137 ? -21.652 23.202 -70.950 1.00 46.92 ? 132 SER A OG 1 ATOM 1053 N N . ALA A 1 138 ? -21.356 20.199 -71.257 1.00 39.36 ? 133 ALA A N 1 ATOM 1054 C CA . ALA A 1 138 ? -20.174 19.414 -70.867 1.00 39.95 ? 133 ALA A CA 1 ATOM 1055 C C . ALA A 1 138 ? -19.376 20.141 -69.811 1.00 41.04 ? 133 ALA A C 1 ATOM 1056 O O . ALA A 1 138 ? -18.584 19.525 -69.126 1.00 37.97 ? 133 ALA A O 1 ATOM 1057 C CB . ALA A 1 138 ? -19.279 19.120 -72.059 1.00 38.97 ? 133 ALA A CB 1 ATOM 1058 N N . ALA A 1 139 ? -19.593 21.455 -69.671 1.00 43.99 ? 134 ALA A N 1 ATOM 1059 C CA . ALA A 1 139 ? -18.915 22.219 -68.617 1.00 44.07 ? 134 ALA A CA 1 ATOM 1060 C C . ALA A 1 139 ? -19.446 21.886 -67.200 1.00 47.40 ? 134 ALA A C 1 ATOM 1061 O O . ALA A 1 139 ? -18.795 22.171 -66.221 1.00 47.53 ? 134 ALA A O 1 ATOM 1062 C CB . ALA A 1 139 ? -19.023 23.712 -68.878 1.00 44.80 ? 134 ALA A CB 1 ATOM 1063 N N . CYS A 1 140 ? -20.628 21.297 -67.121 1.00 45.37 ? 135 CYS A N 1 ATOM 1064 C CA . CYS A 1 140 ? -21.254 20.962 -65.857 1.00 41.11 ? 135 CYS A CA 1 ATOM 1065 C C . CYS A 1 140 ? -21.722 19.481 -65.858 1.00 39.34 ? 135 CYS A C 1 ATOM 1066 O O . CYS A 1 140 ? -22.925 19.172 -65.868 1.00 33.59 ? 135 CYS A O 1 ATOM 1067 C CB . CYS A 1 140 ? -22.463 21.869 -65.622 1.00 39.77 ? 135 CYS A CB 1 ATOM 1068 S SG . CYS A 1 140 ? -22.099 23.626 -65.534 1.00 45.58 ? 135 CYS A SG 1 ATOM 1069 N N . PRO A 1 141 ? -20.781 18.554 -65.849 1.00 37.14 ? 136 PRO A N 1 ATOM 1070 C CA . PRO A 1 141 ? -21.175 17.145 -65.960 1.00 35.66 ? 136 PRO A CA 1 ATOM 1071 C C . PRO A 1 141 ? -21.732 16.649 -64.673 1.00 38.89 ? 136 PRO A C 1 ATOM 1072 O O . PRO A 1 141 ? -21.328 17.100 -63.607 1.00 36.25 ? 136 PRO A O 1 ATOM 1073 C CB . PRO A 1 141 ? -19.861 16.436 -66.288 1.00 39.01 ? 136 PRO A CB 1 ATOM 1074 C CG . PRO A 1 141 ? -18.783 17.355 -65.765 1.00 40.20 ? 136 PRO A CG 1 ATOM 1075 C CD . PRO A 1 141 ? -19.323 18.762 -65.853 1.00 40.26 ? 136 PRO A CD 1 ATOM 1076 N N . TYR A 1 142 ? -22.624 15.692 -64.775 1.00 42.94 ? 137 TYR A N 1 ATOM 1077 C CA . TYR A 1 142 ? -23.064 14.920 -63.651 1.00 52.53 ? 137 TYR A CA 1 ATOM 1078 C C . TYR A 1 142 ? -23.133 13.454 -64.041 1.00 62.84 ? 137 TYR A C 1 ATOM 1079 O O . TYR A 1 142 ? -23.962 13.049 -64.875 1.00 62.19 ? 137 TYR A O 1 ATOM 1080 C CB . TYR A 1 142 ? -24.406 15.416 -63.196 1.00 57.37 ? 137 TYR A CB 1 ATOM 1081 C CG . TYR A 1 142 ? -24.997 14.642 -62.068 1.00 69.42 ? 137 TYR A CG 1 ATOM 1082 C CD1 . TYR A 1 142 ? -24.250 14.364 -60.904 1.00 75.71 ? 137 TYR A CD1 1 ATOM 1083 C CD2 . TYR A 1 142 ? -26.319 14.200 -62.144 1.00 83.68 ? 137 TYR A CD2 1 ATOM 1084 C CE1 . TYR A 1 142 ? -24.800 13.635 -59.868 1.00 82.32 ? 137 TYR A CE1 1 ATOM 1085 C CE2 . TYR A 1 142 ? -26.885 13.482 -61.119 1.00 95.41 ? 137 TYR A CE2 1 ATOM 1086 C CZ . TYR A 1 142 ? -26.132 13.201 -59.985 1.00 99.76 ? 137 TYR A CZ 1 ATOM 1087 O OH . TYR A 1 142 ? -26.743 12.474 -58.988 1.00 118.39 ? 137 TYR A OH 1 ATOM 1088 N N . GLN A 1 143 ? -22.210 12.673 -63.458 1.00 71.99 ? 138 GLN A N 1 ATOM 1089 C CA . GLN A 1 143 ? -21.985 11.281 -63.822 1.00 68.74 ? 138 GLN A CA 1 ATOM 1090 C C . GLN A 1 143 ? -21.387 11.253 -65.217 1.00 68.63 ? 138 GLN A C 1 ATOM 1091 O O . GLN A 1 143 ? -21.861 10.509 -66.082 1.00 59.31 ? 138 GLN A O 1 ATOM 1092 C CB . GLN A 1 143 ? -23.286 10.485 -63.690 1.00 69.26 ? 138 GLN A CB 1 ATOM 1093 C CG . GLN A 1 143 ? -23.625 10.257 -62.227 1.00 75.16 ? 138 GLN A CG 1 ATOM 1094 C CD . GLN A 1 143 ? -25.081 9.945 -61.944 1.00 80.70 ? 138 GLN A CD 1 ATOM 1095 O OE1 . GLN A 1 143 ? -25.983 10.353 -62.676 1.00 81.69 ? 138 GLN A OE1 1 ATOM 1096 N NE2 . GLN A 1 143 ? -25.317 9.256 -60.833 1.00 88.27 ? 138 GLN A NE2 1 ATOM 1097 N N . GLY A 1 144 ? -20.400 12.138 -65.451 1.00 68.87 ? 139 GLY A N 1 ATOM 1098 C CA . GLY A 1 144 ? -19.699 12.233 -66.767 1.00 70.74 ? 139 GLY A CA 1 ATOM 1099 C C . GLY A 1 144 ? -20.486 12.773 -67.973 1.00 76.67 ? 139 GLY A C 1 ATOM 1100 O O . GLY A 1 144 ? -19.878 13.187 -68.975 1.00 64.27 ? 139 GLY A O 1 ATOM 1101 N N . THR A 1 145 ? -21.834 12.734 -67.852 1.00 80.03 ? 140 THR A N 1 ATOM 1102 C CA . THR A 1 145 ? -22.854 13.230 -68.835 1.00 66.76 ? 140 THR A CA 1 ATOM 1103 C C . THR A 1 145 ? -23.234 14.754 -68.659 1.00 53.83 ? 140 THR A C 1 ATOM 1104 O O . THR A 1 145 ? -23.256 15.292 -67.564 1.00 49.42 ? 140 THR A O 1 ATOM 1105 C CB . THR A 1 145 ? -24.129 12.306 -68.854 1.00 72.96 ? 140 THR A CB 1 ATOM 1106 O OG1 . THR A 1 145 ? -25.225 12.982 -69.476 1.00 66.52 ? 140 THR A OG1 1 ATOM 1107 C CG2 . THR A 1 145 ? -24.615 11.910 -67.473 1.00 79.78 ? 140 THR A CG2 1 ATOM 1108 N N . PRO A 1 146 ? -23.475 15.472 -69.758 1.00 50.73 ? 141 PRO A N 1 ATOM 1109 C CA . PRO A 1 146 ? -23.656 16.923 -69.594 1.00 46.05 ? 141 PRO A CA 1 ATOM 1110 C C . PRO A 1 146 ? -24.832 17.282 -68.722 1.00 39.82 ? 141 PRO A C 1 ATOM 1111 O O . PRO A 1 146 ? -25.835 16.599 -68.759 1.00 39.31 ? 141 PRO A O 1 ATOM 1112 C CB . PRO A 1 146 ? -23.889 17.394 -71.017 1.00 45.67 ? 141 PRO A CB 1 ATOM 1113 C CG . PRO A 1 146 ? -23.108 16.428 -71.862 1.00 46.22 ? 141 PRO A CG 1 ATOM 1114 C CD . PRO A 1 146 ? -23.339 15.106 -71.184 1.00 50.04 ? 141 PRO A CD 1 ATOM 1115 N N . SER A 1 147 ? -24.667 18.293 -67.876 1.00 35.39 ? 142 SER A N 1 ATOM 1116 C CA . SER A 1 147 ? -25.736 18.669 -66.936 1.00 35.98 ? 142 SER A CA 1 ATOM 1117 C C . SER A 1 147 ? -25.688 20.151 -66.685 1.00 32.77 ? 142 SER A C 1 ATOM 1118 O O . SER A 1 147 ? -25.229 20.921 -67.547 1.00 33.48 ? 142 SER A O 1 ATOM 1119 C CB . SER A 1 147 ? -25.624 17.882 -65.621 1.00 39.18 ? 142 SER A CB 1 ATOM 1120 O OG . SER A 1 147 ? -26.779 18.039 -64.814 1.00 41.88 ? 142 SER A OG 1 ATOM 1121 N N . PHE A 1 148 ? -26.085 20.560 -65.497 1.00 29.91 ? 143 PHE A N 1 ATOM 1122 C CA . PHE A 1 148 ? -26.130 21.959 -65.208 1.00 31.53 ? 143 PHE A CA 1 ATOM 1123 C C . PHE A 1 148 ? -26.424 22.209 -63.733 1.00 32.26 ? 143 PHE A C 1 ATOM 1124 O O . PHE A 1 148 ? -26.879 21.305 -63.016 1.00 35.23 ? 143 PHE A O 1 ATOM 1125 C CB . PHE A 1 148 ? -27.236 22.568 -66.081 1.00 31.56 ? 143 PHE A CB 1 ATOM 1126 C CG . PHE A 1 148 ? -27.201 24.085 -66.163 1.00 33.57 ? 143 PHE A CG 1 ATOM 1127 C CD1 . PHE A 1 148 ? -26.214 24.726 -66.843 1.00 34.91 ? 143 PHE A CD1 1 ATOM 1128 C CD2 . PHE A 1 148 ? -28.189 24.835 -65.572 1.00 36.08 ? 143 PHE A CD2 1 ATOM 1129 C CE1 . PHE A 1 148 ? -26.176 26.100 -66.929 1.00 35.07 ? 143 PHE A CE1 1 ATOM 1130 C CE2 . PHE A 1 148 ? -28.186 26.197 -65.680 1.00 36.39 ? 143 PHE A CE2 1 ATOM 1131 C CZ . PHE A 1 148 ? -27.157 26.832 -66.345 1.00 36.00 ? 143 PHE A CZ 1 ATOM 1132 N N . PHE A 1 149 ? -26.227 23.456 -63.306 1.00 32.25 ? 144 PHE A N 1 ATOM 1133 C CA . PHE A 1 149 ? -26.580 23.886 -61.963 1.00 33.62 ? 144 PHE A CA 1 ATOM 1134 C C . PHE A 1 149 ? -27.979 23.372 -61.641 1.00 35.79 ? 144 PHE A C 1 ATOM 1135 O O . PHE A 1 149 ? -28.889 23.577 -62.403 1.00 33.53 ? 144 PHE A O 1 ATOM 1136 C CB . PHE A 1 149 ? -26.619 25.413 -61.868 1.00 33.92 ? 144 PHE A CB 1 ATOM 1137 C CG . PHE A 1 149 ? -25.310 26.099 -62.125 1.00 30.69 ? 144 PHE A CG 1 ATOM 1138 C CD1 . PHE A 1 149 ? -24.331 26.105 -61.183 1.00 30.36 ? 144 PHE A CD1 1 ATOM 1139 C CD2 . PHE A 1 149 ? -25.091 26.783 -63.329 1.00 30.70 ? 144 PHE A CD2 1 ATOM 1140 C CE1 . PHE A 1 149 ? -23.121 26.753 -61.434 1.00 30.89 ? 144 PHE A CE1 1 ATOM 1141 C CE2 . PHE A 1 149 ? -23.909 27.445 -63.584 1.00 29.20 ? 144 PHE A CE2 1 ATOM 1142 C CZ . PHE A 1 149 ? -22.911 27.421 -62.633 1.00 30.18 ? 144 PHE A CZ 1 ATOM 1143 N N . ARG A 1 150 ? -28.144 22.741 -60.493 1.00 38.37 ? 145 ARG A N 1 ATOM 1144 C CA . ARG A 1 150 ? -29.397 22.071 -60.148 1.00 41.60 ? 145 ARG A CA 1 ATOM 1145 C C . ARG A 1 150 ? -30.500 22.944 -59.564 1.00 36.65 ? 145 ARG A C 1 ATOM 1146 O O . ARG A 1 150 ? -31.636 22.497 -59.507 1.00 32.53 ? 145 ARG A O 1 ATOM 1147 C CB . ARG A 1 150 ? -29.126 20.891 -59.206 1.00 47.32 ? 145 ARG A CB 1 ATOM 1148 C CG . ARG A 1 150 ? -28.267 19.857 -59.928 1.00 57.82 ? 145 ARG A CG 1 ATOM 1149 C CD . ARG A 1 150 ? -27.508 18.935 -58.999 1.00 66.76 ? 145 ARG A CD 1 ATOM 1150 N NE . ARG A 1 150 ? -28.443 18.035 -58.363 1.00 74.70 ? 145 ARG A NE 1 ATOM 1151 C CZ . ARG A 1 150 ? -29.089 17.072 -59.000 1.00 85.87 ? 145 ARG A CZ 1 ATOM 1152 N NH1 . ARG A 1 150 ? -28.860 16.851 -60.308 1.00 83.81 ? 145 ARG A NH1 1 ATOM 1153 N NH2 . ARG A 1 150 ? -29.959 16.324 -58.321 1.00 82.06 ? 145 ARG A NH2 1 ATOM 1154 N N . ASN A 1 151 ? -30.189 24.157 -59.151 1.00 32.81 ? 146 ASN A N 1 ATOM 1155 C CA . ASN A 1 151 ? -31.187 25.012 -58.546 1.00 32.83 ? 146 ASN A CA 1 ATOM 1156 C C . ASN A 1 151 ? -31.815 26.041 -59.484 1.00 33.31 ? 146 ASN A C 1 ATOM 1157 O O . ASN A 1 151 ? -32.705 26.754 -59.075 1.00 32.46 ? 146 ASN A O 1 ATOM 1158 C CB . ASN A 1 151 ? -30.591 25.695 -57.347 1.00 34.48 ? 146 ASN A CB 1 ATOM 1159 C CG . ASN A 1 151 ? -30.118 24.704 -56.292 1.00 36.13 ? 146 ASN A CG 1 ATOM 1160 O OD1 . ASN A 1 151 ? -29.084 24.924 -55.633 1.00 37.76 ? 146 ASN A OD1 1 ATOM 1161 N ND2 . ASN A 1 151 ? -30.836 23.619 -56.135 1.00 32.64 ? 146 ASN A ND2 1 ATOM 1162 N N . VAL A 1 152 ? -31.318 26.124 -60.717 1.00 32.94 ? 147 VAL A N 1 ATOM 1163 C CA . VAL A 1 152 ? -31.813 27.029 -61.699 1.00 33.84 ? 147 VAL A CA 1 ATOM 1164 C C . VAL A 1 152 ? -31.968 26.259 -62.993 1.00 33.26 ? 147 VAL A C 1 ATOM 1165 O O . VAL A 1 152 ? -31.409 25.188 -63.108 1.00 35.57 ? 147 VAL A O 1 ATOM 1166 C CB . VAL A 1 152 ? -30.876 28.261 -61.926 1.00 36.51 ? 147 VAL A CB 1 ATOM 1167 C CG1 . VAL A 1 152 ? -30.854 29.174 -60.708 1.00 35.14 ? 147 VAL A CG1 1 ATOM 1168 C CG2 . VAL A 1 152 ? -29.466 27.816 -62.280 1.00 38.18 ? 147 VAL A CG2 1 ATOM 1169 N N . VAL A 1 153 ? -32.704 26.815 -63.959 1.00 32.94 ? 148 VAL A N 1 ATOM 1170 C CA . VAL A 1 153 ? -33.029 26.119 -65.195 1.00 35.10 ? 148 VAL A CA 1 ATOM 1171 C C . VAL A 1 153 ? -32.714 26.923 -66.419 1.00 34.84 ? 148 VAL A C 1 ATOM 1172 O O . VAL A 1 153 ? -33.208 28.015 -66.578 1.00 38.02 ? 148 VAL A O 1 ATOM 1173 C CB . VAL A 1 153 ? -34.529 25.804 -65.310 1.00 40.99 ? 148 VAL A CB 1 ATOM 1174 C CG1 . VAL A 1 153 ? -34.777 24.898 -66.503 1.00 41.35 ? 148 VAL A CG1 1 ATOM 1175 C CG2 . VAL A 1 153 ? -35.017 25.075 -64.089 1.00 42.85 ? 148 VAL A CG2 1 ATOM 1176 N N . TRP A 1 154 ? -31.938 26.339 -67.318 1.00 33.68 ? 149 TRP A N 1 ATOM 1177 C CA . TRP A 1 154 ? -31.528 27.011 -68.521 1.00 32.65 ? 149 TRP A CA 1 ATOM 1178 C C . TRP A 1 154 ? -32.576 26.694 -69.558 1.00 35.88 ? 149 TRP A C 1 ATOM 1179 O O . TRP A 1 154 ? -32.500 25.687 -70.257 1.00 34.68 ? 149 TRP A O 1 ATOM 1180 C CB . TRP A 1 154 ? -30.157 26.481 -68.919 1.00 34.24 ? 149 TRP A CB 1 ATOM 1181 C CG . TRP A 1 154 ? -29.547 27.045 -70.167 1.00 32.31 ? 149 TRP A CG 1 ATOM 1182 C CD1 . TRP A 1 154 ? -30.027 28.037 -70.935 1.00 34.06 ? 149 TRP A CD1 1 ATOM 1183 C CD2 . TRP A 1 154 ? -28.289 26.695 -70.712 1.00 32.73 ? 149 TRP A CD2 1 ATOM 1184 N NE1 . TRP A 1 154 ? -29.161 28.320 -71.931 1.00 33.26 ? 149 TRP A NE1 1 ATOM 1185 C CE2 . TRP A 1 154 ? -28.068 27.521 -71.800 1.00 32.01 ? 149 TRP A CE2 1 ATOM 1186 C CE3 . TRP A 1 154 ? -27.290 25.800 -70.334 1.00 33.13 ? 149 TRP A CE3 1 ATOM 1187 C CZ2 . TRP A 1 154 ? -26.920 27.452 -72.557 1.00 33.39 ? 149 TRP A CZ2 1 ATOM 1188 C CZ3 . TRP A 1 154 ? -26.159 25.723 -71.095 1.00 34.51 ? 149 TRP A CZ3 1 ATOM 1189 C CH2 . TRP A 1 154 ? -25.996 26.526 -72.219 1.00 33.11 ? 149 TRP A CH2 1 ATOM 1190 N N . LEU A 1 155 ? -33.577 27.567 -69.654 1.00 36.13 ? 150 LEU A N 1 ATOM 1191 C CA . LEU A 1 155 ? -34.658 27.409 -70.629 1.00 34.43 ? 150 LEU A CA 1 ATOM 1192 C C . LEU A 1 155 ? -34.187 27.585 -72.085 1.00 35.95 ? 150 LEU A C 1 ATOM 1193 O O . LEU A 1 155 ? -33.429 28.492 -72.418 1.00 37.91 ? 150 LEU A O 1 ATOM 1194 C CB . LEU A 1 155 ? -35.760 28.388 -70.353 1.00 33.55 ? 150 LEU A CB 1 ATOM 1195 C CG . LEU A 1 155 ? -36.431 28.235 -69.018 1.00 35.16 ? 150 LEU A CG 1 ATOM 1196 C CD1 . LEU A 1 155 ? -37.367 29.368 -68.851 1.00 33.96 ? 150 LEU A CD1 1 ATOM 1197 C CD2 . LEU A 1 155 ? -37.171 26.913 -68.899 1.00 38.29 ? 150 LEU A CD2 1 ATOM 1198 N N . ILE A 1 156 ? -34.672 26.702 -72.937 1.00 35.60 ? 151 ILE A N 1 ATOM 1199 C CA . ILE A 1 156 ? -34.353 26.704 -74.372 1.00 40.68 ? 151 ILE A CA 1 ATOM 1200 C C . ILE A 1 156 ? -35.657 26.808 -75.223 1.00 43.13 ? 151 ILE A C 1 ATOM 1201 O O . ILE A 1 156 ? -36.753 26.501 -74.731 1.00 40.52 ? 151 ILE A O 1 ATOM 1202 C CB . ILE A 1 156 ? -33.572 25.402 -74.712 1.00 40.72 ? 151 ILE A CB 1 ATOM 1203 C CG1 . ILE A 1 156 ? -32.219 25.452 -74.031 1.00 43.20 ? 151 ILE A CG1 1 ATOM 1204 C CG2 . ILE A 1 156 ? -33.384 25.180 -76.217 1.00 42.11 ? 151 ILE A CG2 1 ATOM 1205 C CD1 . ILE A 1 156 ? -31.290 26.564 -74.495 1.00 42.24 ? 151 ILE A CD1 1 ATOM 1206 N N . LYS A 1 157 ? -35.541 27.280 -76.474 1.00 47.43 ? 152 LYS A N 1 ATOM 1207 C CA . LYS A 1 157 ? -36.721 27.358 -77.379 1.00 47.05 ? 152 LYS A CA 1 ATOM 1208 C C . LYS A 1 157 ? -37.369 25.975 -77.594 1.00 48.60 ? 152 LYS A C 1 ATOM 1209 O O . LYS A 1 157 ? -36.706 24.952 -77.459 1.00 49.34 ? 152 LYS A O 1 ATOM 1210 C CB . LYS A 1 157 ? -36.328 27.927 -78.701 1.00 46.02 ? 152 LYS A CB 1 ATOM 1211 C CG . LYS A 1 157 ? -35.605 26.932 -79.588 1.00 48.13 ? 152 LYS A CG 1 ATOM 1212 C CD . LYS A 1 157 ? -35.196 27.572 -80.901 1.00 47.23 ? 152 LYS A CD 1 ATOM 1213 C CE . LYS A 1 157 ? -34.524 26.561 -81.825 1.00 51.16 ? 152 LYS A CE 1 ATOM 1214 N NZ . LYS A 1 157 ? -33.887 27.241 -83.000 1.00 51.86 ? 152 LYS A NZ 1 ATOM 1215 N N . LYS A 1 158 ? -38.673 25.956 -77.829 1.00 48.38 ? 153 LYS A N 1 ATOM 1216 C CA . LYS A 1 158 ? -39.407 24.712 -77.997 1.00 55.02 ? 153 LYS A CA 1 ATOM 1217 C C . LYS A 1 158 ? -40.160 24.806 -79.290 1.00 60.04 ? 153 LYS A C 1 ATOM 1218 O O . LYS A 1 158 ? -40.700 25.858 -79.623 1.00 53.46 ? 153 LYS A O 1 ATOM 1219 C CB . LYS A 1 158 ? -40.380 24.454 -76.854 1.00 58.18 ? 153 LYS A CB 1 ATOM 1220 C CG . LYS A 1 158 ? -40.982 23.058 -76.857 1.00 62.13 ? 153 LYS A CG 1 ATOM 1221 C CD . LYS A 1 158 ? -42.029 22.886 -75.766 1.00 66.93 ? 153 LYS A CD 1 ATOM 1222 C CE . LYS A 1 158 ? -42.759 21.558 -75.928 1.00 73.82 ? 153 LYS A CE 1 ATOM 1223 N NZ . LYS A 1 158 ? -43.590 21.230 -74.736 1.00 77.68 ? 153 LYS A NZ 1 ATOM 1224 N N . ASN A 1 159 ? -40.195 23.688 -80.018 1.00 72.75 ? 154 ASN A N 1 ATOM 1225 C CA . ASN A 1 159 ? -40.592 23.711 -81.429 1.00 70.62 ? 154 ASN A CA 1 ATOM 1226 C C . ASN A 1 159 ? -39.610 24.735 -81.997 1.00 72.36 ? 154 ASN A C 1 ATOM 1227 O O . ASN A 1 159 ? -38.402 24.604 -81.721 1.00 82.48 ? 154 ASN A O 1 ATOM 1228 C CB . ASN A 1 159 ? -42.089 23.977 -81.528 1.00 67.86 ? 154 ASN A CB 1 ATOM 1229 C CG . ASN A 1 159 ? -42.891 22.973 -80.662 1.00 65.27 ? 154 ASN A CG 1 ATOM 1230 O OD1 . ASN A 1 159 ? -43.678 23.366 -79.807 1.00 67.78 ? 154 ASN A OD1 1 ATOM 1231 N ND2 . ASN A 1 159 ? -42.615 21.676 -80.830 1.00 58.67 ? 154 ASN A ND2 1 ATOM 1232 N N . ASP A 1 160 ? -40.001 25.749 -82.729 1.00 68.23 ? 155 ASP A N 1 ATOM 1233 C CA . ASP A 1 160 ? -38.935 26.708 -83.076 1.00 65.97 ? 155 ASP A CA 1 ATOM 1234 C C . ASP A 1 160 ? -39.305 28.065 -82.511 1.00 62.33 ? 155 ASP A C 1 ATOM 1235 O O . ASP A 1 160 ? -39.215 29.084 -83.185 1.00 59.76 ? 155 ASP A O 1 ATOM 1236 C CB . ASP A 1 160 ? -38.651 26.727 -84.587 1.00 72.54 ? 155 ASP A CB 1 ATOM 1237 C CG . ASP A 1 160 ? -37.384 27.510 -84.964 1.00 80.29 ? 155 ASP A CG 1 ATOM 1238 O OD1 . ASP A 1 160 ? -37.350 28.123 -86.057 1.00 86.11 ? 155 ASP A OD1 1 ATOM 1239 O OD2 . ASP A 1 160 ? -36.412 27.524 -84.198 1.00 82.28 ? 155 ASP A OD2 1 ATOM 1240 N N . ALA A 1 161 ? -39.736 28.073 -81.251 1.00 63.46 ? 156 ALA A N 1 ATOM 1241 C CA . ALA A 1 161 ? -40.203 29.324 -80.624 1.00 61.68 ? 156 ALA A CA 1 ATOM 1242 C C . ALA A 1 161 ? -39.811 29.496 -79.153 1.00 52.28 ? 156 ALA A C 1 ATOM 1243 O O . ALA A 1 161 ? -39.583 28.541 -78.435 1.00 46.04 ? 156 ALA A O 1 ATOM 1244 C CB . ALA A 1 161 ? -41.708 29.458 -80.785 1.00 58.01 ? 156 ALA A CB 1 ATOM 1245 N N . TYR A 1 162 ? -39.730 30.756 -78.750 1.00 50.42 ? 157 TYR A N 1 ATOM 1246 C CA . TYR A 1 162 ? -39.474 31.153 -77.373 1.00 47.61 ? 157 TYR A CA 1 ATOM 1247 C C . TYR A 1 162 ? -40.430 32.286 -77.126 1.00 44.62 ? 157 TYR A C 1 ATOM 1248 O O . TYR A 1 162 ? -40.111 33.453 -77.375 1.00 47.71 ? 157 TYR A O 1 ATOM 1249 C CB . TYR A 1 162 ? -37.990 31.589 -77.152 1.00 46.09 ? 157 TYR A CB 1 ATOM 1250 C CG . TYR A 1 162 ? -37.533 31.679 -75.688 1.00 43.41 ? 157 TYR A CG 1 ATOM 1251 C CD1 . TYR A 1 162 ? -38.056 32.637 -74.820 1.00 44.56 ? 157 TYR A CD1 1 ATOM 1252 C CD2 . TYR A 1 162 ? -36.532 30.846 -75.204 1.00 42.93 ? 157 TYR A CD2 1 ATOM 1253 C CE1 . TYR A 1 162 ? -37.608 32.744 -73.507 1.00 45.28 ? 157 TYR A CE1 1 ATOM 1254 C CE2 . TYR A 1 162 ? -36.082 30.943 -73.894 1.00 42.57 ? 157 TYR A CE2 1 ATOM 1255 C CZ . TYR A 1 162 ? -36.632 31.884 -73.046 1.00 42.72 ? 157 TYR A CZ 1 ATOM 1256 O OH . TYR A 1 162 ? -36.198 31.976 -71.750 1.00 48.03 ? 157 TYR A OH 1 ATOM 1257 N N . PRO A 1 163 ? -41.634 31.942 -76.670 1.00 43.98 ? 158 PRO A N 1 ATOM 1258 C CA . PRO A 1 163 ? -42.594 32.988 -76.352 1.00 45.08 ? 158 PRO A CA 1 ATOM 1259 C C . PRO A 1 163 ? -42.174 33.725 -75.111 1.00 45.48 ? 158 PRO A C 1 ATOM 1260 O O . PRO A 1 163 ? -41.446 33.189 -74.304 1.00 44.72 ? 158 PRO A O 1 ATOM 1261 C CB . PRO A 1 163 ? -43.892 32.219 -76.075 1.00 43.49 ? 158 PRO A CB 1 ATOM 1262 C CG . PRO A 1 163 ? -43.524 30.808 -75.869 1.00 42.74 ? 158 PRO A CG 1 ATOM 1263 C CD . PRO A 1 163 ? -42.195 30.581 -76.530 1.00 44.57 ? 158 PRO A CD 1 ATOM 1264 N N . THR A 1 164 ? -42.651 34.942 -74.985 1.00 46.15 ? 159 THR A N 1 ATOM 1265 C CA . THR A 1 164 ? -42.204 35.829 -73.968 1.00 48.33 ? 159 THR A CA 1 ATOM 1266 C C . THR A 1 164 ? -42.729 35.363 -72.653 1.00 49.10 ? 159 THR A C 1 ATOM 1267 O O . THR A 1 164 ? -43.936 35.215 -72.481 1.00 54.10 ? 159 THR A O 1 ATOM 1268 C CB . THR A 1 164 ? -42.687 37.243 -74.251 1.00 49.28 ? 159 THR A CB 1 ATOM 1269 O OG1 . THR A 1 164 ? -42.057 37.694 -75.461 1.00 53.41 ? 159 THR A OG1 1 ATOM 1270 C CG2 . THR A 1 164 ? -42.338 38.172 -73.107 1.00 48.99 ? 159 THR A CG2 1 ATOM 1271 N N . ILE A 1 165 ? -41.810 35.156 -71.719 1.00 46.63 ? 160 ILE A N 1 ATOM 1272 C CA . ILE A 1 165 ? -42.144 34.678 -70.379 1.00 45.51 ? 160 ILE A CA 1 ATOM 1273 C C . ILE A 1 165 ? -42.611 35.832 -69.549 1.00 41.58 ? 160 ILE A C 1 ATOM 1274 O O . ILE A 1 165 ? -42.010 36.903 -69.623 1.00 41.68 ? 160 ILE A O 1 ATOM 1275 C CB . ILE A 1 165 ? -40.919 34.013 -69.721 1.00 45.84 ? 160 ILE A CB 1 ATOM 1276 C CG1 . ILE A 1 165 ? -40.627 32.681 -70.422 1.00 45.21 ? 160 ILE A CG1 1 ATOM 1277 C CG2 . ILE A 1 165 ? -41.168 33.778 -68.255 1.00 46.57 ? 160 ILE A CG2 1 ATOM 1278 C CD1 . ILE A 1 165 ? -39.202 32.219 -70.247 1.00 47.56 ? 160 ILE A CD1 1 ATOM 1279 N N . LYS A 1 166 ? -43.716 35.638 -68.811 1.00 44.88 ? 161 LYS A N 1 ATOM 1280 C CA . LYS A 1 166 ? -44.182 36.620 -67.793 1.00 48.40 ? 161 LYS A CA 1 ATOM 1281 C C . LYS A 1 166 ? -44.686 35.848 -66.639 1.00 48.68 ? 161 LYS A C 1 ATOM 1282 O O . LYS A 1 166 ? -45.770 35.306 -66.707 1.00 53.68 ? 161 LYS A O 1 ATOM 1283 C CB . LYS A 1 166 ? -45.325 37.534 -68.262 1.00 52.86 ? 161 LYS A CB 1 ATOM 1284 C CG . LYS A 1 166 ? -44.970 38.422 -69.433 1.00 59.50 ? 161 LYS A CG 1 ATOM 1285 C CD . LYS A 1 166 ? -46.110 39.331 -69.855 1.00 69.15 ? 161 LYS A CD 1 ATOM 1286 C CE . LYS A 1 166 ? -45.856 39.884 -71.270 1.00 73.07 ? 161 LYS A CE 1 ATOM 1287 N NZ . LYS A 1 166 ? -46.453 41.227 -71.521 1.00 74.14 ? 161 LYS A NZ 1 ATOM 1288 N N . ILE A 1 167 ? -43.907 35.788 -65.566 1.00 49.28 ? 162 ILE A N 1 ATOM 1289 C CA . ILE A 1 167 ? -44.342 35.051 -64.391 1.00 47.51 ? 162 ILE A CA 1 ATOM 1290 C C . ILE A 1 167 ? -44.061 35.841 -63.151 1.00 45.38 ? 162 ILE A C 1 ATOM 1291 O O . ILE A 1 167 ? -43.263 36.779 -63.163 1.00 42.40 ? 162 ILE A O 1 ATOM 1292 C CB . ILE A 1 167 ? -43.636 33.697 -64.274 1.00 52.23 ? 162 ILE A CB 1 ATOM 1293 C CG1 . ILE A 1 167 ? -42.128 33.899 -64.168 1.00 51.28 ? 162 ILE A CG1 1 ATOM 1294 C CG2 . ILE A 1 167 ? -43.975 32.832 -65.492 1.00 52.56 ? 162 ILE A CG2 1 ATOM 1295 C CD1 . ILE A 1 167 ? -41.427 32.700 -63.599 1.00 53.44 ? 162 ILE A CD1 1 ATOM 1296 N N . SER A 1 168 ? -44.734 35.477 -62.077 1.00 41.57 ? 163 SER A N 1 ATOM 1297 C CA . SER A 1 168 ? -44.419 36.105 -60.823 1.00 43.46 ? 163 SER A CA 1 ATOM 1298 C C . SER A 1 168 ? -44.510 35.071 -59.755 1.00 40.10 ? 163 SER A C 1 ATOM 1299 O O . SER A 1 168 ? -45.159 34.053 -59.952 1.00 39.10 ? 163 SER A O 1 ATOM 1300 C CB . SER A 1 168 ? -45.279 37.338 -60.571 1.00 45.30 ? 163 SER A CB 1 ATOM 1301 O OG . SER A 1 168 ? -46.595 36.981 -60.306 1.00 50.17 ? 163 SER A OG 1 ATOM 1302 N N . TYR A 1 169 ? -43.719 35.250 -58.699 1.00 38.41 ? 164 TYR A N 1 ATOM 1303 C CA . TYR A 1 169 ? -43.746 34.354 -57.538 1.00 35.71 ? 164 TYR A CA 1 ATOM 1304 C C . TYR A 1 169 ? -43.924 35.214 -56.320 1.00 35.88 ? 164 TYR A C 1 ATOM 1305 O O . TYR A 1 169 ? -43.178 36.142 -56.074 1.00 37.31 ? 164 TYR A O 1 ATOM 1306 C CB . TYR A 1 169 ? -42.462 33.510 -57.408 1.00 34.70 ? 164 TYR A CB 1 ATOM 1307 C CG . TYR A 1 169 ? -42.441 32.716 -56.134 1.00 34.24 ? 164 TYR A CG 1 ATOM 1308 C CD1 . TYR A 1 169 ? -43.134 31.502 -56.015 1.00 34.68 ? 164 TYR A CD1 1 ATOM 1309 C CD2 . TYR A 1 169 ? -41.827 33.229 -54.995 1.00 34.04 ? 164 TYR A CD2 1 ATOM 1310 C CE1 . TYR A 1 169 ? -43.192 30.827 -54.766 1.00 37.50 ? 164 TYR A CE1 1 ATOM 1311 C CE2 . TYR A 1 169 ? -41.891 32.577 -53.766 1.00 35.28 ? 164 TYR A CE2 1 ATOM 1312 C CZ . TYR A 1 169 ? -42.565 31.388 -53.651 1.00 37.25 ? 164 TYR A CZ 1 ATOM 1313 O OH . TYR A 1 169 ? -42.536 30.753 -52.432 1.00 47.54 ? 164 TYR A OH 1 ATOM 1314 N N . ASN A 1 170 ? -44.944 34.894 -55.563 1.00 38.35 ? 165 ASN A N 1 ATOM 1315 C CA . ASN A 1 170 ? -45.276 35.596 -54.349 1.00 39.13 ? 165 ASN A CA 1 ATOM 1316 C C . ASN A 1 170 ? -44.658 34.843 -53.173 1.00 38.08 ? 165 ASN A C 1 ATOM 1317 O O . ASN A 1 170 ? -44.913 33.649 -52.993 1.00 41.01 ? 165 ASN A O 1 ATOM 1318 C CB . ASN A 1 170 ? -46.831 35.659 -54.220 1.00 37.80 ? 165 ASN A CB 1 ATOM 1319 C CG . ASN A 1 170 ? -47.295 36.471 -53.030 1.00 42.87 ? 165 ASN A CG 1 ATOM 1320 O OD1 . ASN A 1 170 ? -46.782 36.345 -51.910 1.00 48.37 ? 165 ASN A OD1 1 ATOM 1321 N ND2 . ASN A 1 170 ? -48.267 37.354 -53.286 1.00 51.14 ? 165 ASN A ND2 1 ATOM 1322 N N . ASN A 1 171 ? -43.899 35.532 -52.331 1.00 35.46 ? 166 ASN A N 1 ATOM 1323 C CA . ASN A 1 171 ? -43.377 34.870 -51.131 1.00 34.18 ? 166 ASN A CA 1 ATOM 1324 C C . ASN A 1 171 ? -44.448 34.688 -50.062 1.00 35.77 ? 166 ASN A C 1 ATOM 1325 O O . ASN A 1 171 ? -44.599 35.502 -49.157 1.00 38.37 ? 166 ASN A O 1 ATOM 1326 C CB . ASN A 1 171 ? -42.139 35.573 -50.594 1.00 32.89 ? 166 ASN A CB 1 ATOM 1327 C CG . ASN A 1 171 ? -41.548 34.880 -49.361 1.00 34.86 ? 166 ASN A CG 1 ATOM 1328 O OD1 . ASN A 1 171 ? -41.945 33.780 -48.985 1.00 34.09 ? 166 ASN A OD1 1 ATOM 1329 N ND2 . ASN A 1 171 ? -40.576 35.528 -48.749 1.00 33.33 ? 166 ASN A ND2 1 ATOM 1330 N N . THR A 1 172 ? -45.162 33.570 -50.127 1.00 37.77 ? 167 THR A N 1 ATOM 1331 C CA . THR A 1 172 ? -46.188 33.268 -49.105 1.00 40.00 ? 167 THR A CA 1 ATOM 1332 C C . THR A 1 172 ? -45.615 32.620 -47.865 1.00 42.38 ? 167 THR A C 1 ATOM 1333 O O . THR A 1 172 ? -46.351 32.293 -46.974 1.00 44.06 ? 167 THR A O 1 ATOM 1334 C CB . THR A 1 172 ? -47.268 32.324 -49.650 1.00 40.33 ? 167 THR A CB 1 ATOM 1335 O OG1 . THR A 1 172 ? -46.641 31.141 -50.129 1.00 44.76 ? 167 THR A OG1 1 ATOM 1336 C CG2 . THR A 1 172 ? -47.973 32.957 -50.815 1.00 41.17 ? 167 THR A CG2 1 ATOM 1337 N N . ASN A 1 173 ? -44.297 32.443 -47.793 1.00 42.91 ? 168 ASN A N 1 ATOM 1338 C CA . ASN A 1 173 ? -43.660 31.946 -46.573 1.00 40.01 ? 168 ASN A CA 1 ATOM 1339 C C . ASN A 1 173 ? -43.559 33.102 -45.561 1.00 39.38 ? 168 ASN A C 1 ATOM 1340 O O . ASN A 1 173 ? -43.897 34.221 -45.849 1.00 43.57 ? 168 ASN A O 1 ATOM 1341 C CB . ASN A 1 173 ? -42.281 31.333 -46.869 1.00 36.05 ? 168 ASN A CB 1 ATOM 1342 C CG . ASN A 1 173 ? -42.311 30.346 -48.001 1.00 35.48 ? 168 ASN A CG 1 ATOM 1343 O OD1 . ASN A 1 173 ? -42.669 29.207 -47.792 1.00 46.27 ? 168 ASN A OD1 1 ATOM 1344 N ND2 . ASN A 1 173 ? -41.979 30.767 -49.210 1.00 36.84 ? 168 ASN A ND2 1 ATOM 1345 N N . GLN A 1 174 ? -43.112 32.786 -44.369 1.00 42.82 ? 169 GLN A N 1 ATOM 1346 C CA . GLN A 1 174 ? -43.010 33.729 -43.292 1.00 47.69 ? 169 GLN A CA 1 ATOM 1347 C C . GLN A 1 174 ? -41.618 34.267 -43.196 1.00 46.58 ? 169 GLN A C 1 ATOM 1348 O O . GLN A 1 174 ? -41.343 35.151 -42.401 1.00 47.22 ? 169 GLN A O 1 ATOM 1349 C CB . GLN A 1 174 ? -43.360 33.029 -41.957 1.00 56.65 ? 169 GLN A CB 1 ATOM 1350 C CG . GLN A 1 174 ? -44.832 33.055 -41.634 1.00 67.67 ? 169 GLN A CG 1 ATOM 1351 C CD . GLN A 1 174 ? -45.639 32.362 -42.709 1.00 81.38 ? 169 GLN A CD 1 ATOM 1352 O OE1 . GLN A 1 174 ? -45.598 31.126 -42.859 1.00 78.83 ? 169 GLN A OE1 1 ATOM 1353 N NE2 . GLN A 1 174 ? -46.373 33.161 -43.488 1.00 86.31 ? 169 GLN A NE2 1 ATOM 1354 N N . GLU A 1 175 ? -40.731 33.710 -44.010 1.00 48.78 ? 170 GLU A N 1 ATOM 1355 C CA . GLU A 1 175 ? -39.317 34.051 -43.986 1.00 46.16 ? 170 GLU A CA 1 ATOM 1356 C C . GLU A 1 175 ? -38.937 34.683 -45.283 1.00 41.41 ? 170 GLU A C 1 ATOM 1357 O O . GLU A 1 175 ? -39.526 34.404 -46.331 1.00 38.06 ? 170 GLU A O 1 ATOM 1358 C CB . GLU A 1 175 ? -38.492 32.796 -43.763 1.00 52.78 ? 170 GLU A CB 1 ATOM 1359 C CG . GLU A 1 175 ? -38.454 32.421 -42.295 1.00 60.15 ? 170 GLU A CG 1 ATOM 1360 C CD . GLU A 1 175 ? -38.653 30.958 -42.043 1.00 76.64 ? 170 GLU A CD 1 ATOM 1361 O OE1 . GLU A 1 175 ? -39.780 30.456 -42.277 1.00 95.48 ? 170 GLU A OE1 1 ATOM 1362 O OE2 . GLU A 1 175 ? -37.677 30.315 -41.618 1.00 87.51 ? 170 GLU A OE2 1 ATOM 1363 N N . ASP A 1 176 ? -37.942 35.553 -45.209 1.00 37.04 ? 171 ASP A N 1 ATOM 1364 C CA . ASP A 1 176 ? -37.275 36.023 -46.410 1.00 35.05 ? 171 ASP A CA 1 ATOM 1365 C C . ASP A 1 176 ? -36.856 34.885 -47.312 1.00 32.96 ? 171 ASP A C 1 ATOM 1366 O O . ASP A 1 176 ? -36.417 33.845 -46.845 1.00 36.58 ? 171 ASP A O 1 ATOM 1367 C CB . ASP A 1 176 ? -35.989 36.746 -46.017 1.00 35.08 ? 171 ASP A CB 1 ATOM 1368 C CG . ASP A 1 176 ? -36.237 38.124 -45.414 1.00 39.37 ? 171 ASP A CG 1 ATOM 1369 O OD1 . ASP A 1 176 ? -37.382 38.633 -45.500 1.00 38.60 ? 171 ASP A OD1 1 ATOM 1370 O OD2 . ASP A 1 176 ? -35.265 38.708 -44.831 1.00 39.68 ? 171 ASP A OD2 1 ATOM 1371 N N . LEU A 1 177 ? -36.825 35.134 -48.596 1.00 32.73 ? 172 LEU A N 1 ATOM 1372 C CA . LEU A 1 177 ? -36.359 34.151 -49.558 1.00 32.89 ? 172 LEU A CA 1 ATOM 1373 C C . LEU A 1 177 ? -35.119 34.686 -50.343 1.00 31.42 ? 172 LEU A C 1 ATOM 1374 O O . LEU A 1 177 ? -35.146 35.782 -50.926 1.00 29.41 ? 172 LEU A O 1 ATOM 1375 C CB . LEU A 1 177 ? -37.532 33.920 -50.485 1.00 36.44 ? 172 LEU A CB 1 ATOM 1376 C CG . LEU A 1 177 ? -38.019 32.554 -50.845 1.00 41.63 ? 172 LEU A CG 1 ATOM 1377 C CD1 . LEU A 1 177 ? -38.179 31.654 -49.637 1.00 41.80 ? 172 LEU A CD1 1 ATOM 1378 C CD2 . LEU A 1 177 ? -39.331 32.715 -51.580 1.00 40.40 ? 172 LEU A CD2 1 ATOM 1379 N N . LEU A 1 178 ? -34.041 33.925 -50.370 1.00 29.21 ? 173 LEU A N 1 ATOM 1380 C CA . LEU A 1 178 ? -32.908 34.231 -51.268 1.00 29.31 ? 173 LEU A CA 1 ATOM 1381 C C . LEU A 1 178 ? -33.185 33.584 -52.612 1.00 28.13 ? 173 LEU A C 1 ATOM 1382 O O . LEU A 1 178 ? -33.304 32.377 -52.697 1.00 33.27 ? 173 LEU A O 1 ATOM 1383 C CB . LEU A 1 178 ? -31.595 33.715 -50.685 1.00 28.17 ? 173 LEU A CB 1 ATOM 1384 C CG . LEU A 1 178 ? -30.383 33.643 -51.599 1.00 28.65 ? 173 LEU A CG 1 ATOM 1385 C CD1 . LEU A 1 178 ? -29.966 35.013 -52.069 1.00 31.52 ? 173 LEU A CD1 1 ATOM 1386 C CD2 . LEU A 1 178 ? -29.201 33.048 -50.859 1.00 28.62 ? 173 LEU A CD2 1 ATOM 1387 N N . ILE A 1 179 ? -33.349 34.392 -53.633 1.00 27.72 ? 174 ILE A N 1 ATOM 1388 C CA . ILE A 1 179 ? -33.635 33.925 -54.976 1.00 25.63 ? 174 ILE A CA 1 ATOM 1389 C C . ILE A 1 179 ? -32.493 34.304 -55.897 1.00 26.87 ? 174 ILE A C 1 ATOM 1390 O O . ILE A 1 179 ? -31.952 35.428 -55.827 1.00 28.57 ? 174 ILE A O 1 ATOM 1391 C CB . ILE A 1 179 ? -34.945 34.538 -55.508 1.00 25.88 ? 174 ILE A CB 1 ATOM 1392 C CG1 . ILE A 1 179 ? -36.064 34.212 -54.524 1.00 27.20 ? 174 ILE A CG1 1 ATOM 1393 C CG2 . ILE A 1 179 ? -35.291 33.984 -56.900 1.00 26.59 ? 174 ILE A CG2 1 ATOM 1394 C CD1 . ILE A 1 179 ? -37.428 34.688 -54.962 1.00 28.34 ? 174 ILE A CD1 1 ATOM 1395 N N . LEU A 1 180 ? -32.186 33.387 -56.811 1.00 25.54 ? 175 LEU A N 1 ATOM 1396 C CA . LEU A 1 180 ? -31.169 33.587 -57.810 1.00 27.24 ? 175 LEU A CA 1 ATOM 1397 C C . LEU A 1 180 ? -31.646 33.255 -59.219 1.00 27.45 ? 175 LEU A C 1 ATOM 1398 O O . LEU A 1 180 ? -32.424 32.314 -59.394 1.00 30.74 ? 175 LEU A O 1 ATOM 1399 C CB . LEU A 1 180 ? -29.950 32.708 -57.502 1.00 27.45 ? 175 LEU A CB 1 ATOM 1400 C CG . LEU A 1 180 ? -29.305 32.951 -56.144 1.00 28.12 ? 175 LEU A CG 1 ATOM 1401 C CD1 . LEU A 1 180 ? -29.565 31.770 -55.213 1.00 28.69 ? 175 LEU A CD1 1 ATOM 1402 C CD2 . LEU A 1 180 ? -27.812 33.125 -56.285 1.00 27.89 ? 175 LEU A CD2 1 ATOM 1403 N N . TRP A 1 181 ? -31.097 33.963 -60.209 1.00 26.54 ? 176 TRP A N 1 ATOM 1404 C CA . TRP A 1 181 ? -31.395 33.767 -61.633 1.00 26.53 ? 176 TRP A CA 1 ATOM 1405 C C . TRP A 1 181 ? -30.221 34.312 -62.394 1.00 27.31 ? 176 TRP A C 1 ATOM 1406 O O . TRP A 1 181 ? -29.299 34.869 -61.791 1.00 29.40 ? 176 TRP A O 1 ATOM 1407 C CB . TRP A 1 181 ? -32.640 34.556 -62.058 1.00 26.96 ? 176 TRP A CB 1 ATOM 1408 C CG . TRP A 1 181 ? -32.454 36.021 -61.873 1.00 27.33 ? 176 TRP A CG 1 ATOM 1409 C CD1 . TRP A 1 181 ? -32.055 36.932 -62.822 1.00 29.09 ? 176 TRP A CD1 1 ATOM 1410 C CD2 . TRP A 1 181 ? -32.663 36.757 -60.683 1.00 26.53 ? 176 TRP A CD2 1 ATOM 1411 N NE1 . TRP A 1 181 ? -31.986 38.191 -62.279 1.00 27.35 ? 176 TRP A NE1 1 ATOM 1412 C CE2 . TRP A 1 181 ? -32.355 38.107 -60.960 1.00 27.32 ? 176 TRP A CE2 1 ATOM 1413 C CE3 . TRP A 1 181 ? -33.052 36.404 -59.385 1.00 28.34 ? 176 TRP A CE3 1 ATOM 1414 C CZ2 . TRP A 1 181 ? -32.410 39.094 -59.992 1.00 26.64 ? 176 TRP A CZ2 1 ATOM 1415 C CZ3 . TRP A 1 181 ? -33.159 37.407 -58.429 1.00 26.41 ? 176 TRP A CZ3 1 ATOM 1416 C CH2 . TRP A 1 181 ? -32.804 38.727 -58.736 1.00 26.37 ? 176 TRP A CH2 1 ATOM 1417 N N . GLY A 1 182 ? -30.242 34.185 -63.716 1.00 27.70 ? 177 GLY A N 1 ATOM 1418 C CA . GLY A 1 182 ? -29.113 34.572 -64.509 1.00 28.24 ? 177 GLY A CA 1 ATOM 1419 C C . GLY A 1 182 ? -29.413 34.881 -65.947 1.00 30.40 ? 177 GLY A C 1 ATOM 1420 O O . GLY A 1 182 ? -30.525 34.691 -66.397 1.00 29.08 ? 177 GLY A O 1 ATOM 1421 N N . VAL A 1 183 ? -28.387 35.393 -66.639 1.00 30.70 ? 178 VAL A N 1 ATOM 1422 C CA . VAL A 1 183 ? -28.444 35.690 -68.051 1.00 31.41 ? 178 VAL A CA 1 ATOM 1423 C C . VAL A 1 183 ? -27.320 34.945 -68.739 1.00 31.99 ? 178 VAL A C 1 ATOM 1424 O O . VAL A 1 183 ? -26.171 34.902 -68.221 1.00 30.15 ? 178 VAL A O 1 ATOM 1425 C CB . VAL A 1 183 ? -28.332 37.230 -68.358 1.00 33.66 ? 178 VAL A CB 1 ATOM 1426 C CG1 . VAL A 1 183 ? -27.041 37.868 -67.838 1.00 31.75 ? 178 VAL A CG1 1 ATOM 1427 C CG2 . VAL A 1 183 ? -28.464 37.462 -69.854 1.00 32.60 ? 178 VAL A CG2 1 ATOM 1428 N N . HIS A 1 184 ? -27.654 34.372 -69.886 1.00 30.80 ? 179 HIS A N 1 ATOM 1429 C CA . HIS A 1 184 ? -26.695 33.691 -70.728 1.00 35.11 ? 179 HIS A CA 1 ATOM 1430 C C . HIS A 1 184 ? -26.191 34.603 -71.850 1.00 35.16 ? 179 HIS A C 1 ATOM 1431 O O . HIS A 1 184 ? -26.974 35.077 -72.657 1.00 38.72 ? 179 HIS A O 1 ATOM 1432 C CB . HIS A 1 184 ? -27.278 32.421 -71.346 1.00 35.82 ? 179 HIS A CB 1 ATOM 1433 C CG . HIS A 1 184 ? -26.343 31.728 -72.289 1.00 39.27 ? 179 HIS A CG 1 ATOM 1434 N ND1 . HIS A 1 184 ? -26.728 31.290 -73.542 1.00 45.57 ? 179 HIS A ND1 1 ATOM 1435 C CD2 . HIS A 1 184 ? -25.033 31.415 -72.169 1.00 39.27 ? 179 HIS A CD2 1 ATOM 1436 C CE1 . HIS A 1 184 ? -25.698 30.739 -74.150 1.00 43.28 ? 179 HIS A CE1 1 ATOM 1437 N NE2 . HIS A 1 184 ? -24.656 30.801 -73.337 1.00 44.09 ? 179 HIS A NE2 1 ATOM 1438 N N . HIS A 1 185 ? -24.886 34.837 -71.860 1.00 32.37 ? 180 HIS A N 1 ATOM 1439 C CA . HIS A 1 185 ? -24.246 35.572 -72.937 1.00 34.68 ? 180 HIS A CA 1 ATOM 1440 C C . HIS A 1 185 ? -23.805 34.592 -74.002 1.00 35.77 ? 180 HIS A C 1 ATOM 1441 O O . HIS A 1 185 ? -22.903 33.766 -73.775 1.00 32.50 ? 180 HIS A O 1 ATOM 1442 C CB . HIS A 1 185 ? -23.021 36.282 -72.409 1.00 35.21 ? 180 HIS A CB 1 ATOM 1443 C CG . HIS A 1 185 ? -23.309 37.240 -71.300 1.00 35.29 ? 180 HIS A CG 1 ATOM 1444 N ND1 . HIS A 1 185 ? -24.062 38.374 -71.477 1.00 35.85 ? 180 HIS A ND1 1 ATOM 1445 C CD2 . HIS A 1 185 ? -22.955 37.230 -69.999 1.00 38.34 ? 180 HIS A CD2 1 ATOM 1446 C CE1 . HIS A 1 185 ? -24.161 39.033 -70.343 1.00 35.66 ? 180 HIS A CE1 1 ATOM 1447 N NE2 . HIS A 1 185 ? -23.495 38.359 -69.423 1.00 36.80 ? 180 HIS A NE2 1 ATOM 1448 N N . SER A 1 186 ? -24.476 34.648 -75.142 1.00 36.23 ? 181 SER A N 1 ATOM 1449 C CA . SER A 1 186 ? -24.237 33.711 -76.237 1.00 38.77 ? 181 SER A CA 1 ATOM 1450 C C . SER A 1 186 ? -23.084 34.263 -77.030 1.00 37.08 ? 181 SER A C 1 ATOM 1451 O O . SER A 1 186 ? -22.685 35.389 -76.798 1.00 39.08 ? 181 SER A O 1 ATOM 1452 C CB . SER A 1 186 ? -25.498 33.560 -77.117 1.00 40.62 ? 181 SER A CB 1 ATOM 1453 O OG . SER A 1 186 ? -26.031 34.829 -77.521 1.00 43.34 ? 181 SER A OG 1 ATOM 1454 N N . ASN A 1 187 ? -22.582 33.480 -77.966 1.00 38.74 ? 182 ASN A N 1 ATOM 1455 C CA . ASN A 1 187 ? -21.332 33.789 -78.708 1.00 43.48 ? 182 ASN A CA 1 ATOM 1456 C C . ASN A 1 187 ? -21.447 34.478 -80.070 1.00 46.21 ? 182 ASN A C 1 ATOM 1457 O O . ASN A 1 187 ? -20.512 35.167 -80.498 1.00 45.08 ? 182 ASN A O 1 ATOM 1458 C CB . ASN A 1 187 ? -20.522 32.517 -78.850 1.00 44.46 ? 182 ASN A CB 1 ATOM 1459 C CG . ASN A 1 187 ? -20.172 31.919 -77.501 1.00 42.16 ? 182 ASN A CG 1 ATOM 1460 O OD1 . ASN A 1 187 ? -19.794 32.633 -76.589 1.00 46.14 ? 182 ASN A OD1 1 ATOM 1461 N ND2 . ASN A 1 187 ? -20.298 30.634 -77.373 1.00 39.76 ? 182 ASN A ND2 1 ATOM 1462 N N . ASN A 1 188 ? -22.594 34.317 -80.718 1.00 48.38 ? 183 ASN A N 1 ATOM 1463 C CA . ASN A 1 188 ? -22.866 34.915 -82.022 1.00 45.18 ? 183 ASN A CA 1 ATOM 1464 C C . ASN A 1 188 ? -24.322 34.715 -82.411 1.00 47.19 ? 183 ASN A C 1 ATOM 1465 O O . ASN A 1 188 ? -25.070 33.969 -81.736 1.00 43.19 ? 183 ASN A O 1 ATOM 1466 C CB . ASN A 1 188 ? -21.986 34.283 -83.104 1.00 45.21 ? 183 ASN A CB 1 ATOM 1467 C CG . ASN A 1 188 ? -22.091 32.764 -83.140 1.00 47.22 ? 183 ASN A CG 1 ATOM 1468 O OD1 . ASN A 1 188 ? -23.156 32.170 -83.419 1.00 46.17 ? 183 ASN A OD1 1 ATOM 1469 N ND2 . ASN A 1 188 ? -20.982 32.122 -82.859 1.00 47.19 ? 183 ASN A ND2 1 ATOM 1470 N N . ALA A 1 189 ? -24.717 35.378 -83.497 1.00 49.47 ? 184 ALA A N 1 ATOM 1471 C CA . ALA A 1 189 ? -26.117 35.378 -83.958 1.00 54.17 ? 184 ALA A CA 1 ATOM 1472 C C . ALA A 1 189 ? -26.696 33.989 -84.217 1.00 48.12 ? 184 ALA A C 1 ATOM 1473 O O . ALA A 1 189 ? -27.842 33.722 -83.910 1.00 46.15 ? 184 ALA A O 1 ATOM 1474 C CB . ALA A 1 189 ? -26.249 36.233 -85.215 1.00 57.73 ? 184 ALA A CB 1 ATOM 1475 N N . ALA A 1 190 ? -25.889 33.109 -84.767 1.00 47.71 ? 185 ALA A N 1 ATOM 1476 C CA . ALA A 1 190 ? -26.369 31.780 -85.082 1.00 48.97 ? 185 ALA A CA 1 ATOM 1477 C C . ALA A 1 190 ? -26.707 31.003 -83.841 1.00 49.84 ? 185 ALA A C 1 ATOM 1478 O O . ALA A 1 190 ? -27.730 30.307 -83.786 1.00 56.97 ? 185 ALA A O 1 ATOM 1479 C CB . ALA A 1 190 ? -25.321 31.017 -85.899 1.00 50.84 ? 185 ALA A CB 1 ATOM 1480 N N . GLU A 1 191 ? -25.819 31.071 -82.855 1.00 50.41 ? 186 GLU A N 1 ATOM 1481 C CA . GLU A 1 191 ? -26.023 30.352 -81.576 1.00 49.17 ? 186 GLU A CA 1 ATOM 1482 C C . GLU A 1 191 ? -27.271 30.901 -80.883 1.00 44.26 ? 186 GLU A C 1 ATOM 1483 O O . GLU A 1 191 ? -28.077 30.136 -80.353 1.00 40.78 ? 186 GLU A O 1 ATOM 1484 C CB . GLU A 1 191 ? -24.782 30.484 -80.697 1.00 49.87 ? 186 GLU A CB 1 ATOM 1485 C CG . GLU A 1 191 ? -24.911 29.880 -79.314 1.00 56.33 ? 186 GLU A CG 1 ATOM 1486 C CD . GLU A 1 191 ? -23.612 29.927 -78.540 1.00 62.18 ? 186 GLU A CD 1 ATOM 1487 O OE1 . GLU A 1 191 ? -22.631 29.266 -78.972 1.00 72.28 ? 186 GLU A OE1 1 ATOM 1488 O OE2 . GLU A 1 191 ? -23.572 30.606 -77.512 1.00 60.04 ? 186 GLU A OE2 1 ATOM 1489 N N . GLN A 1 192 ? -27.436 32.225 -80.970 1.00 41.83 ? 187 GLN A N 1 ATOM 1490 C CA . GLN A 1 192 ? -28.568 32.941 -80.383 1.00 41.16 ? 187 GLN A CA 1 ATOM 1491 C C . GLN A 1 192 ? -29.895 32.435 -80.941 1.00 44.07 ? 187 GLN A C 1 ATOM 1492 O O . GLN A 1 192 ? -30.782 32.056 -80.177 1.00 46.86 ? 187 GLN A O 1 ATOM 1493 C CB . GLN A 1 192 ? -28.401 34.448 -80.605 1.00 40.93 ? 187 GLN A CB 1 ATOM 1494 C CG . GLN A 1 192 ? -29.488 35.306 -79.985 1.00 42.72 ? 187 GLN A CG 1 ATOM 1495 C CD . GLN A 1 192 ? -29.578 35.205 -78.466 1.00 42.51 ? 187 GLN A CD 1 ATOM 1496 O OE1 . GLN A 1 192 ? -28.590 34.936 -77.776 1.00 41.96 ? 187 GLN A OE1 1 ATOM 1497 N NE2 . GLN A 1 192 ? -30.787 35.418 -77.944 1.00 42.43 ? 187 GLN A NE2 1 ATOM 1498 N N . THR A 1 193 ? -30.011 32.341 -82.263 1.00 47.16 ? 188 THR A N 1 ATOM 1499 C CA . THR A 1 193 ? -31.252 31.807 -82.854 1.00 49.43 ? 188 THR A CA 1 ATOM 1500 C C . THR A 1 193 ? -31.347 30.301 -82.599 1.00 48.38 ? 188 THR A C 1 ATOM 1501 O O . THR A 1 193 ? -32.410 29.757 -82.357 1.00 44.85 ? 188 THR A O 1 ATOM 1502 C CB . THR A 1 193 ? -31.442 32.165 -84.357 1.00 47.90 ? 188 THR A CB 1 ATOM 1503 O OG1 . THR A 1 193 ? -30.326 31.712 -85.103 1.00 53.25 ? 188 THR A OG1 1 ATOM 1504 C CG2 . THR A 1 193 ? -31.508 33.652 -84.532 1.00 49.98 ? 188 THR A CG2 1 ATOM 1505 N N . ASN A 1 194 ? -30.224 29.624 -82.634 1.00 51.28 ? 189 ASN A N 1 ATOM 1506 C CA . ASN A 1 194 ? -30.214 28.189 -82.371 1.00 52.12 ? 189 ASN A CA 1 ATOM 1507 C C . ASN A 1 194 ? -30.782 27.795 -81.025 1.00 55.83 ? 189 ASN A C 1 ATOM 1508 O O . ASN A 1 194 ? -31.437 26.756 -80.894 1.00 50.14 ? 189 ASN A O 1 ATOM 1509 C CB . ASN A 1 194 ? -28.791 27.716 -82.386 1.00 61.34 ? 189 ASN A CB 1 ATOM 1510 C CG . ASN A 1 194 ? -28.632 26.460 -83.133 1.00 67.61 ? 189 ASN A CG 1 ATOM 1511 O OD1 . ASN A 1 194 ? -28.225 26.496 -84.299 1.00 81.62 ? 189 ASN A OD1 1 ATOM 1512 N ND2 . ASN A 1 194 ? -28.972 25.325 -82.496 1.00 63.98 ? 189 ASN A ND2 1 ATOM 1513 N N . LEU A 1 195 ? -30.501 28.624 -80.009 1.00 54.47 ? 190 LEU A N 1 ATOM 1514 C CA . LEU A 1 195 ? -30.956 28.357 -78.647 1.00 50.10 ? 190 LEU A CA 1 ATOM 1515 C C . LEU A 1 195 ? -32.292 29.002 -78.310 1.00 46.29 ? 190 LEU A C 1 ATOM 1516 O O . LEU A 1 195 ? -33.082 28.436 -77.544 1.00 46.48 ? 190 LEU A O 1 ATOM 1517 C CB . LEU A 1 195 ? -29.917 28.866 -77.631 1.00 52.63 ? 190 LEU A CB 1 ATOM 1518 C CG . LEU A 1 195 ? -28.562 28.163 -77.668 1.00 52.50 ? 190 LEU A CG 1 ATOM 1519 C CD1 . LEU A 1 195 ? -27.660 28.882 -76.714 1.00 49.77 ? 190 LEU A CD1 1 ATOM 1520 C CD2 . LEU A 1 195 ? -28.661 26.691 -77.294 1.00 53.67 ? 190 LEU A CD2 1 ATOM 1521 N N . TYR A 1 196 ? -32.493 30.225 -78.781 1.00 44.53 ? 191 TYR A N 1 ATOM 1522 C CA . TYR A 1 196 ? -33.601 31.063 -78.290 1.00 44.35 ? 191 TYR A CA 1 ATOM 1523 C C . TYR A 1 196 ? -34.512 31.648 -79.365 1.00 46.89 ? 191 TYR A C 1 ATOM 1524 O O . TYR A 1 196 ? -35.500 32.310 -79.046 1.00 43.24 ? 191 TYR A O 1 ATOM 1525 C CB . TYR A 1 196 ? -33.053 32.228 -77.443 1.00 43.73 ? 191 TYR A CB 1 ATOM 1526 C CG . TYR A 1 196 ? -32.043 31.824 -76.396 1.00 44.64 ? 191 TYR A CG 1 ATOM 1527 C CD1 . TYR A 1 196 ? -32.424 31.027 -75.328 1.00 48.04 ? 191 TYR A CD1 1 ATOM 1528 C CD2 . TYR A 1 196 ? -30.714 32.237 -76.479 1.00 44.55 ? 191 TYR A CD2 1 ATOM 1529 C CE1 . TYR A 1 196 ? -31.526 30.665 -74.366 1.00 49.14 ? 191 TYR A CE1 1 ATOM 1530 C CE2 . TYR A 1 196 ? -29.800 31.878 -75.525 1.00 44.56 ? 191 TYR A CE2 1 ATOM 1531 C CZ . TYR A 1 196 ? -30.218 31.095 -74.470 1.00 45.91 ? 191 TYR A CZ 1 ATOM 1532 O OH . TYR A 1 196 ? -29.341 30.699 -73.521 1.00 39.98 ? 191 TYR A OH 1 ATOM 1533 N N . LYS A 1 197 ? -34.169 31.422 -80.625 1.00 50.09 ? 192 LYS A N 1 ATOM 1534 C CA . LYS A 1 197 ? -34.929 31.903 -81.751 1.00 54.58 ? 192 LYS A CA 1 ATOM 1535 C C . LYS A 1 197 ? -34.812 33.415 -81.866 1.00 52.61 ? 192 LYS A C 1 ATOM 1536 O O . LYS A 1 197 ? -34.315 33.937 -82.861 1.00 55.65 ? 192 LYS A O 1 ATOM 1537 C CB . LYS A 1 197 ? -36.388 31.454 -81.613 1.00 62.72 ? 192 LYS A CB 1 ATOM 1538 C CG . LYS A 1 197 ? -37.306 31.892 -82.723 1.00 71.97 ? 192 LYS A CG 1 ATOM 1539 C CD . LYS A 1 197 ? -37.031 31.140 -84.000 1.00 79.85 ? 192 LYS A CD 1 ATOM 1540 C CE . LYS A 1 197 ? -38.197 31.347 -84.961 1.00 86.01 ? 192 LYS A CE 1 ATOM 1541 N NZ . LYS A 1 197 ? -37.636 31.583 -86.312 1.00 94.26 ? 192 LYS A NZ 1 ATOM 1542 N N . ASN A 1 198 ? -35.289 34.112 -80.850 1.00 50.08 ? 193 ASN A N 1 ATOM 1543 C CA . ASN A 1 198 ? -35.357 35.567 -80.877 1.00 49.46 ? 193 ASN A CA 1 ATOM 1544 C C . ASN A 1 198 ? -33.935 36.136 -80.822 1.00 49.91 ? 193 ASN A C 1 ATOM 1545 O O . ASN A 1 198 ? -33.172 35.763 -79.971 1.00 52.35 ? 193 ASN A O 1 ATOM 1546 C CB . ASN A 1 198 ? -36.203 36.073 -79.709 1.00 49.02 ? 193 ASN A CB 1 ATOM 1547 C CG . ASN A 1 198 ? -37.563 35.417 -79.656 1.00 55.25 ? 193 ASN A CG 1 ATOM 1548 O OD1 . ASN A 1 198 ? -38.199 35.261 -80.700 1.00 64.79 ? 193 ASN A OD1 1 ATOM 1549 N ND2 . ASN A 1 198 ? -38.011 34.990 -78.455 1.00 50.60 ? 193 ASN A ND2 1 ATOM 1550 N N . PRO A 1 199 ? -33.566 37.004 -81.764 1.00 50.81 ? 194 PRO A N 1 ATOM 1551 C CA . PRO A 1 199 ? -32.205 37.503 -81.796 1.00 49.99 ? 194 PRO A CA 1 ATOM 1552 C C . PRO A 1 199 ? -31.879 38.602 -80.782 1.00 50.57 ? 194 PRO A C 1 ATOM 1553 O O . PRO A 1 199 ? -30.755 38.664 -80.285 1.00 58.01 ? 194 PRO A O 1 ATOM 1554 C CB . PRO A 1 199 ? -32.097 38.079 -83.225 1.00 55.51 ? 194 PRO A CB 1 ATOM 1555 C CG . PRO A 1 199 ? -33.493 38.475 -83.578 1.00 54.40 ? 194 PRO A CG 1 ATOM 1556 C CD . PRO A 1 199 ? -34.321 37.372 -82.986 1.00 50.35 ? 194 PRO A CD 1 ATOM 1557 N N . THR A 1 200 ? -32.844 39.463 -80.510 1.00 48.83 ? 195 THR A N 1 ATOM 1558 C CA . THR A 1 200 ? -32.685 40.598 -79.616 1.00 50.69 ? 195 THR A CA 1 ATOM 1559 C C . THR A 1 200 ? -33.491 40.360 -78.341 1.00 47.39 ? 195 THR A C 1 ATOM 1560 O O . THR A 1 200 ? -34.728 40.420 -78.350 1.00 52.44 ? 195 THR A O 1 ATOM 1561 C CB . THR A 1 200 ? -33.164 41.880 -80.334 1.00 52.12 ? 195 THR A CB 1 ATOM 1562 O OG1 . THR A 1 200 ? -32.286 42.136 -81.429 1.00 56.19 ? 195 THR A OG1 1 ATOM 1563 C CG2 . THR A 1 200 ? -33.163 43.098 -79.417 1.00 56.13 ? 195 THR A CG2 1 ATOM 1564 N N . THR A 1 201 ? -32.805 40.098 -77.236 1.00 43.66 ? 196 THR A N 1 ATOM 1565 C CA . THR A 1 201 ? -33.487 39.608 -76.021 1.00 40.36 ? 196 THR A CA 1 ATOM 1566 C C . THR A 1 201 ? -33.131 40.409 -74.787 1.00 37.98 ? 196 THR A C 1 ATOM 1567 O O . THR A 1 201 ? -32.238 41.242 -74.806 1.00 41.93 ? 196 THR A O 1 ATOM 1568 C CB . THR A 1 201 ? -33.184 38.118 -75.764 1.00 41.49 ? 196 THR A CB 1 ATOM 1569 O OG1 . THR A 1 201 ? -31.776 37.948 -75.553 1.00 42.10 ? 196 THR A OG1 1 ATOM 1570 C CG2 . THR A 1 201 ? -33.593 37.245 -76.966 1.00 44.95 ? 196 THR A CG2 1 ATOM 1571 N N . TYR A 1 202 ? -33.870 40.144 -73.733 1.00 35.05 ? 197 TYR A N 1 ATOM 1572 C CA . TYR A 1 202 ? -33.744 40.853 -72.496 1.00 35.83 ? 197 TYR A CA 1 ATOM 1573 C C . TYR A 1 202 ? -34.330 39.998 -71.378 1.00 35.60 ? 197 TYR A C 1 ATOM 1574 O O . TYR A 1 202 ? -35.070 39.019 -71.616 1.00 37.52 ? 197 TYR A O 1 ATOM 1575 C CB . TYR A 1 202 ? -34.504 42.202 -72.538 1.00 37.63 ? 197 TYR A CB 1 ATOM 1576 C CG . TYR A 1 202 ? -36.012 42.037 -72.647 1.00 38.28 ? 197 TYR A CG 1 ATOM 1577 C CD1 . TYR A 1 202 ? -36.612 41.828 -73.879 1.00 41.13 ? 197 TYR A CD1 1 ATOM 1578 C CD2 . TYR A 1 202 ? -36.824 42.019 -71.512 1.00 41.02 ? 197 TYR A CD2 1 ATOM 1579 C CE1 . TYR A 1 202 ? -37.981 41.621 -73.996 1.00 42.19 ? 197 TYR A CE1 1 ATOM 1580 C CE2 . TYR A 1 202 ? -38.209 41.817 -71.602 1.00 41.68 ? 197 TYR A CE2 1 ATOM 1581 C CZ . TYR A 1 202 ? -38.775 41.622 -72.853 1.00 45.07 ? 197 TYR A CZ 1 ATOM 1582 O OH . TYR A 1 202 ? -40.115 41.405 -72.991 1.00 44.11 ? 197 TYR A OH 1 ATOM 1583 N N . ILE A 1 203 ? -33.979 40.371 -70.153 1.00 36.31 ? 198 ILE A N 1 ATOM 1584 C CA . ILE A 1 203 ? -34.651 39.884 -68.951 1.00 35.73 ? 198 ILE A CA 1 ATOM 1585 C C . ILE A 1 203 ? -34.984 41.039 -68.060 1.00 36.83 ? 198 ILE A C 1 ATOM 1586 O O . ILE A 1 203 ? -34.108 41.862 -67.778 1.00 41.74 ? 198 ILE A O 1 ATOM 1587 C CB . ILE A 1 203 ? -33.754 38.938 -68.127 1.00 34.40 ? 198 ILE A CB 1 ATOM 1588 C CG1 . ILE A 1 203 ? -33.371 37.734 -68.984 1.00 37.06 ? 198 ILE A CG1 1 ATOM 1589 C CG2 . ILE A 1 203 ? -34.439 38.496 -66.853 1.00 31.73 ? 198 ILE A CG2 1 ATOM 1590 C CD1 . ILE A 1 203 ? -32.069 37.122 -68.506 1.00 38.96 ? 198 ILE A CD1 1 ATOM 1591 N N . SER A 1 204 ? -36.226 41.077 -67.572 1.00 38.26 ? 199 SER A N 1 ATOM 1592 C CA . SER A 1 204 ? -36.625 42.096 -66.607 1.00 40.38 ? 199 SER A CA 1 ATOM 1593 C C . SER A 1 204 ? -36.996 41.433 -65.306 1.00 36.87 ? 199 SER A C 1 ATOM 1594 O O . SER A 1 204 ? -37.714 40.463 -65.311 1.00 37.86 ? 199 SER A O 1 ATOM 1595 C CB . SER A 1 204 ? -37.828 42.913 -67.125 1.00 40.56 ? 199 SER A CB 1 ATOM 1596 O OG . SER A 1 204 ? -37.447 43.688 -68.247 1.00 46.98 ? 199 SER A OG 1 ATOM 1597 N N . VAL A 1 205 ? -36.569 42.026 -64.203 1.00 33.96 ? 200 VAL A N 1 ATOM 1598 C CA . VAL A 1 205 ? -36.874 41.491 -62.910 1.00 33.11 ? 200 VAL A CA 1 ATOM 1599 C C . VAL A 1 205 ? -37.311 42.646 -62.033 1.00 35.12 ? 200 VAL A C 1 ATOM 1600 O O . VAL A 1 205 ? -36.605 43.660 -61.958 1.00 34.16 ? 200 VAL A O 1 ATOM 1601 C CB . VAL A 1 205 ? -35.647 40.809 -62.303 1.00 32.49 ? 200 VAL A CB 1 ATOM 1602 C CG1 . VAL A 1 205 ? -36.012 39.974 -61.067 1.00 32.88 ? 200 VAL A CG1 1 ATOM 1603 C CG2 . VAL A 1 205 ? -34.996 39.922 -63.347 1.00 32.43 ? 200 VAL A CG2 1 ATOM 1604 N N . GLY A 1 206 ? -38.474 42.479 -61.391 1.00 33.21 ? 201 GLY A N 1 ATOM 1605 C CA . GLY A 1 206 ? -39.054 43.493 -60.524 1.00 34.06 ? 201 GLY A CA 1 ATOM 1606 C C . GLY A 1 206 ? -39.595 42.930 -59.221 1.00 33.37 ? 201 GLY A C 1 ATOM 1607 O O . GLY A 1 206 ? -40.186 41.864 -59.200 1.00 37.76 ? 201 GLY A O 1 ATOM 1608 N N . THR A 1 207 ? -39.332 43.614 -58.129 1.00 32.72 ? 202 THR A N 1 ATOM 1609 C CA . THR A 1 207 ? -39.963 43.320 -56.830 1.00 34.80 ? 202 THR A CA 1 ATOM 1610 C C . THR A 1 207 ? -40.524 44.643 -56.306 1.00 36.25 ? 202 THR A C 1 ATOM 1611 O O . THR A 1 207 ? -40.781 45.559 -57.083 1.00 44.33 ? 202 THR A O 1 ATOM 1612 C CB . THR A 1 207 ? -38.960 42.676 -55.808 1.00 33.70 ? 202 THR A CB 1 ATOM 1613 O OG1 . THR A 1 207 ? -37.970 43.623 -55.398 1.00 32.23 ? 202 THR A OG1 1 ATOM 1614 C CG2 . THR A 1 207 ? -38.281 41.488 -56.408 1.00 33.42 ? 202 THR A CG2 1 ATOM 1615 N N . SER A 1 208 ? -40.608 44.812 -55.007 1.00 35.21 ? 203 SER A N 1 ATOM 1616 C CA . SER A 1 208 ? -40.936 46.122 -54.501 1.00 35.39 ? 203 SER A CA 1 ATOM 1617 C C . SER A 1 208 ? -39.750 47.073 -54.498 1.00 37.50 ? 203 SER A C 1 ATOM 1618 O O . SER A 1 208 ? -39.950 48.291 -54.510 1.00 41.30 ? 203 SER A O 1 ATOM 1619 C CB . SER A 1 208 ? -41.581 46.024 -53.125 1.00 34.35 ? 203 SER A CB 1 ATOM 1620 O OG . SER A 1 208 ? -40.679 45.613 -52.160 1.00 38.05 ? 203 SER A OG 1 ATOM 1621 N N . THR A 1 209 ? -38.525 46.528 -54.503 1.00 37.09 ? 204 THR A N 1 ATOM 1622 C CA . THR A 1 209 ? -37.275 47.334 -54.482 1.00 36.73 ? 204 THR A CA 1 ATOM 1623 C C . THR A 1 209 ? -36.382 47.120 -55.697 1.00 39.19 ? 204 THR A C 1 ATOM 1624 O O . THR A 1 209 ? -35.677 48.019 -56.136 1.00 46.62 ? 204 THR A O 1 ATOM 1625 C CB . THR A 1 209 ? -36.418 47.025 -53.270 1.00 39.13 ? 204 THR A CB 1 ATOM 1626 O OG1 . THR A 1 209 ? -36.191 45.595 -53.175 1.00 47.11 ? 204 THR A OG1 1 ATOM 1627 C CG2 . THR A 1 209 ? -37.136 47.533 -52.003 1.00 37.34 ? 204 THR A CG2 1 ATOM 1628 N N . LEU A 1 210 ? -36.471 45.953 -56.290 1.00 39.07 ? 205 LEU A N 1 ATOM 1629 C CA . LEU A 1 210 ? -35.634 45.626 -57.390 1.00 35.40 ? 205 LEU A CA 1 ATOM 1630 C C . LEU A 1 210 ? -36.252 46.071 -58.700 1.00 35.05 ? 205 LEU A C 1 ATOM 1631 O O . LEU A 1 210 ? -37.427 45.919 -58.929 1.00 33.38 ? 205 LEU A O 1 ATOM 1632 C CB . LEU A 1 210 ? -35.448 44.098 -57.444 1.00 36.19 ? 205 LEU A CB 1 ATOM 1633 C CG . LEU A 1 210 ? -34.459 43.580 -58.512 1.00 36.01 ? 205 LEU A CG 1 ATOM 1634 C CD1 . LEU A 1 210 ? -33.039 43.996 -58.150 1.00 36.00 ? 205 LEU A CD1 1 ATOM 1635 C CD2 . LEU A 1 210 ? -34.552 42.071 -58.587 1.00 37.19 ? 205 LEU A CD2 1 ATOM 1636 N N . ASN A 1 211 ? -35.424 46.561 -59.598 1.00 35.73 ? 206 ASN A N 1 ATOM 1637 C CA . ASN A 1 211 ? -35.900 47.016 -60.884 1.00 33.77 ? 206 ASN A CA 1 ATOM 1638 C C . ASN A 1 211 ? -34.762 46.782 -61.876 1.00 33.41 ? 206 ASN A C 1 ATOM 1639 O O . ASN A 1 211 ? -34.005 47.689 -62.196 1.00 35.20 ? 206 ASN A O 1 ATOM 1640 C CB . ASN A 1 211 ? -36.232 48.506 -60.793 1.00 34.91 ? 206 ASN A CB 1 ATOM 1641 C CG . ASN A 1 211 ? -36.849 49.050 -62.067 1.00 34.06 ? 206 ASN A CG 1 ATOM 1642 O OD1 . ASN A 1 211 ? -37.326 48.308 -62.886 1.00 33.39 ? 206 ASN A OD1 1 ATOM 1643 N ND2 . ASN A 1 211 ? -36.835 50.366 -62.215 1.00 37.63 ? 206 ASN A ND2 1 ATOM 1644 N N . GLN A 1 212 ? -34.650 45.568 -62.378 1.00 30.19 ? 207 GLN A N 1 ATOM 1645 C CA . GLN A 1 212 ? -33.450 45.184 -63.129 1.00 32.43 ? 207 GLN A CA 1 ATOM 1646 C C . GLN A 1 212 ? -33.776 44.902 -64.585 1.00 33.58 ? 207 GLN A C 1 ATOM 1647 O O . GLN A 1 212 ? -34.850 44.359 -64.916 1.00 33.62 ? 207 GLN A O 1 ATOM 1648 C CB . GLN A 1 212 ? -32.861 43.922 -62.470 1.00 33.08 ? 207 GLN A CB 1 ATOM 1649 C CG . GLN A 1 212 ? -31.655 43.300 -63.141 1.00 34.26 ? 207 GLN A CG 1 ATOM 1650 C CD . GLN A 1 212 ? -31.193 42.098 -62.373 1.00 35.20 ? 207 GLN A CD 1 ATOM 1651 O OE1 . GLN A 1 212 ? -31.457 40.987 -62.760 1.00 38.66 ? 207 GLN A OE1 1 ATOM 1652 N NE2 . GLN A 1 212 ? -30.542 42.324 -61.238 1.00 39.39 ? 207 GLN A NE2 1 ATOM 1653 N N . ARG A 1 213 ? -32.845 45.216 -65.452 1.00 35.57 ? 208 ARG A N 1 ATOM 1654 C CA . ARG A 1 213 ? -32.961 44.737 -66.829 1.00 38.74 ? 208 ARG A CA 1 ATOM 1655 C C . ARG A 1 213 ? -31.616 44.172 -67.329 1.00 38.91 ? 208 ARG A C 1 ATOM 1656 O O . ARG A 1 213 ? -30.610 44.878 -67.307 1.00 39.18 ? 208 ARG A O 1 ATOM 1657 C CB . ARG A 1 213 ? -33.372 45.870 -67.694 1.00 43.83 ? 208 ARG A CB 1 ATOM 1658 C CG . ARG A 1 213 ? -33.751 45.463 -69.100 1.00 49.32 ? 208 ARG A CG 1 ATOM 1659 C CD . ARG A 1 213 ? -33.768 46.706 -69.956 1.00 56.82 ? 208 ARG A CD 1 ATOM 1660 N NE . ARG A 1 213 ? -33.819 46.368 -71.366 1.00 61.64 ? 208 ARG A NE 1 ATOM 1661 C CZ . ARG A 1 213 ? -34.909 45.932 -71.966 1.00 58.85 ? 208 ARG A CZ 1 ATOM 1662 N NH1 . ARG A 1 213 ? -36.042 45.795 -71.280 1.00 54.20 ? 208 ARG A NH1 1 ATOM 1663 N NH2 . ARG A 1 213 ? -34.844 45.632 -73.250 1.00 63.18 ? 208 ARG A NH2 1 ATOM 1664 N N . LEU A 1 214 ? -31.603 42.925 -67.788 1.00 34.20 ? 209 LEU A N 1 ATOM 1665 C CA . LEU A 1 214 ? -30.375 42.310 -68.250 1.00 33.28 ? 209 LEU A CA 1 ATOM 1666 C C . LEU A 1 214 ? -30.480 42.077 -69.742 1.00 36.85 ? 209 LEU A C 1 ATOM 1667 O O . LEU A 1 214 ? -31.548 41.714 -70.261 1.00 35.66 ? 209 LEU A O 1 ATOM 1668 C CB . LEU A 1 214 ? -30.133 40.974 -67.562 1.00 32.57 ? 209 LEU A CB 1 ATOM 1669 C CG . LEU A 1 214 ? -30.180 40.954 -66.046 1.00 32.00 ? 209 LEU A CG 1 ATOM 1670 C CD1 . LEU A 1 214 ? -30.194 39.548 -65.481 1.00 30.98 ? 209 LEU A CD1 1 ATOM 1671 C CD2 . LEU A 1 214 ? -28.998 41.735 -65.515 1.00 33.09 ? 209 LEU A CD2 1 ATOM 1672 N N . VAL A 1 215 ? -29.353 42.309 -70.415 1.00 40.46 ? 210 VAL A N 1 ATOM 1673 C CA . VAL A 1 215 ? -29.228 42.172 -71.853 1.00 44.18 ? 210 VAL A CA 1 ATOM 1674 C C . VAL A 1 215 ? -27.981 41.362 -72.163 1.00 40.66 ? 210 VAL A C 1 ATOM 1675 O O . VAL A 1 215 ? -26.928 41.687 -71.703 1.00 42.81 ? 210 VAL A O 1 ATOM 1676 C CB . VAL A 1 215 ? -29.112 43.559 -72.551 1.00 48.07 ? 210 VAL A CB 1 ATOM 1677 C CG1 . VAL A 1 215 ? -28.975 43.393 -74.066 1.00 46.07 ? 210 VAL A CG1 1 ATOM 1678 C CG2 . VAL A 1 215 ? -30.350 44.421 -72.242 1.00 50.67 ? 210 VAL A CG2 1 ATOM 1679 N N . PRO A 1 216 ? -28.117 40.315 -72.971 1.00 41.85 ? 211 PRO A N 1 ATOM 1680 C CA . PRO A 1 216 ? -26.964 39.519 -73.347 1.00 41.40 ? 211 PRO A CA 1 ATOM 1681 C C . PRO A 1 216 ? -25.950 40.280 -74.163 1.00 38.26 ? 211 PRO A C 1 ATOM 1682 O O . PRO A 1 216 ? -26.338 41.153 -74.950 1.00 37.70 ? 211 PRO A O 1 ATOM 1683 C CB . PRO A 1 216 ? -27.574 38.395 -74.204 1.00 41.72 ? 211 PRO A CB 1 ATOM 1684 C CG . PRO A 1 216 ? -29.016 38.358 -73.800 1.00 41.63 ? 211 PRO A CG 1 ATOM 1685 C CD . PRO A 1 216 ? -29.359 39.779 -73.565 1.00 41.86 ? 211 PRO A CD 1 ATOM 1686 N N . LYS A 1 217 ? -24.671 39.952 -73.945 1.00 37.34 ? 212 LYS A N 1 ATOM 1687 C CA . LYS A 1 217 ? -23.507 40.558 -74.631 1.00 38.49 ? 212 LYS A CA 1 ATOM 1688 C C . LYS A 1 217 ? -22.944 39.537 -75.548 1.00 41.45 ? 212 LYS A C 1 ATOM 1689 O O . LYS A 1 217 ? -22.298 38.572 -75.117 1.00 45.80 ? 212 LYS A O 1 ATOM 1690 C CB . LYS A 1 217 ? -22.455 41.021 -73.664 1.00 38.30 ? 212 LYS A CB 1 ATOM 1691 C CG . LYS A 1 217 ? -22.877 42.278 -72.916 1.00 40.12 ? 212 LYS A CG 1 ATOM 1692 C CD . LYS A 1 217 ? -21.809 42.708 -71.927 1.00 44.72 ? 212 LYS A CD 1 ATOM 1693 C CE . LYS A 1 217 ? -22.316 42.740 -70.503 1.00 48.55 ? 212 LYS A CE 1 ATOM 1694 N NZ . LYS A 1 217 ? -21.200 42.866 -69.529 1.00 48.59 ? 212 LYS A NZ 1 ATOM 1695 N N . ILE A 1 218 ? -23.323 39.671 -76.815 1.00 46.18 ? 213 ILE A N 1 ATOM 1696 C CA . ILE A 1 218 ? -23.066 38.624 -77.793 1.00 48.41 ? 213 ILE A CA 1 ATOM 1697 C C . ILE A 1 218 ? -21.784 38.982 -78.417 1.00 43.93 ? 213 ILE A C 1 ATOM 1698 O O . ILE A 1 218 ? -21.746 39.897 -79.205 1.00 42.43 ? 213 ILE A O 1 ATOM 1699 C CB . ILE A 1 218 ? -24.197 38.523 -78.836 1.00 50.35 ? 213 ILE A CB 1 ATOM 1700 C CG1 . ILE A 1 218 ? -25.485 38.047 -78.144 1.00 51.00 ? 213 ILE A CG1 1 ATOM 1701 C CG2 . ILE A 1 218 ? -23.806 37.547 -79.935 1.00 51.80 ? 213 ILE A CG2 1 ATOM 1702 C CD1 . ILE A 1 218 ? -26.686 38.026 -79.044 1.00 51.91 ? 213 ILE A CD1 1 ATOM 1703 N N . ALA A 1 219 ? -20.730 38.279 -78.037 1.00 43.18 ? 214 ALA A N 1 ATOM 1704 C CA . ALA A 1 219 ? -19.370 38.689 -78.394 1.00 44.67 ? 214 ALA A CA 1 ATOM 1705 C C . ALA A 1 219 ? -18.366 37.561 -78.300 1.00 43.87 ? 214 ALA A C 1 ATOM 1706 O O . ALA A 1 219 ? -18.672 36.525 -77.725 1.00 46.30 ? 214 ALA A O 1 ATOM 1707 C CB . ALA A 1 219 ? -18.936 39.813 -77.472 1.00 44.37 ? 214 ALA A CB 1 ATOM 1708 N N . THR A 1 220 ? -17.152 37.801 -78.801 1.00 46.08 ? 215 THR A N 1 ATOM 1709 C CA . THR A 1 220 ? -16.055 36.806 -78.746 1.00 45.43 ? 215 THR A CA 1 ATOM 1710 C C . THR A 1 220 ? -15.265 36.867 -77.458 1.00 42.74 ? 215 THR A C 1 ATOM 1711 O O . THR A 1 220 ? -14.803 37.924 -77.098 1.00 46.54 ? 215 THR A O 1 ATOM 1712 C CB . THR A 1 220 ? -15.066 36.996 -79.918 1.00 47.14 ? 215 THR A CB 1 ATOM 1713 O OG1 . THR A 1 220 ? -15.779 36.937 -81.156 1.00 51.34 ? 215 THR A OG1 1 ATOM 1714 C CG2 . THR A 1 220 ? -14.025 35.908 -79.949 1.00 45.97 ? 215 THR A CG2 1 ATOM 1715 N N . ARG A 1 221 ? -15.123 35.714 -76.793 1.00 38.95 ? 216 ARG A N 1 ATOM 1716 C CA . ARG A 1 221 ? -14.415 35.560 -75.536 1.00 36.97 ? 216 ARG A CA 1 ATOM 1717 C C . ARG A 1 221 ? -13.513 34.343 -75.573 1.00 37.54 ? 216 ARG A C 1 ATOM 1718 O O . ARG A 1 221 ? -13.636 33.489 -76.432 1.00 39.63 ? 216 ARG A O 1 ATOM 1719 C CB . ARG A 1 221 ? -15.408 35.419 -74.383 1.00 38.81 ? 216 ARG A CB 1 ATOM 1720 C CG . ARG A 1 221 ? -16.258 36.674 -74.118 1.00 39.21 ? 216 ARG A CG 1 ATOM 1721 C CD . ARG A 1 221 ? -17.420 36.391 -73.183 1.00 38.37 ? 216 ARG A CD 1 ATOM 1722 N NE . ARG A 1 221 ? -18.444 35.621 -73.899 1.00 39.34 ? 216 ARG A NE 1 ATOM 1723 C CZ . ARG A 1 221 ? -19.558 36.111 -74.431 1.00 39.54 ? 216 ARG A CZ 1 ATOM 1724 N NH1 . ARG A 1 221 ? -19.923 37.383 -74.285 1.00 39.32 ? 216 ARG A NH1 1 ATOM 1725 N NH2 . ARG A 1 221 ? -20.361 35.295 -75.069 1.00 40.48 ? 216 ARG A NH2 1 ATOM 1726 N N . SER A 1 222 ? -12.589 34.248 -74.635 1.00 39.67 ? 217 SER A N 1 ATOM 1727 C CA . SER A 1 222 ? -11.701 33.067 -74.542 1.00 40.56 ? 217 SER A CA 1 ATOM 1728 C C . SER A 1 222 ? -12.459 31.861 -73.972 1.00 38.78 ? 217 SER A C 1 ATOM 1729 O O . SER A 1 222 ? -13.535 32.032 -73.425 1.00 37.71 ? 217 SER A O 1 ATOM 1730 C CB . SER A 1 222 ? -10.481 33.402 -73.689 1.00 41.23 ? 217 SER A CB 1 ATOM 1731 O OG . SER A 1 222 ? -9.803 34.490 -74.270 1.00 44.26 ? 217 SER A OG 1 ATOM 1732 N N . GLN A 1 223 ? -11.931 30.654 -74.132 1.00 40.78 ? 218 GLN A N 1 ATOM 1733 C CA . GLN A 1 223 ? -12.588 29.446 -73.632 1.00 43.63 ? 218 GLN A CA 1 ATOM 1734 C C . GLN A 1 223 ? -12.266 29.290 -72.186 1.00 43.61 ? 218 GLN A C 1 ATOM 1735 O O . GLN A 1 223 ? -11.094 29.436 -71.810 1.00 45.03 ? 218 GLN A O 1 ATOM 1736 C CB . GLN A 1 223 ? -12.037 28.172 -74.267 1.00 52.88 ? 218 GLN A CB 1 ATOM 1737 C CG . GLN A 1 223 ? -12.253 28.027 -75.739 1.00 64.67 ? 218 GLN A CG 1 ATOM 1738 C CD . GLN A 1 223 ? -12.382 26.569 -76.142 1.00 76.82 ? 218 GLN A CD 1 ATOM 1739 O OE1 . GLN A 1 223 ? -11.800 25.662 -75.516 1.00 77.54 ? 218 GLN A OE1 1 ATOM 1740 N NE2 . GLN A 1 223 ? -13.190 26.326 -77.179 1.00 82.93 ? 218 GLN A NE2 1 ATOM 1741 N N . VAL A 1 224 ? -13.278 28.959 -71.380 1.00 38.53 ? 219 VAL A N 1 ATOM 1742 C CA . VAL A 1 224 ? -13.093 28.535 -70.013 1.00 35.79 ? 219 VAL A CA 1 ATOM 1743 C C . VAL A 1 224 ? -13.996 27.336 -69.789 1.00 39.55 ? 219 VAL A C 1 ATOM 1744 O O . VAL A 1 224 ? -15.155 27.360 -70.174 1.00 40.30 ? 219 VAL A O 1 ATOM 1745 C CB . VAL A 1 224 ? -13.418 29.652 -69.015 1.00 37.58 ? 219 VAL A CB 1 ATOM 1746 C CG1 . VAL A 1 224 ? -13.199 29.192 -67.571 1.00 36.61 ? 219 VAL A CG1 1 ATOM 1747 C CG2 . VAL A 1 224 ? -12.572 30.916 -69.282 1.00 36.88 ? 219 VAL A CG2 1 ATOM 1748 N N . ASN A 1 225 ? -13.451 26.273 -69.177 1.00 42.15 ? 220 ASN A N 1 ATOM 1749 C CA . ASN A 1 225 ? -14.095 24.946 -69.053 1.00 39.78 ? 220 ASN A CA 1 ATOM 1750 C C . ASN A 1 225 ? -14.729 24.533 -70.348 1.00 35.75 ? 220 ASN A C 1 ATOM 1751 O O . ASN A 1 225 ? -15.813 24.023 -70.343 1.00 35.17 ? 220 ASN A O 1 ATOM 1752 C CB . ASN A 1 225 ? -15.140 24.901 -67.914 1.00 45.52 ? 220 ASN A CB 1 ATOM 1753 C CG . ASN A 1 225 ? -14.601 25.438 -66.582 1.00 53.47 ? 220 ASN A CG 1 ATOM 1754 O OD1 . ASN A 1 225 ? -15.323 26.107 -65.784 1.00 57.77 ? 220 ASN A OD1 1 ATOM 1755 N ND2 . ASN A 1 225 ? -13.328 25.160 -66.317 1.00 52.76 ? 220 ASN A ND2 1 ATOM 1756 N N . GLY A 1 226 ? -14.049 24.793 -71.462 1.00 37.17 ? 221 GLY A N 1 ATOM 1757 C CA . GLY A 1 226 ? -14.495 24.393 -72.771 1.00 40.92 ? 221 GLY A CA 1 ATOM 1758 C C . GLY A 1 226 ? -15.500 25.329 -73.445 1.00 47.06 ? 221 GLY A C 1 ATOM 1759 O O . GLY A 1 226 ? -15.947 25.042 -74.531 1.00 52.29 ? 221 GLY A O 1 ATOM 1760 N N . GLN A 1 227 ? -15.857 26.441 -72.801 1.00 48.84 ? 222 GLN A N 1 ATOM 1761 C CA . GLN A 1 227 ? -16.972 27.306 -73.251 1.00 41.57 ? 222 GLN A CA 1 ATOM 1762 C C . GLN A 1 227 ? -16.570 28.761 -73.466 1.00 36.15 ? 222 GLN A C 1 ATOM 1763 O O . GLN A 1 227 ? -15.805 29.323 -72.697 1.00 32.64 ? 222 GLN A O 1 ATOM 1764 C CB . GLN A 1 227 ? -18.064 27.308 -72.193 1.00 40.65 ? 222 GLN A CB 1 ATOM 1765 C CG . GLN A 1 227 ? -18.574 25.923 -71.837 1.00 42.79 ? 222 GLN A CG 1 ATOM 1766 C CD . GLN A 1 227 ? -19.173 25.175 -73.019 1.00 41.96 ? 222 GLN A CD 1 ATOM 1767 O OE1 . GLN A 1 227 ? -18.896 24.008 -73.222 1.00 50.78 ? 222 GLN A OE1 1 ATOM 1768 N NE2 . GLN A 1 227 ? -19.936 25.846 -73.803 1.00 39.16 ? 222 GLN A NE2 1 ATOM 1769 N N . ARG A 1 228 ? -17.103 29.365 -74.505 1.00 34.78 ? 223 ARG A N 1 ATOM 1770 C CA . ARG A 1 228 ? -16.864 30.799 -74.765 1.00 37.93 ? 223 ARG A CA 1 ATOM 1771 C C . ARG A 1 228 ? -18.031 31.634 -74.282 1.00 35.05 ? 223 ARG A C 1 ATOM 1772 O O . ARG A 1 228 ? -17.931 32.840 -74.118 1.00 32.37 ? 223 ARG A O 1 ATOM 1773 C CB . ARG A 1 228 ? -16.609 31.032 -76.259 1.00 44.04 ? 223 ARG A CB 1 ATOM 1774 C CG . ARG A 1 228 ? -15.379 30.306 -76.768 1.00 46.82 ? 223 ARG A CG 1 ATOM 1775 C CD . ARG A 1 228 ? -15.171 30.384 -78.297 1.00 51.76 ? 223 ARG A CD 1 ATOM 1776 N NE . ARG A 1 228 ? -14.008 31.217 -78.486 1.00 60.41 ? 223 ARG A NE 1 ATOM 1777 C CZ . ARG A 1 228 ? -12.748 30.806 -78.561 1.00 56.01 ? 223 ARG A CZ 1 ATOM 1778 N NH1 . ARG A 1 228 ? -12.426 29.524 -78.636 1.00 59.94 ? 223 ARG A NH1 1 ATOM 1779 N NH2 . ARG A 1 228 ? -11.801 31.728 -78.604 1.00 58.47 ? 223 ARG A NH2 1 ATOM 1780 N N . GLY A 1 229 ? -19.167 30.980 -74.065 1.00 34.93 ? 224 GLY A N 1 ATOM 1781 C CA . GLY A 1 229 ? -20.305 31.639 -73.421 1.00 37.06 ? 224 GLY A CA 1 ATOM 1782 C C . GLY A 1 229 ? -20.081 31.934 -71.950 1.00 36.35 ? 224 GLY A C 1 ATOM 1783 O O . GLY A 1 229 ? -19.121 31.440 -71.302 1.00 42.67 ? 224 GLY A O 1 ATOM 1784 N N . ARG A 1 230 ? -20.971 32.731 -71.390 1.00 32.18 ? 225 ARG A N 1 ATOM 1785 C CA . ARG A 1 230 ? -20.868 33.069 -69.994 1.00 31.97 ? 225 ARG A CA 1 ATOM 1786 C C . ARG A 1 230 ? -22.230 33.107 -69.404 1.00 32.27 ? 225 ARG A C 1 ATOM 1787 O O . ARG A 1 230 ? -23.207 33.454 -70.111 1.00 31.17 ? 225 ARG A O 1 ATOM 1788 C CB . ARG A 1 230 ? -20.194 34.436 -69.811 1.00 32.73 ? 225 ARG A CB 1 ATOM 1789 C CG . ARG A 1 230 ? -18.759 34.516 -70.294 1.00 34.55 ? 225 ARG A CG 1 ATOM 1790 C CD . ARG A 1 230 ? -17.789 33.758 -69.372 1.00 37.15 ? 225 ARG A CD 1 ATOM 1791 N NE . ARG A 1 230 ? -16.414 33.886 -69.811 1.00 35.56 ? 225 ARG A NE 1 ATOM 1792 C CZ . ARG A 1 230 ? -15.819 33.120 -70.722 1.00 35.93 ? 225 ARG A CZ 1 ATOM 1793 N NH1 . ARG A 1 230 ? -16.441 32.109 -71.312 1.00 35.26 ? 225 ARG A NH1 1 ATOM 1794 N NH2 . ARG A 1 230 ? -14.559 33.359 -71.035 1.00 40.21 ? 225 ARG A NH2 1 ATOM 1795 N N . MET A 1 231 ? -22.300 32.875 -68.083 1.00 32.26 ? 226 MET A N 1 ATOM 1796 C CA . MET A 1 231 ? -23.553 33.119 -67.336 1.00 31.31 ? 226 MET A CA 1 ATOM 1797 C C . MET A 1 231 ? -23.352 34.008 -66.140 1.00 30.63 ? 226 MET A C 1 ATOM 1798 O O . MET A 1 231 ? -22.553 33.708 -65.312 1.00 29.94 ? 226 MET A O 1 ATOM 1799 C CB . MET A 1 231 ? -24.132 31.816 -66.919 1.00 33.46 ? 226 MET A CB 1 ATOM 1800 C CG . MET A 1 231 ? -24.745 31.170 -68.151 1.00 37.65 ? 226 MET A CG 1 ATOM 1801 S SD . MET A 1 231 ? -25.483 29.644 -67.746 1.00 44.67 ? 226 MET A SD 1 ATOM 1802 C CE . MET A 1 231 ? -26.063 29.153 -69.348 1.00 40.44 ? 226 MET A CE 1 ATOM 1803 N N . ASP A 1 232 ? -24.078 35.133 -66.114 1.00 30.46 ? 227 ASP A N 1 ATOM 1804 C CA . ASP A 1 232 ? -24.012 36.114 -65.055 1.00 30.05 ? 227 ASP A CA 1 ATOM 1805 C C . ASP A 1 232 ? -25.247 35.957 -64.167 1.00 29.37 ? 227 ASP A C 1 ATOM 1806 O O . ASP A 1 232 ? -26.396 36.041 -64.634 1.00 28.88 ? 227 ASP A O 1 ATOM 1807 C CB . ASP A 1 232 ? -23.954 37.549 -65.617 1.00 34.41 ? 227 ASP A CB 1 ATOM 1808 C CG . ASP A 1 232 ? -22.619 37.903 -66.272 1.00 34.63 ? 227 ASP A CG 1 ATOM 1809 O OD1 . ASP A 1 232 ? -21.624 37.182 -66.072 1.00 44.87 ? 227 ASP A OD1 1 ATOM 1810 O OD2 . ASP A 1 232 ? -22.578 38.911 -67.007 1.00 36.41 ? 227 ASP A OD2 1 ATOM 1811 N N . PHE A 1 233 ? -25.007 35.647 -62.912 1.00 28.78 ? 228 PHE A N 1 ATOM 1812 C CA . PHE A 1 233 ? -26.070 35.335 -61.975 1.00 30.35 ? 228 PHE A CA 1 ATOM 1813 C C . PHE A 1 233 ? -26.273 36.531 -61.095 1.00 30.38 ? 228 PHE A C 1 ATOM 1814 O O . PHE A 1 233 ? -25.330 37.273 -60.813 1.00 31.04 ? 228 PHE A O 1 ATOM 1815 C CB . PHE A 1 233 ? -25.736 34.092 -61.162 1.00 28.58 ? 228 PHE A CB 1 ATOM 1816 C CG . PHE A 1 233 ? -25.869 32.836 -61.954 1.00 29.63 ? 228 PHE A CG 1 ATOM 1817 C CD1 . PHE A 1 233 ? -24.759 32.240 -62.529 1.00 30.50 ? 228 PHE A CD1 1 ATOM 1818 C CD2 . PHE A 1 233 ? -27.106 32.267 -62.163 1.00 30.27 ? 228 PHE A CD2 1 ATOM 1819 C CE1 . PHE A 1 233 ? -24.893 31.106 -63.307 1.00 31.08 ? 228 PHE A CE1 1 ATOM 1820 C CE2 . PHE A 1 233 ? -27.254 31.141 -62.939 1.00 30.67 ? 228 PHE A CE2 1 ATOM 1821 C CZ . PHE A 1 233 ? -26.148 30.570 -63.523 1.00 31.23 ? 228 PHE A CZ 1 ATOM 1822 N N . PHE A 1 234 ? -27.508 36.687 -60.651 1.00 27.40 ? 229 PHE A N 1 ATOM 1823 C CA . PHE A 1 234 ? -27.889 37.786 -59.800 1.00 28.23 ? 229 PHE A CA 1 ATOM 1824 C C . PHE A 1 234 ? -28.767 37.269 -58.680 1.00 28.38 ? 229 PHE A C 1 ATOM 1825 O O . PHE A 1 234 ? -29.356 36.183 -58.822 1.00 28.12 ? 229 PHE A O 1 ATOM 1826 C CB . PHE A 1 234 ? -28.633 38.860 -60.650 1.00 28.42 ? 229 PHE A CB 1 ATOM 1827 C CG . PHE A 1 234 ? -27.746 39.524 -61.674 1.00 27.32 ? 229 PHE A CG 1 ATOM 1828 C CD1 . PHE A 1 234 ? -27.518 38.948 -62.892 1.00 27.60 ? 229 PHE A CD1 1 ATOM 1829 C CD2 . PHE A 1 234 ? -27.129 40.747 -61.399 1.00 28.79 ? 229 PHE A CD2 1 ATOM 1830 C CE1 . PHE A 1 234 ? -26.683 39.582 -63.861 1.00 28.21 ? 229 PHE A CE1 1 ATOM 1831 C CE2 . PHE A 1 234 ? -26.246 41.357 -62.330 1.00 28.95 ? 229 PHE A CE2 1 ATOM 1832 C CZ . PHE A 1 234 ? -26.017 40.768 -63.566 1.00 26.64 ? 229 PHE A CZ 1 ATOM 1833 N N . TRP A 1 235 ? -28.945 38.056 -57.598 1.00 26.94 ? 230 TRP A N 1 ATOM 1834 C CA . TRP A 1 235 ? -29.794 37.595 -56.510 1.00 25.54 ? 230 TRP A CA 1 ATOM 1835 C C . TRP A 1 235 ? -30.586 38.709 -55.858 1.00 27.79 ? 230 TRP A C 1 ATOM 1836 O O . TRP A 1 235 ? -30.312 39.876 -56.090 1.00 35.56 ? 230 TRP A O 1 ATOM 1837 C CB . TRP A 1 235 ? -28.929 36.873 -55.484 1.00 25.38 ? 230 TRP A CB 1 ATOM 1838 C CG . TRP A 1 235 ? -27.798 37.709 -54.936 1.00 23.91 ? 230 TRP A CG 1 ATOM 1839 C CD1 . TRP A 1 235 ? -26.613 37.963 -55.526 1.00 23.60 ? 230 TRP A CD1 1 ATOM 1840 C CD2 . TRP A 1 235 ? -27.782 38.392 -53.691 1.00 23.76 ? 230 TRP A CD2 1 ATOM 1841 N NE1 . TRP A 1 235 ? -25.832 38.764 -54.718 1.00 24.33 ? 230 TRP A NE1 1 ATOM 1842 C CE2 . TRP A 1 235 ? -26.521 39.043 -53.581 1.00 23.30 ? 230 TRP A CE2 1 ATOM 1843 C CE3 . TRP A 1 235 ? -28.687 38.488 -52.640 1.00 24.63 ? 230 TRP A CE3 1 ATOM 1844 C CZ2 . TRP A 1 235 ? -26.145 39.758 -52.478 1.00 23.41 ? 230 TRP A CZ2 1 ATOM 1845 C CZ3 . TRP A 1 235 ? -28.320 39.228 -51.516 1.00 25.83 ? 230 TRP A CZ3 1 ATOM 1846 C CH2 . TRP A 1 235 ? -27.072 39.879 -51.467 1.00 25.22 ? 230 TRP A CH2 1 ATOM 1847 N N . THR A 1 236 ? -31.579 38.346 -55.049 1.00 27.34 ? 231 THR A N 1 ATOM 1848 C CA . THR A 1 236 ? -32.281 39.305 -54.207 1.00 28.40 ? 231 THR A CA 1 ATOM 1849 C C . THR A 1 236 ? -32.873 38.614 -52.996 1.00 29.35 ? 231 THR A C 1 ATOM 1850 O O . THR A 1 236 ? -33.000 37.381 -52.975 1.00 29.17 ? 231 THR A O 1 ATOM 1851 C CB . THR A 1 236 ? -33.397 39.992 -55.005 1.00 30.95 ? 231 THR A CB 1 ATOM 1852 O OG1 . THR A 1 236 ? -33.878 41.113 -54.283 1.00 28.83 ? 231 THR A OG1 1 ATOM 1853 C CG2 . THR A 1 236 ? -34.559 39.056 -55.269 1.00 32.81 ? 231 THR A CG2 1 ATOM 1854 N N . ILE A 1 237 ? -33.235 39.397 -51.996 1.00 29.67 ? 232 ILE A N 1 ATOM 1855 C CA . ILE A 1 237 ? -33.949 38.890 -50.816 1.00 31.65 ? 232 ILE A CA 1 ATOM 1856 C C . ILE A 1 237 ? -35.393 39.315 -50.978 1.00 33.24 ? 232 ILE A C 1 ATOM 1857 O O . ILE A 1 237 ? -35.691 40.508 -50.938 1.00 37.17 ? 232 ILE A O 1 ATOM 1858 C CB . ILE A 1 237 ? -33.406 39.488 -49.515 1.00 31.60 ? 232 ILE A CB 1 ATOM 1859 C CG1 . ILE A 1 237 ? -31.938 39.146 -49.333 1.00 32.25 ? 232 ILE A CG1 1 ATOM 1860 C CG2 . ILE A 1 237 ? -34.177 38.963 -48.305 1.00 32.64 ? 232 ILE A CG2 1 ATOM 1861 C CD1 . ILE A 1 237 ? -31.613 37.677 -49.448 1.00 32.34 ? 232 ILE A CD1 1 ATOM 1862 N N . LEU A 1 238 ? -36.276 38.360 -51.240 1.00 32.69 ? 233 LEU A N 1 ATOM 1863 C CA . LEU A 1 238 ? -37.694 38.677 -51.459 1.00 33.47 ? 233 LEU A CA 1 ATOM 1864 C C . LEU A 1 238 ? -38.379 38.610 -50.119 1.00 32.79 ? 233 LEU A C 1 ATOM 1865 O O . LEU A 1 238 ? -38.403 37.549 -49.498 1.00 32.51 ? 233 LEU A O 1 ATOM 1866 C CB . LEU A 1 238 ? -38.323 37.691 -52.442 1.00 33.21 ? 233 LEU A CB 1 ATOM 1867 C CG . LEU A 1 238 ? -39.770 37.954 -52.823 1.00 32.77 ? 233 LEU A CG 1 ATOM 1868 C CD1 . LEU A 1 238 ? -39.870 39.270 -53.552 1.00 37.75 ? 233 LEU A CD1 1 ATOM 1869 C CD2 . LEU A 1 238 ? -40.311 36.854 -53.688 1.00 33.77 ? 233 LEU A CD2 1 ATOM 1870 N N . LYS A 1 239 ? -38.879 39.736 -49.659 1.00 36.08 ? 234 LYS A N 1 ATOM 1871 C CA . LYS A 1 239 ? -39.474 39.820 -48.319 1.00 41.60 ? 234 LYS A CA 1 ATOM 1872 C C . LYS A 1 239 ? -40.795 39.028 -48.250 1.00 38.06 ? 234 LYS A C 1 ATOM 1873 O O . LYS A 1 239 ? -41.476 38.872 -49.270 1.00 32.08 ? 234 LYS A O 1 ATOM 1874 C CB . LYS A 1 239 ? -39.793 41.279 -47.925 1.00 46.38 ? 234 LYS A CB 1 ATOM 1875 C CG . LYS A 1 239 ? -38.612 42.218 -47.889 1.00 55.18 ? 234 LYS A CG 1 ATOM 1876 C CD . LYS A 1 239 ? -37.577 41.733 -46.906 1.00 65.21 ? 234 LYS A CD 1 ATOM 1877 C CE . LYS A 1 239 ? -36.843 42.906 -46.283 1.00 76.37 ? 234 LYS A CE 1 ATOM 1878 N NZ . LYS A 1 239 ? -35.801 42.392 -45.352 1.00 83.61 ? 234 LYS A NZ 1 ATOM 1879 N N . PRO A 1 240 ? -41.188 38.618 -47.042 1.00 38.30 ? 235 PRO A N 1 ATOM 1880 C CA . PRO A 1 240 ? -42.411 37.872 -46.874 1.00 42.79 ? 235 PRO A CA 1 ATOM 1881 C C . PRO A 1 240 ? -43.664 38.309 -47.595 1.00 48.04 ? 235 PRO A C 1 ATOM 1882 O O . PRO A 1 240 ? -44.318 37.432 -48.204 1.00 55.80 ? 235 PRO A O 1 ATOM 1883 C CB . PRO A 1 240 ? -42.608 37.812 -45.371 1.00 40.82 ? 235 PRO A CB 1 ATOM 1884 C CG . PRO A 1 240 ? -41.219 37.790 -44.854 1.00 39.85 ? 235 PRO A CG 1 ATOM 1885 C CD . PRO A 1 240 ? -40.489 38.761 -45.747 1.00 38.36 ? 235 PRO A CD 1 ATOM 1886 N N . ASN A 1 241 ? -44.087 39.534 -47.702 1.00 45.72 ? 236 ASN A N 1 ATOM 1887 C CA . ASN A 1 241 ? -45.328 39.464 -48.655 1.00 52.11 ? 236 ASN A CA 1 ATOM 1888 C C . ASN A 1 241 ? -45.196 39.973 -50.085 1.00 43.94 ? 236 ASN A C 1 ATOM 1889 O O . ASN A 1 241 ? -46.145 40.398 -50.704 1.00 45.98 ? 236 ASN A O 1 ATOM 1890 C CB . ASN A 1 241 ? -46.620 39.944 -47.989 1.00 56.83 ? 236 ASN A CB 1 ATOM 1891 C CG . ASN A 1 241 ? -47.457 38.791 -47.552 1.00 70.70 ? 236 ASN A CG 1 ATOM 1892 O OD1 . ASN A 1 241 ? -48.296 38.330 -48.313 1.00 83.06 ? 236 ASN A OD1 1 ATOM 1893 N ND2 . ASN A 1 241 ? -47.154 38.226 -46.370 1.00 72.82 ? 236 ASN A ND2 1 ATOM 1894 N N . ASP A 1 242 ? -43.974 40.022 -50.560 1.00 38.29 ? 237 ASP A N 1 ATOM 1895 C CA . ASP A 1 242 ? -43.672 40.656 -51.804 1.00 35.32 ? 237 ASP A CA 1 ATOM 1896 C C . ASP A 1 242 ? -43.685 39.577 -52.879 1.00 33.96 ? 237 ASP A C 1 ATOM 1897 O O . ASP A 1 242 ? -43.742 38.391 -52.599 1.00 36.27 ? 237 ASP A O 1 ATOM 1898 C CB . ASP A 1 242 ? -42.301 41.322 -51.687 1.00 36.76 ? 237 ASP A CB 1 ATOM 1899 C CG . ASP A 1 242 ? -42.035 42.368 -52.751 1.00 36.88 ? 237 ASP A CG 1 ATOM 1900 O OD1 . ASP A 1 242 ? -42.980 42.824 -53.457 1.00 35.69 ? 237 ASP A OD1 1 ATOM 1901 O OD2 . ASP A 1 242 ? -40.839 42.786 -52.830 1.00 38.80 ? 237 ASP A OD2 1 ATOM 1902 N N . ALA A 1 243 ? -43.653 40.007 -54.106 1.00 31.92 ? 238 ALA A N 1 ATOM 1903 C CA . ALA A 1 243 ? -43.582 39.141 -55.197 1.00 33.26 ? 238 ALA A CA 1 ATOM 1904 C C . ALA A 1 243 ? -42.489 39.618 -56.132 1.00 34.89 ? 238 ALA A C 1 ATOM 1905 O O . ALA A 1 243 ? -42.201 40.816 -56.189 1.00 33.56 ? 238 ALA A O 1 ATOM 1906 C CB . ALA A 1 243 ? -44.897 39.114 -55.932 1.00 33.24 ? 238 ALA A CB 1 ATOM 1907 N N . ILE A 1 244 ? -41.962 38.669 -56.911 1.00 33.21 ? 239 ILE A N 1 ATOM 1908 C CA . ILE A 1 244 ? -40.928 38.930 -57.855 1.00 32.31 ? 239 ILE A CA 1 ATOM 1909 C C . ILE A 1 244 ? -41.503 38.713 -59.206 1.00 32.88 ? 239 ILE A C 1 ATOM 1910 O O . ILE A 1 244 ? -42.199 37.724 -59.434 1.00 33.37 ? 239 ILE A O 1 ATOM 1911 C CB . ILE A 1 244 ? -39.684 38.012 -57.597 1.00 32.67 ? 239 ILE A CB 1 ATOM 1912 C CG1 . ILE A 1 244 ? -38.539 38.343 -58.566 1.00 32.94 ? 239 ILE A CG1 1 ATOM 1913 C CG2 . ILE A 1 244 ? -40.010 36.531 -57.677 1.00 30.65 ? 239 ILE A CG2 1 ATOM 1914 C CD1 . ILE A 1 244 ? -37.169 37.930 -58.026 1.00 31.63 ? 239 ILE A CD1 1 ATOM 1915 N N . HIS A 1 245 ? -41.180 39.594 -60.137 1.00 33.99 ? 240 HIS A N 1 ATOM 1916 C CA . HIS A 1 245 ? -41.814 39.521 -61.488 1.00 35.27 ? 240 HIS A CA 1 ATOM 1917 C C . HIS A 1 245 ? -40.741 39.407 -62.566 1.00 33.34 ? 240 HIS A C 1 ATOM 1918 O O . HIS A 1 245 ? -39.905 40.280 -62.679 1.00 32.38 ? 240 HIS A O 1 ATOM 1919 C CB . HIS A 1 245 ? -42.686 40.758 -61.779 1.00 35.18 ? 240 HIS A CB 1 ATOM 1920 C CG . HIS A 1 245 ? -43.652 41.071 -60.696 1.00 34.19 ? 240 HIS A CG 1 ATOM 1921 N ND1 . HIS A 1 245 ? -44.948 40.596 -60.704 1.00 36.31 ? 240 HIS A ND1 1 ATOM 1922 C CD2 . HIS A 1 245 ? -43.508 41.759 -59.544 1.00 34.42 ? 240 HIS A CD2 1 ATOM 1923 C CE1 . HIS A 1 245 ? -45.568 41.002 -59.617 1.00 34.72 ? 240 HIS A CE1 1 ATOM 1924 N NE2 . HIS A 1 245 ? -44.714 41.700 -58.886 1.00 34.49 ? 240 HIS A NE2 1 ATOM 1925 N N . PHE A 1 246 ? -40.779 38.304 -63.315 1.00 31.62 ? 241 PHE A N 1 ATOM 1926 C CA . PHE A 1 246 ? -39.805 38.002 -64.321 1.00 33.02 ? 241 PHE A CA 1 ATOM 1927 C C . PHE A 1 246 ? -40.457 38.150 -65.649 1.00 36.29 ? 241 PHE A C 1 ATOM 1928 O O . PHE A 1 246 ? -41.616 37.769 -65.805 1.00 40.30 ? 241 PHE A O 1 ATOM 1929 C CB . PHE A 1 246 ? -39.337 36.549 -64.195 1.00 32.68 ? 241 PHE A CB 1 ATOM 1930 C CG . PHE A 1 246 ? -38.438 36.308 -63.043 1.00 32.57 ? 241 PHE A CG 1 ATOM 1931 C CD1 . PHE A 1 246 ? -37.114 36.710 -63.094 1.00 32.58 ? 241 PHE A CD1 1 ATOM 1932 C CD2 . PHE A 1 246 ? -38.917 35.709 -61.906 1.00 33.93 ? 241 PHE A CD2 1 ATOM 1933 C CE1 . PHE A 1 246 ? -36.269 36.480 -62.051 1.00 33.73 ? 241 PHE A CE1 1 ATOM 1934 C CE2 . PHE A 1 246 ? -38.091 35.485 -60.839 1.00 36.03 ? 241 PHE A CE2 1 ATOM 1935 C CZ . PHE A 1 246 ? -36.760 35.877 -60.906 1.00 37.24 ? 241 PHE A CZ 1 ATOM 1936 N N . GLU A 1 247 ? -39.715 38.690 -66.611 1.00 37.31 ? 242 GLU A N 1 ATOM 1937 C CA . GLU A 1 247 ? -40.146 38.725 -68.005 1.00 39.54 ? 242 GLU A CA 1 ATOM 1938 C C . GLU A 1 247 ? -38.920 38.574 -68.902 1.00 38.05 ? 242 GLU A C 1 ATOM 1939 O O . GLU A 1 247 ? -37.893 39.253 -68.700 1.00 36.62 ? 242 GLU A O 1 ATOM 1940 C CB . GLU A 1 247 ? -40.899 40.016 -68.327 1.00 45.24 ? 242 GLU A CB 1 ATOM 1941 C CG . GLU A 1 247 ? -41.292 40.160 -69.808 1.00 50.87 ? 242 GLU A CG 1 ATOM 1942 C CD . GLU A 1 247 ? -42.049 41.462 -70.150 1.00 54.04 ? 242 GLU A CD 1 ATOM 1943 O OE1 . GLU A 1 247 ? -42.910 41.903 -69.383 1.00 56.46 ? 242 GLU A OE1 1 ATOM 1944 O OE2 . GLU A 1 247 ? -41.755 42.065 -71.193 1.00 56.41 ? 242 GLU A OE2 1 ATOM 1945 N N . SER A 1 248 ? -39.006 37.669 -69.866 1.00 35.17 ? 243 SER A N 1 ATOM 1946 C CA . SER A 1 248 ? -37.895 37.484 -70.781 1.00 37.20 ? 243 SER A CA 1 ATOM 1947 C C . SER A 1 248 ? -38.350 36.879 -72.083 1.00 39.99 ? 243 SER A C 1 ATOM 1948 O O . SER A 1 248 ? -39.249 36.053 -72.093 1.00 44.17 ? 243 SER A O 1 ATOM 1949 C CB . SER A 1 248 ? -36.840 36.558 -70.174 1.00 35.51 ? 243 SER A CB 1 ATOM 1950 O OG . SER A 1 248 ? -35.765 36.423 -71.064 1.00 30.81 ? 243 SER A OG 1 ATOM 1951 N N . ASN A 1 249 ? -37.657 37.221 -73.153 1.00 38.38 ? 244 ASN A N 1 ATOM 1952 C CA . ASN A 1 249 ? -37.825 36.500 -74.410 1.00 42.51 ? 244 ASN A CA 1 ATOM 1953 C C . ASN A 1 249 ? -36.567 35.759 -74.838 1.00 44.73 ? 244 ASN A C 1 ATOM 1954 O O . ASN A 1 249 ? -36.380 35.528 -76.018 1.00 48.70 ? 244 ASN A O 1 ATOM 1955 C CB . ASN A 1 249 ? -38.237 37.440 -75.510 1.00 42.18 ? 244 ASN A CB 1 ATOM 1956 C CG . ASN A 1 249 ? -37.170 38.440 -75.829 1.00 44.61 ? 244 ASN A CG 1 ATOM 1957 O OD1 . ASN A 1 249 ? -36.233 38.661 -75.040 1.00 50.62 ? 244 ASN A OD1 1 ATOM 1958 N ND2 . ASN A 1 249 ? -37.239 38.993 -77.009 1.00 44.00 ? 244 ASN A ND2 1 ATOM 1959 N N . GLY A 1 250 ? -35.693 35.431 -73.891 1.00 43.35 ? 245 GLY A N 1 ATOM 1960 C CA . GLY A 1 250 ? -34.497 34.670 -74.216 1.00 44.32 ? 245 GLY A CA 1 ATOM 1961 C C . GLY A 1 250 ? -33.355 34.795 -73.224 1.00 40.39 ? 245 GLY A C 1 ATOM 1962 O O . GLY A 1 250 ? -33.305 35.721 -72.454 1.00 40.03 ? 245 GLY A O 1 ATOM 1963 N N . ASN A 1 251 ? -32.433 33.845 -73.273 1.00 38.75 ? 246 ASN A N 1 ATOM 1964 C CA . ASN A 1 251 ? -31.194 33.928 -72.480 1.00 38.65 ? 246 ASN A CA 1 ATOM 1965 C C . ASN A 1 251 ? -31.414 33.940 -70.961 1.00 36.00 ? 246 ASN A C 1 ATOM 1966 O O . ASN A 1 251 ? -30.537 34.366 -70.221 1.00 31.95 ? 246 ASN A O 1 ATOM 1967 C CB . ASN A 1 251 ? -30.349 35.164 -72.894 1.00 36.51 ? 246 ASN A CB 1 ATOM 1968 C CG . ASN A 1 251 ? -30.154 35.257 -74.403 1.00 36.27 ? 246 ASN A CG 1 ATOM 1969 O OD1 . ASN A 1 251 ? -31.112 35.499 -75.137 1.00 34.46 ? 246 ASN A OD1 1 ATOM 1970 N ND2 . ASN A 1 251 ? -28.933 35.024 -74.868 1.00 35.17 ? 246 ASN A ND2 1 ATOM 1971 N N . PHE A 1 252 ? -32.562 33.433 -70.527 1.00 33.49 ? 247 PHE A N 1 ATOM 1972 C CA . PHE A 1 252 ? -32.963 33.524 -69.140 1.00 32.84 ? 247 PHE A CA 1 ATOM 1973 C C . PHE A 1 252 ? -32.639 32.191 -68.439 1.00 34.42 ? 247 PHE A C 1 ATOM 1974 O O . PHE A 1 252 ? -33.005 31.104 -68.919 1.00 30.89 ? 247 PHE A O 1 ATOM 1975 C CB . PHE A 1 252 ? -34.451 33.823 -69.109 1.00 32.84 ? 247 PHE A CB 1 ATOM 1976 C CG . PHE A 1 252 ? -35.069 33.895 -67.738 1.00 31.07 ? 247 PHE A CG 1 ATOM 1977 C CD1 . PHE A 1 252 ? -34.416 34.487 -66.661 1.00 31.43 ? 247 PHE A CD1 1 ATOM 1978 C CD2 . PHE A 1 252 ? -36.398 33.477 -67.566 1.00 30.00 ? 247 PHE A CD2 1 ATOM 1979 C CE1 . PHE A 1 252 ? -35.057 34.615 -65.410 1.00 30.07 ? 247 PHE A CE1 1 ATOM 1980 C CE2 . PHE A 1 252 ? -37.037 33.592 -66.332 1.00 29.72 ? 247 PHE A CE2 1 ATOM 1981 C CZ . PHE A 1 252 ? -36.371 34.150 -65.250 1.00 29.44 ? 247 PHE A CZ 1 ATOM 1982 N N . ILE A 1 253 ? -31.927 32.298 -67.313 1.00 33.10 ? 248 ILE A N 1 ATOM 1983 C CA . ILE A 1 253 ? -31.640 31.152 -66.479 1.00 32.09 ? 248 ILE A CA 1 ATOM 1984 C C . ILE A 1 253 ? -32.521 31.338 -65.260 1.00 30.36 ? 248 ILE A C 1 ATOM 1985 O O . ILE A 1 253 ? -32.223 32.140 -64.395 1.00 26.82 ? 248 ILE A O 1 ATOM 1986 C CB . ILE A 1 253 ? -30.153 31.067 -66.106 1.00 32.30 ? 248 ILE A CB 1 ATOM 1987 C CG1 . ILE A 1 253 ? -29.252 31.262 -67.303 1.00 30.89 ? 248 ILE A CG1 1 ATOM 1988 C CG2 . ILE A 1 253 ? -29.842 29.732 -65.464 1.00 34.78 ? 248 ILE A CG2 1 ATOM 1989 C CD1 . ILE A 1 253 ? -29.347 30.199 -68.347 1.00 30.98 ? 248 ILE A CD1 1 ATOM 1990 N N . ALA A 1 254 ? -33.600 30.551 -65.185 1.00 30.23 ? 249 ALA A N 1 ATOM 1991 C CA . ALA A 1 254 ? -34.688 30.800 -64.267 1.00 28.69 ? 249 ALA A CA 1 ATOM 1992 C C . ALA A 1 254 ? -34.524 30.170 -62.912 1.00 29.92 ? 249 ALA A C 1 ATOM 1993 O O . ALA A 1 254 ? -33.929 29.109 -62.777 1.00 31.38 ? 249 ALA A O 1 ATOM 1994 C CB . ALA A 1 254 ? -35.992 30.310 -64.866 1.00 28.84 ? 249 ALA A CB 1 ATOM 1995 N N . PRO A 1 255 ? -35.108 30.793 -61.883 1.00 29.75 ? 250 PRO A N 1 ATOM 1996 C CA . PRO A 1 255 ? -35.101 30.088 -60.625 1.00 29.61 ? 250 PRO A CA 1 ATOM 1997 C C . PRO A 1 255 ? -35.863 28.796 -60.748 1.00 31.36 ? 250 PRO A C 1 ATOM 1998 O O . PRO A 1 255 ? -36.799 28.689 -61.539 1.00 32.82 ? 250 PRO A O 1 ATOM 1999 C CB . PRO A 1 255 ? -35.823 31.040 -59.682 1.00 30.20 ? 250 PRO A CB 1 ATOM 2000 C CG . PRO A 1 255 ? -35.882 32.366 -60.367 1.00 29.79 ? 250 PRO A CG 1 ATOM 2001 C CD . PRO A 1 255 ? -35.849 32.052 -61.818 1.00 29.79 ? 250 PRO A CD 1 ATOM 2002 N N . GLU A 1 256 ? -35.463 27.819 -59.941 1.00 34.75 ? 251 GLU A N 1 ATOM 2003 C CA . GLU A 1 256 ? -36.247 26.600 -59.711 1.00 33.98 ? 251 GLU A CA 1 ATOM 2004 C C . GLU A 1 256 ? -36.390 26.498 -58.190 1.00 31.67 ? 251 GLU A C 1 ATOM 2005 O O . GLU A 1 256 ? -37.487 26.541 -57.665 1.00 28.66 ? 251 GLU A O 1 ATOM 2006 C CB . GLU A 1 256 ? -35.572 25.397 -60.327 1.00 38.59 ? 251 GLU A CB 1 ATOM 2007 C CG . GLU A 1 256 ? -36.344 24.079 -60.296 1.00 46.05 ? 251 GLU A CG 1 ATOM 2008 C CD . GLU A 1 256 ? -35.544 22.901 -60.887 1.00 49.25 ? 251 GLU A CD 1 ATOM 2009 O OE1 . GLU A 1 256 ? -34.546 23.094 -61.629 1.00 50.97 ? 251 GLU A OE1 1 ATOM 2010 O OE2 . GLU A 1 256 ? -35.970 21.771 -60.653 1.00 56.96 ? 251 GLU A OE2 1 ATOM 2011 N N . TYR A 1 257 ? -35.282 26.394 -57.491 1.00 31.09 ? 252 TYR A N 1 ATOM 2012 C CA . TYR A 1 257 ? -35.287 26.394 -56.045 1.00 31.91 ? 252 TYR A CA 1 ATOM 2013 C C . TYR A 1 257 ? -34.783 27.737 -55.519 1.00 34.87 ? 252 TYR A C 1 ATOM 2014 O O . TYR A 1 257 ? -34.131 28.512 -56.250 1.00 36.30 ? 252 TYR A O 1 ATOM 2015 C CB . TYR A 1 257 ? -34.358 25.322 -55.505 1.00 32.32 ? 252 TYR A CB 1 ATOM 2016 C CG . TYR A 1 257 ? -34.766 23.898 -55.736 1.00 34.17 ? 252 TYR A CG 1 ATOM 2017 C CD1 . TYR A 1 257 ? -35.371 23.149 -54.722 1.00 34.82 ? 252 TYR A CD1 1 ATOM 2018 C CD2 . TYR A 1 257 ? -34.444 23.255 -56.919 1.00 36.21 ? 252 TYR A CD2 1 ATOM 2019 C CE1 . TYR A 1 257 ? -35.736 21.834 -54.906 1.00 36.13 ? 252 TYR A CE1 1 ATOM 2020 C CE2 . TYR A 1 257 ? -34.776 21.906 -57.098 1.00 39.65 ? 252 TYR A CE2 1 ATOM 2021 C CZ . TYR A 1 257 ? -35.439 21.223 -56.079 1.00 39.74 ? 252 TYR A CZ 1 ATOM 2022 O OH . TYR A 1 257 ? -35.774 19.890 -56.208 1.00 48.28 ? 252 TYR A OH 1 ATOM 2023 N N . ALA A 1 258 ? -35.031 27.958 -54.235 1.00 29.81 ? 253 ALA A N 1 ATOM 2024 C CA . ALA A 1 258 ? -34.685 29.194 -53.599 1.00 29.55 ? 253 ALA A CA 1 ATOM 2025 C C . ALA A 1 258 ? -34.544 28.860 -52.139 1.00 29.92 ? 253 ALA A C 1 ATOM 2026 O O . ALA A 1 258 ? -34.686 27.698 -51.769 1.00 29.83 ? 253 ALA A O 1 ATOM 2027 C CB . ALA A 1 258 ? -35.751 30.207 -53.827 1.00 29.80 ? 253 ALA A CB 1 ATOM 2028 N N . TYR A 1 259 ? -34.196 29.823 -51.302 1.00 29.49 ? 254 TYR A N 1 ATOM 2029 C CA . TYR A 1 259 ? -33.867 29.446 -49.915 1.00 31.52 ? 254 TYR A CA 1 ATOM 2030 C C . TYR A 1 259 ? -34.538 30.317 -48.897 1.00 30.38 ? 254 TYR A C 1 ATOM 2031 O O . TYR A 1 259 ? -34.376 31.541 -48.928 1.00 29.78 ? 254 TYR A O 1 ATOM 2032 C CB . TYR A 1 259 ? -32.342 29.548 -49.684 1.00 31.86 ? 254 TYR A CB 1 ATOM 2033 C CG . TYR A 1 259 ? -31.472 28.696 -50.569 1.00 31.04 ? 254 TYR A CG 1 ATOM 2034 C CD1 . TYR A 1 259 ? -30.938 29.195 -51.773 1.00 32.41 ? 254 TYR A CD1 1 ATOM 2035 C CD2 . TYR A 1 259 ? -31.156 27.421 -50.217 1.00 32.02 ? 254 TYR A CD2 1 ATOM 2036 C CE1 . TYR A 1 259 ? -30.110 28.420 -52.574 1.00 29.91 ? 254 TYR A CE1 1 ATOM 2037 C CE2 . TYR A 1 259 ? -30.354 26.627 -51.023 1.00 32.24 ? 254 TYR A CE2 1 ATOM 2038 C CZ . TYR A 1 259 ? -29.806 27.151 -52.169 1.00 32.07 ? 254 TYR A CZ 1 ATOM 2039 O OH . TYR A 1 259 ? -29.034 26.315 -52.932 1.00 36.74 ? 254 TYR A OH 1 ATOM 2040 N N . LYS A 1 260 ? -35.298 29.707 -47.999 1.00 31.54 ? 255 LYS A N 1 ATOM 2041 C CA . LYS A 1 260 ? -35.829 30.435 -46.839 1.00 33.66 ? 255 LYS A CA 1 ATOM 2042 C C . LYS A 1 260 ? -34.656 30.771 -45.947 1.00 34.01 ? 255 LYS A C 1 ATOM 2043 O O . LYS A 1 260 ? -33.808 29.923 -45.685 1.00 37.13 ? 255 LYS A O 1 ATOM 2044 C CB . LYS A 1 260 ? -36.839 29.619 -46.061 1.00 36.30 ? 255 LYS A CB 1 ATOM 2045 C CG . LYS A 1 260 ? -38.023 29.190 -46.910 1.00 41.94 ? 255 LYS A CG 1 ATOM 2046 C CD . LYS A 1 260 ? -39.297 28.980 -46.138 1.00 45.62 ? 255 LYS A CD 1 ATOM 2047 C CE . LYS A 1 260 ? -39.221 27.816 -45.212 1.00 50.58 ? 255 LYS A CE 1 ATOM 2048 N NZ . LYS A 1 260 ? -40.355 27.933 -44.247 1.00 59.83 ? 255 LYS A NZ 1 ATOM 2049 N N . ILE A 1 261 ? -34.576 32.003 -45.496 1.00 33.28 ? 256 ILE A N 1 ATOM 2050 C CA . ILE A 1 261 ? -33.377 32.440 -44.810 1.00 39.05 ? 256 ILE A CA 1 ATOM 2051 C C . ILE A 1 261 ? -33.779 33.313 -43.620 1.00 39.76 ? 256 ILE A C 1 ATOM 2052 O O . ILE A 1 261 ? -34.694 34.143 -43.732 1.00 45.54 ? 256 ILE A O 1 ATOM 2053 C CB . ILE A 1 261 ? -32.465 33.149 -45.820 1.00 43.49 ? 256 ILE A CB 1 ATOM 2054 C CG1 . ILE A 1 261 ? -31.225 33.715 -45.173 1.00 51.06 ? 256 ILE A CG1 1 ATOM 2055 C CG2 . ILE A 1 261 ? -33.192 34.309 -46.450 1.00 51.61 ? 256 ILE A CG2 1 ATOM 2056 C CD1 . ILE A 1 261 ? -30.243 34.310 -46.182 1.00 53.31 ? 256 ILE A CD1 1 ATOM 2057 N N . VAL A 1 262 ? -33.201 33.041 -42.451 1.00 37.41 ? 257 VAL A N 1 ATOM 2058 C CA . VAL A 1 262 ? -33.388 33.895 -41.295 1.00 39.17 ? 257 VAL A CA 1 ATOM 2059 C C . VAL A 1 262 ? -32.022 34.282 -40.803 1.00 39.77 ? 257 VAL A C 1 ATOM 2060 O O . VAL A 1 262 ? -31.221 33.415 -40.504 1.00 37.72 ? 257 VAL A O 1 ATOM 2061 C CB . VAL A 1 262 ? -34.226 33.230 -40.149 1.00 41.24 ? 257 VAL A CB 1 ATOM 2062 C CG1 . VAL A 1 262 ? -34.259 34.109 -38.894 1.00 41.36 ? 257 VAL A CG1 1 ATOM 2063 C CG2 . VAL A 1 262 ? -35.648 33.018 -40.589 1.00 38.99 ? 257 VAL A CG2 1 ATOM 2064 N N . LYS A 1 263 ? -31.799 35.580 -40.601 1.00 47.59 ? 258 LYS A N 1 ATOM 2065 C CA . LYS A 1 263 ? -30.448 36.118 -40.393 1.00 50.50 ? 258 LYS A CA 1 ATOM 2066 C C . LYS A 1 263 ? -29.912 36.271 -38.941 1.00 56.33 ? 258 LYS A C 1 ATOM 2067 O O . LYS A 1 263 ? -28.957 35.522 -38.536 1.00 74.54 ? 258 LYS A O 1 ATOM 2068 C CB . LYS A 1 263 ? -30.282 37.418 -41.158 1.00 55.17 ? 258 LYS A CB 1 ATOM 2069 C CG . LYS A 1 263 ? -29.031 37.403 -42.034 1.00 50.24 ? 258 LYS A CG 1 ATOM 2070 C CD . LYS A 1 263 ? -27.751 37.311 -41.231 1.00 45.07 ? 258 LYS A CD 1 ATOM 2071 C CE . LYS A 1 263 ? -26.602 37.926 -42.019 1.00 42.33 ? 258 LYS A CE 1 ATOM 2072 N NZ . LYS A 1 263 ? -25.295 37.498 -41.484 1.00 44.59 ? 258 LYS A NZ 1 ATOM 2073 N N . LYS A 1 264 ? -30.405 37.219 -38.170 1.00 49.28 ? 259 LYS A N 1 ATOM 2074 C CA . LYS A 1 264 ? -29.925 37.314 -36.732 1.00 56.77 ? 259 LYS A CA 1 ATOM 2075 C C . LYS A 1 264 ? -28.464 37.628 -36.277 1.00 53.35 ? 259 LYS A C 1 ATOM 2076 O O . LYS A 1 264 ? -28.202 37.779 -35.079 1.00 63.63 ? 259 LYS A O 1 ATOM 2077 C CB . LYS A 1 264 ? -30.186 35.974 -36.041 1.00 62.03 ? 259 LYS A CB 1 ATOM 2078 C CG . LYS A 1 264 ? -30.601 36.077 -34.594 1.00 71.27 ? 259 LYS A CG 1 ATOM 2079 C CD . LYS A 1 264 ? -31.754 35.140 -34.295 1.00 79.80 ? 259 LYS A CD 1 ATOM 2080 C CE . LYS A 1 264 ? -33.027 35.619 -34.974 1.00 86.28 ? 259 LYS A CE 1 ATOM 2081 N NZ . LYS A 1 264 ? -34.104 34.604 -34.820 1.00 87.03 ? 259 LYS A NZ 1 ATOM 2082 N N . GLY A 1 265 ? -27.489 37.640 -37.153 1.00 51.02 ? 260 GLY A N 1 ATOM 2083 C CA . GLY A 1 265 ? -26.103 37.656 -36.678 1.00 46.17 ? 260 GLY A CA 1 ATOM 2084 C C . GLY A 1 265 ? -25.092 37.564 -37.818 1.00 47.87 ? 260 GLY A C 1 ATOM 2085 O O . GLY A 1 265 ? -25.372 37.006 -38.854 1.00 37.45 ? 260 GLY A O 1 ATOM 2086 N N . ASP A 1 266 ? -23.901 38.105 -37.595 1.00 51.11 ? 261 ASP A N 1 ATOM 2087 C CA . ASP A 1 266 ? -22.863 38.204 -38.626 1.00 51.93 ? 261 ASP A CA 1 ATOM 2088 C C . ASP A 1 266 ? -21.589 37.438 -38.243 1.00 45.67 ? 261 ASP A C 1 ATOM 2089 O O . ASP A 1 266 ? -21.236 37.294 -37.072 1.00 46.81 ? 261 ASP A O 1 ATOM 2090 C CB . ASP A 1 266 ? -22.486 39.662 -38.826 1.00 58.24 ? 261 ASP A CB 1 ATOM 2091 C CG . ASP A 1 266 ? -23.523 40.442 -39.609 1.00 70.99 ? 261 ASP A CG 1 ATOM 2092 O OD1 . ASP A 1 266 ? -23.707 40.205 -40.855 1.00 57.58 ? 261 ASP A OD1 1 ATOM 2093 O OD2 . ASP A 1 266 ? -24.117 41.332 -38.935 1.00 74.29 ? 261 ASP A OD2 1 ATOM 2094 N N . SER A 1 267 ? -20.861 37.019 -39.250 1.00 39.32 ? 262 SER A N 1 ATOM 2095 C CA . SER A 1 267 ? -19.638 36.288 -39.041 1.00 36.53 ? 262 SER A CA 1 ATOM 2096 C C . SER A 1 267 ? -18.734 36.623 -40.221 1.00 34.14 ? 262 SER A C 1 ATOM 2097 O O . SER A 1 267 ? -18.779 37.739 -40.717 1.00 35.25 ? 262 SER A O 1 ATOM 2098 C CB . SER A 1 267 ? -19.995 34.819 -39.014 1.00 37.67 ? 262 SER A CB 1 ATOM 2099 O OG . SER A 1 267 ? -18.924 34.107 -38.518 1.00 44.16 ? 262 SER A OG 1 ATOM 2100 N N . THR A 1 268 ? -17.957 35.653 -40.722 1.00 31.08 ? 263 THR A N 1 ATOM 2101 C CA . THR A 1 268 ? -17.238 35.825 -41.967 1.00 29.64 ? 263 THR A CA 1 ATOM 2102 C C . THR A 1 268 ? -16.886 34.501 -42.541 1.00 28.10 ? 263 THR A C 1 ATOM 2103 O O . THR A 1 268 ? -17.298 33.484 -42.022 1.00 25.26 ? 263 THR A O 1 ATOM 2104 C CB . THR A 1 268 ? -15.940 36.682 -41.797 1.00 31.77 ? 263 THR A CB 1 ATOM 2105 O OG1 . THR A 1 268 ? -15.457 37.084 -43.077 1.00 30.17 ? 263 THR A OG1 1 ATOM 2106 C CG2 . THR A 1 268 ? -14.855 35.884 -41.097 1.00 34.09 ? 263 THR A CG2 1 ATOM 2107 N N . ILE A 1 269 ? -16.133 34.514 -43.645 1.00 27.73 ? 264 ILE A N 1 ATOM 2108 C CA . ILE A 1 269 ? -15.731 33.269 -44.296 1.00 29.48 ? 264 ILE A CA 1 ATOM 2109 C C . ILE A 1 269 ? -14.325 32.921 -43.820 1.00 30.29 ? 264 ILE A C 1 ATOM 2110 O O . ILE A 1 269 ? -13.434 33.730 -43.956 1.00 33.61 ? 264 ILE A O 1 ATOM 2111 C CB . ILE A 1 269 ? -15.698 33.415 -45.811 1.00 30.29 ? 264 ILE A CB 1 ATOM 2112 C CG1 . ILE A 1 269 ? -17.029 33.950 -46.347 1.00 30.23 ? 264 ILE A CG1 1 ATOM 2113 C CG2 . ILE A 1 269 ? -15.324 32.103 -46.475 1.00 31.30 ? 264 ILE A CG2 1 ATOM 2114 C CD1 . ILE A 1 269 ? -18.211 33.076 -46.052 1.00 30.41 ? 264 ILE A CD1 1 ATOM 2115 N N . MET A 1 270 ? -14.130 31.705 -43.306 1.00 29.74 ? 265 MET A N 1 ATOM 2116 C CA . MET A 1 270 ? -12.831 31.250 -42.902 1.00 29.68 ? 265 MET A CA 1 ATOM 2117 C C . MET A 1 270 ? -12.228 30.412 -44.019 1.00 31.40 ? 265 MET A C 1 ATOM 2118 O O . MET A 1 270 ? -12.887 29.529 -44.564 1.00 35.90 ? 265 MET A O 1 ATOM 2119 C CB . MET A 1 270 ? -12.917 30.448 -41.583 1.00 29.18 ? 265 MET A CB 1 ATOM 2120 C CG . MET A 1 270 ? -11.614 29.767 -41.209 1.00 28.10 ? 265 MET A CG 1 ATOM 2121 S SD . MET A 1 270 ? -11.522 29.170 -39.506 1.00 32.41 ? 265 MET A SD 1 ATOM 2122 C CE . MET A 1 270 ? -11.710 30.671 -38.603 1.00 30.04 ? 265 MET A CE 1 ATOM 2123 N N . LYS A 1 271 ? -10.965 30.641 -44.308 1.00 32.57 ? 266 LYS A N 1 ATOM 2124 C CA . LYS A 1 271 ? -10.205 29.841 -45.275 1.00 35.09 ? 266 LYS A CA 1 ATOM 2125 C C . LYS A 1 271 ? -9.339 28.863 -44.480 1.00 36.43 ? 266 LYS A C 1 ATOM 2126 O O . LYS A 1 271 ? -8.482 29.279 -43.695 1.00 34.07 ? 266 LYS A O 1 ATOM 2127 C CB . LYS A 1 271 ? -9.332 30.732 -46.188 1.00 36.78 ? 266 LYS A CB 1 ATOM 2128 C CG . LYS A 1 271 ? -10.068 31.773 -47.060 1.00 38.97 ? 266 LYS A CG 1 ATOM 2129 C CD . LYS A 1 271 ? -11.147 31.172 -47.960 1.00 45.50 ? 266 LYS A CD 1 ATOM 2130 C CE . LYS A 1 271 ? -11.209 31.742 -49.389 1.00 51.67 ? 266 LYS A CE 1 ATOM 2131 N NZ . LYS A 1 271 ? -11.659 30.715 -50.463 1.00 52.55 ? 266 LYS A NZ 1 ATOM 2132 N N . SER A 1 272 ? -9.620 27.569 -44.632 1.00 37.13 ? 267 SER A N 1 ATOM 2133 C CA . SER A 1 272 ? -8.892 26.523 -43.925 1.00 36.82 ? 267 SER A CA 1 ATOM 2134 C C . SER A 1 272 ? -8.945 25.261 -44.719 1.00 40.35 ? 267 SER A C 1 ATOM 2135 O O . SER A 1 272 ? -9.954 24.980 -45.387 1.00 43.48 ? 267 SER A O 1 ATOM 2136 C CB . SER A 1 272 ? -9.557 26.196 -42.588 1.00 38.67 ? 267 SER A CB 1 ATOM 2137 O OG . SER A 1 272 ? -8.739 25.304 -41.826 1.00 40.22 ? 267 SER A OG 1 ATOM 2138 N N . GLU A 1 273 ? -7.918 24.439 -44.586 1.00 41.68 ? 268 GLU A N 1 ATOM 2139 C CA . GLU A 1 273 ? -7.929 23.130 -45.251 1.00 49.23 ? 268 GLU A CA 1 ATOM 2140 C C . GLU A 1 273 ? -8.426 22.010 -44.341 1.00 51.59 ? 268 GLU A C 1 ATOM 2141 O O . GLU A 1 273 ? -8.691 20.896 -44.785 1.00 63.13 ? 268 GLU A O 1 ATOM 2142 C CB . GLU A 1 273 ? -6.543 22.831 -45.824 1.00 49.99 ? 268 GLU A CB 1 ATOM 2143 C CG . GLU A 1 273 ? -5.961 23.984 -46.666 1.00 49.06 ? 268 GLU A CG 1 ATOM 2144 C CD . GLU A 1 273 ? -6.858 24.421 -47.836 1.00 51.89 ? 268 GLU A CD 1 ATOM 2145 O OE1 . GLU A 1 273 ? -7.181 23.569 -48.710 1.00 50.55 ? 268 GLU A OE1 1 ATOM 2146 O OE2 . GLU A 1 273 ? -7.226 25.626 -47.904 1.00 52.02 ? 268 GLU A OE2 1 ATOM 2147 N N . MET A 1 274 ? -8.565 22.316 -43.066 1.00 51.70 ? 269 MET A N 1 ATOM 2148 C CA . MET A 1 274 ? -8.939 21.331 -42.077 1.00 51.28 ? 269 MET A CA 1 ATOM 2149 C C . MET A 1 274 ? -10.382 20.853 -42.183 1.00 54.58 ? 269 MET A C 1 ATOM 2150 O O . MET A 1 274 ? -11.210 21.466 -42.848 1.00 49.45 ? 269 MET A O 1 ATOM 2151 C CB . MET A 1 274 ? -8.657 21.898 -40.714 1.00 53.05 ? 269 MET A CB 1 ATOM 2152 C CG . MET A 1 274 ? -7.173 22.140 -40.505 1.00 60.96 ? 269 MET A CG 1 ATOM 2153 S SD . MET A 1 274 ? -6.803 22.274 -38.755 1.00 69.62 ? 269 MET A SD 1 ATOM 2154 C CE . MET A 1 274 ? -8.050 23.432 -38.179 1.00 57.50 ? 269 MET A CE 1 ATOM 2155 N N . GLU A 1 275 ? -10.679 19.722 -41.544 1.00 62.23 ? 270 GLU A N 1 ATOM 2156 C CA . GLU A 1 275 ? -12.044 19.195 -41.501 1.00 62.18 ? 270 GLU A CA 1 ATOM 2157 C C . GLU A 1 275 ? -12.585 19.340 -40.065 1.00 50.32 ? 270 GLU A C 1 ATOM 2158 O O . GLU A 1 275 ? -11.862 19.602 -39.092 1.00 44.88 ? 270 GLU A O 1 ATOM 2159 C CB . GLU A 1 275 ? -12.077 17.708 -41.938 1.00 72.53 ? 270 GLU A CB 1 ATOM 2160 C CG . GLU A 1 275 ? -13.255 17.298 -42.856 1.00 84.63 ? 270 GLU A CG 1 ATOM 2161 C CD . GLU A 1 275 ? -12.895 17.185 -44.353 1.00 97.44 ? 270 GLU A CD 1 ATOM 2162 O OE1 . GLU A 1 275 ? -11.734 16.852 -44.684 1.00 106.91 ? 270 GLU A OE1 1 ATOM 2163 O OE2 . GLU A 1 275 ? -13.782 17.414 -45.214 1.00 92.71 ? 270 GLU A OE2 1 ATOM 2164 N N . TYR A 1 276 ? -13.877 19.131 -39.952 1.00 45.03 ? 271 TYR A N 1 ATOM 2165 C CA . TYR A 1 276 ? -14.553 19.220 -38.682 1.00 42.13 ? 271 TYR A CA 1 ATOM 2166 C C . TYR A 1 276 ? -13.897 18.344 -37.651 1.00 42.76 ? 271 TYR A C 1 ATOM 2167 O O . TYR A 1 276 ? -13.448 17.255 -37.984 1.00 47.12 ? 271 TYR A O 1 ATOM 2168 C CB . TYR A 1 276 ? -15.979 18.788 -38.902 1.00 40.00 ? 271 TYR A CB 1 ATOM 2169 C CG . TYR A 1 276 ? -16.852 19.017 -37.729 1.00 43.38 ? 271 TYR A CG 1 ATOM 2170 C CD1 . TYR A 1 276 ? -16.846 20.238 -37.045 1.00 42.37 ? 271 TYR A CD1 1 ATOM 2171 C CD2 . TYR A 1 276 ? -17.705 18.042 -37.302 1.00 43.73 ? 271 TYR A CD2 1 ATOM 2172 C CE1 . TYR A 1 276 ? -17.688 20.443 -35.999 1.00 40.40 ? 271 TYR A CE1 1 ATOM 2173 C CE2 . TYR A 1 276 ? -18.552 18.256 -36.234 1.00 41.55 ? 271 TYR A CE2 1 ATOM 2174 C CZ . TYR A 1 276 ? -18.527 19.436 -35.596 1.00 39.46 ? 271 TYR A CZ 1 ATOM 2175 O OH . TYR A 1 276 ? -19.355 19.623 -34.552 1.00 42.63 ? 271 TYR A OH 1 ATOM 2176 N N . GLY A 1 277 ? -13.824 18.803 -36.413 1.00 40.56 ? 272 GLY A N 1 ATOM 2177 C CA . GLY A 1 277 ? -13.154 18.044 -35.347 1.00 39.66 ? 272 GLY A CA 1 ATOM 2178 C C . GLY A 1 277 ? -14.051 17.703 -34.184 1.00 42.31 ? 272 GLY A C 1 ATOM 2179 O O . GLY A 1 277 ? -13.575 17.324 -33.110 1.00 52.28 ? 272 GLY A O 1 ATOM 2180 N N . HIS A 1 278 ? -15.354 17.793 -34.372 1.00 42.32 ? 273 HIS A N 1 ATOM 2181 C CA . HIS A 1 278 ? -16.278 17.269 -33.351 1.00 50.57 ? 273 HIS A CA 1 ATOM 2182 C C . HIS A 1 278 ? -15.956 17.834 -31.964 1.00 50.55 ? 273 HIS A C 1 ATOM 2183 O O . HIS A 1 278 ? -15.927 17.114 -30.992 1.00 52.31 ? 273 HIS A O 1 ATOM 2184 C CB . HIS A 1 278 ? -16.242 15.716 -33.330 1.00 47.85 ? 273 HIS A CB 1 ATOM 2185 C CG . HIS A 1 278 ? -16.458 15.114 -34.684 1.00 52.96 ? 273 HIS A CG 1 ATOM 2186 N ND1 . HIS A 1 278 ? -17.718 14.936 -35.235 1.00 50.94 ? 273 HIS A ND1 1 ATOM 2187 C CD2 . HIS A 1 278 ? -15.570 14.711 -35.632 1.00 51.97 ? 273 HIS A CD2 1 ATOM 2188 C CE1 . HIS A 1 278 ? -17.594 14.426 -36.448 1.00 48.27 ? 273 HIS A CE1 1 ATOM 2189 N NE2 . HIS A 1 278 ? -16.303 14.264 -36.704 1.00 49.27 ? 273 HIS A NE2 1 ATOM 2190 N N . CYS A 1 279 ? -15.749 19.145 -31.927 1.00 53.35 ? 274 CYS A N 1 ATOM 2191 C CA . CYS A 1 279 ? -15.357 19.897 -30.742 1.00 49.93 ? 274 CYS A CA 1 ATOM 2192 C C . CYS A 1 279 ? -16.190 21.193 -30.688 1.00 44.73 ? 274 CYS A C 1 ATOM 2193 O O . CYS A 1 279 ? -16.908 21.527 -31.615 1.00 41.20 ? 274 CYS A O 1 ATOM 2194 C CB . CYS A 1 279 ? -13.875 20.257 -30.835 1.00 51.72 ? 274 CYS A CB 1 ATOM 2195 S SG . CYS A 1 279 ? -13.382 20.863 -32.511 1.00 54.18 ? 274 CYS A SG 1 ATOM 2196 N N . ASN A 1 280 ? -16.110 21.898 -29.577 1.00 42.26 ? 275 ASN A N 1 ATOM 2197 C CA . ASN A 1 280 ? -16.755 23.187 -29.423 1.00 41.83 ? 275 ASN A CA 1 ATOM 2198 C C . ASN A 1 280 ? -15.714 24.217 -28.907 1.00 39.51 ? 275 ASN A C 1 ATOM 2199 O O . ASN A 1 280 ? -14.746 23.848 -28.247 1.00 37.02 ? 275 ASN A O 1 ATOM 2200 C CB . ASN A 1 280 ? -17.963 23.083 -28.497 1.00 42.63 ? 275 ASN A CB 1 ATOM 2201 C CG . ASN A 1 280 ? -18.727 24.400 -28.371 1.00 48.49 ? 275 ASN A CG 1 ATOM 2202 O OD1 . ASN A 1 280 ? -19.082 25.033 -29.371 1.00 53.23 ? 275 ASN A OD1 1 ATOM 2203 N ND2 . ASN A 1 280 ? -18.982 24.823 -27.145 1.00 48.31 ? 275 ASN A ND2 1 ATOM 2204 N N . THR A 1 281 ? -15.897 25.481 -29.262 1.00 38.31 ? 276 THR A N 1 ATOM 2205 C CA . THR A 1 281 ? -14.991 26.563 -28.844 1.00 36.67 ? 276 THR A CA 1 ATOM 2206 C C . THR A 1 281 ? -15.653 27.923 -28.862 1.00 36.75 ? 276 THR A C 1 ATOM 2207 O O . THR A 1 281 ? -16.758 28.112 -29.447 1.00 38.46 ? 276 THR A O 1 ATOM 2208 C CB . THR A 1 281 ? -13.749 26.608 -29.742 1.00 37.67 ? 276 THR A CB 1 ATOM 2209 O OG1 . THR A 1 281 ? -12.792 27.502 -29.197 1.00 39.91 ? 276 THR A OG1 1 ATOM 2210 C CG2 . THR A 1 281 ? -14.066 27.077 -31.147 1.00 39.32 ? 276 THR A CG2 1 ATOM 2211 N N . LYS A 1 282 ? -15.018 28.871 -28.194 1.00 37.42 ? 277 LYS A N 1 ATOM 2212 C CA . LYS A 1 282 ? -15.435 30.295 -28.239 1.00 41.55 ? 277 LYS A CA 1 ATOM 2213 C C . LYS A 1 282 ? -14.602 31.073 -29.244 1.00 38.35 ? 277 LYS A C 1 ATOM 2214 O O . LYS A 1 282 ? -14.999 32.180 -29.618 1.00 33.78 ? 277 LYS A O 1 ATOM 2215 C CB . LYS A 1 282 ? -15.176 30.985 -26.923 1.00 49.57 ? 277 LYS A CB 1 ATOM 2216 C CG . LYS A 1 282 ? -15.781 30.332 -25.702 1.00 62.73 ? 277 LYS A CG 1 ATOM 2217 C CD . LYS A 1 282 ? -15.664 31.284 -24.508 1.00 74.28 ? 277 LYS A CD 1 ATOM 2218 C CE . LYS A 1 282 ? -15.892 30.610 -23.155 1.00 83.20 ? 277 LYS A CE 1 ATOM 2219 N NZ . LYS A 1 282 ? -17.337 30.629 -22.780 1.00 85.95 ? 277 LYS A NZ 1 ATOM 2220 N N . CYS A 1 283 ? -13.442 30.508 -29.640 1.00 34.81 ? 278 CYS A N 1 ATOM 2221 C CA . CYS A 1 283 ? -12.453 31.204 -30.473 1.00 34.78 ? 278 CYS A CA 1 ATOM 2222 C C . CYS A 1 283 ? -11.799 30.279 -31.519 1.00 33.81 ? 278 CYS A C 1 ATOM 2223 O O . CYS A 1 283 ? -11.049 29.392 -31.164 1.00 34.65 ? 278 CYS A O 1 ATOM 2224 C CB . CYS A 1 283 ? -11.376 31.795 -29.581 1.00 35.24 ? 278 CYS A CB 1 ATOM 2225 S SG . CYS A 1 283 ? -10.063 32.628 -30.534 1.00 36.49 ? 278 CYS A SG 1 ATOM 2226 N N . GLN A 1 284 ? -12.159 30.426 -32.785 1.00 31.01 ? 279 GLN A N 1 ATOM 2227 C CA . GLN A 1 284 ? -11.659 29.566 -33.814 1.00 29.22 ? 279 GLN A CA 1 ATOM 2228 C C . GLN A 1 284 ? -10.587 30.281 -34.617 1.00 29.91 ? 279 GLN A C 1 ATOM 2229 O O . GLN A 1 284 ? -10.771 31.438 -34.974 1.00 31.11 ? 279 GLN A O 1 ATOM 2230 C CB . GLN A 1 284 ? -12.787 29.154 -34.746 1.00 27.98 ? 279 GLN A CB 1 ATOM 2231 C CG . GLN A 1 284 ? -12.401 28.071 -35.767 1.00 29.94 ? 279 GLN A CG 1 ATOM 2232 C CD . GLN A 1 284 ? -12.017 26.743 -35.110 1.00 32.58 ? 279 GLN A CD 1 ATOM 2233 O OE1 . GLN A 1 284 ? -12.817 26.163 -34.363 1.00 41.48 ? 279 GLN A OE1 1 ATOM 2234 N NE2 . GLN A 1 284 ? -10.808 26.258 -35.376 1.00 31.83 ? 279 GLN A NE2 1 ATOM 2235 N N . THR A 1 285 ? -9.504 29.565 -34.949 1.00 29.32 ? 280 THR A N 1 ATOM 2236 C CA . THR A 1 285 ? -8.536 30.034 -35.935 1.00 30.61 ? 280 THR A CA 1 ATOM 2237 C C . THR A 1 285 ? -8.461 29.012 -37.082 1.00 32.13 ? 280 THR A C 1 ATOM 2238 O O . THR A 1 285 ? -8.904 27.861 -36.940 1.00 36.17 ? 280 THR A O 1 ATOM 2239 C CB . THR A 1 285 ? -7.141 30.242 -35.335 1.00 31.29 ? 280 THR A CB 1 ATOM 2240 O OG1 . THR A 1 285 ? -6.384 29.028 -35.413 1.00 33.05 ? 280 THR A OG1 1 ATOM 2241 C CG2 . THR A 1 285 ? -7.244 30.646 -33.893 1.00 32.92 ? 280 THR A CG2 1 ATOM 2242 N N . PRO A 1 286 ? -7.896 29.400 -38.213 1.00 29.47 ? 281 PRO A N 1 ATOM 2243 C CA . PRO A 1 286 ? -7.910 28.455 -39.323 1.00 31.46 ? 281 PRO A CA 1 ATOM 2244 C C . PRO A 1 286 ? -7.001 27.238 -39.131 1.00 31.28 ? 281 PRO A C 1 ATOM 2245 O O . PRO A 1 286 ? -7.069 26.317 -39.944 1.00 34.75 ? 281 PRO A O 1 ATOM 2246 C CB . PRO A 1 286 ? -7.430 29.297 -40.503 1.00 30.60 ? 281 PRO A CB 1 ATOM 2247 C CG . PRO A 1 286 ? -7.590 30.749 -40.070 1.00 30.50 ? 281 PRO A CG 1 ATOM 2248 C CD . PRO A 1 286 ? -7.349 30.704 -38.601 1.00 30.98 ? 281 PRO A CD 1 ATOM 2249 N N . ILE A 1 287 ? -6.122 27.271 -38.130 1.00 30.39 ? 282 ILE A N 1 ATOM 2250 C CA . ILE A 1 287 ? -5.243 26.142 -37.834 1.00 29.90 ? 282 ILE A CA 1 ATOM 2251 C C . ILE A 1 287 ? -5.633 25.404 -36.546 1.00 33.19 ? 282 ILE A C 1 ATOM 2252 O O . ILE A 1 287 ? -4.966 24.430 -36.131 1.00 37.21 ? 282 ILE A O 1 ATOM 2253 C CB . ILE A 1 287 ? -3.760 26.540 -37.754 1.00 30.35 ? 282 ILE A CB 1 ATOM 2254 C CG1 . ILE A 1 287 ? -3.471 27.571 -36.653 1.00 31.72 ? 282 ILE A CG1 1 ATOM 2255 C CG2 . ILE A 1 287 ? -3.273 27.066 -39.086 1.00 30.83 ? 282 ILE A CG2 1 ATOM 2256 C CD1 . ILE A 1 287 ? -1.966 27.803 -36.402 1.00 31.31 ? 282 ILE A CD1 1 ATOM 2257 N N . GLY A 1 288 ? -6.697 25.871 -35.904 1.00 32.56 ? 283 GLY A N 1 ATOM 2258 C CA . GLY A 1 288 ? -7.158 25.259 -34.644 1.00 32.03 ? 283 GLY A CA 1 ATOM 2259 C C . GLY A 1 288 ? -7.803 26.224 -33.673 1.00 31.18 ? 283 GLY A C 1 ATOM 2260 O O . GLY A 1 288 ? -7.631 27.420 -33.777 1.00 33.35 ? 283 GLY A O 1 ATOM 2261 N N . ALA A 1 289 ? -8.623 25.682 -32.787 1.00 32.81 ? 284 ALA A N 1 ATOM 2262 C CA . ALA A 1 289 ? -9.381 26.432 -31.797 1.00 31.74 ? 284 ALA A CA 1 ATOM 2263 C C . ALA A 1 289 ? -8.531 26.765 -30.591 1.00 33.57 ? 284 ALA A C 1 ATOM 2264 O O . ALA A 1 289 ? -7.622 26.030 -30.235 1.00 37.59 ? 284 ALA A O 1 ATOM 2265 C CB . ALA A 1 289 ? -10.603 25.635 -31.374 1.00 31.54 ? 284 ALA A CB 1 ATOM 2266 N N . ILE A 1 290 ? -8.853 27.865 -29.955 1.00 37.09 ? 285 ILE A N 1 ATOM 2267 C CA . ILE A 1 290 ? -8.103 28.378 -28.800 1.00 38.86 ? 285 ILE A CA 1 ATOM 2268 C C . ILE A 1 290 ? -9.019 28.252 -27.619 1.00 41.18 ? 285 ILE A C 1 ATOM 2269 O O . ILE A 1 290 ? -10.218 28.574 -27.702 1.00 39.14 ? 285 ILE A O 1 ATOM 2270 C CB . ILE A 1 290 ? -7.760 29.867 -28.953 1.00 40.75 ? 285 ILE A CB 1 ATOM 2271 C CG1 . ILE A 1 290 ? -6.623 30.054 -29.926 1.00 38.97 ? 285 ILE A CG1 1 ATOM 2272 C CG2 . ILE A 1 290 ? -7.340 30.498 -27.623 1.00 44.15 ? 285 ILE A CG2 1 ATOM 2273 C CD1 . ILE A 1 290 ? -6.432 31.495 -30.322 1.00 37.79 ? 285 ILE A CD1 1 ATOM 2274 N N . ASN A 1 291 ? -8.481 27.745 -26.523 1.00 43.11 ? 286 ASN A N 1 ATOM 2275 C CA . ASN A 1 291 ? -9.273 27.580 -25.294 1.00 47.81 ? 286 ASN A CA 1 ATOM 2276 C C . ASN A 1 291 ? -8.462 28.174 -24.160 1.00 47.83 ? 286 ASN A C 1 ATOM 2277 O O . ASN A 1 291 ? -7.528 27.525 -23.641 1.00 44.56 ? 286 ASN A O 1 ATOM 2278 C CB . ASN A 1 291 ? -9.578 26.109 -24.989 1.00 52.44 ? 286 ASN A CB 1 ATOM 2279 C CG . ASN A 1 291 ? -10.161 25.929 -23.597 1.00 55.99 ? 286 ASN A CG 1 ATOM 2280 O OD1 . ASN A 1 291 ? -10.951 26.770 -23.160 1.00 61.24 ? 286 ASN A OD1 1 ATOM 2281 N ND2 . ASN A 1 291 ? -9.774 24.857 -22.878 1.00 66.72 ? 286 ASN A ND2 1 ATOM 2282 N N . SER A 1 292 ? -8.807 29.402 -23.794 1.00 48.44 ? 287 SER A N 1 ATOM 2283 C CA . SER A 1 292 ? -7.956 30.182 -22.944 1.00 46.99 ? 287 SER A CA 1 ATOM 2284 C C . SER A 1 292 ? -8.627 31.364 -22.268 1.00 47.76 ? 287 SER A C 1 ATOM 2285 O O . SER A 1 292 ? -9.553 31.979 -22.809 1.00 39.04 ? 287 SER A O 1 ATOM 2286 C CB . SER A 1 292 ? -6.792 30.721 -23.777 1.00 47.71 ? 287 SER A CB 1 ATOM 2287 O OG . SER A 1 292 ? -5.886 31.408 -22.956 1.00 44.78 ? 287 SER A OG 1 ATOM 2288 N N . SER A 1 293 ? -8.091 31.686 -21.086 1.00 51.88 ? 288 SER A N 1 ATOM 2289 C CA . SER A 1 293 ? -8.484 32.856 -20.335 1.00 52.62 ? 288 SER A CA 1 ATOM 2290 C C . SER A 1 293 ? -7.415 33.911 -20.450 1.00 48.00 ? 288 SER A C 1 ATOM 2291 O O . SER A 1 293 ? -7.621 35.035 -20.005 1.00 45.80 ? 288 SER A O 1 ATOM 2292 C CB . SER A 1 293 ? -8.674 32.497 -18.879 1.00 60.29 ? 288 SER A CB 1 ATOM 2293 O OG . SER A 1 293 ? -9.829 31.692 -18.779 1.00 68.91 ? 288 SER A OG 1 ATOM 2294 N N . MET A 1 294 ? -6.300 33.574 -21.088 1.00 42.86 ? 289 MET A N 1 ATOM 2295 C CA . MET A 1 294 ? -5.222 34.525 -21.230 1.00 44.29 ? 289 MET A CA 1 ATOM 2296 C C . MET A 1 294 ? -5.623 35.745 -22.060 1.00 44.19 ? 289 MET A C 1 ATOM 2297 O O . MET A 1 294 ? -6.451 35.661 -22.960 1.00 45.91 ? 289 MET A O 1 ATOM 2298 C CB . MET A 1 294 ? -3.985 33.860 -21.811 1.00 46.64 ? 289 MET A CB 1 ATOM 2299 C CG . MET A 1 294 ? -3.342 32.796 -20.910 1.00 52.64 ? 289 MET A CG 1 ATOM 2300 S SD . MET A 1 294 ? -3.265 33.321 -19.189 1.00 61.72 ? 289 MET A SD 1 ATOM 2301 C CE . MET A 1 294 ? -2.445 31.957 -18.381 1.00 66.90 ? 289 MET A CE 1 ATOM 2302 N N . PRO A 1 295 ? -5.046 36.906 -21.733 1.00 42.96 ? 290 PRO A N 1 ATOM 2303 C CA . PRO A 1 295 ? -5.381 38.157 -22.406 1.00 39.07 ? 290 PRO A CA 1 ATOM 2304 C C . PRO A 1 295 ? -4.710 38.354 -23.755 1.00 38.97 ? 290 PRO A C 1 ATOM 2305 O O . PRO A 1 295 ? -5.158 39.193 -24.531 1.00 40.12 ? 290 PRO A O 1 ATOM 2306 C CB . PRO A 1 295 ? -4.871 39.211 -21.425 1.00 40.47 ? 290 PRO A CB 1 ATOM 2307 C CG . PRO A 1 295 ? -3.722 38.544 -20.742 1.00 41.69 ? 290 PRO A CG 1 ATOM 2308 C CD . PRO A 1 295 ? -4.125 37.113 -20.599 1.00 41.70 ? 290 PRO A CD 1 ATOM 2309 N N . PHE A 1 296 ? -3.652 37.595 -24.034 1.00 36.29 ? 291 PHE A N 1 ATOM 2310 C CA . PHE A 1 296 ? -2.952 37.677 -25.304 1.00 35.18 ? 291 PHE A CA 1 ATOM 2311 C C . PHE A 1 296 ? -2.724 36.304 -25.942 1.00 33.96 ? 291 PHE A C 1 ATOM 2312 O O . PHE A 1 296 ? -2.733 35.292 -25.259 1.00 33.93 ? 291 PHE A O 1 ATOM 2313 C CB . PHE A 1 296 ? -1.617 38.390 -25.118 1.00 37.29 ? 291 PHE A CB 1 ATOM 2314 C CG . PHE A 1 296 ? -1.742 39.732 -24.470 1.00 36.01 ? 291 PHE A CG 1 ATOM 2315 C CD1 . PHE A 1 296 ? -2.319 40.777 -25.145 1.00 36.55 ? 291 PHE A CD1 1 ATOM 2316 C CD2 . PHE A 1 296 ? -1.374 39.913 -23.160 1.00 34.98 ? 291 PHE A CD2 1 ATOM 2317 C CE1 . PHE A 1 296 ? -2.492 42.006 -24.537 1.00 37.35 ? 291 PHE A CE1 1 ATOM 2318 C CE2 . PHE A 1 296 ? -1.547 41.137 -22.552 1.00 36.16 ? 291 PHE A CE2 1 ATOM 2319 C CZ . PHE A 1 296 ? -2.082 42.190 -23.230 1.00 34.92 ? 291 PHE A CZ 1 ATOM 2320 N N . HIS A 1 297 ? -2.539 36.278 -27.267 1.00 32.98 ? 292 HIS A N 1 ATOM 2321 C CA . HIS A 1 297 ? -2.175 35.052 -27.974 1.00 33.67 ? 292 HIS A CA 1 ATOM 2322 C C . HIS A 1 297 ? -1.358 35.337 -29.191 1.00 33.59 ? 292 HIS A C 1 ATOM 2323 O O . HIS A 1 297 ? -1.309 36.473 -29.648 1.00 31.60 ? 292 HIS A O 1 ATOM 2324 C CB . HIS A 1 297 ? -3.401 34.217 -28.367 1.00 36.79 ? 292 HIS A CB 1 ATOM 2325 C CG . HIS A 1 297 ? -4.134 34.735 -29.569 1.00 36.28 ? 292 HIS A CG 1 ATOM 2326 N ND1 . HIS A 1 297 ? -3.884 34.288 -30.843 1.00 36.87 ? 292 HIS A ND1 1 ATOM 2327 C CD2 . HIS A 1 297 ? -5.090 35.677 -29.688 1.00 38.30 ? 292 HIS A CD2 1 ATOM 2328 C CE1 . HIS A 1 297 ? -4.673 34.909 -31.695 1.00 38.41 ? 292 HIS A CE1 1 ATOM 2329 N NE2 . HIS A 1 297 ? -5.392 35.783 -31.025 1.00 39.13 ? 292 HIS A NE2 1 ATOM 2330 N N . ASN A 1 298 ? -0.654 34.315 -29.699 1.00 34.73 ? 293 ASN A N 1 ATOM 2331 C CA . ASN A 1 298 ? 0.176 34.542 -30.900 1.00 37.00 ? 293 ASN A CA 1 ATOM 2332 C C . ASN A 1 298 ? -0.055 33.495 -31.983 1.00 36.11 ? 293 ASN A C 1 ATOM 2333 O O . ASN A 1 298 ? 0.805 33.285 -32.820 1.00 32.22 ? 293 ASN A O 1 ATOM 2334 C CB . ASN A 1 298 ? 1.650 34.570 -30.539 1.00 34.71 ? 293 ASN A CB 1 ATOM 2335 C CG . ASN A 1 298 ? 2.133 33.221 -30.094 1.00 37.60 ? 293 ASN A CG 1 ATOM 2336 O OD1 . ASN A 1 298 ? 1.332 32.298 -29.860 1.00 37.87 ? 293 ASN A OD1 1 ATOM 2337 N ND2 . ASN A 1 298 ? 3.432 33.094 -29.944 1.00 37.83 ? 293 ASN A ND2 1 ATOM 2338 N N . ILE A 1 299 ? -1.212 32.861 -31.957 1.00 35.40 ? 294 ILE A N 1 ATOM 2339 C CA . ILE A 1 299 ? -1.502 31.739 -32.830 1.00 36.22 ? 294 ILE A CA 1 ATOM 2340 C C . ILE A 1 299 ? -1.741 32.107 -34.286 1.00 34.46 ? 294 ILE A C 1 ATOM 2341 O O . ILE A 1 299 ? -1.071 31.565 -35.178 1.00 38.79 ? 294 ILE A O 1 ATOM 2342 C CB . ILE A 1 299 ? -2.638 30.906 -32.246 1.00 40.12 ? 294 ILE A CB 1 ATOM 2343 C CG1 . ILE A 1 299 ? -2.100 30.273 -30.965 1.00 42.74 ? 294 ILE A CG1 1 ATOM 2344 C CG2 . ILE A 1 299 ? -3.093 29.793 -33.223 1.00 41.94 ? 294 ILE A CG2 1 ATOM 2345 C CD1 . ILE A 1 299 ? -3.047 30.270 -29.831 1.00 42.85 ? 294 ILE A CD1 1 ATOM 2346 N N . HIS A 1 300 ? -2.668 33.015 -34.545 1.00 33.27 ? 295 HIS A N 1 ATOM 2347 C CA . HIS A 1 300 ? -3.052 33.323 -35.931 1.00 33.19 ? 295 HIS A CA 1 ATOM 2348 C C . HIS A 1 300 ? -3.888 34.572 -35.882 1.00 32.63 ? 295 HIS A C 1 ATOM 2349 O O . HIS A 1 300 ? -4.678 34.745 -34.945 1.00 32.10 ? 295 HIS A O 1 ATOM 2350 C CB . HIS A 1 300 ? -3.903 32.173 -36.458 1.00 36.02 ? 295 HIS A CB 1 ATOM 2351 C CG . HIS A 1 300 ? -3.990 32.100 -37.940 1.00 37.90 ? 295 HIS A CG 1 ATOM 2352 N ND1 . HIS A 1 300 ? -4.799 32.921 -38.674 1.00 37.60 ? 295 HIS A ND1 1 ATOM 2353 C CD2 . HIS A 1 300 ? -3.385 31.282 -38.827 1.00 38.81 ? 295 HIS A CD2 1 ATOM 2354 C CE1 . HIS A 1 300 ? -4.655 32.653 -39.955 1.00 39.05 ? 295 HIS A CE1 1 ATOM 2355 N NE2 . HIS A 1 300 ? -3.806 31.656 -40.072 1.00 36.54 ? 295 HIS A NE2 1 ATOM 2356 N N . PRO A 1 301 ? -3.757 35.459 -36.870 1.00 31.81 ? 296 PRO A N 1 ATOM 2357 C CA . PRO A 1 301 ? -4.615 36.673 -36.883 1.00 30.33 ? 296 PRO A CA 1 ATOM 2358 C C . PRO A 1 301 ? -6.087 36.513 -37.339 1.00 30.77 ? 296 PRO A C 1 ATOM 2359 O O . PRO A 1 301 ? -6.962 37.323 -36.953 1.00 33.31 ? 296 PRO A O 1 ATOM 2360 C CB . PRO A 1 301 ? -3.896 37.585 -37.907 1.00 29.61 ? 296 PRO A CB 1 ATOM 2361 C CG . PRO A 1 301 ? -3.148 36.619 -38.815 1.00 28.74 ? 296 PRO A CG 1 ATOM 2362 C CD . PRO A 1 301 ? -2.677 35.553 -37.871 1.00 30.34 ? 296 PRO A CD 1 ATOM 2363 N N . LEU A 1 302 ? -6.365 35.525 -38.172 1.00 29.02 ? 297 LEU A N 1 ATOM 2364 C CA . LEU A 1 302 ? -7.695 35.385 -38.770 1.00 31.36 ? 297 LEU A CA 1 ATOM 2365 C C . LEU A 1 302 ? -8.660 34.536 -37.906 1.00 32.41 ? 297 LEU A C 1 ATOM 2366 O O . LEU A 1 302 ? -9.205 33.523 -38.340 1.00 34.46 ? 297 LEU A O 1 ATOM 2367 C CB . LEU A 1 302 ? -7.587 34.842 -40.217 1.00 30.68 ? 297 LEU A CB 1 ATOM 2368 C CG . LEU A 1 302 ? -6.479 35.470 -41.027 1.00 29.25 ? 297 LEU A CG 1 ATOM 2369 C CD1 . LEU A 1 302 ? -6.457 34.926 -42.448 1.00 29.87 ? 297 LEU A CD1 1 ATOM 2370 C CD2 . LEU A 1 302 ? -6.633 36.975 -41.055 1.00 29.89 ? 297 LEU A CD2 1 ATOM 2371 N N . THR A 1 303 ? -8.956 35.076 -36.729 1.00 33.38 ? 298 THR A N 1 ATOM 2372 C CA . THR A 1 303 ? -9.816 34.453 -35.758 1.00 31.95 ? 298 THR A CA 1 ATOM 2373 C C . THR A 1 303 ? -11.291 34.844 -35.882 1.00 31.20 ? 298 THR A C 1 ATOM 2374 O O . THR A 1 303 ? -11.636 35.934 -36.301 1.00 29.20 ? 298 THR A O 1 ATOM 2375 C CB . THR A 1 303 ? -9.367 34.820 -34.328 1.00 33.70 ? 298 THR A CB 1 ATOM 2376 O OG1 . THR A 1 303 ? -9.399 36.238 -34.134 1.00 31.27 ? 298 THR A OG1 1 ATOM 2377 C CG2 . THR A 1 303 ? -7.953 34.336 -34.100 1.00 35.14 ? 298 THR A CG2 1 ATOM 2378 N N . ILE A 1 304 ? -12.152 33.911 -35.505 1.00 30.53 ? 299 ILE A N 1 ATOM 2379 C CA . ILE A 1 304 ? -13.587 34.165 -35.417 1.00 31.35 ? 299 ILE A CA 1 ATOM 2380 C C . ILE A 1 304 ? -14.046 33.706 -34.050 1.00 30.97 ? 299 ILE A C 1 ATOM 2381 O O . ILE A 1 304 ? -13.850 32.575 -33.683 1.00 32.10 ? 299 ILE A O 1 ATOM 2382 C CB . ILE A 1 304 ? -14.382 33.411 -36.469 1.00 29.13 ? 299 ILE A CB 1 ATOM 2383 C CG1 . ILE A 1 304 ? -13.890 33.802 -37.865 1.00 29.97 ? 299 ILE A CG1 1 ATOM 2384 C CG2 . ILE A 1 304 ? -15.846 33.730 -36.332 1.00 29.88 ? 299 ILE A CG2 1 ATOM 2385 C CD1 . ILE A 1 304 ? -14.548 33.010 -38.974 1.00 32.36 ? 299 ILE A CD1 1 ATOM 2386 N N . GLY A 1 305 ? -14.647 34.622 -33.324 1.00 31.48 ? 300 GLY A N 1 ATOM 2387 C CA . GLY A 1 305 ? -15.068 34.392 -31.973 1.00 33.81 ? 300 GLY A CA 1 ATOM 2388 C C . GLY A 1 305 ? -14.584 35.477 -31.036 1.00 34.46 ? 300 GLY A C 1 ATOM 2389 O O . GLY A 1 305 ? -14.248 36.579 -31.472 1.00 34.65 ? 300 GLY A O 1 ATOM 2390 N N . GLU A 1 306 ? -14.588 35.146 -29.749 1.00 37.69 ? 301 GLU A N 1 ATOM 2391 C CA . GLU A 1 306 ? -14.135 36.047 -28.710 1.00 43.98 ? 301 GLU A CA 1 ATOM 2392 C C . GLU A 1 306 ? -12.783 35.563 -28.305 1.00 40.59 ? 301 GLU A C 1 ATOM 2393 O O . GLU A 1 306 ? -12.672 34.554 -27.632 1.00 45.33 ? 301 GLU A O 1 ATOM 2394 C CB . GLU A 1 306 ? -15.011 35.978 -27.508 1.00 49.21 ? 301 GLU A CB 1 ATOM 2395 C CG . GLU A 1 306 ? -16.459 36.189 -27.796 1.00 60.45 ? 301 GLU A CG 1 ATOM 2396 C CD . GLU A 1 306 ? -17.279 35.845 -26.566 1.00 77.95 ? 301 GLU A CD 1 ATOM 2397 O OE1 . GLU A 1 306 ? -17.050 36.545 -25.512 1.00 77.58 ? 301 GLU A OE1 1 ATOM 2398 O OE2 . GLU A 1 306 ? -18.082 34.861 -26.679 1.00 66.36 ? 301 GLU A OE2 1 ATOM 2399 N N . CYS A 1 307 ? -11.756 36.260 -28.742 1.00 36.95 ? 302 CYS A N 1 ATOM 2400 C CA . CYS A 1 307 ? -10.423 35.769 -28.578 1.00 37.92 ? 302 CYS A CA 1 ATOM 2401 C C . CYS A 1 307 ? -9.550 36.719 -27.739 1.00 36.71 ? 302 CYS A C 1 ATOM 2402 O O . CYS A 1 307 ? -9.874 37.903 -27.603 1.00 33.40 ? 302 CYS A O 1 ATOM 2403 C CB . CYS A 1 307 ? -9.826 35.593 -29.971 1.00 41.94 ? 302 CYS A CB 1 ATOM 2404 S SG . CYS A 1 307 ? -10.801 34.496 -31.002 1.00 41.32 ? 302 CYS A SG 1 ATOM 2405 N N . PRO A 1 308 ? -8.414 36.217 -27.219 1.00 37.86 ? 303 PRO A N 1 ATOM 2406 C CA . PRO A 1 308 ? -7.412 37.129 -26.662 1.00 37.37 ? 303 PRO A CA 1 ATOM 2407 C C . PRO A 1 308 ? -6.880 38.059 -27.728 1.00 36.30 ? 303 PRO A C 1 ATOM 2408 O O . PRO A 1 308 ? -7.157 37.862 -28.908 1.00 37.56 ? 303 PRO A O 1 ATOM 2409 C CB . PRO A 1 308 ? -6.305 36.206 -26.180 1.00 39.39 ? 303 PRO A CB 1 ATOM 2410 C CG . PRO A 1 308 ? -6.935 34.836 -26.075 1.00 40.26 ? 303 PRO A CG 1 ATOM 2411 C CD . PRO A 1 308 ? -8.019 34.805 -27.095 1.00 40.71 ? 303 PRO A CD 1 ATOM 2412 N N . LYS A 1 309 ? -6.128 39.071 -27.319 1.00 33.59 ? 304 LYS A N 1 ATOM 2413 C CA . LYS A 1 309 ? -5.599 40.036 -28.240 1.00 33.62 ? 304 LYS A CA 1 ATOM 2414 C C . LYS A 1 309 ? -4.379 39.455 -28.921 1.00 33.99 ? 304 LYS A C 1 ATOM 2415 O O . LYS A 1 309 ? -3.479 38.945 -28.264 1.00 36.37 ? 304 LYS A O 1 ATOM 2416 C CB . LYS A 1 309 ? -5.266 41.316 -27.491 1.00 34.34 ? 304 LYS A CB 1 ATOM 2417 C CG . LYS A 1 309 ? -6.495 42.003 -26.892 1.00 40.31 ? 304 LYS A CG 1 ATOM 2418 C CD . LYS A 1 309 ? -7.579 42.195 -27.951 1.00 47.82 ? 304 LYS A CD 1 ATOM 2419 C CE . LYS A 1 309 ? -8.769 43.025 -27.506 1.00 54.15 ? 304 LYS A CE 1 ATOM 2420 N NZ . LYS A 1 309 ? -9.596 42.260 -26.535 1.00 61.04 ? 304 LYS A NZ 1 ATOM 2421 N N . TYR A 1 310 ? -4.349 39.519 -30.238 1.00 34.81 ? 305 TYR A N 1 ATOM 2422 C CA . TYR A 1 310 ? -3.231 38.940 -31.026 1.00 35.34 ? 305 TYR A CA 1 ATOM 2423 C C . TYR A 1 310 ? -2.016 39.820 -30.946 1.00 35.87 ? 305 TYR A C 1 ATOM 2424 O O . TYR A 1 310 ? -2.119 41.031 -31.166 1.00 37.51 ? 305 TYR A O 1 ATOM 2425 C CB . TYR A 1 310 ? -3.643 38.764 -32.487 1.00 33.25 ? 305 TYR A CB 1 ATOM 2426 C CG . TYR A 1 310 ? -2.633 38.096 -33.382 1.00 33.21 ? 305 TYR A CG 1 ATOM 2427 C CD1 . TYR A 1 310 ? -2.181 36.784 -33.145 1.00 35.77 ? 305 TYR A CD1 1 ATOM 2428 C CD2 . TYR A 1 310 ? -2.166 38.737 -34.512 1.00 32.71 ? 305 TYR A CD2 1 ATOM 2429 C CE1 . TYR A 1 310 ? -1.243 36.188 -33.982 1.00 34.30 ? 305 TYR A CE1 1 ATOM 2430 C CE2 . TYR A 1 310 ? -1.249 38.152 -35.353 1.00 33.41 ? 305 TYR A CE2 1 ATOM 2431 C CZ . TYR A 1 310 ? -0.781 36.896 -35.107 1.00 35.27 ? 305 TYR A CZ 1 ATOM 2432 O OH . TYR A 1 310 ? 0.161 36.381 -36.009 1.00 35.66 ? 305 TYR A OH 1 ATOM 2433 N N . VAL A 1 311 ? -0.863 39.216 -30.644 1.00 36.97 ? 306 VAL A N 1 ATOM 2434 C CA . VAL A 1 311 ? 0.420 39.944 -30.577 1.00 36.98 ? 306 VAL A CA 1 ATOM 2435 C C . VAL A 1 311 ? 1.606 39.201 -31.221 1.00 38.08 ? 306 VAL A C 1 ATOM 2436 O O . VAL A 1 311 ? 1.552 37.993 -31.429 1.00 36.13 ? 306 VAL A O 1 ATOM 2437 C CB . VAL A 1 311 ? 0.814 40.268 -29.103 1.00 35.90 ? 306 VAL A CB 1 ATOM 2438 C CG1 . VAL A 1 311 ? -0.273 41.081 -28.426 1.00 37.56 ? 306 VAL A CG1 1 ATOM 2439 C CG2 . VAL A 1 311 ? 1.086 39.025 -28.302 1.00 33.41 ? 306 VAL A CG2 1 ATOM 2440 N N . LYS A 1 312 ? 2.684 39.940 -31.474 1.00 39.17 ? 307 LYS A N 1 ATOM 2441 C CA . LYS A 1 312 ? 3.921 39.357 -31.944 1.00 45.47 ? 307 LYS A CA 1 ATOM 2442 C C . LYS A 1 312 ? 4.894 39.122 -30.751 1.00 44.93 ? 307 LYS A C 1 ATOM 2443 O O . LYS A 1 312 ? 5.684 39.987 -30.428 1.00 53.57 ? 307 LYS A O 1 ATOM 2444 C CB . LYS A 1 312 ? 4.534 40.285 -32.995 1.00 47.18 ? 307 LYS A CB 1 ATOM 2445 C CG . LYS A 1 312 ? 5.892 39.806 -33.442 1.00 53.75 ? 307 LYS A CG 1 ATOM 2446 C CD . LYS A 1 312 ? 6.338 40.268 -34.822 1.00 61.40 ? 307 LYS A CD 1 ATOM 2447 C CE . LYS A 1 312 ? 7.198 39.173 -35.461 1.00 68.58 ? 307 LYS A CE 1 ATOM 2448 N NZ . LYS A 1 312 ? 8.228 39.682 -36.397 1.00 74.80 ? 307 LYS A NZ 1 ATOM 2449 N N . SER A 1 313 ? 4.756 38.013 -30.053 1.00 45.74 ? 308 SER A N 1 ATOM 2450 C CA . SER A 1 313 ? 5.653 37.642 -28.932 1.00 46.85 ? 308 SER A CA 1 ATOM 2451 C C . SER A 1 313 ? 5.762 36.166 -28.848 1.00 42.98 ? 308 SER A C 1 ATOM 2452 O O . SER A 1 313 ? 4.851 35.453 -29.247 1.00 49.19 ? 308 SER A O 1 ATOM 2453 C CB . SER A 1 313 ? 5.150 38.055 -27.534 1.00 49.42 ? 308 SER A CB 1 ATOM 2454 O OG . SER A 1 313 ? 4.684 39.373 -27.504 1.00 61.72 ? 308 SER A OG 1 ATOM 2455 N N . ASN A 1 314 ? 6.822 35.710 -28.219 1.00 45.67 ? 309 ASN A N 1 ATOM 2456 C CA . ASN A 1 314 ? 6.994 34.297 -27.932 1.00 50.24 ? 309 ASN A CA 1 ATOM 2457 C C . ASN A 1 314 ? 6.589 33.926 -26.534 1.00 47.00 ? 309 ASN A C 1 ATOM 2458 O O . ASN A 1 314 ? 6.372 32.745 -26.246 1.00 49.24 ? 309 ASN A O 1 ATOM 2459 C CB . ASN A 1 314 ? 8.452 33.921 -28.143 1.00 56.18 ? 309 ASN A CB 1 ATOM 2460 C CG . ASN A 1 314 ? 8.971 34.416 -29.473 1.00 64.41 ? 309 ASN A CG 1 ATOM 2461 O OD1 . ASN A 1 314 ? 10.007 35.088 -29.527 1.00 78.00 ? 309 ASN A OD1 1 ATOM 2462 N ND2 . ASN A 1 314 ? 8.239 34.111 -30.561 1.00 65.15 ? 309 ASN A ND2 1 ATOM 2463 N N . LYS A 1 315 ? 6.422 34.936 -25.690 1.00 48.45 ? 310 LYS A N 1 ATOM 2464 C CA . LYS A 1 315 ? 6.658 34.772 -24.255 1.00 52.77 ? 310 LYS A CA 1 ATOM 2465 C C . LYS A 1 315 ? 6.257 36.040 -23.549 1.00 45.73 ? 310 LYS A C 1 ATOM 2466 O O . LYS A 1 315 ? 6.790 37.098 -23.857 1.00 40.18 ? 310 LYS A O 1 ATOM 2467 C CB . LYS A 1 315 ? 8.169 34.637 -24.089 1.00 62.90 ? 310 LYS A CB 1 ATOM 2468 C CG . LYS A 1 315 ? 8.677 33.711 -23.020 1.00 72.35 ? 310 LYS A CG 1 ATOM 2469 C CD . LYS A 1 315 ? 10.206 33.808 -22.984 1.00 80.71 ? 310 LYS A CD 1 ATOM 2470 C CE . LYS A 1 315 ? 10.678 35.269 -22.904 1.00 87.65 ? 310 LYS A CE 1 ATOM 2471 N NZ . LYS A 1 315 ? 12.112 35.438 -22.567 1.00 91.54 ? 310 LYS A NZ 1 ATOM 2472 N N . LEU A 1 316 ? 5.283 35.967 -22.659 1.00 41.80 ? 311 LEU A N 1 ATOM 2473 C CA . LEU A 1 316 ? 4.964 37.122 -21.802 1.00 44.49 ? 311 LEU A CA 1 ATOM 2474 C C . LEU A 1 316 ? 4.946 36.652 -20.347 1.00 46.96 ? 311 LEU A C 1 ATOM 2475 O O . LEU A 1 316 ? 3.903 36.244 -19.829 1.00 45.15 ? 311 LEU A O 1 ATOM 2476 C CB . LEU A 1 316 ? 3.625 37.795 -22.166 1.00 42.88 ? 311 LEU A CB 1 ATOM 2477 C CG . LEU A 1 316 ? 3.536 38.579 -23.486 1.00 40.67 ? 311 LEU A CG 1 ATOM 2478 C CD1 . LEU A 1 316 ? 2.105 39.007 -23.697 1.00 41.14 ? 311 LEU A CD1 1 ATOM 2479 C CD2 . LEU A 1 316 ? 4.424 39.793 -23.540 1.00 38.69 ? 311 LEU A CD2 1 ATOM 2480 N N . VAL A 1 317 ? 6.110 36.675 -19.714 1.00 46.09 ? 312 VAL A N 1 ATOM 2481 C CA . VAL A 1 317 ? 6.249 36.005 -18.424 1.00 48.73 ? 312 VAL A CA 1 ATOM 2482 C C . VAL A 1 317 ? 6.303 36.972 -17.265 1.00 45.65 ? 312 VAL A C 1 ATOM 2483 O O . VAL A 1 317 ? 7.212 37.800 -17.178 1.00 42.27 ? 312 VAL A O 1 ATOM 2484 C CB . VAL A 1 317 ? 7.503 35.126 -18.379 1.00 51.73 ? 312 VAL A CB 1 ATOM 2485 C CG1 . VAL A 1 317 ? 7.525 34.337 -17.083 1.00 50.46 ? 312 VAL A CG1 1 ATOM 2486 C CG2 . VAL A 1 317 ? 7.526 34.189 -19.581 1.00 49.76 ? 312 VAL A CG2 1 ATOM 2487 N N . LEU A 1 318 ? 5.300 36.876 -16.403 1.00 42.54 ? 313 LEU A N 1 ATOM 2488 C CA . LEU A 1 318 ? 5.275 37.659 -15.183 1.00 44.79 ? 313 LEU A CA 1 ATOM 2489 C C . LEU A 1 318 ? 5.974 36.901 -14.051 1.00 47.14 ? 313 LEU A C 1 ATOM 2490 O O . LEU A 1 318 ? 5.672 35.736 -13.794 1.00 40.17 ? 313 LEU A O 1 ATOM 2491 C CB . LEU A 1 318 ? 3.840 37.952 -14.742 1.00 44.35 ? 313 LEU A CB 1 ATOM 2492 C CG . LEU A 1 318 ? 3.024 38.947 -15.575 1.00 41.56 ? 313 LEU A CG 1 ATOM 2493 C CD1 . LEU A 1 318 ? 1.575 38.903 -15.138 1.00 42.16 ? 313 LEU A CD1 1 ATOM 2494 C CD2 . LEU A 1 318 ? 3.573 40.345 -15.498 1.00 40.67 ? 313 LEU A CD2 1 ATOM 2495 N N . ALA A 1 319 ? 6.875 37.581 -13.355 1.00 49.19 ? 314 ALA A N 1 ATOM 2496 C CA . ALA A 1 319 ? 7.344 37.071 -12.056 1.00 50.05 ? 314 ALA A CA 1 ATOM 2497 C C . ALA A 1 319 ? 6.219 37.000 -11.039 1.00 48.26 ? 314 ALA A C 1 ATOM 2498 O O . ALA A 1 319 ? 5.396 37.934 -10.906 1.00 44.46 ? 314 ALA A O 1 ATOM 2499 C CB . ALA A 1 319 ? 8.466 37.931 -11.506 1.00 51.79 ? 314 ALA A CB 1 ATOM 2500 N N . THR A 1 320 ? 6.171 35.870 -10.342 1.00 51.55 ? 315 THR A N 1 ATOM 2501 C CA . THR A 1 320 ? 5.299 35.690 -9.182 1.00 58.61 ? 315 THR A CA 1 ATOM 2502 C C . THR A 1 320 ? 6.100 35.471 -7.911 1.00 63.16 ? 315 THR A C 1 ATOM 2503 O O . THR A 1 320 ? 5.721 35.948 -6.837 1.00 69.21 ? 315 THR A O 1 ATOM 2504 C CB . THR A 1 320 ? 4.306 34.537 -9.371 1.00 61.24 ? 315 THR A CB 1 ATOM 2505 O OG1 . THR A 1 320 ? 4.953 33.427 -10.002 1.00 62.79 ? 315 THR A OG1 1 ATOM 2506 C CG2 . THR A 1 320 ? 3.141 35.019 -10.244 1.00 59.16 ? 315 THR A CG2 1 ATOM 2507 N N . GLY A 1 321 ? 7.244 34.817 -8.041 1.00 63.21 ? 316 GLY A N 1 ATOM 2508 C CA . GLY A 1 321 ? 8.113 34.587 -6.901 1.00 63.09 ? 316 GLY A CA 1 ATOM 2509 C C . GLY A 1 321 ? 9.251 35.586 -6.754 1.00 60.33 ? 316 GLY A C 1 ATOM 2510 O O . GLY A 1 321 ? 9.187 36.711 -7.233 1.00 52.64 ? 316 GLY A O 1 ATOM 2511 N N . LEU A 1 322 ? 10.308 35.133 -6.094 1.00 62.90 ? 317 LEU A N 1 ATOM 2512 C CA . LEU A 1 322 ? 11.434 35.977 -5.731 1.00 65.89 ? 317 LEU A CA 1 ATOM 2513 C C . LEU A 1 322 ? 12.613 35.729 -6.629 1.00 57.66 ? 317 LEU A C 1 ATOM 2514 O O . LEU A 1 322 ? 12.646 34.731 -7.337 1.00 57.42 ? 317 LEU A O 1 ATOM 2515 C CB . LEU A 1 322 ? 11.845 35.649 -4.308 1.00 72.28 ? 317 LEU A CB 1 ATOM 2516 C CG . LEU A 1 322 ? 10.655 35.659 -3.339 1.00 78.97 ? 317 LEU A CG 1 ATOM 2517 C CD1 . LEU A 1 322 ? 10.070 34.276 -3.051 1.00 80.75 ? 317 LEU A CD1 1 ATOM 2518 C CD2 . LEU A 1 322 ? 11.097 36.309 -2.052 1.00 86.55 ? 317 LEU A CD2 1 ATOM 2519 N N . ARG A 1 323 ? 13.582 36.631 -6.604 1.00 56.77 ? 318 ARG A N 1 ATOM 2520 C CA . ARG A 1 323 ? 14.904 36.361 -7.211 1.00 61.19 ? 318 ARG A CA 1 ATOM 2521 C C . ARG A 1 323 ? 15.520 35.097 -6.617 1.00 60.18 ? 318 ARG A C 1 ATOM 2522 O O . ARG A 1 323 ? 15.443 34.912 -5.405 1.00 56.43 ? 318 ARG A O 1 ATOM 2523 C CB . ARG A 1 323 ? 15.830 37.550 -6.913 1.00 60.57 ? 318 ARG A CB 1 ATOM 2524 C CG . ARG A 1 323 ? 16.694 38.027 -8.054 1.00 66.03 ? 318 ARG A CG 1 ATOM 2525 C CD . ARG A 1 323 ? 17.541 39.195 -7.565 1.00 66.49 ? 318 ARG A CD 1 ATOM 2526 N NE . ARG A 1 323 ? 16.744 40.428 -7.586 1.00 68.92 ? 318 ARG A NE 1 ATOM 2527 C CZ . ARG A 1 323 ? 16.737 41.267 -8.606 1.00 65.66 ? 318 ARG A CZ 1 ATOM 2528 N NH1 . ARG A 1 323 ? 17.453 40.963 -9.684 1.00 67.90 ? 318 ARG A NH1 1 ATOM 2529 N NH2 . ARG A 1 323 ? 16.001 42.360 -8.557 1.00 58.81 ? 318 ARG A NH2 1 ATOM 2530 N N . ASN A 1 324 ? 16.120 34.241 -7.457 1.00 66.93 ? 319 ASN A N 1 ATOM 2531 C CA . ASN A 1 324 ? 16.541 32.867 -7.052 1.00 67.20 ? 319 ASN A CA 1 ATOM 2532 C C . ASN A 1 324 ? 18.031 32.578 -7.008 1.00 63.46 ? 319 ASN A C 1 ATOM 2533 O O . ASN A 1 324 ? 18.828 33.490 -6.854 1.00 65.33 ? 319 ASN A O 1 ATOM 2534 C CB . ASN A 1 324 ? 15.864 31.837 -7.963 1.00 69.27 ? 319 ASN A CB 1 ATOM 2535 C CG . ASN A 1 324 ? 15.745 30.463 -7.323 1.00 69.82 ? 319 ASN A CG 1 ATOM 2536 O OD1 . ASN A 1 324 ? 15.884 30.321 -6.113 1.00 68.69 ? 319 ASN A OD1 1 ATOM 2537 N ND2 . ASN A 1 324 ? 15.511 29.436 -8.145 1.00 67.76 ? 319 ASN A ND2 1 ATOM 2538 N N . SER B 1 5 ? 6.568 60.558 31.533 1.00 102.66 ? 0 SER C N 1 ATOM 2539 C CA . SER B 1 5 ? 7.563 60.867 30.457 1.00 102.93 ? 0 SER C CA 1 ATOM 2540 C C . SER B 1 5 ? 6.870 61.309 29.131 1.00 106.35 ? 0 SER C C 1 ATOM 2541 O O . SER B 1 5 ? 5.940 60.660 28.619 1.00 102.50 ? 0 SER C O 1 ATOM 2542 C CB . SER B 1 5 ? 8.572 59.708 30.264 1.00 98.03 ? 0 SER C CB 1 ATOM 2543 O OG . SER B 1 5 ? 7.991 58.431 30.451 1.00 92.77 ? 0 SER C OG 1 ATOM 2544 N N . ASP B 1 6 ? 7.328 62.442 28.599 1.00 105.94 ? 1 ASP C N 1 ATOM 2545 C CA . ASP B 1 6 ? 6.760 63.063 27.383 1.00 100.79 ? 1 ASP C CA 1 ATOM 2546 C C . ASP B 1 6 ? 6.854 62.183 26.115 1.00 100.71 ? 1 ASP C C 1 ATOM 2547 O O . ASP B 1 6 ? 7.810 61.425 25.958 1.00 103.44 ? 1 ASP C O 1 ATOM 2548 C CB . ASP B 1 6 ? 7.469 64.403 27.140 1.00 94.67 ? 1 ASP C CB 1 ATOM 2549 C CG . ASP B 1 6 ? 7.159 65.448 28.221 1.00 93.18 ? 1 ASP C CG 1 ATOM 2550 O OD1 . ASP B 1 6 ? 6.223 65.229 29.032 1.00 86.25 ? 1 ASP C OD1 1 ATOM 2551 O OD2 . ASP B 1 6 ? 7.852 66.499 28.247 1.00 90.31 ? 1 ASP C OD2 1 ATOM 2552 N N . GLN B 1 7 ? 5.866 62.300 25.218 1.00 103.05 ? 2 GLN C N 1 ATOM 2553 C CA . GLN B 1 7 ? 5.848 61.550 23.925 1.00 96.70 ? 2 GLN C CA 1 ATOM 2554 C C . GLN B 1 7 ? 5.564 62.425 22.708 1.00 93.62 ? 2 GLN C C 1 ATOM 2555 O O . GLN B 1 7 ? 4.653 63.255 22.731 1.00 95.32 ? 2 GLN C O 1 ATOM 2556 C CB . GLN B 1 7 ? 4.779 60.443 23.929 1.00 101.98 ? 2 GLN C CB 1 ATOM 2557 C CG . GLN B 1 7 ? 5.271 59.035 24.240 1.00 107.88 ? 2 GLN C CG 1 ATOM 2558 C CD . GLN B 1 7 ? 4.159 57.976 24.155 1.00 113.89 ? 2 GLN C CD 1 ATOM 2559 O OE1 . GLN B 1 7 ? 3.265 58.037 23.300 1.00 108.77 ? 2 GLN C OE1 1 ATOM 2560 N NE2 . GLN B 1 7 ? 4.215 56.995 25.056 1.00 114.18 ? 2 GLN C NE2 1 ATOM 2561 N N . ILE B 1 8 ? 6.308 62.206 21.625 1.00 90.58 ? 3 ILE C N 1 ATOM 2562 C CA . ILE B 1 8 ? 5.885 62.707 20.301 1.00 85.48 ? 3 ILE C CA 1 ATOM 2563 C C . ILE B 1 8 ? 5.646 61.541 19.331 1.00 81.86 ? 3 ILE C C 1 ATOM 2564 O O . ILE B 1 8 ? 6.386 60.558 19.314 1.00 81.81 ? 3 ILE C O 1 ATOM 2565 C CB . ILE B 1 8 ? 6.860 63.757 19.703 1.00 77.22 ? 3 ILE C CB 1 ATOM 2566 C CG1 . ILE B 1 8 ? 6.166 64.534 18.572 1.00 77.27 ? 3 ILE C CG1 1 ATOM 2567 C CG2 . ILE B 1 8 ? 8.144 63.118 19.227 1.00 72.77 ? 3 ILE C CG2 1 ATOM 2568 C CD1 . ILE B 1 8 ? 6.900 65.788 18.127 1.00 75.18 ? 3 ILE C CD1 1 ATOM 2569 N N . CYS B 1 9 ? 4.581 61.639 18.552 1.00 82.17 ? 4 CYS C N 1 ATOM 2570 C CA . CYS B 1 9 ? 4.305 60.633 17.554 1.00 78.17 ? 4 CYS C CA 1 ATOM 2571 C C . CYS B 1 9 ? 4.172 61.236 16.181 1.00 78.40 ? 4 CYS C C 1 ATOM 2572 O O . CYS B 1 9 ? 3.783 62.391 16.025 1.00 73.50 ? 4 CYS C O 1 ATOM 2573 C CB . CYS B 1 9 ? 3.017 59.925 17.910 1.00 87.87 ? 4 CYS C CB 1 ATOM 2574 S SG . CYS B 1 9 ? 3.048 59.275 19.585 1.00 93.30 ? 4 CYS C SG 1 ATOM 2575 N N . ILE B 1 10 ? 4.496 60.430 15.173 1.00 80.87 ? 5 ILE C N 1 ATOM 2576 C CA . ILE B 1 10 ? 4.232 60.791 13.780 1.00 76.57 ? 5 ILE C CA 1 ATOM 2577 C C . ILE B 1 10 ? 3.014 59.985 13.352 1.00 78.25 ? 5 ILE C C 1 ATOM 2578 O O . ILE B 1 10 ? 2.845 58.844 13.778 1.00 69.18 ? 5 ILE C O 1 ATOM 2579 C CB . ILE B 1 10 ? 5.458 60.555 12.875 1.00 77.24 ? 5 ILE C CB 1 ATOM 2580 C CG1 . ILE B 1 10 ? 6.431 61.729 12.988 1.00 82.75 ? 5 ILE C CG1 1 ATOM 2581 C CG2 . ILE B 1 10 ? 5.059 60.397 11.433 1.00 75.61 ? 5 ILE C CG2 1 ATOM 2582 C CD1 . ILE B 1 10 ? 7.305 61.675 14.225 1.00 80.88 ? 5 ILE C CD1 1 ATOM 2583 N N . GLY B 1 11 ? 2.134 60.620 12.572 1.00 78.29 ? 6 GLY C N 1 ATOM 2584 C CA . GLY B 1 11 ? 0.896 60.002 12.093 1.00 74.54 ? 6 GLY C CA 1 ATOM 2585 C C . GLY B 1 11 ? 0.346 60.711 10.865 1.00 77.76 ? 6 GLY C C 1 ATOM 2586 O O . GLY B 1 11 ? 0.985 61.600 10.288 1.00 82.89 ? 6 GLY C O 1 ATOM 2587 N N . TYR B 1 12 ? -0.856 60.337 10.461 1.00 72.90 ? 7 TYR C N 1 ATOM 2588 C CA . TYR B 1 12 ? -1.414 60.873 9.236 1.00 69.16 ? 7 TYR C CA 1 ATOM 2589 C C . TYR B 1 12 ? -2.931 60.989 9.316 1.00 71.73 ? 7 TYR C C 1 ATOM 2590 O O . TYR B 1 12 ? -3.585 60.399 10.197 1.00 68.20 ? 7 TYR C O 1 ATOM 2591 C CB . TYR B 1 12 ? -0.986 60.025 8.049 1.00 69.74 ? 7 TYR C CB 1 ATOM 2592 C CG . TYR B 1 12 ? -1.352 58.574 8.194 1.00 70.49 ? 7 TYR C CG 1 ATOM 2593 C CD1 . TYR B 1 12 ? -0.528 57.699 8.885 1.00 67.08 ? 7 TYR C CD1 1 ATOM 2594 C CD2 . TYR B 1 12 ? -2.546 58.076 7.654 1.00 72.91 ? 7 TYR C CD2 1 ATOM 2595 C CE1 . TYR B 1 12 ? -0.865 56.374 9.047 1.00 66.92 ? 7 TYR C CE1 1 ATOM 2596 C CE2 . TYR B 1 12 ? -2.891 56.747 7.814 1.00 71.87 ? 7 TYR C CE2 1 ATOM 2597 C CZ . TYR B 1 12 ? -2.033 55.909 8.505 1.00 68.62 ? 7 TYR C CZ 1 ATOM 2598 O OH . TYR B 1 12 ? -2.357 54.605 8.667 1.00 72.85 ? 7 TYR C OH 1 ATOM 2599 N N . HIS B 1 13 ? -3.469 61.760 8.372 1.00 72.79 ? 8 HIS C N 1 ATOM 2600 C CA . HIS B 1 13 ? -4.893 62.150 8.326 1.00 69.08 ? 8 HIS C CA 1 ATOM 2601 C C . HIS B 1 13 ? -5.839 60.973 8.175 1.00 63.30 ? 8 HIS C C 1 ATOM 2602 O O . HIS B 1 13 ? -5.485 59.901 7.649 1.00 60.53 ? 8 HIS C O 1 ATOM 2603 C CB . HIS B 1 13 ? -5.098 63.116 7.161 1.00 74.40 ? 8 HIS C CB 1 ATOM 2604 C CG . HIS B 1 13 ? -6.491 63.637 7.020 1.00 76.99 ? 8 HIS C CG 1 ATOM 2605 N ND1 . HIS B 1 13 ? -6.977 64.682 7.772 1.00 81.67 ? 8 HIS C ND1 1 ATOM 2606 C CD2 . HIS B 1 13 ? -7.488 63.282 6.180 1.00 79.29 ? 8 HIS C CD2 1 ATOM 2607 C CE1 . HIS B 1 13 ? -8.225 64.929 7.423 1.00 81.35 ? 8 HIS C CE1 1 ATOM 2608 N NE2 . HIS B 1 13 ? -8.554 64.101 6.451 1.00 81.20 ? 8 HIS C NE2 1 ATOM 2609 N N . ALA B 1 14 ? -7.030 61.163 8.709 1.00 64.17 ? 9 ALA C N 1 ATOM 2610 C CA . ALA B 1 14 ? -8.107 60.186 8.584 1.00 65.46 ? 9 ALA C CA 1 ATOM 2611 C C . ALA B 1 14 ? -9.427 60.930 8.699 1.00 65.14 ? 9 ALA C C 1 ATOM 2612 O O . ALA B 1 14 ? -9.470 62.038 9.223 1.00 69.46 ? 9 ALA C O 1 ATOM 2613 C CB . ALA B 1 14 ? -8.003 59.088 9.635 1.00 62.59 ? 9 ALA C CB 1 ATOM 2614 N N . ASN B 1 15 ? -10.480 60.340 8.151 1.00 62.30 ? 10 ASN C N 1 ATOM 2615 C CA . ASN B 1 15 ? -11.772 60.985 8.103 1.00 61.04 ? 10 ASN C CA 1 ATOM 2616 C C . ASN B 1 15 ? -12.869 59.954 7.977 1.00 61.48 ? 10 ASN C C 1 ATOM 2617 O O . ASN B 1 15 ? -12.591 58.775 8.139 1.00 63.19 ? 10 ASN C O 1 ATOM 2618 C CB . ASN B 1 15 ? -11.822 62.058 7.018 1.00 62.60 ? 10 ASN C CB 1 ATOM 2619 C CG . ASN B 1 15 ? -11.648 61.504 5.617 1.00 64.91 ? 10 ASN C CG 1 ATOM 2620 O OD1 . ASN B 1 15 ? -11.687 60.296 5.380 1.00 60.81 ? 10 ASN C OD1 1 ATOM 2621 N ND2 . ASN B 1 15 ? -11.466 62.407 4.670 1.00 66.90 ? 10 ASN C ND2 1 ATOM 2622 N N . ASN B 1 16 ? -14.116 60.361 7.753 1.00 73.74 ? 11 ASN C N 1 ATOM 2623 C CA . ASN B 1 16 ? -15.205 59.358 7.663 1.00 86.33 ? 11 ASN C CA 1 ATOM 2624 C C . ASN B 1 16 ? -15.699 59.169 6.218 1.00 82.92 ? 11 ASN C C 1 ATOM 2625 O O . ASN B 1 16 ? -16.841 58.808 5.977 1.00 82.79 ? 11 ASN C O 1 ATOM 2626 C CB . ASN B 1 16 ? -16.337 59.603 8.694 1.00 93.38 ? 11 ASN C CB 1 ATOM 2627 C CG . ASN B 1 16 ? -16.598 61.077 8.953 1.00 104.60 ? 11 ASN C CG 1 ATOM 2628 O OD1 . ASN B 1 16 ? -16.651 61.869 8.012 1.00 115.44 ? 11 ASN C OD1 1 ATOM 2629 N ND2 . ASN B 1 16 ? -16.762 61.458 10.233 1.00 110.52 ? 11 ASN C ND2 1 ATOM 2630 N N . SER B 1 17 ? -14.801 59.414 5.265 1.00 84.78 ? 12 SER C N 1 ATOM 2631 C CA . SER B 1 17 ? -14.993 59.012 3.867 1.00 83.01 ? 12 SER C CA 1 ATOM 2632 C C . SER B 1 17 ? -15.089 57.499 3.742 1.00 81.40 ? 12 SER C C 1 ATOM 2633 O O . SER B 1 17 ? -14.331 56.766 4.376 1.00 72.62 ? 12 SER C O 1 ATOM 2634 C CB . SER B 1 17 ? -13.845 59.512 2.973 1.00 81.16 ? 12 SER C CB 1 ATOM 2635 O OG . SER B 1 17 ? -13.640 58.653 1.874 1.00 75.13 ? 12 SER C OG 1 ATOM 2636 N N . THR B 1 18 ? -16.049 57.055 2.928 1.00 82.89 ? 13 THR C N 1 ATOM 2637 C CA . THR B 1 18 ? -16.214 55.639 2.593 1.00 83.73 ? 13 THR C CA 1 ATOM 2638 C C . THR B 1 18 ? -15.745 55.305 1.182 1.00 79.03 ? 13 THR C C 1 ATOM 2639 O O . THR B 1 18 ? -15.748 54.124 0.815 1.00 77.30 ? 13 THR C O 1 ATOM 2640 C CB . THR B 1 18 ? -17.691 55.204 2.716 1.00 87.07 ? 13 THR C CB 1 ATOM 2641 O OG1 . THR B 1 18 ? -18.539 56.284 2.302 1.00 77.42 ? 13 THR C OG1 1 ATOM 2642 C CG2 . THR B 1 18 ? -18.011 54.784 4.158 1.00 83.98 ? 13 THR C CG2 1 ATOM 2643 N N . GLU B 1 19 ? -15.340 56.329 0.417 1.00 70.86 ? 14 GLU C N 1 ATOM 2644 C CA . GLU B 1 19 ? -14.757 56.156 -0.916 1.00 73.05 ? 14 GLU C CA 1 ATOM 2645 C C . GLU B 1 19 ? -13.801 54.962 -0.940 1.00 67.36 ? 14 GLU C C 1 ATOM 2646 O O . GLU B 1 19 ? -12.956 54.805 -0.062 1.00 59.12 ? 14 GLU C O 1 ATOM 2647 C CB . GLU B 1 19 ? -13.993 57.408 -1.370 1.00 82.21 ? 14 GLU C CB 1 ATOM 2648 C CG . GLU B 1 19 ? -14.847 58.618 -1.739 1.00 94.22 ? 14 GLU C CG 1 ATOM 2649 C CD . GLU B 1 19 ? -15.741 58.394 -2.957 1.00 103.69 ? 14 GLU C CD 1 ATOM 2650 O OE1 . GLU B 1 19 ? -15.257 57.951 -4.035 1.00 103.80 ? 14 GLU C OE1 1 ATOM 2651 O OE2 . GLU B 1 19 ? -16.954 58.674 -2.835 1.00 115.47 ? 14 GLU C OE2 1 ATOM 2652 N N . GLN B 1 20 ? -13.953 54.129 -1.959 1.00 63.63 ? 15 GLN C N 1 ATOM 2653 C CA . GLN B 1 20 ? -13.146 52.942 -2.138 1.00 62.80 ? 15 GLN C CA 1 ATOM 2654 C C . GLN B 1 20 ? -12.452 52.997 -3.475 1.00 55.02 ? 15 GLN C C 1 ATOM 2655 O O . GLN B 1 20 ? -12.904 53.644 -4.410 1.00 55.94 ? 15 GLN C O 1 ATOM 2656 C CB . GLN B 1 20 ? -14.016 51.687 -2.027 1.00 67.59 ? 15 GLN C CB 1 ATOM 2657 C CG . GLN B 1 20 ? -14.123 51.172 -0.603 1.00 76.44 ? 15 GLN C CG 1 ATOM 2658 C CD . GLN B 1 20 ? -14.810 49.837 -0.494 1.00 82.63 ? 15 GLN C CD 1 ATOM 2659 O OE1 . GLN B 1 20 ? -14.852 49.067 -1.445 1.00 80.73 ? 15 GLN C OE1 1 ATOM 2660 N NE2 . GLN B 1 20 ? -15.325 49.545 0.685 1.00 85.59 ? 15 GLN C NE2 1 ATOM 2661 N N . VAL B 1 21 ? -11.379 52.247 -3.585 1.00 54.60 ? 16 VAL C N 1 ATOM 2662 C CA . VAL B 1 21 ? -10.463 52.366 -4.716 1.00 52.97 ? 16 VAL C CA 1 ATOM 2663 C C . VAL B 1 21 ? -9.807 51.007 -4.869 1.00 49.61 ? 16 VAL C C 1 ATOM 2664 O O . VAL B 1 21 ? -9.624 50.313 -3.877 1.00 46.03 ? 16 VAL C O 1 ATOM 2665 C CB . VAL B 1 21 ? -9.450 53.482 -4.399 1.00 52.62 ? 16 VAL C CB 1 ATOM 2666 C CG1 . VAL B 1 21 ? -8.019 53.016 -4.469 1.00 51.69 ? 16 VAL C CG1 1 ATOM 2667 C CG2 . VAL B 1 21 ? -9.707 54.735 -5.218 1.00 52.11 ? 16 VAL C CG2 1 ATOM 2668 N N . ASP B 1 22 ? -9.509 50.593 -6.100 1.00 51.73 ? 17 ASP C N 1 ATOM 2669 C CA . ASP B 1 22 ? -8.757 49.363 -6.301 1.00 52.14 ? 17 ASP C CA 1 ATOM 2670 C C . ASP B 1 22 ? -7.314 49.733 -6.696 1.00 50.89 ? 17 ASP C C 1 ATOM 2671 O O . ASP B 1 22 ? -7.024 50.844 -7.185 1.00 40.84 ? 17 ASP C O 1 ATOM 2672 C CB . ASP B 1 22 ? -9.380 48.447 -7.370 1.00 59.64 ? 17 ASP C CB 1 ATOM 2673 C CG . ASP B 1 22 ? -10.704 47.803 -6.930 1.00 63.89 ? 17 ASP C CG 1 ATOM 2674 O OD1 . ASP B 1 22 ? -11.142 48.031 -5.798 1.00 63.22 ? 17 ASP C OD1 1 ATOM 2675 O OD2 . ASP B 1 22 ? -11.306 47.057 -7.739 1.00 68.36 ? 17 ASP C OD2 1 ATOM 2676 N N . THR B 1 23 ? -6.441 48.756 -6.492 1.00 48.23 ? 18 THR C N 1 ATOM 2677 C CA . THR B 1 23 ? -5.015 48.843 -6.708 1.00 51.22 ? 18 THR C CA 1 ATOM 2678 C C . THR B 1 23 ? -4.679 47.573 -7.490 1.00 55.78 ? 18 THR C C 1 ATOM 2679 O O . THR B 1 23 ? -5.494 46.644 -7.540 1.00 45.78 ? 18 THR C O 1 ATOM 2680 C CB . THR B 1 23 ? -4.335 48.877 -5.311 1.00 53.16 ? 18 THR C CB 1 ATOM 2681 O OG1 . THR B 1 23 ? -4.249 50.247 -4.855 1.00 60.07 ? 18 THR C OG1 1 ATOM 2682 C CG2 . THR B 1 23 ? -3.003 48.268 -5.294 1.00 52.90 ? 18 THR C CG2 1 ATOM 2683 N N . ILE B 1 24 ? -3.504 47.510 -8.118 1.00 59.04 ? 19 ILE C N 1 ATOM 2684 C CA . ILE B 1 24 ? -3.143 46.292 -8.868 1.00 58.57 ? 19 ILE C CA 1 ATOM 2685 C C . ILE B 1 24 ? -2.966 45.072 -7.948 1.00 51.32 ? 19 ILE C C 1 ATOM 2686 O O . ILE B 1 24 ? -3.207 43.957 -8.341 1.00 56.70 ? 19 ILE C O 1 ATOM 2687 C CB . ILE B 1 24 ? -1.942 46.545 -9.805 1.00 59.15 ? 19 ILE C CB 1 ATOM 2688 C CG1 . ILE B 1 24 ? -2.015 45.630 -11.008 1.00 63.76 ? 19 ILE C CG1 1 ATOM 2689 C CG2 . ILE B 1 24 ? -0.656 46.320 -9.083 1.00 60.98 ? 19 ILE C CG2 1 ATOM 2690 C CD1 . ILE B 1 24 ? -1.097 46.061 -12.132 1.00 70.47 ? 19 ILE C CD1 1 ATOM 2691 N N . MET B 1 25 ? -2.589 45.304 -6.705 1.00 52.87 ? 20 MET C N 1 ATOM 2692 C CA . MET B 1 25 ? -2.471 44.243 -5.714 1.00 50.87 ? 20 MET C CA 1 ATOM 2693 C C . MET B 1 25 ? -3.528 44.160 -4.650 1.00 50.76 ? 20 MET C C 1 ATOM 2694 O O . MET B 1 25 ? -3.556 43.160 -3.908 1.00 46.91 ? 20 MET C O 1 ATOM 2695 C CB . MET B 1 25 ? -1.123 44.363 -5.019 1.00 58.74 ? 20 MET C CB 1 ATOM 2696 C CG . MET B 1 25 ? 0.015 44.106 -5.985 1.00 60.24 ? 20 MET C CG 1 ATOM 2697 S SD . MET B 1 25 ? 1.423 43.466 -5.130 1.00 62.29 ? 20 MET C SD 1 ATOM 2698 C CE . MET B 1 25 ? 1.771 44.930 -4.183 1.00 65.32 ? 20 MET C CE 1 ATOM 2699 N N . GLU B 1 26 ? -4.399 45.164 -4.565 1.00 51.13 ? 21 GLU C N 1 ATOM 2700 C CA . GLU B 1 26 ? -5.471 45.178 -3.533 1.00 58.66 ? 21 GLU C CA 1 ATOM 2701 C C . GLU B 1 26 ? -6.771 45.745 -4.031 1.00 55.30 ? 21 GLU C C 1 ATOM 2702 O O . GLU B 1 26 ? -6.780 46.724 -4.774 1.00 58.74 ? 21 GLU C O 1 ATOM 2703 C CB . GLU B 1 26 ? -5.085 46.046 -2.342 1.00 60.86 ? 21 GLU C CB 1 ATOM 2704 C CG . GLU B 1 26 ? -3.848 45.607 -1.596 1.00 65.05 ? 21 GLU C CG 1 ATOM 2705 C CD . GLU B 1 26 ? -3.452 46.613 -0.535 1.00 69.04 ? 21 GLU C CD 1 ATOM 2706 O OE1 . GLU B 1 26 ? -4.202 46.750 0.483 1.00 63.30 ? 21 GLU C OE1 1 ATOM 2707 O OE2 . GLU B 1 26 ? -2.390 47.263 -0.735 1.00 74.07 ? 21 GLU C OE2 1 ATOM 2708 N N . LYS B 1 27 ? -7.867 45.148 -3.590 1.00 58.53 ? 22 LYS C N 1 ATOM 2709 C CA . LYS B 1 27 ? -9.187 45.634 -3.929 1.00 63.39 ? 22 LYS C CA 1 ATOM 2710 C C . LYS B 1 27 ? -9.909 46.264 -2.746 1.00 56.44 ? 22 LYS C C 1 ATOM 2711 O O . LYS B 1 27 ? -9.623 45.974 -1.610 1.00 55.53 ? 22 LYS C O 1 ATOM 2712 C CB . LYS B 1 27 ? -10.013 44.486 -4.478 1.00 68.26 ? 22 LYS C CB 1 ATOM 2713 C CG . LYS B 1 27 ? -9.413 43.816 -5.695 1.00 71.04 ? 22 LYS C CG 1 ATOM 2714 C CD . LYS B 1 27 ? -10.483 43.031 -6.423 1.00 76.57 ? 22 LYS C CD 1 ATOM 2715 C CE . LYS B 1 27 ? -9.898 42.196 -7.530 1.00 82.74 ? 22 LYS C CE 1 ATOM 2716 N NZ . LYS B 1 27 ? -10.808 41.059 -7.798 1.00 86.06 ? 22 LYS C NZ 1 ATOM 2717 N N . ASN B 1 28 ? -10.850 47.144 -3.049 1.00 60.01 ? 23 ASN C N 1 ATOM 2718 C CA . ASN B 1 28 ? -11.765 47.677 -2.060 1.00 67.02 ? 23 ASN C CA 1 ATOM 2719 C C . ASN B 1 28 ? -10.998 48.279 -0.887 1.00 69.35 ? 23 ASN C C 1 ATOM 2720 O O . ASN B 1 28 ? -11.218 47.947 0.271 1.00 78.07 ? 23 ASN C O 1 ATOM 2721 C CB . ASN B 1 28 ? -12.786 46.592 -1.644 1.00 72.88 ? 23 ASN C CB 1 ATOM 2722 C CG . ASN B 1 28 ? -13.849 46.343 -2.724 1.00 84.75 ? 23 ASN C CG 1 ATOM 2723 O OD1 . ASN B 1 28 ? -13.736 46.802 -3.864 1.00 86.55 ? 23 ASN C OD1 1 ATOM 2724 N ND2 . ASN B 1 28 ? -14.905 45.625 -2.359 1.00 103.93 ? 23 ASN C ND2 1 ATOM 2725 N N . VAL B 1 29 ? -10.084 49.172 -1.224 1.00 63.66 ? 24 VAL C N 1 ATOM 2726 C CA . VAL B 1 29 ? -9.297 49.902 -0.248 1.00 60.97 ? 24 VAL C CA 1 ATOM 2727 C C . VAL B 1 29 ? -9.919 51.270 0.035 1.00 60.57 ? 24 VAL C C 1 ATOM 2728 O O . VAL B 1 29 ? -10.018 52.114 -0.855 1.00 58.41 ? 24 VAL C O 1 ATOM 2729 C CB . VAL B 1 29 ? -7.867 50.130 -0.771 1.00 60.95 ? 24 VAL C CB 1 ATOM 2730 C CG1 . VAL B 1 29 ? -7.085 51.034 0.183 1.00 63.41 ? 24 VAL C CG1 1 ATOM 2731 C CG2 . VAL B 1 29 ? -7.154 48.796 -0.947 1.00 58.16 ? 24 VAL C CG2 1 ATOM 2732 N N . THR B 1 30 ? -10.315 51.489 1.282 1.00 56.96 ? 25 THR C N 1 ATOM 2733 C CA . THR B 1 30 ? -10.977 52.711 1.642 1.00 56.25 ? 25 THR C CA 1 ATOM 2734 C C . THR B 1 30 ? -9.930 53.795 1.729 1.00 53.30 ? 25 THR C C 1 ATOM 2735 O O . THR B 1 30 ? -8.864 53.592 2.285 1.00 52.40 ? 25 THR C O 1 ATOM 2736 C CB . THR B 1 30 ? -11.736 52.578 2.983 1.00 61.13 ? 25 THR C CB 1 ATOM 2737 O OG1 . THR B 1 30 ? -12.552 51.409 2.954 1.00 59.31 ? 25 THR C OG1 1 ATOM 2738 C CG2 . THR B 1 30 ? -12.639 53.808 3.240 1.00 61.88 ? 25 THR C CG2 1 ATOM 2739 N N . VAL B 1 31 ? -10.249 54.947 1.164 1.00 51.29 ? 26 VAL C N 1 ATOM 2740 C CA . VAL B 1 31 ? -9.349 56.060 1.157 1.00 55.13 ? 26 VAL C CA 1 ATOM 2741 C C . VAL B 1 31 ? -10.032 57.348 1.603 1.00 60.99 ? 26 VAL C C 1 ATOM 2742 O O . VAL B 1 31 ? -11.251 57.429 1.767 1.00 67.34 ? 26 VAL C O 1 ATOM 2743 C CB . VAL B 1 31 ? -8.672 56.276 -0.216 1.00 54.19 ? 26 VAL C CB 1 ATOM 2744 C CG1 . VAL B 1 31 ? -7.899 55.045 -0.599 1.00 52.90 ? 26 VAL C CG1 1 ATOM 2745 C CG2 . VAL B 1 31 ? -9.682 56.676 -1.293 1.00 56.01 ? 26 VAL C CG2 1 ATOM 2746 N N . THR B 1 32 ? -9.192 58.352 1.771 1.00 57.38 ? 27 THR C N 1 ATOM 2747 C CA . THR B 1 32 ? -9.523 59.595 2.411 1.00 58.88 ? 27 THR C CA 1 ATOM 2748 C C . THR B 1 32 ? -10.223 60.509 1.412 1.00 64.43 ? 27 THR C C 1 ATOM 2749 O O . THR B 1 32 ? -11.250 61.126 1.714 1.00 74.47 ? 27 THR C O 1 ATOM 2750 C CB . THR B 1 32 ? -8.185 60.151 2.988 1.00 56.28 ? 27 THR C CB 1 ATOM 2751 O OG1 . THR B 1 32 ? -8.178 59.980 4.410 1.00 61.92 ? 27 THR C OG1 1 ATOM 2752 C CG2 . THR B 1 32 ? -7.917 61.549 2.630 1.00 52.07 ? 27 THR C CG2 1 ATOM 2753 N N . HIS B 1 33 ? -9.658 60.576 0.212 1.00 67.73 ? 28 HIS C N 1 ATOM 2754 C CA . HIS B 1 33 ? -10.188 61.362 -0.915 1.00 66.66 ? 28 HIS C CA 1 ATOM 2755 C C . HIS B 1 33 ? -9.943 60.584 -2.206 1.00 66.80 ? 28 HIS C C 1 ATOM 2756 O O . HIS B 1 33 ? -9.005 59.785 -2.295 1.00 63.42 ? 28 HIS C O 1 ATOM 2757 C CB . HIS B 1 33 ? -9.493 62.721 -1.047 1.00 71.88 ? 28 HIS C CB 1 ATOM 2758 C CG . HIS B 1 33 ? -9.456 63.522 0.217 1.00 88.25 ? 28 HIS C CG 1 ATOM 2759 N ND1 . HIS B 1 33 ? -8.275 63.865 0.850 1.00 87.73 ? 28 HIS C ND1 1 ATOM 2760 C CD2 . HIS B 1 33 ? -10.455 64.068 0.955 1.00 88.91 ? 28 HIS C CD2 1 ATOM 2761 C CE1 . HIS B 1 33 ? -8.554 64.572 1.931 1.00 87.32 ? 28 HIS C CE1 1 ATOM 2762 N NE2 . HIS B 1 33 ? -9.865 64.708 2.016 1.00 88.92 ? 28 HIS C NE2 1 ATOM 2763 N N . ALA B 1 34 ? -10.782 60.831 -3.207 1.00 67.12 ? 29 ALA C N 1 ATOM 2764 C CA . ALA B 1 34 ? -10.690 60.133 -4.474 1.00 60.00 ? 29 ALA C CA 1 ATOM 2765 C C . ALA B 1 34 ? -11.324 60.934 -5.565 1.00 64.40 ? 29 ALA C C 1 ATOM 2766 O O . ALA B 1 34 ? -12.214 61.733 -5.318 1.00 67.26 ? 29 ALA C O 1 ATOM 2767 C CB . ALA B 1 34 ? -11.364 58.773 -4.402 1.00 56.29 ? 29 ALA C CB 1 ATOM 2768 N N . GLN B 1 35 ? -10.873 60.676 -6.787 1.00 69.11 ? 30 GLN C N 1 ATOM 2769 C CA . GLN B 1 35 ? -11.377 61.374 -7.949 1.00 68.51 ? 30 GLN C CA 1 ATOM 2770 C C . GLN B 1 35 ? -11.640 60.442 -9.135 1.00 66.76 ? 30 GLN C C 1 ATOM 2771 O O . GLN B 1 35 ? -10.732 59.693 -9.567 1.00 62.88 ? 30 GLN C O 1 ATOM 2772 C CB . GLN B 1 35 ? -10.396 62.454 -8.354 1.00 69.70 ? 30 GLN C CB 1 ATOM 2773 C CG . GLN B 1 35 ? -11.159 63.710 -8.659 1.00 76.90 ? 30 GLN C CG 1 ATOM 2774 C CD . GLN B 1 35 ? -10.405 64.644 -9.544 1.00 80.94 ? 30 GLN C CD 1 ATOM 2775 O OE1 . GLN B 1 35 ? -9.348 65.158 -9.162 1.00 88.81 ? 30 GLN C OE1 1 ATOM 2776 N NE2 . GLN B 1 35 ? -10.948 64.895 -10.731 1.00 85.16 ? 30 GLN C NE2 1 ATOM 2777 N N . ASP B 1 36 ? -12.876 60.492 -9.644 1.00 57.87 ? 31 ASP C N 1 ATOM 2778 C CA . ASP B 1 36 ? -13.281 59.675 -10.785 1.00 57.60 ? 31 ASP C CA 1 ATOM 2779 C C . ASP B 1 36 ? -12.950 60.403 -12.077 1.00 53.33 ? 31 ASP C C 1 ATOM 2780 O O . ASP B 1 36 ? -13.382 61.535 -12.246 1.00 63.79 ? 31 ASP C O 1 ATOM 2781 C CB . ASP B 1 36 ? -14.770 59.366 -10.729 1.00 59.26 ? 31 ASP C CB 1 ATOM 2782 C CG . ASP B 1 36 ? -15.133 58.094 -11.512 1.00 63.64 ? 31 ASP C CG 1 ATOM 2783 O OD1 . ASP B 1 36 ? -14.506 57.829 -12.563 1.00 62.51 ? 31 ASP C OD1 1 ATOM 2784 O OD2 . ASP B 1 36 ? -16.063 57.373 -11.083 1.00 57.01 ? 31 ASP C OD2 1 ATOM 2785 N N . ILE B 1 37 ? -12.196 59.766 -12.978 1.00 45.57 ? 32 ILE C N 1 ATOM 2786 C CA . ILE B 1 37 ? -11.848 60.399 -14.285 1.00 48.35 ? 32 ILE C CA 1 ATOM 2787 C C . ILE B 1 37 ? -12.690 59.895 -15.455 1.00 47.14 ? 32 ILE C C 1 ATOM 2788 O O . ILE B 1 37 ? -12.385 60.171 -16.600 1.00 50.33 ? 32 ILE C O 1 ATOM 2789 C CB . ILE B 1 37 ? -10.383 60.254 -14.648 1.00 50.48 ? 32 ILE C CB 1 ATOM 2790 C CG1 . ILE B 1 37 ? -9.976 58.779 -14.724 1.00 50.38 ? 32 ILE C CG1 1 ATOM 2791 C CG2 . ILE B 1 37 ? -9.555 60.994 -13.619 1.00 54.18 ? 32 ILE C CG2 1 ATOM 2792 C CD1 . ILE B 1 37 ? -8.549 58.557 -15.170 1.00 51.27 ? 32 ILE C CD1 1 ATOM 2793 N N . LEU B 1 38 ? -13.771 59.178 -15.146 1.00 47.66 ? 33 LEU C N 1 ATOM 2794 C CA . LEU B 1 38 ? -14.753 58.751 -16.136 1.00 46.77 ? 33 LEU C CA 1 ATOM 2795 C C . LEU B 1 38 ? -15.945 59.731 -16.138 1.00 49.43 ? 33 LEU C C 1 ATOM 2796 O O . LEU B 1 38 ? -16.646 59.892 -15.118 1.00 46.79 ? 33 LEU C O 1 ATOM 2797 C CB . LEU B 1 38 ? -15.242 57.338 -15.817 1.00 43.92 ? 33 LEU C CB 1 ATOM 2798 C CG . LEU B 1 38 ? -16.190 56.717 -16.836 1.00 48.52 ? 33 LEU C CG 1 ATOM 2799 C CD1 . LEU B 1 38 ? -15.562 56.616 -18.241 1.00 46.92 ? 33 LEU C CD1 1 ATOM 2800 C CD2 . LEU B 1 38 ? -16.588 55.348 -16.350 1.00 47.94 ? 33 LEU C CD2 1 ATOM 2801 N N . GLU B 1 39 ? -16.167 60.357 -17.287 1.00 49.29 ? 34 GLU C N 1 ATOM 2802 C CA . GLU B 1 39 ? -17.356 61.146 -17.531 1.00 50.58 ? 34 GLU C CA 1 ATOM 2803 C C . GLU B 1 39 ? -18.576 60.216 -17.748 1.00 50.75 ? 34 GLU C C 1 ATOM 2804 O O . GLU B 1 39 ? -18.589 59.409 -18.673 1.00 54.10 ? 34 GLU C O 1 ATOM 2805 C CB . GLU B 1 39 ? -17.165 62.070 -18.747 1.00 51.02 ? 34 GLU C CB 1 ATOM 2806 C CG . GLU B 1 39 ? -18.298 63.072 -18.941 1.00 52.94 ? 34 GLU C CG 1 ATOM 2807 C CD . GLU B 1 39 ? -18.605 63.833 -17.659 1.00 54.95 ? 34 GLU C CD 1 ATOM 2808 O OE1 . GLU B 1 39 ? -19.702 63.611 -17.091 1.00 52.03 ? 34 GLU C OE1 1 ATOM 2809 O OE2 . GLU B 1 39 ? -17.719 64.611 -17.204 1.00 59.64 ? 34 GLU C OE2 1 ATOM 2810 N N . LYS B 1 40 ? -19.598 60.361 -16.903 1.00 50.53 ? 35 LYS C N 1 ATOM 2811 C CA . LYS B 1 40 ? -20.811 59.525 -16.950 1.00 50.43 ? 35 LYS C CA 1 ATOM 2812 C C . LYS B 1 40 ? -22.078 60.308 -17.288 1.00 51.32 ? 35 LYS C C 1 ATOM 2813 O O . LYS B 1 40 ? -23.148 59.733 -17.425 1.00 52.46 ? 35 LYS C O 1 ATOM 2814 C CB . LYS B 1 40 ? -21.029 58.873 -15.597 1.00 52.77 ? 35 LYS C CB 1 ATOM 2815 C CG . LYS B 1 40 ? -20.208 57.640 -15.351 1.00 61.95 ? 35 LYS C CG 1 ATOM 2816 C CD . LYS B 1 40 ? -20.007 57.391 -13.857 1.00 63.15 ? 35 LYS C CD 1 ATOM 2817 C CE . LYS B 1 40 ? -18.933 58.332 -13.397 1.00 67.75 ? 35 LYS C CE 1 ATOM 2818 N NZ . LYS B 1 40 ? -18.237 57.988 -12.157 1.00 73.67 ? 35 LYS C NZ 1 ATOM 2819 N N . THR B 1 41 ? -21.984 61.626 -17.367 1.00 55.33 ? 36 THR C N 1 ATOM 2820 C CA . THR B 1 41 ? -23.185 62.440 -17.476 1.00 55.91 ? 36 THR C CA 1 ATOM 2821 C C . THR B 1 41 ? -23.242 63.289 -18.747 1.00 54.64 ? 36 THR C C 1 ATOM 2822 O O . THR B 1 41 ? -22.229 63.736 -19.287 1.00 48.85 ? 36 THR C O 1 ATOM 2823 C CB . THR B 1 41 ? -23.367 63.375 -16.246 1.00 63.37 ? 36 THR C CB 1 ATOM 2824 O OG1 . THR B 1 41 ? -22.291 64.298 -16.213 1.00 53.35 ? 36 THR C OG1 1 ATOM 2825 C CG2 . THR B 1 41 ? -23.441 62.633 -14.857 1.00 67.26 ? 36 THR C CG2 1 ATOM 2826 N N . HIS B 1 42 ? -24.466 63.533 -19.171 1.00 55.82 ? 37 HIS C N 1 ATOM 2827 C CA . HIS B 1 42 ? -24.771 64.370 -20.314 1.00 57.81 ? 37 HIS C CA 1 ATOM 2828 C C . HIS B 1 42 ? -26.063 65.162 -20.033 1.00 57.65 ? 37 HIS C C 1 ATOM 2829 O O . HIS B 1 42 ? -26.863 64.793 -19.174 1.00 60.96 ? 37 HIS C O 1 ATOM 2830 C CB . HIS B 1 42 ? -24.981 63.479 -21.547 1.00 54.85 ? 37 HIS C CB 1 ATOM 2831 C CG . HIS B 1 42 ? -26.090 62.493 -21.386 1.00 50.65 ? 37 HIS C CG 1 ATOM 2832 N ND1 . HIS B 1 42 ? -27.395 62.778 -21.721 1.00 47.78 ? 37 HIS C ND1 1 ATOM 2833 C CD2 . HIS B 1 42 ? -26.096 61.231 -20.895 1.00 54.09 ? 37 HIS C CD2 1 ATOM 2834 C CE1 . HIS B 1 42 ? -28.161 61.733 -21.446 1.00 52.13 ? 37 HIS C CE1 1 ATOM 2835 N NE2 . HIS B 1 42 ? -27.397 60.777 -20.948 1.00 52.32 ? 37 HIS C NE2 1 ATOM 2836 N N . ASN B 1 43 ? -26.280 66.209 -20.822 1.00 56.47 ? 38 ASN C N 1 ATOM 2837 C CA . ASN B 1 43 ? -27.348 67.177 -20.581 1.00 54.27 ? 38 ASN C CA 1 ATOM 2838 C C . ASN B 1 43 ? -28.711 66.799 -21.192 1.00 55.69 ? 38 ASN C C 1 ATOM 2839 O O . ASN B 1 43 ? -29.620 67.607 -21.214 1.00 63.10 ? 38 ASN C O 1 ATOM 2840 C CB . ASN B 1 43 ? -26.909 68.524 -21.134 1.00 52.05 ? 38 ASN C CB 1 ATOM 2841 C CG . ASN B 1 43 ? -27.027 68.593 -22.653 1.00 55.73 ? 38 ASN C CG 1 ATOM 2842 O OD1 . ASN B 1 43 ? -27.433 67.641 -23.301 1.00 56.59 ? 38 ASN C OD1 1 ATOM 2843 N ND2 . ASN B 1 43 ? -26.680 69.726 -23.215 1.00 59.50 ? 38 ASN C ND2 1 ATOM 2844 N N . GLY B 1 44 ? -28.826 65.607 -21.766 1.00 54.69 ? 39 GLY C N 1 ATOM 2845 C CA . GLY B 1 44 ? -30.096 65.094 -22.264 1.00 46.48 ? 39 GLY C CA 1 ATOM 2846 C C . GLY B 1 44 ? -30.665 65.746 -23.522 1.00 47.91 ? 39 GLY C C 1 ATOM 2847 O O . GLY B 1 44 ? -31.794 65.430 -23.924 1.00 42.01 ? 39 GLY C O 1 ATOM 2848 N N . LYS B 1 45 ? -29.892 66.611 -24.175 1.00 53.04 ? 40 LYS C N 1 ATOM 2849 C CA . LYS B 1 45 ? -30.388 67.454 -25.275 1.00 58.78 ? 40 LYS C CA 1 ATOM 2850 C C . LYS B 1 45 ? -29.514 67.479 -26.552 1.00 57.70 ? 40 LYS C C 1 ATOM 2851 O O . LYS B 1 45 ? -28.364 67.103 -26.510 1.00 55.64 ? 40 LYS C O 1 ATOM 2852 C CB . LYS B 1 45 ? -30.576 68.868 -24.733 1.00 69.07 ? 40 LYS C CB 1 ATOM 2853 C CG . LYS B 1 45 ? -31.647 68.910 -23.643 1.00 84.41 ? 40 LYS C CG 1 ATOM 2854 C CD . LYS B 1 45 ? -31.790 70.203 -22.853 1.00 95.58 ? 40 LYS C CD 1 ATOM 2855 C CE . LYS B 1 45 ? -32.993 70.130 -21.911 1.00 104.42 ? 40 LYS C CE 1 ATOM 2856 N NZ . LYS B 1 45 ? -33.185 71.400 -21.162 1.00 110.40 ? 40 LYS C NZ 1 ATOM 2857 N N . LEU B 1 46 ? -30.105 67.888 -27.683 1.00 55.92 ? 41 LEU C N 1 ATOM 2858 C CA . LEU B 1 46 ? -29.370 68.143 -28.931 1.00 51.73 ? 41 LEU C CA 1 ATOM 2859 C C . LEU B 1 46 ? -29.010 69.595 -29.086 1.00 50.38 ? 41 LEU C C 1 ATOM 2860 O O . LEU B 1 46 ? -29.880 70.478 -29.063 1.00 53.88 ? 41 LEU C O 1 ATOM 2861 C CB . LEU B 1 46 ? -30.186 67.822 -30.184 1.00 53.52 ? 41 LEU C CB 1 ATOM 2862 C CG . LEU B 1 46 ? -30.648 66.418 -30.491 1.00 55.26 ? 41 LEU C CG 1 ATOM 2863 C CD1 . LEU B 1 46 ? -31.358 66.427 -31.832 1.00 57.78 ? 41 LEU C CD1 1 ATOM 2864 C CD2 . LEU B 1 46 ? -29.496 65.427 -30.503 1.00 57.22 ? 41 LEU C CD2 1 ATOM 2865 N N . CYS B 1 47 ? -27.741 69.834 -29.295 1.00 46.87 ? 42 CYS C N 1 ATOM 2866 C CA . CYS B 1 47 ? -27.196 71.155 -29.207 1.00 54.22 ? 42 CYS C CA 1 ATOM 2867 C C . CYS B 1 47 ? -26.490 71.576 -30.443 1.00 54.82 ? 42 CYS C C 1 ATOM 2868 O O . CYS B 1 47 ? -26.119 70.754 -31.264 1.00 55.88 ? 42 CYS C O 1 ATOM 2869 C CB . CYS B 1 47 ? -26.178 71.204 -28.060 1.00 53.81 ? 42 CYS C CB 1 ATOM 2870 S SG . CYS B 1 47 ? -26.823 70.744 -26.448 1.00 55.20 ? 42 CYS C SG 1 ATOM 2871 N N . ASP B 1 48 ? -26.252 72.877 -30.515 1.00 55.25 ? 43 ASP C N 1 ATOM 2872 C CA . ASP B 1 48 ? -25.322 73.423 -31.467 1.00 56.89 ? 43 ASP C CA 1 ATOM 2873 C C . ASP B 1 48 ? -23.962 72.805 -31.188 1.00 53.59 ? 43 ASP C C 1 ATOM 2874 O O . ASP B 1 48 ? -23.628 72.428 -30.075 1.00 51.43 ? 43 ASP C O 1 ATOM 2875 C CB . ASP B 1 48 ? -25.157 74.962 -31.325 1.00 59.81 ? 43 ASP C CB 1 ATOM 2876 C CG . ASP B 1 48 ? -26.449 75.743 -31.521 1.00 60.32 ? 43 ASP C CG 1 ATOM 2877 O OD1 . ASP B 1 48 ? -27.474 75.151 -31.888 1.00 64.27 ? 43 ASP C OD1 1 ATOM 2878 O OD2 . ASP B 1 48 ? -26.432 76.978 -31.310 1.00 68.24 ? 43 ASP C OD2 1 ATOM 2879 N N . LEU B 1 49 ? -23.138 72.797 -32.202 1.00 55.20 ? 44 LEU C N 1 ATOM 2880 C CA . LEU B 1 49 ? -21.824 72.268 -32.084 1.00 55.10 ? 44 LEU C CA 1 ATOM 2881 C C . LEU B 1 49 ? -20.913 73.432 -32.353 1.00 52.50 ? 44 LEU C C 1 ATOM 2882 O O . LEU B 1 49 ? -20.855 73.881 -33.485 1.00 49.46 ? 44 LEU C O 1 ATOM 2883 C CB . LEU B 1 49 ? -21.614 71.188 -33.159 1.00 56.45 ? 44 LEU C CB 1 ATOM 2884 C CG . LEU B 1 49 ? -21.083 69.799 -32.846 1.00 56.54 ? 44 LEU C CG 1 ATOM 2885 C CD1 . LEU B 1 49 ? -20.443 69.257 -34.116 1.00 54.39 ? 44 LEU C CD1 1 ATOM 2886 C CD2 . LEU B 1 49 ? -20.124 69.755 -31.664 1.00 53.82 ? 44 LEU C CD2 1 ATOM 2887 N N . ASN B 1 50 ? -20.161 73.880 -31.350 1.00 52.97 ? 45 ASN C N 1 ATOM 2888 C CA . ASN B 1 50 ? -19.256 75.036 -31.515 1.00 60.74 ? 45 ASN C CA 1 ATOM 2889 C C . ASN B 1 50 ? -19.960 76.251 -32.130 1.00 61.47 ? 45 ASN C C 1 ATOM 2890 O O . ASN B 1 50 ? -19.488 76.866 -33.092 1.00 56.32 ? 45 ASN C O 1 ATOM 2891 C CB . ASN B 1 50 ? -18.019 74.672 -32.326 1.00 62.38 ? 45 ASN C CB 1 ATOM 2892 C CG . ASN B 1 50 ? -17.261 73.498 -31.726 1.00 74.68 ? 45 ASN C CG 1 ATOM 2893 O OD1 . ASN B 1 50 ? -16.895 73.491 -30.546 1.00 78.60 ? 45 ASN C OD1 1 ATOM 2894 N ND2 . ASN B 1 50 ? -17.038 72.484 -32.540 1.00 83.57 ? 45 ASN C ND2 1 ATOM 2895 N N . GLY B 1 51 ? -21.127 76.559 -31.590 1.00 58.37 ? 46 GLY C N 1 ATOM 2896 C CA . GLY B 1 51 ? -21.856 77.700 -32.049 1.00 59.99 ? 46 GLY C CA 1 ATOM 2897 C C . GLY B 1 51 ? -22.743 77.516 -33.253 1.00 61.86 ? 46 GLY C C 1 ATOM 2898 O O . GLY B 1 51 ? -23.511 78.422 -33.555 1.00 65.68 ? 46 GLY C O 1 ATOM 2899 N N . VAL B 1 52 ? -22.660 76.403 -33.982 1.00 63.14 ? 47 VAL C N 1 ATOM 2900 C CA . VAL B 1 52 ? -23.597 76.242 -35.122 1.00 61.56 ? 47 VAL C CA 1 ATOM 2901 C C . VAL B 1 52 ? -24.620 75.118 -34.984 1.00 60.03 ? 47 VAL C C 1 ATOM 2902 O O . VAL B 1 52 ? -24.337 73.990 -34.576 1.00 56.94 ? 47 VAL C O 1 ATOM 2903 C CB . VAL B 1 52 ? -22.958 76.397 -36.550 1.00 62.12 ? 47 VAL C CB 1 ATOM 2904 C CG1 . VAL B 1 52 ? -21.453 76.609 -36.534 1.00 60.83 ? 47 VAL C CG1 1 ATOM 2905 C CG2 . VAL B 1 52 ? -23.406 75.328 -37.510 1.00 58.86 ? 47 VAL C CG2 1 ATOM 2906 N N . LYS B 1 53 ? -25.844 75.491 -35.296 1.00 59.07 ? 48 LYS C N 1 ATOM 2907 C CA . LYS B 1 53 ? -27.005 74.652 -35.071 1.00 68.08 ? 48 LYS C CA 1 ATOM 2908 C C . LYS B 1 53 ? -27.040 73.438 -36.007 1.00 62.22 ? 48 LYS C C 1 ATOM 2909 O O . LYS B 1 53 ? -26.582 73.529 -37.136 1.00 57.47 ? 48 LYS C O 1 ATOM 2910 C CB . LYS B 1 53 ? -28.264 75.517 -35.276 1.00 78.52 ? 48 LYS C CB 1 ATOM 2911 C CG . LYS B 1 53 ? -29.551 74.892 -34.770 1.00 87.55 ? 48 LYS C CG 1 ATOM 2912 C CD . LYS B 1 53 ? -30.762 75.797 -35.014 1.00 94.42 ? 48 LYS C CD 1 ATOM 2913 C CE . LYS B 1 53 ? -32.023 75.006 -35.397 1.00 101.69 ? 48 LYS C CE 1 ATOM 2914 N NZ . LYS B 1 53 ? -33.212 75.251 -34.526 1.00 99.55 ? 48 LYS C NZ 1 ATOM 2915 N N . PRO B 1 54 ? -27.596 72.301 -35.546 1.00 57.84 ? 49 PRO C N 1 ATOM 2916 C CA . PRO B 1 54 ? -27.797 71.205 -36.473 1.00 56.30 ? 49 PRO C CA 1 ATOM 2917 C C . PRO B 1 54 ? -28.996 71.441 -37.371 1.00 54.32 ? 49 PRO C C 1 ATOM 2918 O O . PRO B 1 54 ? -29.827 72.285 -37.088 1.00 58.97 ? 49 PRO C O 1 ATOM 2919 C CB . PRO B 1 54 ? -28.074 70.012 -35.567 1.00 57.45 ? 49 PRO C CB 1 ATOM 2920 C CG . PRO B 1 54 ? -28.599 70.607 -34.320 1.00 58.28 ? 49 PRO C CG 1 ATOM 2921 C CD . PRO B 1 54 ? -27.904 71.912 -34.168 1.00 56.83 ? 49 PRO C CD 1 ATOM 2922 N N . LEU B 1 55 ? -29.055 70.684 -38.458 1.00 52.27 ? 50 LEU C N 1 ATOM 2923 C CA . LEU B 1 55 ? -30.235 70.588 -39.300 1.00 48.58 ? 50 LEU C CA 1 ATOM 2924 C C . LEU B 1 55 ? -31.051 69.427 -38.766 1.00 47.34 ? 50 LEU C C 1 ATOM 2925 O O . LEU B 1 55 ? -30.611 68.280 -38.832 1.00 43.80 ? 50 LEU C O 1 ATOM 2926 C CB . LEU B 1 55 ? -29.844 70.312 -40.746 1.00 48.47 ? 50 LEU C CB 1 ATOM 2927 C CG . LEU B 1 55 ? -30.994 70.115 -41.734 1.00 47.53 ? 50 LEU C CG 1 ATOM 2928 C CD1 . LEU B 1 55 ? -31.872 71.342 -41.744 1.00 49.87 ? 50 LEU C CD1 1 ATOM 2929 C CD2 . LEU B 1 55 ? -30.433 69.878 -43.129 1.00 52.52 ? 50 LEU C CD2 1 ATOM 2930 N N . ILE B 1 56 ? -32.217 69.726 -38.207 1.00 47.31 ? 51 ILE C N 1 ATOM 2931 C CA . ILE B 1 56 ? -33.030 68.709 -37.590 1.00 48.29 ? 51 ILE C CA 1 ATOM 2932 C C . ILE B 1 56 ? -34.205 68.452 -38.498 1.00 48.15 ? 51 ILE C C 1 ATOM 2933 O O . ILE B 1 56 ? -35.072 69.299 -38.655 1.00 53.11 ? 51 ILE C O 1 ATOM 2934 C CB . ILE B 1 56 ? -33.498 69.143 -36.202 1.00 52.74 ? 51 ILE C CB 1 ATOM 2935 C CG1 . ILE B 1 56 ? -32.271 69.332 -35.308 1.00 54.67 ? 51 ILE C CG1 1 ATOM 2936 C CG2 . ILE B 1 56 ? -34.413 68.082 -35.582 1.00 55.21 ? 51 ILE C CG2 1 ATOM 2937 C CD1 . ILE B 1 56 ? -32.596 69.710 -33.898 1.00 54.20 ? 51 ILE C CD1 1 ATOM 2938 N N . LEU B 1 57 ? -34.243 67.261 -39.067 1.00 48.72 ? 52 LEU C N 1 ATOM 2939 C CA . LEU B 1 57 ? -35.172 66.994 -40.160 1.00 52.37 ? 52 LEU C CA 1 ATOM 2940 C C . LEU B 1 57 ? -36.549 66.497 -39.763 1.00 55.69 ? 52 LEU C C 1 ATOM 2941 O O . LEU B 1 57 ? -37.484 66.558 -40.573 1.00 56.73 ? 52 LEU C O 1 ATOM 2942 C CB . LEU B 1 57 ? -34.541 66.059 -41.189 1.00 47.39 ? 52 LEU C CB 1 ATOM 2943 C CG . LEU B 1 57 ? -33.499 66.762 -42.037 1.00 44.87 ? 52 LEU C CG 1 ATOM 2944 C CD1 . LEU B 1 57 ? -32.896 65.771 -43.012 1.00 42.70 ? 52 LEU C CD1 1 ATOM 2945 C CD2 . LEU B 1 57 ? -34.092 67.937 -42.796 1.00 49.05 ? 52 LEU C CD2 1 ATOM 2946 N N . LYS B 1 58 ? -36.667 65.989 -38.545 1.00 52.50 ? 53 LYS C N 1 ATOM 2947 C CA . LYS B 1 58 ? -37.974 65.605 -38.019 1.00 60.11 ? 53 LYS C CA 1 ATOM 2948 C C . LYS B 1 58 ? -38.560 64.383 -38.779 1.00 61.69 ? 53 LYS C C 1 ATOM 2949 O O . LYS B 1 58 ? -37.942 63.317 -38.776 1.00 58.03 ? 53 LYS C O 1 ATOM 2950 C CB . LYS B 1 58 ? -38.939 66.789 -38.007 1.00 68.84 ? 53 LYS C CB 1 ATOM 2951 C CG . LYS B 1 58 ? -38.386 68.045 -37.358 1.00 85.43 ? 53 LYS C CG 1 ATOM 2952 C CD . LYS B 1 58 ? -39.394 68.772 -36.463 1.00 97.57 ? 53 LYS C CD 1 ATOM 2953 C CE . LYS B 1 58 ? -40.262 69.749 -37.247 1.00 111.04 ? 53 LYS C CE 1 ATOM 2954 N NZ . LYS B 1 58 ? -41.609 69.913 -36.623 1.00 118.42 ? 53 LYS C NZ 1 ATOM 2955 N N . ASP B 1 59 ? -39.716 64.533 -39.431 1.00 56.79 ? 54 ASP C N 1 ATOM 2956 C CA . ASP B 1 59 ? -40.368 63.421 -40.092 1.00 58.06 ? 54 ASP C CA 1 ATOM 2957 C C . ASP B 1 59 ? -39.931 63.246 -41.547 1.00 53.42 ? 54 ASP C C 1 ATOM 2958 O O . ASP B 1 59 ? -40.515 62.439 -42.280 1.00 49.99 ? 54 ASP C O 1 ATOM 2959 C CB . ASP B 1 59 ? -41.898 63.551 -40.008 1.00 68.40 ? 54 ASP C CB 1 ATOM 2960 C CG . ASP B 1 59 ? -42.420 64.940 -40.452 1.00 78.08 ? 54 ASP C CG 1 ATOM 2961 O OD1 . ASP B 1 59 ? -41.621 65.803 -40.856 1.00 83.30 ? 54 ASP C OD1 1 ATOM 2962 O OD2 . ASP B 1 59 ? -43.650 65.177 -40.374 1.00 96.21 ? 54 ASP C OD2 1 ATOM 2963 N N . CYS B 1 60 ? -38.915 63.978 -41.970 1.00 49.07 ? 55 CYS C N 1 ATOM 2964 C CA . CYS B 1 60 ? -38.403 63.809 -43.316 1.00 54.84 ? 55 CYS C CA 1 ATOM 2965 C C . CYS B 1 60 ? -37.015 63.188 -43.342 1.00 50.21 ? 55 CYS C C 1 ATOM 2966 O O . CYS B 1 60 ? -36.177 63.454 -42.490 1.00 43.79 ? 55 CYS C O 1 ATOM 2967 C CB . CYS B 1 60 ? -38.381 65.151 -44.078 1.00 60.36 ? 55 CYS C CB 1 ATOM 2968 S SG . CYS B 1 60 ? -40.060 65.790 -44.254 1.00 78.89 ? 55 CYS C SG 1 ATOM 2969 N N . SER B 1 61 ? -36.782 62.412 -44.394 1.00 47.58 ? 56 SER C N 1 ATOM 2970 C CA . SER B 1 61 ? -35.451 61.975 -44.757 1.00 45.60 ? 56 SER C CA 1 ATOM 2971 C C . SER B 1 61 ? -34.740 63.084 -45.533 1.00 43.50 ? 56 SER C C 1 ATOM 2972 O O . SER B 1 61 ? -35.371 64.042 -46.003 1.00 37.64 ? 56 SER C O 1 ATOM 2973 C CB . SER B 1 61 ? -35.538 60.750 -45.625 1.00 42.13 ? 56 SER C CB 1 ATOM 2974 O OG . SER B 1 61 ? -35.982 61.147 -46.885 1.00 44.63 ? 56 SER C OG 1 ATOM 2975 N N . VAL B 1 62 ? -33.415 62.983 -45.624 1.00 40.17 ? 57 VAL C N 1 ATOM 2976 C CA . VAL B 1 62 ? -32.626 63.970 -46.403 1.00 39.59 ? 57 VAL C CA 1 ATOM 2977 C C . VAL B 1 62 ? -33.150 63.984 -47.842 1.00 41.08 ? 57 VAL C C 1 ATOM 2978 O O . VAL B 1 62 ? -33.293 65.028 -48.435 1.00 41.72 ? 57 VAL C O 1 ATOM 2979 C CB . VAL B 1 62 ? -31.122 63.631 -46.401 1.00 35.74 ? 57 VAL C CB 1 ATOM 2980 C CG1 . VAL B 1 62 ? -30.334 64.480 -47.384 1.00 34.81 ? 57 VAL C CG1 1 ATOM 2981 C CG2 . VAL B 1 62 ? -30.549 63.825 -44.999 1.00 37.74 ? 57 VAL C CG2 1 ATOM 2982 N N . ALA B 1 63 ? -33.483 62.823 -48.375 1.00 39.27 ? 58 ALA C N 1 ATOM 2983 C CA . ALA B 1 63 ? -34.028 62.790 -49.725 1.00 37.96 ? 58 ALA C CA 1 ATOM 2984 C C . ALA B 1 63 ? -35.364 63.554 -49.876 1.00 36.65 ? 58 ALA C C 1 ATOM 2985 O O . ALA B 1 63 ? -35.568 64.282 -50.844 1.00 38.91 ? 58 ALA C O 1 ATOM 2986 C CB . ALA B 1 63 ? -34.168 61.349 -50.185 1.00 33.17 ? 58 ALA C CB 1 ATOM 2987 N N . GLY B 1 64 ? -36.271 63.373 -48.921 1.00 39.84 ? 59 GLY C N 1 ATOM 2988 C CA . GLY B 1 64 ? -37.619 63.989 -48.990 1.00 42.47 ? 59 GLY C CA 1 ATOM 2989 C C . GLY B 1 64 ? -37.508 65.488 -48.856 1.00 43.12 ? 59 GLY C C 1 ATOM 2990 O O . GLY B 1 64 ? -38.143 66.241 -49.573 1.00 41.21 ? 59 GLY C O 1 ATOM 2991 N N . TRP B 1 65 ? -36.654 65.909 -47.942 1.00 44.78 ? 60 TRP C N 1 ATOM 2992 C CA . TRP B 1 65 ? -36.349 67.323 -47.748 1.00 44.73 ? 60 TRP C CA 1 ATOM 2993 C C . TRP B 1 65 ? -35.755 67.941 -49.013 1.00 44.32 ? 60 TRP C C 1 ATOM 2994 O O . TRP B 1 65 ? -36.222 68.951 -49.493 1.00 47.01 ? 60 TRP C O 1 ATOM 2995 C CB . TRP B 1 65 ? -35.422 67.452 -46.549 1.00 45.56 ? 60 TRP C CB 1 ATOM 2996 C CG . TRP B 1 65 ? -34.836 68.699 -46.414 1.00 50.80 ? 60 TRP C CG 1 ATOM 2997 C CD1 . TRP B 1 65 ? -35.467 69.863 -46.096 1.00 54.46 ? 60 TRP C CD1 1 ATOM 2998 C CD2 . TRP B 1 65 ? -33.435 69.008 -46.559 1.00 50.16 ? 60 TRP C CD2 1 ATOM 2999 N NE1 . TRP B 1 65 ? -34.538 70.886 -46.046 1.00 59.17 ? 60 TRP C NE1 1 ATOM 3000 C CE2 . TRP B 1 65 ? -33.291 70.392 -46.327 1.00 54.59 ? 60 TRP C CE2 1 ATOM 3001 C CE3 . TRP B 1 65 ? -32.299 68.259 -46.857 1.00 51.10 ? 60 TRP C CE3 1 ATOM 3002 C CZ2 . TRP B 1 65 ? -32.058 71.040 -46.390 1.00 53.36 ? 60 TRP C CZ2 1 ATOM 3003 C CZ3 . TRP B 1 65 ? -31.051 68.909 -46.922 1.00 50.71 ? 60 TRP C CZ3 1 ATOM 3004 C CH2 . TRP B 1 65 ? -30.949 70.277 -46.692 1.00 52.29 ? 60 TRP C CH2 1 ATOM 3005 N N . LEU B 1 66 ? -34.753 67.296 -49.580 1.00 44.44 ? 61 LEU C N 1 ATOM 3006 C CA . LEU B 1 66 ? -34.031 67.846 -50.727 1.00 43.12 ? 61 LEU C CA 1 ATOM 3007 C C . LEU B 1 66 ? -34.922 67.939 -51.937 1.00 42.85 ? 61 LEU C C 1 ATOM 3008 O O . LEU B 1 66 ? -34.915 68.950 -52.631 1.00 41.99 ? 61 LEU C O 1 ATOM 3009 C CB . LEU B 1 66 ? -32.844 66.961 -51.120 1.00 42.70 ? 61 LEU C CB 1 ATOM 3010 C CG . LEU B 1 66 ? -31.438 67.152 -50.592 1.00 42.55 ? 61 LEU C CG 1 ATOM 3011 C CD1 . LEU B 1 66 ? -30.529 66.221 -51.388 1.00 42.56 ? 61 LEU C CD1 1 ATOM 3012 C CD2 . LEU B 1 66 ? -30.987 68.586 -50.760 1.00 43.43 ? 61 LEU C CD2 1 ATOM 3013 N N . LEU B 1 67 ? -35.641 66.854 -52.228 1.00 39.53 ? 62 LEU C N 1 ATOM 3014 C CA . LEU B 1 67 ? -36.507 66.837 -53.400 1.00 39.13 ? 62 LEU C CA 1 ATOM 3015 C C . LEU B 1 67 ? -37.799 67.666 -53.215 1.00 39.73 ? 62 LEU C C 1 ATOM 3016 O O . LEU B 1 67 ? -38.482 67.992 -54.192 1.00 35.69 ? 62 LEU C O 1 ATOM 3017 C CB . LEU B 1 67 ? -36.865 65.420 -53.795 1.00 40.04 ? 62 LEU C CB 1 ATOM 3018 C CG . LEU B 1 67 ? -35.659 64.646 -54.374 1.00 45.37 ? 62 LEU C CG 1 ATOM 3019 C CD1 . LEU B 1 67 ? -35.905 63.143 -54.360 1.00 41.30 ? 62 LEU C CD1 1 ATOM 3020 C CD2 . LEU B 1 67 ? -35.337 65.133 -55.787 1.00 49.72 ? 62 LEU C CD2 1 ATOM 3021 N N . GLY B 1 68 ? -38.125 67.974 -51.971 1.00 36.53 ? 63 GLY C N 1 ATOM 3022 C CA . GLY B 1 68 ? -39.378 68.626 -51.648 1.00 37.40 ? 63 GLY C CA 1 ATOM 3023 C C . GLY B 1 68 ? -40.640 67.780 -51.659 1.00 38.22 ? 63 GLY C C 1 ATOM 3024 O O . GLY B 1 68 ? -41.684 68.218 -52.135 1.00 41.42 ? 63 GLY C O 1 ATOM 3025 N N . ASN B 1 69 ? -40.561 66.576 -51.109 1.00 41.34 ? 64 ASN C N 1 ATOM 3026 C CA . ASN B 1 69 ? -41.749 65.784 -50.751 1.00 44.53 ? 64 ASN C CA 1 ATOM 3027 C C . ASN B 1 69 ? -42.810 66.714 -50.134 1.00 47.52 ? 64 ASN C C 1 ATOM 3028 O O . ASN B 1 69 ? -42.508 67.429 -49.169 1.00 44.19 ? 64 ASN C O 1 ATOM 3029 C CB . ASN B 1 69 ? -41.356 64.682 -49.744 1.00 46.69 ? 64 ASN C CB 1 ATOM 3030 C CG . ASN B 1 69 ? -42.516 63.755 -49.385 1.00 47.53 ? 64 ASN C CG 1 ATOM 3031 O OD1 . ASN B 1 69 ? -43.648 64.196 -49.267 1.00 51.04 ? 64 ASN C OD1 1 ATOM 3032 N ND2 . ASN B 1 69 ? -42.223 62.474 -49.175 1.00 49.31 ? 64 ASN C ND2 1 ATOM 3033 N N . PRO B 1 70 ? -44.043 66.703 -50.664 1.00 48.36 ? 65 PRO C N 1 ATOM 3034 C CA . PRO B 1 70 ? -44.945 67.761 -50.198 1.00 51.03 ? 65 PRO C CA 1 ATOM 3035 C C . PRO B 1 70 ? -45.365 67.620 -48.745 1.00 53.88 ? 65 PRO C C 1 ATOM 3036 O O . PRO B 1 70 ? -45.819 68.577 -48.165 1.00 62.44 ? 65 PRO C O 1 ATOM 3037 C CB . PRO B 1 70 ? -46.149 67.680 -51.149 1.00 52.06 ? 65 PRO C CB 1 ATOM 3038 C CG . PRO B 1 70 ? -46.015 66.397 -51.877 1.00 49.46 ? 65 PRO C CG 1 ATOM 3039 C CD . PRO B 1 70 ? -44.576 65.971 -51.820 1.00 47.75 ? 65 PRO C CD 1 ATOM 3040 N N . MET B 1 71 ? -45.152 66.476 -48.113 1.00 59.68 ? 66 MET C N 1 ATOM 3041 C CA . MET B 1 71 ? -45.296 66.439 -46.640 1.00 64.27 ? 66 MET C CA 1 ATOM 3042 C C . MET B 1 71 ? -44.100 67.068 -45.874 1.00 64.63 ? 66 MET C C 1 ATOM 3043 O O . MET B 1 71 ? -44.034 67.006 -44.677 1.00 64.24 ? 66 MET C O 1 ATOM 3044 C CB . MET B 1 71 ? -45.581 65.014 -46.150 1.00 68.23 ? 66 MET C CB 1 ATOM 3045 C CG . MET B 1 71 ? -46.903 64.901 -45.385 1.00 81.45 ? 66 MET C CG 1 ATOM 3046 S SD . MET B 1 71 ? -48.380 64.980 -46.424 1.00 87.74 ? 66 MET C SD 1 ATOM 3047 C CE . MET B 1 71 ? -48.658 63.227 -46.663 1.00 87.97 ? 66 MET C CE 1 ATOM 3048 N N . CYS B 1 72 ? -43.136 67.640 -46.570 1.00 69.10 ? 67 CYS C N 1 ATOM 3049 C CA . CYS B 1 72 ? -41.979 68.288 -45.939 1.00 80.83 ? 67 CYS C CA 1 ATOM 3050 C C . CYS B 1 72 ? -41.922 69.833 -46.253 1.00 86.78 ? 67 CYS C C 1 ATOM 3051 O O . CYS B 1 72 ? -40.989 70.526 -45.848 1.00 76.73 ? 67 CYS C O 1 ATOM 3052 C CB . CYS B 1 72 ? -40.667 67.639 -46.469 1.00 78.23 ? 67 CYS C CB 1 ATOM 3053 S SG . CYS B 1 72 ? -40.393 65.853 -46.256 1.00 69.95 ? 67 CYS C SG 1 ATOM 3054 N N . ASP B 1 73 ? -42.916 70.372 -46.962 1.00 110.36 ? 68 ASP C N 1 ATOM 3055 C CA . ASP B 1 73 ? -42.878 71.780 -47.550 1.00 130.01 ? 68 ASP C CA 1 ATOM 3056 C C . ASP B 1 73 ? -42.004 72.824 -46.791 1.00 140.09 ? 68 ASP C C 1 ATOM 3057 O O . ASP B 1 73 ? -41.456 73.806 -47.384 1.00 125.29 ? 68 ASP C O 1 ATOM 3058 C CB . ASP B 1 73 ? -44.298 72.416 -47.600 1.00 118.86 ? 68 ASP C CB 1 ATOM 3059 C CG . ASP B 1 73 ? -45.336 71.608 -48.405 1.00 113.99 ? 68 ASP C CG 1 ATOM 3060 O OD1 . ASP B 1 73 ? -45.289 71.562 -49.665 1.00 86.94 ? 68 ASP C OD1 1 ATOM 3061 O OD2 . ASP B 1 73 ? -46.264 71.068 -47.735 1.00 109.75 ? 68 ASP C OD2 1 ATOM 3062 N N . GLU B 1 74 ? -41.811 72.511 -45.504 1.00 150.06 ? 69 GLU C N 1 ATOM 3063 C CA . GLU B 1 74 ? -41.926 73.437 -44.357 1.00 154.43 ? 69 GLU C CA 1 ATOM 3064 C C . GLU B 1 74 ? -40.846 74.482 -44.463 1.00 161.02 ? 69 GLU C C 1 ATOM 3065 O O . GLU B 1 74 ? -40.532 75.175 -43.471 1.00 150.16 ? 69 GLU C O 1 ATOM 3066 C CB . GLU B 1 74 ? -41.786 72.654 -43.016 1.00 151.07 ? 69 GLU C CB 1 ATOM 3067 C CG . GLU B 1 74 ? -42.243 71.175 -43.113 1.00 138.43 ? 69 GLU C CG 1 ATOM 3068 C CD . GLU B 1 74 ? -42.665 70.475 -41.826 1.00 127.15 ? 69 GLU C CD 1 ATOM 3069 O OE1 . GLU B 1 74 ? -42.329 70.941 -40.719 1.00 125.70 ? 69 GLU C OE1 1 ATOM 3070 O OE2 . GLU B 1 74 ? -43.320 69.408 -41.942 1.00 108.75 ? 69 GLU C OE2 1 ATOM 3071 N N . PHE B 1 75 ? -40.330 74.607 -45.696 1.00 169.36 ? 70 PHE C N 1 ATOM 3072 C CA . PHE B 1 75 ? -38.953 75.035 -45.950 1.00 169.34 ? 70 PHE C CA 1 ATOM 3073 C C . PHE B 1 75 ? -38.606 76.362 -45.294 1.00 168.26 ? 70 PHE C C 1 ATOM 3074 O O . PHE B 1 75 ? -38.569 77.407 -45.947 1.00 149.19 ? 70 PHE C O 1 ATOM 3075 C CB . PHE B 1 75 ? -38.580 75.075 -47.445 1.00 165.01 ? 70 PHE C CB 1 ATOM 3076 C CG . PHE B 1 75 ? -37.083 75.151 -47.662 1.00 173.17 ? 70 PHE C CG 1 ATOM 3077 C CD1 . PHE B 1 75 ? -36.305 73.992 -47.600 1.00 159.55 ? 70 PHE C CD1 1 ATOM 3078 C CD2 . PHE B 1 75 ? -36.434 76.377 -47.850 1.00 175.37 ? 70 PHE C CD2 1 ATOM 3079 C CE1 . PHE B 1 75 ? -34.925 74.043 -47.765 1.00 144.74 ? 70 PHE C CE1 1 ATOM 3080 C CE2 . PHE B 1 75 ? -35.052 76.425 -48.009 1.00 167.13 ? 70 PHE C CE2 1 ATOM 3081 C CZ . PHE B 1 75 ? -34.299 75.261 -47.967 1.00 147.85 ? 70 PHE C CZ 1 ATOM 3082 N N . ILE B 1 76 ? -38.382 76.292 -43.983 1.00 175.77 ? 71 ILE C N 1 ATOM 3083 C CA . ILE B 1 76 ? -37.616 77.300 -43.271 1.00 172.00 ? 71 ILE C CA 1 ATOM 3084 C C . ILE B 1 76 ? -36.154 77.022 -43.682 1.00 154.23 ? 71 ILE C C 1 ATOM 3085 O O . ILE B 1 76 ? -35.768 75.874 -43.904 1.00 149.93 ? 71 ILE C O 1 ATOM 3086 C CB . ILE B 1 76 ? -37.827 77.212 -41.721 1.00 164.58 ? 71 ILE C CB 1 ATOM 3087 C CG1 . ILE B 1 76 ? -39.279 77.596 -41.320 1.00 161.02 ? 71 ILE C CG1 1 ATOM 3088 C CG2 . ILE B 1 76 ? -36.763 78.018 -40.968 1.00 154.32 ? 71 ILE C CG2 1 ATOM 3089 C CD1 . ILE B 1 76 ? -39.762 78.973 -41.759 1.00 155.95 ? 71 ILE C CD1 1 ATOM 3090 N N . ARG B 1 77 ? -35.372 78.082 -43.841 1.00 133.84 ? 72 ARG C N 1 ATOM 3091 C CA . ARG B 1 77 ? -33.935 77.967 -44.043 1.00 112.02 ? 72 ARG C CA 1 ATOM 3092 C C . ARG B 1 77 ? -33.213 77.815 -42.699 1.00 97.10 ? 72 ARG C C 1 ATOM 3093 O O . ARG B 1 77 ? -33.505 78.534 -41.735 1.00 89.74 ? 72 ARG C O 1 ATOM 3094 C CB . ARG B 1 77 ? -33.379 79.234 -44.700 1.00 121.61 ? 72 ARG C CB 1 ATOM 3095 C CG . ARG B 1 77 ? -34.202 79.868 -45.824 1.00 134.07 ? 72 ARG C CG 1 ATOM 3096 C CD . ARG B 1 77 ? -34.406 81.354 -45.546 1.00 142.13 ? 72 ARG C CD 1 ATOM 3097 N NE . ARG B 1 77 ? -35.387 82.004 -46.411 1.00 136.47 ? 72 ARG C NE 1 ATOM 3098 C CZ . ARG B 1 77 ? -35.419 83.313 -46.654 1.00 131.25 ? 72 ARG C CZ 1 ATOM 3099 N NH1 . ARG B 1 77 ? -34.503 84.133 -46.135 1.00 121.49 ? 72 ARG C NH1 1 ATOM 3100 N NH2 . ARG B 1 77 ? -36.364 83.804 -47.440 1.00 135.26 ? 72 ARG C NH2 1 ATOM 3101 N N . VAL B 1 78 ? -32.325 76.829 -42.627 1.00 94.65 ? 73 VAL C N 1 ATOM 3102 C CA . VAL B 1 78 ? -31.068 76.980 -41.918 1.00 92.70 ? 73 VAL C CA 1 ATOM 3103 C C . VAL B 1 78 ? -30.114 77.196 -43.099 1.00 82.12 ? 73 VAL C C 1 ATOM 3104 O O . VAL B 1 78 ? -30.056 76.361 -43.999 1.00 83.51 ? 73 VAL C O 1 ATOM 3105 C CB . VAL B 1 78 ? -30.677 75.728 -41.092 1.00 89.43 ? 73 VAL C CB 1 ATOM 3106 N N . PRO B 1 79 ? -29.446 78.354 -43.174 1.00 76.38 ? 74 PRO C N 1 ATOM 3107 C CA . PRO B 1 79 ? -28.484 78.551 -44.273 1.00 66.83 ? 74 PRO C CA 1 ATOM 3108 C C . PRO B 1 79 ? -27.115 77.901 -44.011 1.00 59.06 ? 74 PRO C C 1 ATOM 3109 O O . PRO B 1 79 ? -26.288 77.823 -44.918 1.00 56.64 ? 74 PRO C O 1 ATOM 3110 C CB . PRO B 1 79 ? -28.343 80.072 -44.348 1.00 69.29 ? 74 PRO C CB 1 ATOM 3111 C CG . PRO B 1 79 ? -28.635 80.535 -42.959 1.00 74.00 ? 74 PRO C CG 1 ATOM 3112 C CD . PRO B 1 79 ? -29.657 79.586 -42.392 1.00 75.29 ? 74 PRO C CD 1 ATOM 3113 N N . GLU B 1 80 ? -26.878 77.472 -42.782 1.00 54.36 ? 75 GLU C N 1 ATOM 3114 C CA . GLU B 1 80 ? -25.700 76.673 -42.466 1.00 57.13 ? 75 GLU C CA 1 ATOM 3115 C C . GLU B 1 80 ? -26.014 75.738 -41.313 1.00 51.32 ? 75 GLU C C 1 ATOM 3116 O O . GLU B 1 80 ? -26.930 75.998 -40.542 1.00 54.44 ? 75 GLU C O 1 ATOM 3117 C CB . GLU B 1 80 ? -24.484 77.557 -42.136 1.00 59.49 ? 75 GLU C CB 1 ATOM 3118 C CG . GLU B 1 80 ? -24.533 78.303 -40.806 1.00 67.62 ? 75 GLU C CG 1 ATOM 3119 C CD . GLU B 1 80 ? -23.172 78.817 -40.322 1.00 75.84 ? 75 GLU C CD 1 ATOM 3120 O OE1 . GLU B 1 80 ? -23.191 79.777 -39.502 1.00 77.16 ? 75 GLU C OE1 1 ATOM 3121 O OE2 . GLU B 1 80 ? -22.091 78.258 -40.709 1.00 81.64 ? 75 GLU C OE2 1 ATOM 3122 N N . TRP B 1 81 ? -25.255 74.657 -41.195 1.00 47.06 ? 76 TRP C N 1 ATOM 3123 C CA . TRP B 1 81 ? -25.434 73.698 -40.101 1.00 43.32 ? 76 TRP C CA 1 ATOM 3124 C C . TRP B 1 81 ? -24.188 72.896 -39.885 1.00 45.61 ? 76 TRP C C 1 ATOM 3125 O O . TRP B 1 81 ? -23.330 72.813 -40.776 1.00 46.38 ? 76 TRP C O 1 ATOM 3126 C CB . TRP B 1 81 ? -26.633 72.774 -40.327 1.00 42.52 ? 76 TRP C CB 1 ATOM 3127 C CG . TRP B 1 81 ? -26.569 71.920 -41.555 1.00 46.83 ? 76 TRP C CG 1 ATOM 3128 C CD1 . TRP B 1 81 ? -26.002 70.701 -41.667 1.00 46.59 ? 76 TRP C CD1 1 ATOM 3129 C CD2 . TRP B 1 81 ? -27.137 72.219 -42.836 1.00 43.70 ? 76 TRP C CD2 1 ATOM 3130 N NE1 . TRP B 1 81 ? -26.161 70.228 -42.942 1.00 46.09 ? 76 TRP C NE1 1 ATOM 3131 C CE2 . TRP B 1 81 ? -26.861 71.145 -43.675 1.00 45.89 ? 76 TRP C CE2 1 ATOM 3132 C CE3 . TRP B 1 81 ? -27.822 73.299 -43.345 1.00 44.58 ? 76 TRP C CE3 1 ATOM 3133 C CZ2 . TRP B 1 81 ? -27.261 71.109 -45.015 1.00 48.42 ? 76 TRP C CZ2 1 ATOM 3134 C CZ3 . TRP B 1 81 ? -28.229 73.265 -44.687 1.00 51.30 ? 76 TRP C CZ3 1 ATOM 3135 C CH2 . TRP B 1 81 ? -27.920 72.192 -45.508 1.00 46.88 ? 76 TRP C CH2 1 ATOM 3136 N N . SER B 1 82 ? -24.072 72.326 -38.689 1.00 42.10 ? 77 SER C N 1 ATOM 3137 C CA . SER B 1 82 ? -22.863 71.618 -38.305 1.00 43.11 ? 77 SER C CA 1 ATOM 3138 C C . SER B 1 82 ? -23.004 70.080 -38.414 1.00 43.50 ? 77 SER C C 1 ATOM 3139 O O . SER B 1 82 ? -21.990 69.376 -38.600 1.00 40.40 ? 77 SER C O 1 ATOM 3140 C CB . SER B 1 82 ? -22.534 71.964 -36.871 1.00 43.45 ? 77 SER C CB 1 ATOM 3141 O OG . SER B 1 82 ? -23.661 71.707 -36.055 1.00 45.39 ? 77 SER C OG 1 ATOM 3142 N N . TYR B 1 83 ? -24.232 69.576 -38.224 1.00 39.31 ? 78 TYR C N 1 ATOM 3143 C CA . TYR B 1 83 ? -24.521 68.160 -38.463 1.00 40.67 ? 78 TYR C CA 1 ATOM 3144 C C . TYR B 1 83 ? -25.986 68.017 -38.840 1.00 41.85 ? 78 TYR C C 1 ATOM 3145 O O . TYR B 1 83 ? -26.739 68.966 -38.683 1.00 49.64 ? 78 TYR C O 1 ATOM 3146 C CB . TYR B 1 83 ? -24.123 67.279 -37.271 1.00 40.91 ? 78 TYR C CB 1 ATOM 3147 C CG . TYR B 1 83 ? -24.781 67.580 -35.921 1.00 40.75 ? 78 TYR C CG 1 ATOM 3148 C CD1 . TYR B 1 83 ? -24.443 68.715 -35.168 1.00 41.07 ? 78 TYR C CD1 1 ATOM 3149 C CD2 . TYR B 1 83 ? -25.702 66.720 -35.405 1.00 40.10 ? 78 TYR C CD2 1 ATOM 3150 C CE1 . TYR B 1 83 ? -25.010 68.949 -33.927 1.00 42.70 ? 78 TYR C CE1 1 ATOM 3151 C CE2 . TYR B 1 83 ? -26.297 66.960 -34.186 1.00 46.37 ? 78 TYR C CE2 1 ATOM 3152 C CZ . TYR B 1 83 ? -25.937 68.066 -33.434 1.00 43.40 ? 78 TYR C CZ 1 ATOM 3153 O OH . TYR B 1 83 ? -26.591 68.252 -32.232 1.00 44.60 ? 78 TYR C OH 1 ATOM 3154 N N . ILE B 1 84 ? -26.375 66.868 -39.373 1.00 36.79 ? 79 ILE C N 1 ATOM 3155 C CA . ILE B 1 84 ? -27.784 66.584 -39.630 1.00 38.54 ? 79 ILE C CA 1 ATOM 3156 C C . ILE B 1 84 ? -28.276 65.542 -38.644 1.00 37.60 ? 79 ILE C C 1 ATOM 3157 O O . ILE B 1 84 ? -27.605 64.566 -38.389 1.00 43.49 ? 79 ILE C O 1 ATOM 3158 C CB . ILE B 1 84 ? -28.002 66.044 -41.048 1.00 40.56 ? 79 ILE C CB 1 ATOM 3159 C CG1 . ILE B 1 84 ? -27.524 67.068 -42.079 1.00 42.86 ? 79 ILE C CG1 1 ATOM 3160 C CG2 . ILE B 1 84 ? -29.452 65.684 -41.301 1.00 41.64 ? 79 ILE C CG2 1 ATOM 3161 C CD1 . ILE B 1 84 ? -27.801 66.692 -43.524 1.00 38.61 ? 79 ILE C CD1 1 ATOM 3162 N N . VAL B 1 85 ? -29.476 65.745 -38.127 1.00 41.09 ? 80 VAL C N 1 ATOM 3163 C CA . VAL B 1 85 ? -30.173 64.804 -37.260 1.00 41.22 ? 80 VAL C CA 1 ATOM 3164 C C . VAL B 1 85 ? -31.383 64.291 -38.000 1.00 39.46 ? 80 VAL C C 1 ATOM 3165 O O . VAL B 1 85 ? -32.246 65.059 -38.428 1.00 45.81 ? 80 VAL C O 1 ATOM 3166 C CB . VAL B 1 85 ? -30.672 65.470 -35.990 1.00 43.22 ? 80 VAL C CB 1 ATOM 3167 C CG1 . VAL B 1 85 ? -31.458 64.490 -35.157 1.00 46.59 ? 80 VAL C CG1 1 ATOM 3168 C CG2 . VAL B 1 85 ? -29.499 66.012 -35.201 1.00 48.90 ? 80 VAL C CG2 1 ATOM 3169 N N . GLU B 1 86 ? -31.415 62.988 -38.190 1.00 40.19 ? 81 GLU C N 1 ATOM 3170 C CA . GLU B 1 86 ? -32.505 62.316 -38.865 1.00 41.56 ? 81 GLU C CA 1 ATOM 3171 C C . GLU B 1 86 ? -33.095 61.324 -37.865 1.00 42.86 ? 81 GLU C C 1 ATOM 3172 O O . GLU B 1 86 ? -32.392 60.806 -36.978 1.00 43.49 ? 81 GLU C O 1 ATOM 3173 C CB . GLU B 1 86 ? -31.931 61.640 -40.096 1.00 42.83 ? 81 GLU C CB 1 ATOM 3174 C CG . GLU B 1 86 ? -32.834 61.398 -41.269 1.00 45.02 ? 81 GLU C CG 1 ATOM 3175 C CD . GLU B 1 86 ? -32.099 60.719 -42.448 1.00 47.67 ? 81 GLU C CD 1 ATOM 3176 O OE1 . GLU B 1 86 ? -31.283 59.752 -42.246 1.00 45.73 ? 81 GLU C OE1 1 ATOM 3177 O OE2 . GLU B 1 86 ? -32.368 61.131 -43.603 1.00 50.29 ? 81 GLU C OE2 1 ATOM 3178 N N . ARG B 1 87 ? -34.403 61.122 -37.931 1.00 42.72 ? 82 ARG C N 1 ATOM 3179 C CA . ARG B 1 87 ? -35.004 60.079 -37.140 1.00 44.20 ? 82 ARG C CA 1 ATOM 3180 C C . ARG B 1 87 ? -34.612 58.719 -37.661 1.00 42.29 ? 82 ARG C C 1 ATOM 3181 O O . ARG B 1 87 ? -34.206 58.597 -38.797 1.00 38.81 ? 82 ARG C O 1 ATOM 3182 C CB . ARG B 1 87 ? -36.507 60.224 -37.118 1.00 50.00 ? 82 ARG C CB 1 ATOM 3183 C CG . ARG B 1 87 ? -36.929 61.384 -36.258 1.00 59.89 ? 82 ARG C CG 1 ATOM 3184 C CD . ARG B 1 87 ? -38.425 61.539 -36.229 1.00 72.25 ? 82 ARG C CD 1 ATOM 3185 N NE . ARG B 1 87 ? -38.770 62.843 -35.664 1.00 86.70 ? 82 ARG C NE 1 ATOM 3186 C CZ . ARG B 1 87 ? -39.996 63.359 -35.648 1.00 87.56 ? 82 ARG C CZ 1 ATOM 3187 N NH1 . ARG B 1 87 ? -41.026 62.660 -36.123 1.00 86.47 ? 82 ARG C NH1 1 ATOM 3188 N NH2 . ARG B 1 87 ? -40.189 64.573 -35.144 1.00 88.30 ? 82 ARG C NH2 1 ATOM 3189 N N . ALA B 1 88 ? -34.712 57.701 -36.804 1.00 42.87 ? 83 ALA C N 1 ATOM 3190 C CA . ALA B 1 88 ? -34.381 56.349 -37.223 1.00 44.63 ? 83 ALA C CA 1 ATOM 3191 C C . ALA B 1 88 ? -35.159 55.984 -38.484 1.00 50.05 ? 83 ALA C C 1 ATOM 3192 O O . ALA B 1 88 ? -34.587 55.414 -39.412 1.00 52.42 ? 83 ALA C O 1 ATOM 3193 C CB . ALA B 1 88 ? -34.641 55.336 -36.130 1.00 43.00 ? 83 ALA C CB 1 ATOM 3194 N N . ASN B 1 89 ? -36.442 56.339 -38.509 1.00 53.38 ? 84 ASN C N 1 ATOM 3195 C CA . ASN B 1 89 ? -37.336 56.015 -39.618 1.00 57.24 ? 84 ASN C CA 1 ATOM 3196 C C . ASN B 1 89 ? -38.219 57.183 -40.003 1.00 52.51 ? 84 ASN C C 1 ATOM 3197 O O . ASN B 1 89 ? -39.404 57.226 -39.668 1.00 46.36 ? 84 ASN C O 1 ATOM 3198 C CB . ASN B 1 89 ? -38.239 54.844 -39.252 1.00 66.94 ? 84 ASN C CB 1 ATOM 3199 C CG . ASN B 1 89 ? -37.468 53.571 -39.046 1.00 74.55 ? 84 ASN C CG 1 ATOM 3200 O OD1 . ASN B 1 89 ? -36.885 53.044 -39.992 1.00 85.31 ? 84 ASN C OD1 1 ATOM 3201 N ND2 . ASN B 1 89 ? -37.426 53.083 -37.800 1.00 81.73 ? 84 ASN C ND2 1 ATOM 3202 N N . PRO B 1 90 ? -37.635 58.150 -40.706 1.00 49.04 ? 85 PRO C N 1 ATOM 3203 C CA . PRO B 1 90 ? -38.457 59.256 -41.152 1.00 47.85 ? 85 PRO C CA 1 ATOM 3204 C C . PRO B 1 90 ? -39.627 58.719 -41.942 1.00 46.69 ? 85 PRO C C 1 ATOM 3205 O O . PRO B 1 90 ? -39.480 57.719 -42.662 1.00 46.06 ? 85 PRO C O 1 ATOM 3206 C CB . PRO B 1 90 ? -37.539 60.050 -42.060 1.00 48.21 ? 85 PRO C CB 1 ATOM 3207 C CG . PRO B 1 90 ? -36.167 59.500 -41.834 1.00 49.10 ? 85 PRO C CG 1 ATOM 3208 C CD . PRO B 1 90 ? -36.316 58.115 -41.350 1.00 46.71 ? 85 PRO C CD 1 ATOM 3209 N N . ALA B 1 91 ? -40.786 59.351 -41.764 1.00 47.23 ? 86 ALA C N 1 ATOM 3210 C CA . ALA B 1 91 ? -42.023 58.906 -42.411 1.00 52.88 ? 86 ALA C CA 1 ATOM 3211 C C . ALA B 1 91 ? -42.086 59.392 -43.849 1.00 52.65 ? 86 ALA C C 1 ATOM 3212 O O . ALA B 1 91 ? -42.659 58.731 -44.712 1.00 54.08 ? 86 ALA C O 1 ATOM 3213 C CB . ALA B 1 91 ? -43.238 59.387 -41.637 1.00 52.74 ? 86 ALA C CB 1 ATOM 3214 N N . ASN B 1 92 ? -41.509 60.549 -44.093 1.00 45.76 ? 87 ASN C N 1 ATOM 3215 C CA . ASN B 1 92 ? -41.577 61.131 -45.410 1.00 48.66 ? 87 ASN C CA 1 ATOM 3216 C C . ASN B 1 92 ? -40.230 61.087 -46.139 1.00 49.82 ? 87 ASN C C 1 ATOM 3217 O O . ASN B 1 92 ? -39.258 61.733 -45.744 1.00 41.10 ? 87 ASN C O 1 ATOM 3218 C CB . ASN B 1 92 ? -42.106 62.558 -45.296 1.00 54.89 ? 87 ASN C CB 1 ATOM 3219 C CG . ASN B 1 92 ? -43.422 62.620 -44.536 1.00 53.64 ? 87 ASN C CG 1 ATOM 3220 O OD1 . ASN B 1 92 ? -43.522 63.310 -43.520 1.00 54.74 ? 87 ASN C OD1 1 ATOM 3221 N ND2 . ASN B 1 92 ? -44.427 61.889 -45.014 1.00 48.52 ? 87 ASN C ND2 1 ATOM 3222 N N . ASP B 1 93 ? -40.203 60.312 -47.222 1.00 48.61 ? 88 ASP C N 1 ATOM 3223 C CA . ASP B 1 93 ? -38.990 60.022 -47.931 1.00 43.18 ? 88 ASP C CA 1 ATOM 3224 C C . ASP B 1 93 ? -39.280 60.119 -49.436 1.00 42.07 ? 88 ASP C C 1 ATOM 3225 O O . ASP B 1 93 ? -39.596 61.215 -49.929 1.00 47.15 ? 88 ASP C O 1 ATOM 3226 C CB . ASP B 1 93 ? -38.470 58.687 -47.430 1.00 49.54 ? 88 ASP C CB 1 ATOM 3227 C CG . ASP B 1 93 ? -37.175 58.228 -48.123 1.00 52.72 ? 88 ASP C CG 1 ATOM 3228 O OD1 . ASP B 1 93 ? -36.147 58.940 -48.065 1.00 49.00 ? 88 ASP C OD1 1 ATOM 3229 O OD2 . ASP B 1 93 ? -37.215 57.101 -48.673 1.00 62.48 ? 88 ASP C OD2 1 ATOM 3230 N N . LEU B 1 94 ? -39.196 59.041 -50.193 1.00 39.25 ? 89 LEU C N 1 ATOM 3231 C CA . LEU B 1 94 ? -39.552 59.133 -51.596 1.00 41.94 ? 89 LEU C CA 1 ATOM 3232 C C . LEU B 1 94 ? -41.031 58.756 -51.731 1.00 39.30 ? 89 LEU C C 1 ATOM 3233 O O . LEU B 1 94 ? -41.372 57.584 -51.836 1.00 38.32 ? 89 LEU C O 1 ATOM 3234 C CB . LEU B 1 94 ? -38.678 58.236 -52.443 1.00 42.69 ? 89 LEU C CB 1 ATOM 3235 C CG . LEU B 1 94 ? -37.179 58.549 -52.392 1.00 45.65 ? 89 LEU C CG 1 ATOM 3236 C CD1 . LEU B 1 94 ? -36.396 57.433 -53.058 1.00 44.85 ? 89 LEU C CD1 1 ATOM 3237 C CD2 . LEU B 1 94 ? -36.875 59.881 -53.066 1.00 42.05 ? 89 LEU C CD2 1 ATOM 3238 N N . CYS B 1 95 ? -41.887 59.766 -51.716 1.00 40.12 ? 90 CYS C N 1 ATOM 3239 C CA . CYS B 1 95 ? -43.336 59.556 -51.771 1.00 40.91 ? 90 CYS C CA 1 ATOM 3240 C C . CYS B 1 95 ? -43.675 58.759 -53.037 1.00 39.22 ? 90 CYS C C 1 ATOM 3241 O O . CYS B 1 95 ? -44.377 57.740 -52.975 1.00 37.90 ? 90 CYS C O 1 ATOM 3242 C CB . CYS B 1 95 ? -44.102 60.891 -51.680 1.00 42.53 ? 90 CYS C CB 1 ATOM 3243 S SG . CYS B 1 95 ? -43.691 62.199 -52.862 1.00 47.12 ? 90 CYS C SG 1 ATOM 3244 N N . TYR B 1 96 ? -43.137 59.196 -54.165 1.00 34.98 ? 91 TYR C N 1 ATOM 3245 C CA . TYR B 1 96 ? -43.203 58.382 -55.384 1.00 34.03 ? 91 TYR C CA 1 ATOM 3246 C C . TYR B 1 96 ? -42.004 57.445 -55.322 1.00 34.07 ? 91 TYR C C 1 ATOM 3247 O O . TYR B 1 96 ? -40.884 57.908 -55.179 1.00 40.50 ? 91 TYR C O 1 ATOM 3248 C CB . TYR B 1 96 ? -43.175 59.247 -56.652 1.00 32.97 ? 91 TYR C CB 1 ATOM 3249 C CG . TYR B 1 96 ? -43.679 58.494 -57.851 1.00 34.11 ? 91 TYR C CG 1 ATOM 3250 C CD1 . TYR B 1 96 ? -44.986 58.609 -58.271 1.00 34.37 ? 91 TYR C CD1 1 ATOM 3251 C CD2 . TYR B 1 96 ? -42.864 57.590 -58.498 1.00 34.53 ? 91 TYR C CD2 1 ATOM 3252 C CE1 . TYR B 1 96 ? -45.476 57.850 -59.336 1.00 35.42 ? 91 TYR C CE1 1 ATOM 3253 C CE2 . TYR B 1 96 ? -43.326 56.823 -59.537 1.00 37.57 ? 91 TYR C CE2 1 ATOM 3254 C CZ . TYR B 1 96 ? -44.629 56.947 -59.968 1.00 38.98 ? 91 TYR C CZ 1 ATOM 3255 O OH . TYR B 1 96 ? -45.051 56.161 -61.023 1.00 37.75 ? 91 TYR C OH 1 ATOM 3256 N N . PRO B 1 97 ? -42.220 56.140 -55.362 1.00 33.42 ? 92 PRO C N 1 ATOM 3257 C CA . PRO B 1 97 ? -41.137 55.215 -54.983 1.00 34.55 ? 92 PRO C CA 1 ATOM 3258 C C . PRO B 1 97 ? -40.038 55.127 -56.027 1.00 34.61 ? 92 PRO C C 1 ATOM 3259 O O . PRO B 1 97 ? -40.272 55.450 -57.192 1.00 33.75 ? 92 PRO C O 1 ATOM 3260 C CB . PRO B 1 97 ? -41.842 53.876 -54.894 1.00 34.70 ? 92 PRO C CB 1 ATOM 3261 C CG . PRO B 1 97 ? -43.019 54.020 -55.800 1.00 33.75 ? 92 PRO C CG 1 ATOM 3262 C CD . PRO B 1 97 ? -43.465 55.424 -55.655 1.00 36.46 ? 92 PRO C CD 1 ATOM 3263 N N . GLY B 1 98 ? -38.842 54.751 -55.577 1.00 34.76 ? 93 GLY C N 1 ATOM 3264 C CA . GLY B 1 98 ? -37.693 54.677 -56.447 1.00 36.48 ? 93 GLY C CA 1 ATOM 3265 C C . GLY B 1 98 ? -36.371 54.741 -55.705 1.00 35.81 ? 93 GLY C C 1 ATOM 3266 O O . GLY B 1 98 ? -36.208 54.064 -54.711 1.00 36.54 ? 93 GLY C O 1 ATOM 3267 N N . ASN B 1 99 ? -35.441 55.560 -56.210 1.00 34.69 ? 94 ASN C N 1 ATOM 3268 C CA . ASN B 1 99 ? -34.105 55.733 -55.614 1.00 34.56 ? 94 ASN C CA 1 ATOM 3269 C C . ASN B 1 99 ? -33.532 57.117 -55.816 1.00 37.54 ? 94 ASN C C 1 ATOM 3270 O O . ASN B 1 99 ? -33.974 57.878 -56.696 1.00 34.89 ? 94 ASN C O 1 ATOM 3271 C CB . ASN B 1 99 ? -33.113 54.799 -56.285 1.00 38.18 ? 94 ASN C CB 1 ATOM 3272 C CG . ASN B 1 99 ? -33.494 53.328 -56.143 1.00 39.35 ? 94 ASN C CG 1 ATOM 3273 O OD1 . ASN B 1 99 ? -33.967 52.653 -57.107 1.00 43.41 ? 94 ASN C OD1 1 ATOM 3274 N ND2 . ASN B 1 99 ? -33.312 52.826 -54.951 1.00 40.56 ? 94 ASN C ND2 1 ATOM 3275 N N . LEU B 1 100 ? -32.538 57.421 -54.994 1.00 38.05 ? 95 LEU C N 1 ATOM 3276 C CA . LEU B 1 100 ? -31.660 58.553 -55.154 1.00 35.77 ? 95 LEU C CA 1 ATOM 3277 C C . LEU B 1 100 ? -30.250 58.010 -55.242 1.00 34.48 ? 95 LEU C C 1 ATOM 3278 O O . LEU B 1 100 ? -29.760 57.386 -54.310 1.00 30.27 ? 95 LEU C O 1 ATOM 3279 C CB . LEU B 1 100 ? -31.713 59.439 -53.923 1.00 38.68 ? 95 LEU C CB 1 ATOM 3280 C CG . LEU B 1 100 ? -31.625 60.943 -54.128 1.00 44.10 ? 95 LEU C CG 1 ATOM 3281 C CD1 . LEU B 1 100 ? -31.333 61.591 -52.801 1.00 46.18 ? 95 LEU C CD1 1 ATOM 3282 C CD2 . LEU B 1 100 ? -30.558 61.305 -55.111 1.00 47.84 ? 95 LEU C CD2 1 ATOM 3283 N N . ASN B 1 101 ? -29.607 58.261 -56.367 1.00 34.70 ? 96 ASN C N 1 ATOM 3284 C CA . ASN B 1 101 ? -28.307 57.695 -56.630 1.00 33.60 ? 96 ASN C CA 1 ATOM 3285 C C . ASN B 1 101 ? -27.234 58.250 -55.703 1.00 33.32 ? 96 ASN C C 1 ATOM 3286 O O . ASN B 1 101 ? -27.294 59.391 -55.287 1.00 32.37 ? 96 ASN C O 1 ATOM 3287 C CB . ASN B 1 101 ? -27.940 57.993 -58.073 1.00 36.14 ? 96 ASN C CB 1 ATOM 3288 C CG . ASN B 1 101 ? -26.801 57.127 -58.553 1.00 37.99 ? 96 ASN C CG 1 ATOM 3289 O OD1 . ASN B 1 101 ? -26.870 55.877 -58.510 1.00 42.51 ? 96 ASN C OD1 1 ATOM 3290 N ND2 . ASN B 1 101 ? -25.736 57.768 -58.990 1.00 32.84 ? 96 ASN C ND2 1 ATOM 3291 N N . ASP B 1 102 ? -26.275 57.414 -55.339 1.00 33.16 ? 97 ASP C N 1 ATOM 3292 C CA . ASP B 1 102 ? -25.190 57.799 -54.407 1.00 33.36 ? 97 ASP C CA 1 ATOM 3293 C C . ASP B 1 102 ? -25.689 58.478 -53.162 1.00 31.16 ? 97 ASP C C 1 ATOM 3294 O O . ASP B 1 102 ? -25.151 59.487 -52.707 1.00 33.69 ? 97 ASP C O 1 ATOM 3295 C CB . ASP B 1 102 ? -24.192 58.694 -55.147 1.00 37.26 ? 97 ASP C CB 1 ATOM 3296 C CG . ASP B 1 102 ? -23.249 57.892 -56.062 1.00 42.71 ? 97 ASP C CG 1 ATOM 3297 O OD1 . ASP B 1 102 ? -22.983 56.712 -55.765 1.00 45.27 ? 97 ASP C OD1 1 ATOM 3298 O OD2 . ASP B 1 102 ? -22.765 58.440 -57.073 1.00 50.38 ? 97 ASP C OD2 1 ATOM 3299 N N . TYR B 1 103 ? -26.776 57.970 -52.632 1.00 28.97 ? 98 TYR C N 1 ATOM 3300 C CA . TYR B 1 103 ? -27.514 58.699 -51.594 1.00 29.77 ? 98 TYR C CA 1 ATOM 3301 C C . TYR B 1 103 ? -26.621 58.925 -50.391 1.00 28.72 ? 98 TYR C C 1 ATOM 3302 O O . TYR B 1 103 ? -26.638 59.981 -49.802 1.00 31.03 ? 98 TYR C O 1 ATOM 3303 C CB . TYR B 1 103 ? -28.751 57.887 -51.175 1.00 31.16 ? 98 TYR C CB 1 ATOM 3304 C CG . TYR B 1 103 ? -29.649 58.525 -50.127 1.00 35.17 ? 98 TYR C CG 1 ATOM 3305 C CD1 . TYR B 1 103 ? -29.874 59.923 -50.108 1.00 32.75 ? 98 TYR C CD1 1 ATOM 3306 C CD2 . TYR B 1 103 ? -30.375 57.711 -49.225 1.00 31.50 ? 98 TYR C CD2 1 ATOM 3307 C CE1 . TYR B 1 103 ? -30.745 60.472 -49.201 1.00 36.05 ? 98 TYR C CE1 1 ATOM 3308 C CE2 . TYR B 1 103 ? -31.270 58.258 -48.342 1.00 31.83 ? 98 TYR C CE2 1 ATOM 3309 C CZ . TYR B 1 103 ? -31.435 59.635 -48.303 1.00 35.70 ? 98 TYR C CZ 1 ATOM 3310 O OH . TYR B 1 103 ? -32.315 60.205 -47.404 1.00 37.13 ? 98 TYR C OH 1 ATOM 3311 N N . GLU B 1 104 ? -25.863 57.913 -50.024 1.00 29.41 ? 99 GLU C N 1 ATOM 3312 C CA . GLU B 1 104 ? -25.129 57.974 -48.782 1.00 31.61 ? 99 GLU C CA 1 ATOM 3313 C C . GLU B 1 104 ? -23.972 58.948 -48.873 1.00 31.27 ? 99 GLU C C 1 ATOM 3314 O O . GLU B 1 104 ? -23.677 59.649 -47.903 1.00 34.32 ? 99 GLU C O 1 ATOM 3315 C CB . GLU B 1 104 ? -24.623 56.595 -48.354 1.00 33.20 ? 99 GLU C CB 1 ATOM 3316 C CG . GLU B 1 104 ? -25.734 55.561 -48.056 1.00 34.05 ? 99 GLU C CG 1 ATOM 3317 C CD . GLU B 1 104 ? -26.293 54.884 -49.317 1.00 38.11 ? 99 GLU C CD 1 ATOM 3318 O OE1 . GLU B 1 104 ? -25.728 55.020 -50.443 1.00 36.64 ? 99 GLU C OE1 1 ATOM 3319 O OE2 . GLU B 1 104 ? -27.355 54.242 -49.221 1.00 51.53 ? 99 GLU C OE2 1 ATOM 3320 N N . GLU B 1 105 ? -23.358 59.034 -50.043 1.00 32.19 ? 100 GLU C N 1 ATOM 3321 C CA . GLU B 1 105 ? -22.278 60.004 -50.275 1.00 33.18 ? 100 GLU C CA 1 ATOM 3322 C C . GLU B 1 105 ? -22.870 61.404 -50.309 1.00 33.44 ? 100 GLU C C 1 ATOM 3323 O O . GLU B 1 105 ? -22.299 62.324 -49.769 1.00 37.65 ? 100 GLU C O 1 ATOM 3324 C CB . GLU B 1 105 ? -21.545 59.700 -51.567 1.00 33.32 ? 100 GLU C CB 1 ATOM 3325 C CG . GLU B 1 105 ? -20.599 58.510 -51.463 1.00 33.84 ? 100 GLU C CG 1 ATOM 3326 C CD . GLU B 1 105 ? -19.346 58.795 -50.619 1.00 37.38 ? 100 GLU C CD 1 ATOM 3327 O OE1 . GLU B 1 105 ? -18.705 59.899 -50.733 1.00 39.23 ? 100 GLU C OE1 1 ATOM 3328 O OE2 . GLU B 1 105 ? -18.989 57.883 -49.843 1.00 36.66 ? 100 GLU C OE2 1 ATOM 3329 N N . LEU B 1 106 ? -24.051 61.561 -50.899 1.00 36.24 ? 101 LEU C N 1 ATOM 3330 C CA . LEU B 1 106 ? -24.765 62.850 -50.846 1.00 33.63 ? 101 LEU C CA 1 ATOM 3331 C C . LEU B 1 106 ? -25.037 63.300 -49.414 1.00 32.36 ? 101 LEU C C 1 ATOM 3332 O O . LEU B 1 106 ? -24.797 64.436 -49.058 1.00 35.75 ? 101 LEU C O 1 ATOM 3333 C CB . LEU B 1 106 ? -26.069 62.778 -51.633 1.00 34.12 ? 101 LEU C CB 1 ATOM 3334 C CG . LEU B 1 106 ? -26.928 64.029 -51.663 1.00 32.87 ? 101 LEU C CG 1 ATOM 3335 C CD1 . LEU B 1 106 ? -26.137 65.164 -52.263 1.00 34.43 ? 101 LEU C CD1 1 ATOM 3336 C CD2 . LEU B 1 106 ? -28.156 63.801 -52.507 1.00 34.30 ? 101 LEU C CD2 1 ATOM 3337 N N . LYS B 1 107 ? -25.539 62.407 -48.598 1.00 33.74 ? 102 LYS C N 1 ATOM 3338 C CA . LYS B 1 107 ? -25.819 62.749 -47.215 1.00 36.95 ? 102 LYS C CA 1 ATOM 3339 C C . LYS B 1 107 ? -24.564 63.123 -46.484 1.00 40.38 ? 102 LYS C C 1 ATOM 3340 O O . LYS B 1 107 ? -24.548 64.056 -45.672 1.00 47.10 ? 102 LYS C O 1 ATOM 3341 C CB . LYS B 1 107 ? -26.489 61.602 -46.496 1.00 36.54 ? 102 LYS C CB 1 ATOM 3342 C CG . LYS B 1 107 ? -27.929 61.430 -46.950 1.00 40.27 ? 102 LYS C CG 1 ATOM 3343 C CD . LYS B 1 107 ? -28.742 60.606 -45.954 1.00 46.33 ? 102 LYS C CD 1 ATOM 3344 C CE . LYS B 1 107 ? -28.515 59.125 -46.140 1.00 49.96 ? 102 LYS C CE 1 ATOM 3345 N NZ . LYS B 1 107 ? -29.181 58.459 -44.999 1.00 58.37 ? 102 LYS C NZ 1 ATOM 3346 N N . HIS B 1 108 ? -23.488 62.413 -46.785 1.00 38.43 ? 103 HIS C N 1 ATOM 3347 C CA . HIS B 1 108 ? -22.212 62.729 -46.181 1.00 36.01 ? 103 HIS C CA 1 ATOM 3348 C C . HIS B 1 108 ? -21.681 64.107 -46.616 1.00 38.70 ? 103 HIS C C 1 ATOM 3349 O O . HIS B 1 108 ? -21.130 64.861 -45.828 1.00 32.99 ? 103 HIS C O 1 ATOM 3350 C CB . HIS B 1 108 ? -21.182 61.690 -46.543 1.00 35.53 ? 103 HIS C CB 1 ATOM 3351 C CG . HIS B 1 108 ? -20.005 61.718 -45.636 1.00 33.93 ? 103 HIS C CG 1 ATOM 3352 N ND1 . HIS B 1 108 ? -18.818 62.292 -45.985 1.00 35.00 ? 103 HIS C ND1 1 ATOM 3353 C CD2 . HIS B 1 108 ? -19.845 61.276 -44.374 1.00 34.02 ? 103 HIS C CD2 1 ATOM 3354 C CE1 . HIS B 1 108 ? -17.958 62.177 -44.992 1.00 33.95 ? 103 HIS C CE1 1 ATOM 3355 N NE2 . HIS B 1 108 ? -18.570 61.585 -43.993 1.00 35.44 ? 103 HIS C NE2 1 ATOM 3356 N N . LEU B 1 109 ? -21.847 64.411 -47.893 1.00 41.22 ? 104 LEU C N 1 ATOM 3357 C CA . LEU B 1 109 ? -21.547 65.740 -48.426 1.00 41.37 ? 104 LEU C CA 1 ATOM 3358 C C . LEU B 1 109 ? -22.360 66.825 -47.685 1.00 44.46 ? 104 LEU C C 1 ATOM 3359 O O . LEU B 1 109 ? -21.851 67.867 -47.303 1.00 51.71 ? 104 LEU C O 1 ATOM 3360 C CB . LEU B 1 109 ? -21.917 65.767 -49.916 1.00 42.55 ? 104 LEU C CB 1 ATOM 3361 C CG . LEU B 1 109 ? -21.255 66.733 -50.912 1.00 47.96 ? 104 LEU C CG 1 ATOM 3362 C CD1 . LEU B 1 109 ? -22.268 67.414 -51.779 1.00 47.46 ? 104 LEU C CD1 1 ATOM 3363 C CD2 . LEU B 1 109 ? -20.361 67.772 -50.279 1.00 52.06 ? 104 LEU C CD2 1 ATOM 3364 N N . LEU B 1 110 ? -23.648 66.592 -47.504 1.00 43.86 ? 105 LEU C N 1 ATOM 3365 C CA . LEU B 1 110 ? -24.508 67.598 -46.902 1.00 40.17 ? 105 LEU C CA 1 ATOM 3366 C C . LEU B 1 110 ? -24.440 67.568 -45.366 1.00 42.49 ? 105 LEU C C 1 ATOM 3367 O O . LEU B 1 110 ? -25.134 68.322 -44.719 1.00 43.81 ? 105 LEU C O 1 ATOM 3368 C CB . LEU B 1 110 ? -25.947 67.345 -47.318 1.00 41.46 ? 105 LEU C CB 1 ATOM 3369 C CG . LEU B 1 110 ? -26.236 67.486 -48.807 1.00 42.44 ? 105 LEU C CG 1 ATOM 3370 C CD1 . LEU B 1 110 ? -27.631 66.988 -49.175 1.00 42.85 ? 105 LEU C CD1 1 ATOM 3371 C CD2 . LEU B 1 110 ? -26.135 68.943 -49.167 1.00 45.31 ? 105 LEU C CD2 1 ATOM 3372 N N . SER B 1 111 ? -23.662 66.677 -44.767 1.00 42.73 ? 106 SER C N 1 ATOM 3373 C CA . SER B 1 111 ? -23.707 66.524 -43.309 1.00 43.26 ? 106 SER C CA 1 ATOM 3374 C C . SER B 1 111 ? -23.369 67.855 -42.620 1.00 43.72 ? 106 SER C C 1 ATOM 3375 O O . SER B 1 111 ? -24.000 68.254 -41.654 1.00 43.19 ? 106 SER C O 1 ATOM 3376 C CB . SER B 1 111 ? -22.766 65.400 -42.844 1.00 44.02 ? 106 SER C CB 1 ATOM 3377 O OG . SER B 1 111 ? -21.410 65.746 -43.072 1.00 42.42 ? 106 SER C OG 1 ATOM 3378 N N . ARG B 1 112 ? -22.377 68.541 -43.150 1.00 47.37 ? 107 ARG C N 1 ATOM 3379 C CA . ARG B 1 112 ? -22.021 69.846 -42.683 1.00 49.34 ? 107 ARG C CA 1 ATOM 3380 C C . ARG B 1 112 ? -21.834 70.786 -43.844 1.00 49.28 ? 107 ARG C C 1 ATOM 3381 O O . ARG B 1 112 ? -20.999 70.549 -44.726 1.00 52.03 ? 107 ARG C O 1 ATOM 3382 C CB . ARG B 1 112 ? -20.745 69.798 -41.854 1.00 54.56 ? 107 ARG C CB 1 ATOM 3383 C CG . ARG B 1 112 ? -20.267 71.177 -41.439 1.00 59.93 ? 107 ARG C CG 1 ATOM 3384 C CD . ARG B 1 112 ? -18.843 71.140 -40.949 1.00 66.29 ? 107 ARG C CD 1 ATOM 3385 N NE . ARG B 1 112 ? -18.800 70.928 -39.516 1.00 73.79 ? 107 ARG C NE 1 ATOM 3386 C CZ . ARG B 1 112 ? -17.723 70.538 -38.852 1.00 83.79 ? 107 ARG C CZ 1 ATOM 3387 N NH1 . ARG B 1 112 ? -16.566 70.312 -39.489 1.00 85.33 ? 107 ARG C NH1 1 ATOM 3388 N NH2 . ARG B 1 112 ? -17.807 70.366 -37.537 1.00 89.21 ? 107 ARG C NH2 1 ATOM 3389 N N . ILE B 1 113 ? -22.552 71.899 -43.774 1.00 49.66 ? 108 ILE C N 1 ATOM 3390 C CA . ILE B 1 113 ? -22.626 72.839 -44.860 1.00 51.69 ? 108 ILE C CA 1 ATOM 3391 C C . ILE B 1 113 ? -22.479 74.271 -44.312 1.00 56.75 ? 108 ILE C C 1 ATOM 3392 O O . ILE B 1 113 ? -23.130 74.667 -43.347 1.00 54.01 ? 108 ILE C O 1 ATOM 3393 C CB . ILE B 1 113 ? -23.930 72.648 -45.627 1.00 53.42 ? 108 ILE C CB 1 ATOM 3394 C CG1 . ILE B 1 113 ? -23.885 71.322 -46.400 1.00 53.89 ? 108 ILE C CG1 1 ATOM 3395 C CG2 . ILE B 1 113 ? -24.186 73.765 -46.628 1.00 57.17 ? 108 ILE C CG2 1 ATOM 3396 C CD1 . ILE B 1 113 ? -22.924 71.257 -47.574 1.00 50.32 ? 108 ILE C CD1 1 ATOM 3397 N N . ASN B 1 114 ? -21.618 75.043 -44.969 1.00 56.25 ? 109 ASN C N 1 ATOM 3398 C CA . ASN B 1 114 ? -21.277 76.386 -44.544 1.00 58.71 ? 109 ASN C CA 1 ATOM 3399 C C . ASN B 1 114 ? -22.273 77.421 -45.100 1.00 58.19 ? 109 ASN C C 1 ATOM 3400 O O . ASN B 1 114 ? -22.589 78.380 -44.412 1.00 47.23 ? 109 ASN C O 1 ATOM 3401 C CB . ASN B 1 114 ? -19.846 76.699 -44.980 1.00 64.99 ? 109 ASN C CB 1 ATOM 3402 C CG . ASN B 1 114 ? -19.421 78.100 -44.611 1.00 68.83 ? 109 ASN C CG 1 ATOM 3403 O OD1 . ASN B 1 114 ? -19.171 78.933 -45.486 1.00 67.52 ? 109 ASN C OD1 1 ATOM 3404 N ND2 . ASN B 1 114 ? -19.373 78.381 -43.318 1.00 65.34 ? 109 ASN C ND2 1 ATOM 3405 N N . HIS B 1 115 ? -22.764 77.218 -46.332 1.00 57.91 ? 110 HIS C N 1 ATOM 3406 C CA . HIS B 1 115 ? -23.853 78.042 -46.891 1.00 56.70 ? 110 HIS C CA 1 ATOM 3407 C C . HIS B 1 115 ? -24.733 77.215 -47.777 1.00 50.69 ? 110 HIS C C 1 ATOM 3408 O O . HIS B 1 115 ? -24.247 76.520 -48.658 1.00 53.49 ? 110 HIS C O 1 ATOM 3409 C CB . HIS B 1 115 ? -23.333 79.241 -47.704 1.00 58.41 ? 110 HIS C CB 1 ATOM 3410 C CG . HIS B 1 115 ? -24.426 80.090 -48.277 1.00 61.96 ? 110 HIS C CG 1 ATOM 3411 N ND1 . HIS B 1 115 ? -25.215 80.924 -47.504 1.00 69.92 ? 110 HIS C ND1 1 ATOM 3412 C CD2 . HIS B 1 115 ? -24.899 80.201 -49.538 1.00 66.95 ? 110 HIS C CD2 1 ATOM 3413 C CE1 . HIS B 1 115 ? -26.105 81.531 -48.270 1.00 65.53 ? 110 HIS C CE1 1 ATOM 3414 N NE2 . HIS B 1 115 ? -25.934 81.109 -49.509 1.00 69.93 ? 110 HIS C NE2 1 ATOM 3415 N N . PHE B 1 116 ? -26.041 77.323 -47.573 1.00 52.95 ? 111 PHE C N 1 ATOM 3416 C CA . PHE B 1 116 ? -27.019 76.527 -48.329 1.00 52.59 ? 111 PHE C CA 1 ATOM 3417 C C . PHE B 1 116 ? -28.240 77.399 -48.700 1.00 51.68 ? 111 PHE C C 1 ATOM 3418 O O . PHE B 1 116 ? -28.906 77.940 -47.827 1.00 46.89 ? 111 PHE C O 1 ATOM 3419 C CB . PHE B 1 116 ? -27.457 75.332 -47.479 1.00 50.75 ? 111 PHE C CB 1 ATOM 3420 C CG . PHE B 1 116 ? -28.158 74.258 -48.245 1.00 52.26 ? 111 PHE C CG 1 ATOM 3421 C CD1 . PHE B 1 116 ? -27.471 73.438 -49.104 1.00 51.16 ? 111 PHE C CD1 1 ATOM 3422 C CD2 . PHE B 1 116 ? -29.544 74.061 -48.105 1.00 55.57 ? 111 PHE C CD2 1 ATOM 3423 C CE1 . PHE B 1 116 ? -28.129 72.414 -49.813 1.00 51.24 ? 111 PHE C CE1 1 ATOM 3424 C CE2 . PHE B 1 116 ? -30.206 73.055 -48.817 1.00 54.26 ? 111 PHE C CE2 1 ATOM 3425 C CZ . PHE B 1 116 ? -29.491 72.220 -49.667 1.00 49.97 ? 111 PHE C CZ 1 ATOM 3426 N N . GLU B 1 117 ? -28.520 77.548 -49.991 1.00 48.45 ? 112 GLU C N 1 ATOM 3427 C CA . GLU B 1 117 ? -29.594 78.407 -50.411 1.00 48.91 ? 112 GLU C CA 1 ATOM 3428 C C . GLU B 1 117 ? -30.330 77.881 -51.614 1.00 48.57 ? 112 GLU C C 1 ATOM 3429 O O . GLU B 1 117 ? -29.748 77.680 -52.681 1.00 47.41 ? 112 GLU C O 1 ATOM 3430 C CB . GLU B 1 117 ? -29.045 79.795 -50.754 1.00 58.96 ? 112 GLU C CB 1 ATOM 3431 C CG . GLU B 1 117 ? -30.129 80.841 -51.047 1.00 64.10 ? 112 GLU C CG 1 ATOM 3432 C CD . GLU B 1 117 ? -29.584 82.195 -51.527 1.00 73.03 ? 112 GLU C CD 1 ATOM 3433 O OE1 . GLU B 1 117 ? -28.346 82.421 -51.479 1.00 77.28 ? 112 GLU C OE1 1 ATOM 3434 O OE2 . GLU B 1 117 ? -30.412 83.031 -51.960 1.00 69.98 ? 112 GLU C OE2 1 ATOM 3435 N N . LYS B 1 118 ? -31.637 77.716 -51.460 1.00 49.88 ? 113 LYS C N 1 ATOM 3436 C CA . LYS B 1 118 ? -32.504 77.289 -52.557 1.00 53.06 ? 113 LYS C CA 1 ATOM 3437 C C . LYS B 1 118 ? -32.765 78.431 -53.530 1.00 52.17 ? 113 LYS C C 1 ATOM 3438 O O . LYS B 1 118 ? -33.197 79.478 -53.125 1.00 52.35 ? 113 LYS C O 1 ATOM 3439 C CB . LYS B 1 118 ? -33.841 76.728 -52.013 1.00 53.98 ? 113 LYS C CB 1 ATOM 3440 C CG . LYS B 1 118 ? -34.745 76.126 -53.096 1.00 54.10 ? 113 LYS C CG 1 ATOM 3441 C CD . LYS B 1 118 ? -35.706 75.047 -52.577 1.00 57.43 ? 113 LYS C CD 1 ATOM 3442 C CE . LYS B 1 118 ? -36.919 75.568 -51.833 1.00 60.96 ? 113 LYS C CE 1 ATOM 3443 N NZ . LYS B 1 118 ? -37.984 75.851 -52.805 1.00 69.65 ? 113 LYS C NZ 1 ATOM 3444 N N . ILE B 1 119 ? -32.526 78.182 -54.814 1.00 53.54 ? 114 ILE C N 1 ATOM 3445 C CA . ILE B 1 119 ? -32.830 79.131 -55.873 1.00 54.41 ? 114 ILE C CA 1 ATOM 3446 C C . ILE B 1 119 ? -33.559 78.466 -57.046 1.00 59.51 ? 114 ILE C C 1 ATOM 3447 O O . ILE B 1 119 ? -33.398 77.276 -57.327 1.00 59.52 ? 114 ILE C O 1 ATOM 3448 C CB . ILE B 1 119 ? -31.550 79.765 -56.422 1.00 56.42 ? 114 ILE C CB 1 ATOM 3449 C CG1 . ILE B 1 119 ? -30.568 78.710 -56.952 1.00 57.75 ? 114 ILE C CG1 1 ATOM 3450 C CG2 . ILE B 1 119 ? -30.832 80.560 -55.341 1.00 56.19 ? 114 ILE C CG2 1 ATOM 3451 C CD1 . ILE B 1 119 ? -29.526 79.322 -57.871 1.00 60.28 ? 114 ILE C CD1 1 ATOM 3452 N N . LEU B 1 120 ? -34.335 79.252 -57.764 1.00 60.88 ? 115 LEU C N 1 ATOM 3453 C CA . LEU B 1 120 ? -35.026 78.767 -58.949 1.00 59.66 ? 115 LEU C CA 1 ATOM 3454 C C . LEU B 1 120 ? -34.031 78.829 -60.089 1.00 58.03 ? 115 LEU C C 1 ATOM 3455 O O . LEU B 1 120 ? -33.427 79.869 -60.294 1.00 61.14 ? 115 LEU C O 1 ATOM 3456 C CB . LEU B 1 120 ? -36.235 79.642 -59.250 1.00 57.62 ? 115 LEU C CB 1 ATOM 3457 C CG . LEU B 1 120 ? -37.185 79.227 -60.376 1.00 65.86 ? 115 LEU C CG 1 ATOM 3458 C CD1 . LEU B 1 120 ? -37.801 77.855 -60.176 1.00 65.53 ? 115 LEU C CD1 1 ATOM 3459 C CD2 . LEU B 1 120 ? -38.309 80.247 -60.472 1.00 65.43 ? 115 LEU C CD2 1 ATOM 3460 N N . ILE B 1 121 ? -33.858 77.727 -60.819 1.00 49.38 ? 116 ILE C N 1 ATOM 3461 C CA . ILE B 1 121 ? -32.963 77.724 -61.972 1.00 46.26 ? 116 ILE C CA 1 ATOM 3462 C C . ILE B 1 121 ? -33.632 77.500 -63.322 1.00 45.96 ? 116 ILE C C 1 ATOM 3463 O O . ILE B 1 121 ? -33.139 77.984 -64.340 1.00 44.47 ? 116 ILE C O 1 ATOM 3464 C CB . ILE B 1 121 ? -31.805 76.726 -61.805 1.00 48.73 ? 116 ILE C CB 1 ATOM 3465 C CG1 . ILE B 1 121 ? -32.294 75.286 -61.674 1.00 52.22 ? 116 ILE C CG1 1 ATOM 3466 C CG2 . ILE B 1 121 ? -30.998 77.088 -60.570 1.00 50.57 ? 116 ILE C CG2 1 ATOM 3467 C CD1 . ILE B 1 121 ? -31.244 74.258 -62.051 1.00 53.92 ? 116 ILE C CD1 1 ATOM 3468 N N . ILE B 1 122 ? -34.743 76.767 -63.338 1.00 45.91 ? 117 ILE C N 1 ATOM 3469 C CA . ILE B 1 122 ? -35.509 76.550 -64.552 1.00 51.50 ? 117 ILE C CA 1 ATOM 3470 C C . ILE B 1 122 ? -37.013 76.715 -64.310 1.00 58.48 ? 117 ILE C C 1 ATOM 3471 O O . ILE B 1 122 ? -37.666 75.795 -63.826 1.00 60.76 ? 117 ILE C O 1 ATOM 3472 C CB . ILE B 1 122 ? -35.298 75.163 -65.107 1.00 52.10 ? 117 ILE C CB 1 ATOM 3473 C CG1 . ILE B 1 122 ? -33.814 74.951 -65.411 1.00 55.89 ? 117 ILE C CG1 1 ATOM 3474 C CG2 . ILE B 1 122 ? -36.149 74.982 -66.368 1.00 50.42 ? 117 ILE C CG2 1 ATOM 3475 C CD1 . ILE B 1 122 ? -33.496 73.547 -65.858 1.00 54.03 ? 117 ILE C CD1 1 ATOM 3476 N N . PRO B 1 123 ? -37.568 77.890 -64.654 1.00 58.37 ? 118 PRO C N 1 ATOM 3477 C CA . PRO B 1 123 ? -38.932 78.139 -64.177 1.00 57.94 ? 118 PRO C CA 1 ATOM 3478 C C . PRO B 1 123 ? -39.902 77.254 -64.906 1.00 57.13 ? 118 PRO C C 1 ATOM 3479 O O . PRO B 1 123 ? -39.651 76.923 -66.050 1.00 53.50 ? 118 PRO C O 1 ATOM 3480 C CB . PRO B 1 123 ? -39.179 79.620 -64.508 1.00 60.06 ? 118 PRO C CB 1 ATOM 3481 C CG . PRO B 1 123 ? -37.840 80.208 -64.793 1.00 62.13 ? 118 PRO C CG 1 ATOM 3482 C CD . PRO B 1 123 ? -36.903 79.100 -65.177 1.00 57.81 ? 118 PRO C CD 1 ATOM 3483 N N . LYS B 1 124 ? -40.968 76.844 -64.220 1.00 54.57 ? 119 LYS C N 1 ATOM 3484 C CA . LYS B 1 124 ? -42.019 76.047 -64.826 1.00 55.80 ? 119 LYS C CA 1 ATOM 3485 C C . LYS B 1 124 ? -42.508 76.635 -66.125 1.00 57.33 ? 119 LYS C C 1 ATOM 3486 O O . LYS B 1 124 ? -42.795 75.900 -67.078 1.00 63.37 ? 119 LYS C O 1 ATOM 3487 C CB . LYS B 1 124 ? -43.224 75.947 -63.917 1.00 56.75 ? 119 LYS C CB 1 ATOM 3488 C CG . LYS B 1 124 ? -43.244 74.784 -62.971 1.00 63.61 ? 119 LYS C CG 1 ATOM 3489 C CD . LYS B 1 124 ? -44.676 74.417 -62.621 1.00 69.96 ? 119 LYS C CD 1 ATOM 3490 C CE . LYS B 1 124 ? -44.710 73.339 -61.554 1.00 78.78 ? 119 LYS C CE 1 ATOM 3491 N NZ . LYS B 1 124 ? -46.005 72.599 -61.589 1.00 87.55 ? 119 LYS C NZ 1 ATOM 3492 N N . SER B 1 125 ? -42.657 77.952 -66.139 1.00 55.24 ? 120 SER C N 1 ATOM 3493 C CA . SER B 1 125 ? -43.261 78.652 -67.264 1.00 56.78 ? 120 SER C CA 1 ATOM 3494 C C . SER B 1 125 ? -42.416 78.548 -68.528 1.00 58.19 ? 120 SER C C 1 ATOM 3495 O O . SER B 1 125 ? -42.871 78.893 -69.618 1.00 58.54 ? 120 SER C O 1 ATOM 3496 C CB . SER B 1 125 ? -43.530 80.123 -66.895 1.00 60.70 ? 120 SER C CB 1 ATOM 3497 O OG . SER B 1 125 ? -42.369 80.810 -66.438 1.00 59.49 ? 120 SER C OG 1 ATOM 3498 N N . SER B 1 126 ? -41.183 78.077 -68.382 1.00 57.59 ? 121 SER C N 1 ATOM 3499 C CA . SER B 1 126 ? -40.270 78.003 -69.505 1.00 59.80 ? 121 SER C CA 1 ATOM 3500 C C . SER B 1 126 ? -40.552 76.801 -70.406 1.00 59.52 ? 121 SER C C 1 ATOM 3501 O O . SER B 1 126 ? -40.065 76.742 -71.526 1.00 57.92 ? 121 SER C O 1 ATOM 3502 C CB . SER B 1 126 ? -38.827 77.985 -69.006 1.00 61.18 ? 121 SER C CB 1 ATOM 3503 O OG . SER B 1 126 ? -38.502 76.715 -68.520 1.00 63.51 ? 121 SER C OG 1 ATOM 3504 N N . TRP B 1 127 ? -41.331 75.846 -69.918 1.00 62.35 ? 122 TRP C N 1 ATOM 3505 C CA . TRP B 1 127 ? -41.664 74.660 -70.716 1.00 62.62 ? 122 TRP C CA 1 ATOM 3506 C C . TRP B 1 127 ? -42.899 74.916 -71.584 1.00 60.78 ? 122 TRP C C 1 ATOM 3507 O O . TRP B 1 127 ? -44.026 74.603 -71.204 1.00 66.81 ? 122 TRP C O 1 ATOM 3508 C CB . TRP B 1 127 ? -41.900 73.447 -69.800 1.00 61.13 ? 122 TRP C CB 1 ATOM 3509 C CG . TRP B 1 127 ? -40.728 73.120 -68.887 1.00 55.55 ? 122 TRP C CG 1 ATOM 3510 C CD1 . TRP B 1 127 ? -40.642 73.353 -67.539 1.00 54.22 ? 122 TRP C CD1 1 ATOM 3511 C CD2 . TRP B 1 127 ? -39.506 72.515 -69.271 1.00 49.91 ? 122 TRP C CD2 1 ATOM 3512 N NE1 . TRP B 1 127 ? -39.421 72.926 -67.060 1.00 48.87 ? 122 TRP C NE1 1 ATOM 3513 C CE2 . TRP B 1 127 ? -38.702 72.407 -68.106 1.00 48.50 ? 122 TRP C CE2 1 ATOM 3514 C CE3 . TRP B 1 127 ? -38.990 72.080 -70.499 1.00 51.41 ? 122 TRP C CE3 1 ATOM 3515 C CZ2 . TRP B 1 127 ? -37.423 71.866 -68.130 1.00 45.46 ? 122 TRP C CZ2 1 ATOM 3516 C CZ3 . TRP B 1 127 ? -37.702 71.550 -70.530 1.00 49.76 ? 122 TRP C CZ3 1 ATOM 3517 C CH2 . TRP B 1 127 ? -36.937 71.441 -69.348 1.00 48.24 ? 122 TRP C CH2 1 ATOM 3518 N N . THR B 1 128 ? -42.692 75.502 -72.751 1.00 58.55 ? 123 THR C N 1 ATOM 3519 C CA . THR B 1 128 ? -43.837 75.918 -73.574 1.00 61.76 ? 123 THR C CA 1 ATOM 3520 C C . THR B 1 128 ? -44.461 74.765 -74.350 1.00 64.15 ? 123 THR C C 1 ATOM 3521 O O . THR B 1 128 ? -45.670 74.771 -74.593 1.00 64.56 ? 123 THR C O 1 ATOM 3522 C CB . THR B 1 128 ? -43.463 77.055 -74.528 1.00 58.98 ? 123 THR C CB 1 ATOM 3523 O OG1 . THR B 1 128 ? -42.314 76.665 -75.291 1.00 57.32 ? 123 THR C OG1 1 ATOM 3524 C CG2 . THR B 1 128 ? -43.156 78.324 -73.731 1.00 57.67 ? 123 THR C CG2 1 ATOM 3525 N N . ASN B 1 129 ? -43.646 73.766 -74.689 1.00 63.81 ? 124 ASN C N 1 ATOM 3526 C CA . ASN B 1 129 ? -44.094 72.645 -75.509 1.00 62.70 ? 124 ASN C CA 1 ATOM 3527 C C . ASN B 1 129 ? -44.375 71.365 -74.772 1.00 61.59 ? 124 ASN C C 1 ATOM 3528 O O . ASN B 1 129 ? -44.631 70.348 -75.418 1.00 65.46 ? 124 ASN C O 1 ATOM 3529 C CB . ASN B 1 129 ? -43.084 72.378 -76.615 1.00 65.53 ? 124 ASN C CB 1 ATOM 3530 C CG . ASN B 1 129 ? -42.911 73.574 -77.513 1.00 69.43 ? 124 ASN C CG 1 ATOM 3531 O OD1 . ASN B 1 129 ? -43.872 74.287 -77.808 1.00 66.30 ? 124 ASN C OD1 1 ATOM 3532 N ND2 . ASN B 1 129 ? -41.686 73.825 -77.929 1.00 70.69 ? 124 ASN C ND2 1 ATOM 3533 N N . HIS B 1 130 ? -44.372 71.411 -73.438 1.00 59.35 ? 125 HIS C N 1 ATOM 3534 C CA . HIS B 1 130 ? -44.702 70.226 -72.612 1.00 55.12 ? 125 HIS C CA 1 ATOM 3535 C C . HIS B 1 130 ? -45.671 70.610 -71.520 1.00 51.89 ? 125 HIS C C 1 ATOM 3536 O O . HIS B 1 130 ? -45.732 71.746 -71.123 1.00 55.66 ? 125 HIS C O 1 ATOM 3537 C CB . HIS B 1 130 ? -43.428 69.610 -71.999 1.00 51.64 ? 125 HIS C CB 1 ATOM 3538 C CG . HIS B 1 130 ? -42.405 69.231 -73.021 1.00 49.60 ? 125 HIS C CG 1 ATOM 3539 N ND1 . HIS B 1 130 ? -41.552 70.152 -73.591 1.00 51.12 ? 125 HIS C ND1 1 ATOM 3540 C CD2 . HIS B 1 130 ? -42.131 68.046 -73.615 1.00 49.72 ? 125 HIS C CD2 1 ATOM 3541 C CE1 . HIS B 1 130 ? -40.800 69.550 -74.499 1.00 51.51 ? 125 HIS C CE1 1 ATOM 3542 N NE2 . HIS B 1 130 ? -41.137 68.271 -74.539 1.00 48.61 ? 125 HIS C NE2 1 ATOM 3543 N N . GLU B 1 131 ? -46.413 69.631 -71.030 1.00 54.60 ? 126 GLU C N 1 ATOM 3544 C CA . GLU B 1 131 ? -47.387 69.821 -69.948 1.00 55.34 ? 126 GLU C CA 1 ATOM 3545 C C . GLU B 1 131 ? -46.639 69.850 -68.614 1.00 52.09 ? 126 GLU C C 1 ATOM 3546 O O . GLU B 1 131 ? -45.871 68.916 -68.314 1.00 50.69 ? 126 GLU C O 1 ATOM 3547 C CB . GLU B 1 131 ? -48.356 68.633 -69.910 1.00 58.55 ? 126 GLU C CB 1 ATOM 3548 C CG . GLU B 1 131 ? -49.840 68.907 -69.897 1.00 65.04 ? 126 GLU C CG 1 ATOM 3549 C CD . GLU B 1 131 ? -50.247 70.298 -69.465 1.00 68.89 ? 126 GLU C CD 1 ATOM 3550 O OE1 . GLU B 1 131 ? -50.131 70.660 -68.272 1.00 55.55 ? 126 GLU C OE1 1 ATOM 3551 O OE2 . GLU B 1 131 ? -50.710 71.020 -70.369 1.00 81.51 ? 126 GLU C OE2 1 ATOM 3552 N N . THR B 1 132 ? -46.875 70.880 -67.807 1.00 50.81 ? 127 THR C N 1 ATOM 3553 C CA . THR B 1 132 ? -46.196 71.030 -66.524 1.00 50.04 ? 127 THR C CA 1 ATOM 3554 C C . THR B 1 132 ? -47.104 70.959 -65.319 1.00 51.56 ? 127 THR C C 1 ATOM 3555 O O . THR B 1 132 ? -46.638 71.103 -64.174 1.00 48.92 ? 127 THR C O 1 ATOM 3556 C CB . THR B 1 132 ? -45.504 72.378 -66.426 1.00 52.40 ? 127 THR C CB 1 ATOM 3557 O OG1 . THR B 1 132 ? -46.493 73.405 -66.436 1.00 48.98 ? 127 THR C OG1 1 ATOM 3558 C CG2 . THR B 1 132 ? -44.537 72.598 -67.592 1.00 56.08 ? 127 THR C CG2 1 ATOM 3559 N N . SER B 1 133 ? -48.383 70.692 -65.546 1.00 50.11 ? 128 SER C N 1 ATOM 3560 C CA . SER B 1 133 ? -49.355 70.712 -64.464 1.00 54.03 ? 128 SER C CA 1 ATOM 3561 C C . SER B 1 133 ? -50.059 69.368 -64.238 1.00 52.73 ? 128 SER C C 1 ATOM 3562 O O . SER B 1 133 ? -50.875 69.258 -63.316 1.00 59.25 ? 128 SER C O 1 ATOM 3563 C CB . SER B 1 133 ? -50.415 71.756 -64.776 1.00 61.21 ? 128 SER C CB 1 ATOM 3564 O OG . SER B 1 133 ? -51.234 71.299 -65.850 1.00 65.10 ? 128 SER C OG 1 ATOM 3565 N N . LEU B 1 134 ? -49.720 68.359 -65.037 1.00 49.56 ? 129 LEU C N 1 ATOM 3566 C CA . LEU B 1 134 ? -50.329 67.016 -64.943 1.00 51.03 ? 129 LEU C CA 1 ATOM 3567 C C . LEU B 1 134 ? -49.469 65.938 -64.256 1.00 49.93 ? 129 LEU C C 1 ATOM 3568 O O . LEU B 1 134 ? -49.913 64.794 -64.110 1.00 51.83 ? 129 LEU C O 1 ATOM 3569 C CB . LEU B 1 134 ? -50.683 66.522 -66.339 1.00 59.29 ? 129 LEU C CB 1 ATOM 3570 C CG . LEU B 1 134 ? -52.123 66.748 -66.865 1.00 63.75 ? 129 LEU C CG 1 ATOM 3571 C CD1 . LEU B 1 134 ? -52.741 68.057 -66.408 1.00 62.52 ? 129 LEU C CD1 1 ATOM 3572 C CD2 . LEU B 1 134 ? -52.143 66.626 -68.393 1.00 61.22 ? 129 LEU C CD2 1 ATOM 3573 N N . GLY B 1 135 ? -48.245 66.280 -63.856 1.00 43.72 ? 130 GLY C N 1 ATOM 3574 C CA . GLY B 1 135 ? -47.364 65.321 -63.204 1.00 42.65 ? 130 GLY C CA 1 ATOM 3575 C C . GLY B 1 135 ? -47.517 65.316 -61.681 1.00 42.40 ? 130 GLY C C 1 ATOM 3576 O O . GLY B 1 135 ? -46.674 65.840 -60.949 1.00 37.26 ? 130 GLY C O 1 ATOM 3577 N N . VAL B 1 136 ? -48.601 64.721 -61.213 1.00 43.19 ? 131 VAL C N 1 ATOM 3578 C CA . VAL B 1 136 ? -48.906 64.669 -59.777 1.00 45.37 ? 131 VAL C CA 1 ATOM 3579 C C . VAL B 1 136 ? -49.400 63.263 -59.552 1.00 42.00 ? 131 VAL C C 1 ATOM 3580 O O . VAL B 1 136 ? -49.769 62.603 -60.483 1.00 41.01 ? 131 VAL C O 1 ATOM 3581 C CB . VAL B 1 136 ? -49.995 65.688 -59.328 1.00 49.80 ? 131 VAL C CB 1 ATOM 3582 C CG1 . VAL B 1 136 ? -49.482 67.120 -59.450 1.00 51.55 ? 131 VAL C CG1 1 ATOM 3583 C CG2 . VAL B 1 136 ? -51.288 65.510 -60.123 1.00 48.84 ? 131 VAL C CG2 1 ATOM 3584 N N . SER B 1 137 ? -49.397 62.811 -58.309 1.00 40.26 ? 132 SER C N 1 ATOM 3585 C CA . SER B 1 137 ? -49.717 61.460 -58.027 1.00 37.54 ? 132 SER C CA 1 ATOM 3586 C C . SER B 1 137 ? -50.365 61.368 -56.668 1.00 38.21 ? 132 SER C C 1 ATOM 3587 O O . SER B 1 137 ? -49.972 62.097 -55.749 1.00 38.95 ? 132 SER C O 1 ATOM 3588 C CB . SER B 1 137 ? -48.430 60.620 -58.042 1.00 40.16 ? 132 SER C CB 1 ATOM 3589 O OG . SER B 1 137 ? -48.675 59.254 -57.628 1.00 43.38 ? 132 SER C OG 1 ATOM 3590 N N . ALA B 1 138 ? -51.319 60.435 -56.535 1.00 36.62 ? 133 ALA C N 1 ATOM 3591 C CA . ALA B 1 138 ? -51.842 60.051 -55.228 1.00 37.70 ? 133 ALA C CA 1 ATOM 3592 C C . ALA B 1 138 ? -50.748 59.523 -54.307 1.00 39.00 ? 133 ALA C C 1 ATOM 3593 O O . ALA B 1 138 ? -50.931 59.502 -53.087 1.00 35.46 ? 133 ALA C O 1 ATOM 3594 C CB . ALA B 1 138 ? -52.931 58.993 -55.360 1.00 38.07 ? 133 ALA C CB 1 ATOM 3595 N N . ALA B 1 139 ? -49.604 59.099 -54.854 1.00 37.40 ? 134 ALA C N 1 ATOM 3596 C CA . ALA B 1 139 ? -48.482 58.701 -53.969 1.00 38.20 ? 134 ALA C CA 1 ATOM 3597 C C . ALA B 1 139 ? -47.821 59.887 -53.232 1.00 39.08 ? 134 ALA C C 1 ATOM 3598 O O . ALA B 1 139 ? -47.064 59.694 -52.292 1.00 37.83 ? 134 ALA C O 1 ATOM 3599 C CB . ALA B 1 139 ? -47.428 57.940 -54.765 1.00 39.04 ? 134 ALA C CB 1 ATOM 3600 N N . CYS B 1 140 ? -48.051 61.113 -53.712 1.00 44.41 ? 135 CYS C N 1 ATOM 3601 C CA . CYS B 1 140 ? -47.450 62.331 -53.142 1.00 45.43 ? 135 CYS C CA 1 ATOM 3602 C C . CYS B 1 140 ? -48.552 63.342 -52.847 1.00 45.61 ? 135 CYS C C 1 ATOM 3603 O O . CYS B 1 140 ? -48.622 64.408 -53.489 1.00 42.51 ? 135 CYS C O 1 ATOM 3604 C CB . CYS B 1 140 ? -46.422 62.936 -54.119 1.00 49.02 ? 135 CYS C CB 1 ATOM 3605 S SG . CYS B 1 140 ? -45.017 61.871 -54.505 1.00 55.09 ? 135 CYS C SG 1 ATOM 3606 N N . PRO B 1 141 ? -49.408 63.023 -51.862 1.00 49.34 ? 136 PRO C N 1 ATOM 3607 C CA . PRO B 1 141 ? -50.530 63.903 -51.587 1.00 49.58 ? 136 PRO C CA 1 ATOM 3608 C C . PRO B 1 141 ? -50.102 65.109 -50.812 1.00 48.08 ? 136 PRO C C 1 ATOM 3609 O O . PRO B 1 141 ? -49.073 65.096 -50.132 1.00 44.03 ? 136 PRO C O 1 ATOM 3610 C CB . PRO B 1 141 ? -51.440 63.065 -50.697 1.00 50.60 ? 136 PRO C CB 1 ATOM 3611 C CG . PRO B 1 141 ? -50.524 62.094 -50.017 1.00 50.88 ? 136 PRO C CG 1 ATOM 3612 C CD . PRO B 1 141 ? -49.418 61.830 -50.989 1.00 51.09 ? 136 PRO C CD 1 ATOM 3613 N N . TYR B 1 142 ? -50.827 66.183 -51.029 1.00 43.39 ? 137 TYR C N 1 ATOM 3614 C CA . TYR B 1 142 ? -50.774 67.297 -50.145 1.00 44.22 ? 137 TYR C CA 1 ATOM 3615 C C . TYR B 1 142 ? -52.193 67.501 -49.652 1.00 45.32 ? 137 TYR C C 1 ATOM 3616 O O . TYR B 1 142 ? -53.077 67.844 -50.452 1.00 39.79 ? 137 TYR C O 1 ATOM 3617 C CB . TYR B 1 142 ? -50.227 68.535 -50.828 1.00 44.55 ? 137 TYR C CB 1 ATOM 3618 C CG . TYR B 1 142 ? -50.359 69.725 -49.874 1.00 46.78 ? 137 TYR C CG 1 ATOM 3619 C CD1 . TYR B 1 142 ? -49.640 69.790 -48.677 1.00 49.98 ? 137 TYR C CD1 1 ATOM 3620 C CD2 . TYR B 1 142 ? -51.225 70.746 -50.140 1.00 48.98 ? 137 TYR C CD2 1 ATOM 3621 C CE1 . TYR B 1 142 ? -49.774 70.884 -47.787 1.00 45.64 ? 137 TYR C CE1 1 ATOM 3622 C CE2 . TYR B 1 142 ? -51.359 71.826 -49.273 1.00 50.33 ? 137 TYR C CE2 1 ATOM 3623 C CZ . TYR B 1 142 ? -50.631 71.890 -48.095 1.00 47.35 ? 137 TYR C CZ 1 ATOM 3624 O OH . TYR B 1 142 ? -50.820 73.016 -47.293 1.00 49.30 ? 137 TYR C OH 1 ATOM 3625 N N . GLN B 1 143 ? -52.399 67.307 -48.350 1.00 46.55 ? 138 GLN C N 1 ATOM 3626 C CA . GLN B 1 143 ? -53.747 67.335 -47.745 1.00 50.07 ? 138 GLN C CA 1 ATOM 3627 C C . GLN B 1 143 ? -54.775 66.515 -48.457 1.00 49.59 ? 138 GLN C C 1 ATOM 3628 O O . GLN B 1 143 ? -55.811 67.054 -48.848 1.00 48.50 ? 138 GLN C O 1 ATOM 3629 C CB . GLN B 1 143 ? -54.260 68.760 -47.742 1.00 56.91 ? 138 GLN C CB 1 ATOM 3630 C CG . GLN B 1 143 ? -53.202 69.704 -47.197 1.00 68.58 ? 138 GLN C CG 1 ATOM 3631 C CD . GLN B 1 143 ? -53.798 70.791 -46.359 1.00 77.15 ? 138 GLN C CD 1 ATOM 3632 O OE1 . GLN B 1 143 ? -54.062 71.888 -46.843 1.00 86.60 ? 138 GLN C OE1 1 ATOM 3633 N NE2 . GLN B 1 143 ? -54.075 70.469 -45.092 1.00 81.35 ? 138 GLN C NE2 1 ATOM 3634 N N . GLY B 1 144 ? -54.485 65.232 -48.647 1.00 48.86 ? 139 GLY C N 1 ATOM 3635 C CA . GLY B 1 144 ? -55.375 64.338 -49.394 1.00 48.69 ? 139 GLY C CA 1 ATOM 3636 C C . GLY B 1 144 ? -55.432 64.449 -50.913 1.00 50.69 ? 139 GLY C C 1 ATOM 3637 O O . GLY B 1 144 ? -56.017 63.598 -51.581 1.00 55.27 ? 139 GLY C O 1 ATOM 3638 N N . THR B 1 145 ? -54.825 65.470 -51.484 1.00 50.33 ? 140 THR C N 1 ATOM 3639 C CA . THR B 1 145 ? -54.976 65.714 -52.906 1.00 53.52 ? 140 THR C CA 1 ATOM 3640 C C . THR B 1 145 ? -53.675 65.423 -53.685 1.00 49.03 ? 140 THR C C 1 ATOM 3641 O O . THR B 1 145 ? -52.604 65.680 -53.208 1.00 49.14 ? 140 THR C O 1 ATOM 3642 C CB . THR B 1 145 ? -55.438 67.183 -53.136 1.00 59.19 ? 140 THR C CB 1 ATOM 3643 O OG1 . THR B 1 145 ? -55.368 67.532 -54.523 1.00 63.43 ? 140 THR C OG1 1 ATOM 3644 C CG2 . THR B 1 145 ? -54.573 68.167 -52.395 1.00 62.28 ? 140 THR C CG2 1 ATOM 3645 N N . PRO B 1 146 ? -53.771 64.921 -54.905 1.00 46.75 ? 141 PRO C N 1 ATOM 3646 C CA . PRO B 1 146 ? -52.526 64.456 -55.501 1.00 46.83 ? 141 PRO C CA 1 ATOM 3647 C C . PRO B 1 146 ? -51.573 65.579 -55.779 1.00 49.97 ? 141 PRO C C 1 ATOM 3648 O O . PRO B 1 146 ? -51.988 66.640 -56.221 1.00 51.23 ? 141 PRO C O 1 ATOM 3649 C CB . PRO B 1 146 ? -52.976 63.807 -56.808 1.00 47.64 ? 141 PRO C CB 1 ATOM 3650 C CG . PRO B 1 146 ? -54.363 63.322 -56.496 1.00 52.14 ? 141 PRO C CG 1 ATOM 3651 C CD . PRO B 1 146 ? -54.950 64.405 -55.617 1.00 49.65 ? 141 PRO C CD 1 ATOM 3652 N N . SER B 1 147 ? -50.295 65.335 -55.527 1.00 47.06 ? 142 SER C N 1 ATOM 3653 C CA . SER B 1 147 ? -49.290 66.351 -55.755 1.00 42.28 ? 142 SER C CA 1 ATOM 3654 C C . SER B 1 147 ? -47.956 65.690 -56.153 1.00 44.78 ? 142 SER C C 1 ATOM 3655 O O . SER B 1 147 ? -47.929 64.606 -56.781 1.00 39.25 ? 142 SER C O 1 ATOM 3656 C CB . SER B 1 147 ? -49.141 67.188 -54.495 1.00 41.38 ? 142 SER C CB 1 ATOM 3657 O OG . SER B 1 147 ? -48.331 68.332 -54.714 1.00 37.61 ? 142 SER C OG 1 ATOM 3658 N N . PHE B 1 148 ? -46.853 66.344 -55.827 1.00 41.79 ? 143 PHE C N 1 ATOM 3659 C CA . PHE B 1 148 ? -45.550 65.850 -56.262 1.00 43.29 ? 143 PHE C CA 1 ATOM 3660 C C . PHE B 1 148 ? -44.417 66.617 -55.599 1.00 43.63 ? 143 PHE C C 1 ATOM 3661 O O . PHE B 1 148 ? -44.617 67.720 -55.095 1.00 44.76 ? 143 PHE C O 1 ATOM 3662 C CB . PHE B 1 148 ? -45.440 65.986 -57.798 1.00 44.05 ? 143 PHE C CB 1 ATOM 3663 C CG . PHE B 1 148 ? -44.322 65.165 -58.415 1.00 43.32 ? 143 PHE C CG 1 ATOM 3664 C CD1 . PHE B 1 148 ? -44.409 63.770 -58.479 1.00 40.78 ? 143 PHE C CD1 1 ATOM 3665 C CD2 . PHE B 1 148 ? -43.228 65.782 -58.952 1.00 38.93 ? 143 PHE C CD2 1 ATOM 3666 C CE1 . PHE B 1 148 ? -43.399 63.027 -59.018 1.00 41.35 ? 143 PHE C CE1 1 ATOM 3667 C CE2 . PHE B 1 148 ? -42.218 65.032 -59.518 1.00 41.21 ? 143 PHE C CE2 1 ATOM 3668 C CZ . PHE B 1 148 ? -42.293 63.661 -59.536 1.00 39.84 ? 143 PHE C CZ 1 ATOM 3669 N N . PHE B 1 149 ? -43.233 66.036 -55.651 1.00 42.84 ? 144 PHE C N 1 ATOM 3670 C CA . PHE B 1 149 ? -42.015 66.694 -55.198 1.00 43.86 ? 144 PHE C CA 1 ATOM 3671 C C . PHE B 1 149 ? -41.991 68.132 -55.722 1.00 45.00 ? 144 PHE C C 1 ATOM 3672 O O . PHE B 1 149 ? -42.153 68.349 -56.899 1.00 51.87 ? 144 PHE C O 1 ATOM 3673 C CB . PHE B 1 149 ? -40.763 65.986 -55.754 1.00 41.07 ? 144 PHE C CB 1 ATOM 3674 C CG . PHE B 1 149 ? -40.601 64.565 -55.315 1.00 38.56 ? 144 PHE C CG 1 ATOM 3675 C CD1 . PHE B 1 149 ? -40.218 64.258 -54.026 1.00 38.18 ? 144 PHE C CD1 1 ATOM 3676 C CD2 . PHE B 1 149 ? -40.812 63.531 -56.196 1.00 40.86 ? 144 PHE C CD2 1 ATOM 3677 C CE1 . PHE B 1 149 ? -40.019 62.941 -53.643 1.00 40.76 ? 144 PHE C CE1 1 ATOM 3678 C CE2 . PHE B 1 149 ? -40.625 62.199 -55.820 1.00 40.34 ? 144 PHE C CE2 1 ATOM 3679 C CZ . PHE B 1 149 ? -40.230 61.904 -54.544 1.00 39.84 ? 144 PHE C CZ 1 ATOM 3680 N N . ARG B 1 150 ? -41.762 69.095 -54.854 1.00 43.12 ? 145 ARG C N 1 ATOM 3681 C CA . ARG B 1 150 ? -41.893 70.504 -55.212 1.00 43.88 ? 145 ARG C CA 1 ATOM 3682 C C . ARG B 1 150 ? -40.710 71.156 -55.897 1.00 40.39 ? 145 ARG C C 1 ATOM 3683 O O . ARG B 1 150 ? -40.843 72.233 -56.445 1.00 42.08 ? 145 ARG C O 1 ATOM 3684 C CB . ARG B 1 150 ? -42.269 71.292 -53.957 1.00 51.35 ? 145 ARG C CB 1 ATOM 3685 C CG . ARG B 1 150 ? -43.640 70.840 -53.440 1.00 60.08 ? 145 ARG C CG 1 ATOM 3686 C CD . ARG B 1 150 ? -43.924 71.176 -51.980 1.00 70.48 ? 145 ARG C CD 1 ATOM 3687 N NE . ARG B 1 150 ? -44.436 72.523 -51.903 1.00 83.04 ? 145 ARG C NE 1 ATOM 3688 C CZ . ARG B 1 150 ? -45.646 72.897 -52.339 1.00 100.74 ? 145 ARG C CZ 1 ATOM 3689 N NH1 . ARG B 1 150 ? -46.512 71.994 -52.829 1.00 89.52 ? 145 ARG C NH1 1 ATOM 3690 N NH2 . ARG B 1 150 ? -45.989 74.195 -52.274 1.00 104.76 ? 145 ARG C NH2 1 ATOM 3691 N N . ASN B 1 151 ? -39.545 70.510 -55.878 1.00 39.96 ? 146 ASN C N 1 ATOM 3692 C CA . ASN B 1 151 ? -38.341 71.073 -56.444 1.00 37.37 ? 146 ASN C CA 1 ATOM 3693 C C . ASN B 1 151 ? -37.988 70.575 -57.844 1.00 37.18 ? 146 ASN C C 1 ATOM 3694 O O . ASN B 1 151 ? -37.026 71.081 -58.456 1.00 33.00 ? 146 ASN C O 1 ATOM 3695 C CB . ASN B 1 151 ? -37.175 70.831 -55.507 1.00 41.05 ? 146 ASN C CB 1 ATOM 3696 C CG . ASN B 1 151 ? -37.386 71.454 -54.170 1.00 40.39 ? 146 ASN C CG 1 ATOM 3697 O OD1 . ASN B 1 151 ? -36.992 70.893 -53.146 1.00 50.27 ? 146 ASN C OD1 1 ATOM 3698 N ND2 . ASN B 1 151 ? -38.008 72.598 -54.149 1.00 41.36 ? 146 ASN C ND2 1 ATOM 3699 N N . VAL B 1 152 ? -38.757 69.618 -58.353 1.00 34.24 ? 147 VAL C N 1 ATOM 3700 C CA . VAL B 1 152 ? -38.521 69.091 -59.682 1.00 35.95 ? 147 VAL C CA 1 ATOM 3701 C C . VAL B 1 152 ? -39.877 69.025 -60.321 1.00 38.00 ? 147 VAL C C 1 ATOM 3702 O O . VAL B 1 152 ? -40.866 69.117 -59.620 1.00 36.70 ? 147 VAL C O 1 ATOM 3703 C CB . VAL B 1 152 ? -37.868 67.690 -59.652 1.00 37.73 ? 147 VAL C CB 1 ATOM 3704 C CG1 . VAL B 1 152 ? -36.414 67.752 -59.162 1.00 38.43 ? 147 VAL C CG1 1 ATOM 3705 C CG2 . VAL B 1 152 ? -38.676 66.694 -58.791 1.00 37.14 ? 147 VAL C CG2 1 ATOM 3706 N N . VAL B 1 153 ? -39.913 68.799 -61.634 1.00 40.08 ? 148 VAL C N 1 ATOM 3707 C CA . VAL B 1 153 ? -41.163 68.809 -62.411 1.00 42.07 ? 148 VAL C CA 1 ATOM 3708 C C . VAL B 1 153 ? -41.291 67.591 -63.269 1.00 40.55 ? 148 VAL C C 1 ATOM 3709 O O . VAL B 1 153 ? -40.456 67.342 -64.121 1.00 41.62 ? 148 VAL C O 1 ATOM 3710 C CB . VAL B 1 153 ? -41.238 69.997 -63.404 1.00 44.33 ? 148 VAL C CB 1 ATOM 3711 C CG1 . VAL B 1 153 ? -42.612 70.086 -64.014 1.00 40.51 ? 148 VAL C CG1 1 ATOM 3712 C CG2 . VAL B 1 153 ? -40.961 71.293 -62.680 1.00 53.19 ? 148 VAL C CG2 1 ATOM 3713 N N . TRP B 1 154 ? -42.402 66.902 -63.107 1.00 39.67 ? 149 TRP C N 1 ATOM 3714 C CA . TRP B 1 154 ? -42.701 65.737 -63.889 1.00 38.85 ? 149 TRP C CA 1 ATOM 3715 C C . TRP B 1 154 ? -43.390 66.220 -65.171 1.00 43.08 ? 149 TRP C C 1 ATOM 3716 O O . TRP B 1 154 ? -44.608 66.320 -65.226 1.00 46.52 ? 149 TRP C O 1 ATOM 3717 C CB . TRP B 1 154 ? -43.585 64.809 -63.052 1.00 37.55 ? 149 TRP C CB 1 ATOM 3718 C CG . TRP B 1 154 ? -43.937 63.506 -63.640 1.00 35.50 ? 149 TRP C CG 1 ATOM 3719 C CD1 . TRP B 1 154 ? -43.539 63.004 -64.854 1.00 40.26 ? 149 TRP C CD1 1 ATOM 3720 C CD2 . TRP B 1 154 ? -44.764 62.512 -63.052 1.00 33.51 ? 149 TRP C CD2 1 ATOM 3721 N NE1 . TRP B 1 154 ? -44.059 61.732 -65.051 1.00 39.69 ? 149 TRP C NE1 1 ATOM 3722 C CE2 . TRP B 1 154 ? -44.806 61.409 -63.946 1.00 37.42 ? 149 TRP C CE2 1 ATOM 3723 C CE3 . TRP B 1 154 ? -45.437 62.423 -61.859 1.00 32.96 ? 149 TRP C CE3 1 ATOM 3724 C CZ2 . TRP B 1 154 ? -45.513 60.267 -63.678 1.00 38.96 ? 149 TRP C CZ2 1 ATOM 3725 C CZ3 . TRP B 1 154 ? -46.140 61.250 -61.585 1.00 35.44 ? 149 TRP C CZ3 1 ATOM 3726 C CH2 . TRP B 1 154 ? -46.185 60.201 -62.495 1.00 36.80 ? 149 TRP C CH2 1 ATOM 3727 N N . LEU B 1 155 ? -42.597 66.452 -66.215 1.00 44.02 ? 150 LEU C N 1 ATOM 3728 C CA . LEU B 1 155 ? -43.106 66.835 -67.548 1.00 43.17 ? 150 LEU C CA 1 ATOM 3729 C C . LEU B 1 155 ? -43.888 65.743 -68.276 1.00 43.85 ? 150 LEU C C 1 ATOM 3730 O O . LEU B 1 155 ? -43.523 64.565 -68.279 1.00 40.92 ? 150 LEU C O 1 ATOM 3731 C CB . LEU B 1 155 ? -41.967 67.263 -68.453 1.00 43.46 ? 150 LEU C CB 1 ATOM 3732 C CG . LEU B 1 155 ? -41.165 68.444 -67.942 1.00 42.63 ? 150 LEU C CG 1 ATOM 3733 C CD1 . LEU B 1 155 ? -40.013 68.624 -68.885 1.00 46.30 ? 150 LEU C CD1 1 ATOM 3734 C CD2 . LEU B 1 155 ? -41.996 69.714 -67.886 1.00 46.24 ? 150 LEU C CD2 1 ATOM 3735 N N . ILE B 1 156 ? -44.993 66.157 -68.879 1.00 50.21 ? 151 ILE C N 1 ATOM 3736 C CA . ILE B 1 156 ? -45.907 65.248 -69.603 1.00 50.21 ? 151 ILE C CA 1 ATOM 3737 C C . ILE B 1 156 ? -46.070 65.745 -71.056 1.00 48.37 ? 151 ILE C C 1 ATOM 3738 O O . ILE B 1 156 ? -45.857 66.911 -71.336 1.00 49.67 ? 151 ILE C O 1 ATOM 3739 C CB . ILE B 1 156 ? -47.261 65.178 -68.841 1.00 50.65 ? 151 ILE C CB 1 ATOM 3740 C CG1 . ILE B 1 156 ? -47.065 64.482 -67.486 1.00 54.15 ? 151 ILE C CG1 1 ATOM 3741 C CG2 . ILE B 1 156 ? -48.366 64.471 -69.615 1.00 48.05 ? 151 ILE C CG2 1 ATOM 3742 C CD1 . ILE B 1 156 ? -46.631 63.047 -67.566 1.00 51.04 ? 151 ILE C CD1 1 ATOM 3743 N N . LYS B 1 157 ? -46.445 64.860 -71.966 1.00 48.89 ? 152 LYS C N 1 ATOM 3744 C CA . LYS B 1 157 ? -46.744 65.265 -73.345 1.00 51.94 ? 152 LYS C CA 1 ATOM 3745 C C . LYS B 1 157 ? -47.847 66.339 -73.407 1.00 52.52 ? 152 LYS C C 1 ATOM 3746 O O . LYS B 1 157 ? -48.691 66.418 -72.538 1.00 52.05 ? 152 LYS C O 1 ATOM 3747 C CB . LYS B 1 157 ? -47.188 64.077 -74.175 1.00 49.28 ? 152 LYS C CB 1 ATOM 3748 C CG . LYS B 1 157 ? -48.621 63.667 -73.940 1.00 49.13 ? 152 LYS C CG 1 ATOM 3749 C CD . LYS B 1 157 ? -48.988 62.458 -74.770 1.00 53.10 ? 152 LYS C CD 1 ATOM 3750 C CE . LYS B 1 157 ? -50.452 62.052 -74.555 1.00 51.72 ? 152 LYS C CE 1 ATOM 3751 N NZ . LYS B 1 157 ? -50.719 60.693 -75.148 1.00 53.44 ? 152 LYS C NZ 1 ATOM 3752 N N . LYS B 1 158 ? -47.798 67.165 -74.438 1.00 51.47 ? 153 LYS C N 1 ATOM 3753 C CA . LYS B 1 158 ? -48.742 68.257 -74.627 1.00 56.55 ? 153 LYS C CA 1 ATOM 3754 C C . LYS B 1 158 ? -49.278 68.184 -76.055 1.00 57.78 ? 153 LYS C C 1 ATOM 3755 O O . LYS B 1 158 ? -48.522 67.911 -77.008 1.00 59.74 ? 153 LYS C O 1 ATOM 3756 C CB . LYS B 1 158 ? -48.083 69.618 -74.419 1.00 59.30 ? 153 LYS C CB 1 ATOM 3757 C CG . LYS B 1 158 ? -49.092 70.751 -74.342 1.00 63.43 ? 153 LYS C CG 1 ATOM 3758 C CD . LYS B 1 158 ? -48.415 72.095 -74.232 1.00 71.42 ? 153 LYS C CD 1 ATOM 3759 C CE . LYS B 1 158 ? -49.424 73.226 -74.346 1.00 75.91 ? 153 LYS C CE 1 ATOM 3760 N NZ . LYS B 1 158 ? -48.838 74.541 -73.958 1.00 79.29 ? 153 LYS C NZ 1 ATOM 3761 N N . ASN B 1 159 ? -50.572 68.446 -76.196 1.00 56.22 ? 154 ASN C N 1 ATOM 3762 C CA . ASN B 1 159 ? -51.271 68.093 -77.406 1.00 59.00 ? 154 ASN C CA 1 ATOM 3763 C C . ASN B 1 159 ? -51.003 66.609 -77.483 1.00 60.61 ? 154 ASN C C 1 ATOM 3764 O O . ASN B 1 159 ? -51.165 65.917 -76.448 1.00 69.79 ? 154 ASN C O 1 ATOM 3765 C CB . ASN B 1 159 ? -50.804 68.997 -78.541 1.00 58.35 ? 154 ASN C CB 1 ATOM 3766 C CG . ASN B 1 159 ? -50.943 70.493 -78.145 1.00 62.97 ? 154 ASN C CG 1 ATOM 3767 O OD1 . ASN B 1 159 ? -49.990 71.263 -78.208 1.00 65.64 ? 154 ASN C OD1 1 ATOM 3768 N ND2 . ASN B 1 159 ? -52.138 70.881 -77.671 1.00 61.98 ? 154 ASN C ND2 1 ATOM 3769 N N . ASP B 1 160 ? -50.593 66.041 -78.582 1.00 57.73 ? 155 ASP C N 1 ATOM 3770 C CA . ASP B 1 160 ? -50.249 64.603 -78.403 1.00 59.62 ? 155 ASP C CA 1 ATOM 3771 C C . ASP B 1 160 ? -48.781 64.410 -78.734 1.00 58.84 ? 155 ASP C C 1 ATOM 3772 O O . ASP B 1 160 ? -48.414 63.516 -79.513 1.00 61.60 ? 155 ASP C O 1 ATOM 3773 C CB . ASP B 1 160 ? -51.178 63.693 -79.236 1.00 65.14 ? 155 ASP C CB 1 ATOM 3774 C CG . ASP B 1 160 ? -51.040 62.208 -78.894 1.00 68.42 ? 155 ASP C CG 1 ATOM 3775 O OD1 . ASP B 1 160 ? -51.229 61.365 -79.790 1.00 72.62 ? 155 ASP C OD1 1 ATOM 3776 O OD2 . ASP B 1 160 ? -50.766 61.869 -77.730 1.00 82.84 ? 155 ASP C OD2 1 ATOM 3777 N N . ALA B 1 161 ? -47.942 65.286 -78.190 1.00 51.69 ? 156 ALA C N 1 ATOM 3778 C CA . ALA B 1 161 ? -46.529 65.269 -78.546 1.00 54.41 ? 156 ALA C CA 1 ATOM 3779 C C . ALA B 1 161 ? -45.596 65.587 -77.373 1.00 51.61 ? 156 ALA C C 1 ATOM 3780 O O . ALA B 1 161 ? -45.972 66.241 -76.410 1.00 47.11 ? 156 ALA C O 1 ATOM 3781 C CB . ALA B 1 161 ? -46.241 66.200 -79.712 1.00 51.05 ? 156 ALA C CB 1 ATOM 3782 N N . TYR B 1 162 ? -44.373 65.084 -77.499 1.00 48.88 ? 157 TYR C N 1 ATOM 3783 C CA . TYR B 1 162 ? -43.296 65.351 -76.568 1.00 49.50 ? 157 TYR C CA 1 ATOM 3784 C C . TYR B 1 162 ? -42.100 65.584 -77.488 1.00 52.13 ? 157 TYR C C 1 ATOM 3785 O O . TYR B 1 162 ? -41.383 64.658 -77.842 1.00 48.12 ? 157 TYR C O 1 ATOM 3786 C CB . TYR B 1 162 ? -43.091 64.168 -75.603 1.00 44.53 ? 157 TYR C CB 1 ATOM 3787 C CG . TYR B 1 162 ? -42.245 64.469 -74.384 1.00 44.99 ? 157 TYR C CG 1 ATOM 3788 C CD1 . TYR B 1 162 ? -40.879 64.776 -74.502 1.00 42.56 ? 157 TYR C CD1 1 ATOM 3789 C CD2 . TYR B 1 162 ? -42.786 64.378 -73.086 1.00 41.80 ? 157 TYR C CD2 1 ATOM 3790 C CE1 . TYR B 1 162 ? -40.111 65.046 -73.378 1.00 42.40 ? 157 TYR C CE1 1 ATOM 3791 C CE2 . TYR B 1 162 ? -42.015 64.633 -71.952 1.00 39.00 ? 157 TYR C CE2 1 ATOM 3792 C CZ . TYR B 1 162 ? -40.676 64.952 -72.097 1.00 42.05 ? 157 TYR C CZ 1 ATOM 3793 O OH . TYR B 1 162 ? -39.885 65.167 -70.972 1.00 42.34 ? 157 TYR C OH 1 ATOM 3794 N N . PRO B 1 163 ? -41.919 66.827 -77.924 1.00 56.57 ? 158 PRO C N 1 ATOM 3795 C CA . PRO B 1 163 ? -40.734 67.154 -78.681 1.00 57.45 ? 158 PRO C CA 1 ATOM 3796 C C . PRO B 1 163 ? -39.487 67.040 -77.816 1.00 57.37 ? 158 PRO C C 1 ATOM 3797 O O . PRO B 1 163 ? -39.546 67.189 -76.604 1.00 54.12 ? 158 PRO C O 1 ATOM 3798 C CB . PRO B 1 163 ? -40.962 68.617 -79.116 1.00 58.40 ? 158 PRO C CB 1 ATOM 3799 C CG . PRO B 1 163 ? -42.002 69.151 -78.208 1.00 57.50 ? 158 PRO C CG 1 ATOM 3800 C CD . PRO B 1 163 ? -42.779 67.993 -77.668 1.00 58.56 ? 158 PRO C CD 1 ATOM 3801 N N . THR B 1 164 ? -38.365 66.819 -78.479 1.00 55.45 ? 159 THR C N 1 ATOM 3802 C CA . THR B 1 164 ? -37.133 66.533 -77.834 1.00 53.09 ? 159 THR C CA 1 ATOM 3803 C C . THR B 1 164 ? -36.609 67.767 -77.160 1.00 52.54 ? 159 THR C C 1 ATOM 3804 O O . THR B 1 164 ? -36.430 68.796 -77.800 1.00 59.83 ? 159 THR C O 1 ATOM 3805 C CB . THR B 1 164 ? -36.112 66.032 -78.852 1.00 56.44 ? 159 THR C CB 1 ATOM 3806 O OG1 . THR B 1 164 ? -36.583 64.795 -79.397 1.00 56.33 ? 159 THR C OG1 1 ATOM 3807 C CG2 . THR B 1 164 ? -34.750 65.812 -78.186 1.00 58.70 ? 159 THR C CG2 1 ATOM 3808 N N . ILE B 1 165 ? -36.402 67.658 -75.857 1.00 48.29 ? 160 ILE C N 1 ATOM 3809 C CA . ILE B 1 165 ? -35.938 68.758 -75.046 1.00 48.66 ? 160 ILE C CA 1 ATOM 3810 C C . ILE B 1 165 ? -34.444 68.883 -75.257 1.00 51.69 ? 160 ILE C C 1 ATOM 3811 O O . ILE B 1 165 ? -33.751 67.859 -75.265 1.00 48.64 ? 160 ILE C O 1 ATOM 3812 C CB . ILE B 1 165 ? -36.258 68.500 -73.564 1.00 48.90 ? 160 ILE C CB 1 ATOM 3813 C CG1 . ILE B 1 165 ? -37.765 68.627 -73.332 1.00 53.15 ? 160 ILE C CG1 1 ATOM 3814 C CG2 . ILE B 1 165 ? -35.515 69.478 -72.660 1.00 48.30 ? 160 ILE C CG2 1 ATOM 3815 C CD1 . ILE B 1 165 ? -38.272 67.909 -72.084 1.00 55.51 ? 160 ILE C CD1 1 ATOM 3816 N N . LYS B 1 166 ? -33.954 70.120 -75.426 1.00 52.02 ? 161 LYS C N 1 ATOM 3817 C CA . LYS B 1 166 ? -32.495 70.428 -75.405 1.00 58.54 ? 161 LYS C CA 1 ATOM 3818 C C . LYS B 1 166 ? -32.297 71.731 -74.702 1.00 56.12 ? 161 LYS C C 1 ATOM 3819 O O . LYS B 1 166 ? -32.598 72.761 -75.253 1.00 65.35 ? 161 LYS C O 1 ATOM 3820 C CB . LYS B 1 166 ? -31.872 70.573 -76.794 1.00 63.15 ? 161 LYS C CB 1 ATOM 3821 C CG . LYS B 1 166 ? -31.933 69.320 -77.641 1.00 73.96 ? 161 LYS C CG 1 ATOM 3822 C CD . LYS B 1 166 ? -31.274 69.487 -79.002 1.00 79.53 ? 161 LYS C CD 1 ATOM 3823 C CE . LYS B 1 166 ? -31.719 68.360 -79.937 1.00 87.34 ? 161 LYS C CE 1 ATOM 3824 N NZ . LYS B 1 166 ? -30.718 68.013 -80.974 1.00 90.81 ? 161 LYS C NZ 1 ATOM 3825 N N . ILE B 1 167 ? -31.840 71.700 -73.463 1.00 55.06 ? 162 ILE C N 1 ATOM 3826 C CA . ILE B 1 167 ? -31.676 72.941 -72.712 1.00 54.55 ? 162 ILE C CA 1 ATOM 3827 C C . ILE B 1 167 ? -30.373 72.917 -72.000 1.00 49.77 ? 162 ILE C C 1 ATOM 3828 O O . ILE B 1 167 ? -29.788 71.857 -71.800 1.00 46.58 ? 162 ILE C O 1 ATOM 3829 C CB . ILE B 1 167 ? -32.804 73.165 -71.679 1.00 55.01 ? 162 ILE C CB 1 ATOM 3830 C CG1 . ILE B 1 167 ? -32.837 72.008 -70.681 1.00 57.77 ? 162 ILE C CG1 1 ATOM 3831 C CG2 . ILE B 1 167 ? -34.160 73.281 -72.384 1.00 53.02 ? 162 ILE C CG2 1 ATOM 3832 C CD1 . ILE B 1 167 ? -33.564 72.359 -69.398 1.00 62.63 ? 162 ILE C CD1 1 ATOM 3833 N N . SER B 1 168 ? -29.932 74.086 -71.574 1.00 48.84 ? 163 SER C N 1 ATOM 3834 C CA . SER B 1 168 ? -28.749 74.141 -70.729 1.00 53.33 ? 163 SER C CA 1 ATOM 3835 C C . SER B 1 168 ? -28.892 75.236 -69.712 1.00 47.47 ? 163 SER C C 1 ATOM 3836 O O . SER B 1 168 ? -29.689 76.121 -69.884 1.00 57.28 ? 163 SER C O 1 ATOM 3837 C CB . SER B 1 168 ? -27.475 74.267 -71.583 1.00 53.16 ? 163 SER C CB 1 ATOM 3838 O OG . SER B 1 168 ? -27.420 75.514 -72.180 1.00 56.05 ? 163 SER C OG 1 ATOM 3839 N N . TYR B 1 169 ? -28.225 75.084 -68.591 1.00 50.55 ? 164 TYR C N 1 ATOM 3840 C CA . TYR B 1 169 ? -28.219 76.088 -67.535 1.00 47.92 ? 164 TYR C CA 1 ATOM 3841 C C . TYR B 1 169 ? -26.777 76.332 -67.175 1.00 52.37 ? 164 TYR C C 1 ATOM 3842 O O . TYR B 1 169 ? -26.039 75.398 -66.806 1.00 53.33 ? 164 TYR C O 1 ATOM 3843 C CB . TYR B 1 169 ? -29.001 75.655 -66.281 1.00 47.15 ? 164 TYR C CB 1 ATOM 3844 C CG . TYR B 1 169 ? -28.805 76.615 -65.122 1.00 46.95 ? 164 TYR C CG 1 ATOM 3845 C CD1 . TYR B 1 169 ? -29.580 77.768 -65.001 1.00 52.32 ? 164 TYR C CD1 1 ATOM 3846 C CD2 . TYR B 1 169 ? -27.833 76.389 -64.156 1.00 45.97 ? 164 TYR C CD2 1 ATOM 3847 C CE1 . TYR B 1 169 ? -29.405 78.665 -63.937 1.00 47.65 ? 164 TYR C CE1 1 ATOM 3848 C CE2 . TYR B 1 169 ? -27.661 77.271 -63.101 1.00 48.43 ? 164 TYR C CE2 1 ATOM 3849 C CZ . TYR B 1 169 ? -28.449 78.396 -62.989 1.00 48.03 ? 164 TYR C CZ 1 ATOM 3850 O OH . TYR B 1 169 ? -28.238 79.258 -61.955 1.00 55.24 ? 164 TYR C OH 1 ATOM 3851 N N . ASN B 1 170 ? -26.397 77.601 -67.230 1.00 52.71 ? 165 ASN C N 1 ATOM 3852 C CA . ASN B 1 170 ? -25.093 78.021 -66.827 1.00 55.53 ? 165 ASN C CA 1 ATOM 3853 C C . ASN B 1 170 ? -25.120 78.491 -65.365 1.00 52.09 ? 165 ASN C C 1 ATOM 3854 O O . ASN B 1 170 ? -25.954 79.304 -64.991 1.00 50.59 ? 165 ASN C O 1 ATOM 3855 C CB . ASN B 1 170 ? -24.674 79.148 -67.752 1.00 62.89 ? 165 ASN C CB 1 ATOM 3856 C CG . ASN B 1 170 ? -23.251 79.628 -67.511 1.00 66.41 ? 165 ASN C CG 1 ATOM 3857 O OD1 . ASN B 1 170 ? -22.807 79.797 -66.380 1.00 65.96 ? 165 ASN C OD1 1 ATOM 3858 N ND2 . ASN B 1 170 ? -22.530 79.866 -68.593 1.00 71.21 ? 165 ASN C ND2 1 ATOM 3859 N N . ASN B 1 171 ? -24.204 77.986 -64.545 1.00 50.83 ? 166 ASN C N 1 ATOM 3860 C CA . ASN B 1 171 ? -24.107 78.458 -63.159 1.00 50.78 ? 166 ASN C CA 1 ATOM 3861 C C . ASN B 1 171 ? -23.410 79.818 -63.061 1.00 55.23 ? 166 ASN C C 1 ATOM 3862 O O . ASN B 1 171 ? -22.221 79.918 -62.851 1.00 56.67 ? 166 ASN C O 1 ATOM 3863 C CB . ASN B 1 171 ? -23.438 77.425 -62.256 1.00 48.59 ? 166 ASN C CB 1 ATOM 3864 C CG . ASN B 1 171 ? -23.384 77.860 -60.815 1.00 47.56 ? 166 ASN C CG 1 ATOM 3865 O OD1 . ASN B 1 171 ? -23.931 78.890 -60.427 1.00 47.36 ? 166 ASN C OD1 1 ATOM 3866 N ND2 . ASN B 1 171 ? -22.659 77.102 -60.016 1.00 45.84 ? 166 ASN C ND2 1 ATOM 3867 N N . THR B 1 172 ? -24.194 80.881 -63.184 1.00 62.21 ? 167 THR C N 1 ATOM 3868 C CA . THR B 1 172 ? -23.662 82.242 -63.077 1.00 62.14 ? 167 THR C CA 1 ATOM 3869 C C . THR B 1 172 ? -23.556 82.727 -61.639 1.00 61.62 ? 167 THR C C 1 ATOM 3870 O O . THR B 1 172 ? -23.168 83.844 -61.401 1.00 67.71 ? 167 THR C O 1 ATOM 3871 C CB . THR B 1 172 ? -24.529 83.249 -63.848 1.00 59.80 ? 167 THR C CB 1 ATOM 3872 O OG1 . THR B 1 172 ? -25.848 83.209 -63.342 1.00 55.65 ? 167 THR C OG1 1 ATOM 3873 C CG2 . THR B 1 172 ? -24.572 82.902 -65.315 1.00 61.22 ? 167 THR C CG2 1 ATOM 3874 N N . ASN B 1 173 ? -23.877 81.888 -60.676 1.00 62.38 ? 168 ASN C N 1 ATOM 3875 C CA . ASN B 1 173 ? -23.638 82.233 -59.283 1.00 60.49 ? 168 ASN C CA 1 ATOM 3876 C C . ASN B 1 173 ? -22.134 82.065 -58.972 1.00 63.70 ? 168 ASN C C 1 ATOM 3877 O O . ASN B 1 173 ? -21.363 81.574 -59.794 1.00 60.55 ? 168 ASN C O 1 ATOM 3878 C CB . ASN B 1 173 ? -24.500 81.364 -58.360 1.00 60.07 ? 168 ASN C CB 1 ATOM 3879 C CG . ASN B 1 173 ? -25.972 81.359 -58.764 1.00 60.91 ? 168 ASN C CG 1 ATOM 3880 O OD1 . ASN B 1 173 ? -26.704 82.275 -58.402 1.00 63.26 ? 168 ASN C OD1 1 ATOM 3881 N ND2 . ASN B 1 173 ? -26.411 80.337 -59.522 1.00 54.74 ? 168 ASN C ND2 1 ATOM 3882 N N . GLN B 1 174 ? -21.732 82.463 -57.777 1.00 63.35 ? 169 GLN C N 1 ATOM 3883 C CA . GLN B 1 174 ? -20.349 82.356 -57.352 1.00 65.90 ? 169 GLN C CA 1 ATOM 3884 C C . GLN B 1 174 ? -20.134 81.094 -56.557 1.00 64.12 ? 169 GLN C C 1 ATOM 3885 O O . GLN B 1 174 ? -19.026 80.793 -56.153 1.00 65.90 ? 169 GLN C O 1 ATOM 3886 C CB . GLN B 1 174 ? -19.951 83.578 -56.523 1.00 76.63 ? 169 GLN C CB 1 ATOM 3887 C CG . GLN B 1 174 ? -19.194 84.664 -57.308 1.00 86.27 ? 169 GLN C CG 1 ATOM 3888 C CD . GLN B 1 174 ? -19.854 85.052 -58.635 1.00 89.52 ? 169 GLN C CD 1 ATOM 3889 O OE1 . GLN B 1 174 ? -21.075 85.195 -58.715 1.00 98.41 ? 169 GLN C OE1 1 ATOM 3890 N NE2 . GLN B 1 174 ? -19.044 85.215 -59.684 1.00 90.10 ? 169 GLN C NE2 1 ATOM 3891 N N . GLU B 1 175 ? -21.202 80.343 -56.347 1.00 65.18 ? 170 GLU C N 1 ATOM 3892 C CA . GLU B 1 175 ? -21.161 79.130 -55.524 1.00 64.49 ? 170 GLU C CA 1 ATOM 3893 C C . GLU B 1 175 ? -21.513 77.912 -56.327 1.00 56.97 ? 170 GLU C C 1 ATOM 3894 O O . GLU B 1 175 ? -22.262 78.003 -57.295 1.00 55.16 ? 170 GLU C O 1 ATOM 3895 C CB . GLU B 1 175 ? -22.144 79.255 -54.365 1.00 68.62 ? 170 GLU C CB 1 ATOM 3896 C CG . GLU B 1 175 ? -21.571 80.073 -53.238 1.00 77.19 ? 170 GLU C CG 1 ATOM 3897 C CD . GLU B 1 175 ? -22.540 81.053 -52.664 1.00 87.83 ? 170 GLU C CD 1 ATOM 3898 O OE1 . GLU B 1 175 ? -22.881 82.038 -53.369 1.00 112.60 ? 170 GLU C OE1 1 ATOM 3899 O OE2 . GLU B 1 175 ? -22.928 80.852 -51.504 1.00 94.06 ? 170 GLU C OE2 1 ATOM 3900 N N . ASP B 1 176 ? -20.945 76.785 -55.932 1.00 50.73 ? 171 ASP C N 1 ATOM 3901 C CA . ASP B 1 176 ? -21.373 75.484 -56.451 1.00 49.85 ? 171 ASP C CA 1 ATOM 3902 C C . ASP B 1 176 ? -22.874 75.314 -56.328 1.00 44.71 ? 171 ASP C C 1 ATOM 3903 O O . ASP B 1 176 ? -23.491 75.801 -55.407 1.00 42.64 ? 171 ASP C O 1 ATOM 3904 C CB . ASP B 1 176 ? -20.769 74.346 -55.642 1.00 51.97 ? 171 ASP C CB 1 ATOM 3905 C CG . ASP B 1 176 ? -19.280 74.126 -55.901 1.00 55.47 ? 171 ASP C CG 1 ATOM 3906 O OD1 . ASP B 1 176 ? -18.713 74.678 -56.866 1.00 60.95 ? 171 ASP C OD1 1 ATOM 3907 O OD2 . ASP B 1 176 ? -18.666 73.397 -55.085 1.00 57.40 ? 171 ASP C OD2 1 ATOM 3908 N N . LEU B 1 177 ? -23.458 74.586 -57.261 1.00 42.41 ? 172 LEU C N 1 ATOM 3909 C CA . LEU B 1 177 ? -24.890 74.339 -57.265 1.00 43.51 ? 172 LEU C CA 1 ATOM 3910 C C . LEU B 1 177 ? -25.160 72.823 -57.184 1.00 42.48 ? 172 LEU C C 1 ATOM 3911 O O . LEU B 1 177 ? -24.598 72.032 -57.952 1.00 41.08 ? 172 LEU C O 1 ATOM 3912 C CB . LEU B 1 177 ? -25.421 74.901 -58.569 1.00 46.15 ? 172 LEU C CB 1 ATOM 3913 C CG . LEU B 1 177 ? -26.644 75.782 -58.621 1.00 53.27 ? 172 LEU C CG 1 ATOM 3914 C CD1 . LEU B 1 177 ? -26.604 76.899 -57.597 1.00 54.44 ? 172 LEU C CD1 1 ATOM 3915 C CD2 . LEU B 1 177 ? -26.732 76.329 -60.028 1.00 57.23 ? 172 LEU C CD2 1 ATOM 3916 N N . LEU B 1 178 ? -25.975 72.410 -56.234 1.00 41.81 ? 173 LEU C N 1 ATOM 3917 C CA . LEU B 1 178 ? -26.406 71.022 -56.172 1.00 38.17 ? 173 LEU C CA 1 ATOM 3918 C C . LEU B 1 178 ? -27.650 70.941 -56.991 1.00 36.88 ? 173 LEU C C 1 ATOM 3919 O O . LEU B 1 178 ? -28.651 71.588 -56.677 1.00 37.04 ? 173 LEU C O 1 ATOM 3920 C CB . LEU B 1 178 ? -26.668 70.583 -54.727 1.00 37.36 ? 173 LEU C CB 1 ATOM 3921 C CG . LEU B 1 178 ? -27.467 69.269 -54.486 1.00 37.68 ? 173 LEU C CG 1 ATOM 3922 C CD1 . LEU B 1 178 ? -26.743 68.070 -55.031 1.00 36.90 ? 173 LEU C CD1 1 ATOM 3923 C CD2 . LEU B 1 178 ? -27.679 69.041 -53.003 1.00 36.63 ? 173 LEU C CD2 1 ATOM 3924 N N . ILE B 1 179 ? -27.593 70.162 -58.057 1.00 35.89 ? 174 ILE C N 1 ATOM 3925 C CA . ILE B 1 179 ? -28.746 69.985 -58.981 1.00 36.97 ? 174 ILE C CA 1 ATOM 3926 C C . ILE B 1 179 ? -29.197 68.506 -59.013 1.00 38.04 ? 174 ILE C C 1 ATOM 3927 O O . ILE B 1 179 ? -28.356 67.590 -58.982 1.00 38.74 ? 174 ILE C O 1 ATOM 3928 C CB . ILE B 1 179 ? -28.391 70.428 -60.402 1.00 36.19 ? 174 ILE C CB 1 ATOM 3929 C CG1 . ILE B 1 179 ? -27.861 71.869 -60.378 1.00 38.63 ? 174 ILE C CG1 1 ATOM 3930 C CG2 . ILE B 1 179 ? -29.581 70.324 -61.326 1.00 37.14 ? 174 ILE C CG2 1 ATOM 3931 C CD1 . ILE B 1 179 ? -27.497 72.417 -61.742 1.00 40.64 ? 174 ILE C CD1 1 ATOM 3932 N N . LEU B 1 180 ? -30.515 68.311 -59.054 1.00 36.42 ? 175 LEU C N 1 ATOM 3933 C CA . LEU B 1 180 ? -31.150 67.023 -59.071 1.00 37.14 ? 175 LEU C CA 1 ATOM 3934 C C . LEU B 1 180 ? -32.182 66.924 -60.170 1.00 36.72 ? 175 LEU C C 1 ATOM 3935 O O . LEU B 1 180 ? -32.864 67.896 -60.465 1.00 42.68 ? 175 LEU C O 1 ATOM 3936 C CB . LEU B 1 180 ? -31.857 66.736 -57.751 1.00 38.46 ? 175 LEU C CB 1 ATOM 3937 C CG . LEU B 1 180 ? -30.961 66.774 -56.513 1.00 40.62 ? 175 LEU C CG 1 ATOM 3938 C CD1 . LEU B 1 180 ? -31.254 67.985 -55.653 1.00 41.44 ? 175 LEU C CD1 1 ATOM 3939 C CD2 . LEU B 1 180 ? -31.144 65.532 -55.667 1.00 44.10 ? 175 LEU C CD2 1 ATOM 3940 N N . TRP B 1 181 ? -32.308 65.718 -60.726 1.00 34.00 ? 176 TRP C N 1 ATOM 3941 C CA . TRP B 1 181 ? -33.269 65.387 -61.763 1.00 36.46 ? 176 TRP C CA 1 ATOM 3942 C C . TRP B 1 181 ? -33.512 63.898 -61.665 1.00 35.64 ? 176 TRP C C 1 ATOM 3943 O O . TRP B 1 181 ? -32.828 63.212 -60.928 1.00 34.35 ? 176 TRP C O 1 ATOM 3944 C CB . TRP B 1 181 ? -32.701 65.710 -63.172 1.00 38.57 ? 176 TRP C CB 1 ATOM 3945 C CG . TRP B 1 181 ? -31.470 64.915 -63.492 1.00 37.45 ? 176 TRP C CG 1 ATOM 3946 C CD1 . TRP B 1 181 ? -31.385 63.742 -64.212 1.00 38.11 ? 176 TRP C CD1 1 ATOM 3947 C CD2 . TRP B 1 181 ? -30.146 65.217 -63.073 1.00 39.24 ? 176 TRP C CD2 1 ATOM 3948 N NE1 . TRP B 1 181 ? -30.072 63.308 -64.265 1.00 36.46 ? 176 TRP C NE1 1 ATOM 3949 C CE2 . TRP B 1 181 ? -29.295 64.205 -63.585 1.00 37.09 ? 176 TRP C CE2 1 ATOM 3950 C CE3 . TRP B 1 181 ? -29.579 66.283 -62.371 1.00 40.24 ? 176 TRP C CE3 1 ATOM 3951 C CZ2 . TRP B 1 181 ? -27.952 64.209 -63.367 1.00 37.46 ? 176 TRP C CZ2 1 ATOM 3952 C CZ3 . TRP B 1 181 ? -28.219 66.287 -62.171 1.00 39.66 ? 176 TRP C CZ3 1 ATOM 3953 C CH2 . TRP B 1 181 ? -27.423 65.258 -62.666 1.00 38.83 ? 176 TRP C CH2 1 ATOM 3954 N N . GLY B 1 182 ? -34.404 63.379 -62.499 1.00 35.74 ? 177 GLY C N 1 ATOM 3955 C CA . GLY B 1 182 ? -34.763 61.974 -62.421 1.00 35.23 ? 177 GLY C CA 1 ATOM 3956 C C . GLY B 1 182 ? -35.275 61.377 -63.724 1.00 34.68 ? 177 GLY C C 1 ATOM 3957 O O . GLY B 1 182 ? -35.550 62.091 -64.674 1.00 34.93 ? 177 GLY C O 1 ATOM 3958 N N . VAL B 1 183 ? -35.388 60.053 -63.724 1.00 33.51 ? 178 VAL C N 1 ATOM 3959 C CA . VAL B 1 183 ? -35.997 59.313 -64.782 1.00 33.31 ? 178 VAL C CA 1 ATOM 3960 C C . VAL B 1 183 ? -37.206 58.565 -64.215 1.00 35.89 ? 178 VAL C C 1 ATOM 3961 O O . VAL B 1 183 ? -37.136 57.995 -63.108 1.00 40.41 ? 178 VAL C O 1 ATOM 3962 C CB . VAL B 1 183 ? -35.022 58.328 -65.461 1.00 33.06 ? 178 VAL C CB 1 ATOM 3963 C CG1 . VAL B 1 183 ? -34.468 57.323 -64.511 1.00 33.41 ? 178 VAL C CG1 1 ATOM 3964 C CG2 . VAL B 1 183 ? -35.720 57.610 -66.624 1.00 33.04 ? 178 VAL C CG2 1 ATOM 3965 N N . HIS B 1 184 ? -38.296 58.573 -64.983 1.00 33.84 ? 179 HIS C N 1 ATOM 3966 C CA . HIS B 1 184 ? -39.509 57.824 -64.644 1.00 37.57 ? 179 HIS C CA 1 ATOM 3967 C C . HIS B 1 184 ? -39.555 56.494 -65.393 1.00 38.98 ? 179 HIS C C 1 ATOM 3968 O O . HIS B 1 184 ? -39.544 56.454 -66.611 1.00 43.90 ? 179 HIS C O 1 ATOM 3969 C CB . HIS B 1 184 ? -40.786 58.625 -64.966 1.00 37.35 ? 179 HIS C CB 1 ATOM 3970 C CG . HIS B 1 184 ? -42.039 57.861 -64.707 1.00 39.46 ? 179 HIS C CG 1 ATOM 3971 N ND1 . HIS B 1 184 ? -43.045 57.747 -65.640 1.00 44.68 ? 179 HIS C ND1 1 ATOM 3972 C CD2 . HIS B 1 184 ? -42.434 57.127 -63.642 1.00 42.12 ? 179 HIS C CD2 1 ATOM 3973 C CE1 . HIS B 1 184 ? -44.021 57.001 -65.151 1.00 48.12 ? 179 HIS C CE1 1 ATOM 3974 N NE2 . HIS B 1 184 ? -43.673 56.607 -63.940 1.00 47.38 ? 179 HIS C NE2 1 ATOM 3975 N N . HIS B 1 185 ? -39.572 55.412 -64.642 1.00 40.09 ? 180 HIS C N 1 ATOM 3976 C CA . HIS B 1 185 ? -39.760 54.085 -65.192 1.00 36.17 ? 180 HIS C CA 1 ATOM 3977 C C . HIS B 1 185 ? -41.231 53.783 -65.236 1.00 37.54 ? 180 HIS C C 1 ATOM 3978 O O . HIS B 1 185 ? -41.874 53.602 -64.186 1.00 35.60 ? 180 HIS C O 1 ATOM 3979 C CB . HIS B 1 185 ? -39.093 53.055 -64.291 1.00 37.99 ? 180 HIS C CB 1 ATOM 3980 C CG . HIS B 1 185 ? -37.637 53.298 -64.085 1.00 35.19 ? 180 HIS C CG 1 ATOM 3981 N ND1 . HIS B 1 185 ? -36.726 53.187 -65.110 1.00 36.40 ? 180 HIS C ND1 1 ATOM 3982 C CD2 . HIS B 1 185 ? -36.932 53.630 -62.984 1.00 33.93 ? 180 HIS C CD2 1 ATOM 3983 C CE1 . HIS B 1 185 ? -35.524 53.498 -64.663 1.00 38.15 ? 180 HIS C CE1 1 ATOM 3984 N NE2 . HIS B 1 185 ? -35.614 53.730 -63.365 1.00 34.44 ? 180 HIS C NE2 1 ATOM 3985 N N . SER B 1 186 ? -41.769 53.741 -66.448 1.00 36.56 ? 181 SER C N 1 ATOM 3986 C CA . SER B 1 186 ? -43.191 53.504 -66.662 1.00 38.54 ? 181 SER C CA 1 ATOM 3987 C C . SER B 1 186 ? -43.442 52.006 -66.604 1.00 39.30 ? 181 SER C C 1 ATOM 3988 O O . SER B 1 186 ? -42.491 51.230 -66.627 1.00 39.65 ? 181 SER C O 1 ATOM 3989 C CB . SER B 1 186 ? -43.635 54.085 -68.019 1.00 41.47 ? 181 SER C CB 1 ATOM 3990 O OG . SER B 1 186 ? -42.798 53.651 -69.100 1.00 43.88 ? 181 SER C OG 1 ATOM 3991 N N . ASN B 1 187 ? -44.711 51.618 -66.583 1.00 38.80 ? 182 ASN C N 1 ATOM 3992 C CA . ASN B 1 187 ? -45.105 50.209 -66.373 1.00 44.16 ? 182 ASN C CA 1 ATOM 3993 C C . ASN B 1 187 ? -45.356 49.334 -67.605 1.00 44.63 ? 182 ASN C C 1 ATOM 3994 O O . ASN B 1 187 ? -45.220 48.119 -67.521 1.00 39.91 ? 182 ASN C O 1 ATOM 3995 C CB . ASN B 1 187 ? -46.319 50.175 -65.484 1.00 42.76 ? 182 ASN C CB 1 ATOM 3996 C CG . ASN B 1 187 ? -46.039 50.818 -64.169 1.00 49.07 ? 182 ASN C CG 1 ATOM 3997 O OD1 . ASN B 1 187 ? -44.978 50.602 -63.592 1.00 44.45 ? 182 ASN C OD1 1 ATOM 3998 N ND2 . ASN B 1 187 ? -46.966 51.633 -63.683 1.00 55.35 ? 182 ASN C ND2 1 ATOM 3999 N N . ASN B 1 188 ? -45.706 49.958 -68.728 1.00 45.67 ? 183 ASN C N 1 ATOM 4000 C CA . ASN B 1 188 ? -45.982 49.267 -69.984 1.00 47.14 ? 183 ASN C CA 1 ATOM 4001 C C . ASN B 1 188 ? -46.110 50.245 -71.141 1.00 46.64 ? 183 ASN C C 1 ATOM 4002 O O . ASN B 1 188 ? -46.171 51.447 -70.941 1.00 52.09 ? 183 ASN C O 1 ATOM 4003 C CB . ASN B 1 188 ? -47.256 48.438 -69.886 1.00 47.52 ? 183 ASN C CB 1 ATOM 4004 C CG . ASN B 1 188 ? -48.429 49.250 -69.422 1.00 50.47 ? 183 ASN C CG 1 ATOM 4005 O OD1 . ASN B 1 188 ? -48.903 50.182 -70.104 1.00 52.64 ? 183 ASN C OD1 1 ATOM 4006 N ND2 . ASN B 1 188 ? -48.913 48.910 -68.252 1.00 50.31 ? 183 ASN C ND2 1 ATOM 4007 N N . ALA B 1 189 ? -46.147 49.695 -72.349 1.00 52.39 ? 184 ALA C N 1 ATOM 4008 C CA . ALA B 1 189 ? -46.186 50.474 -73.586 1.00 54.25 ? 184 ALA C CA 1 ATOM 4009 C C . ALA B 1 189 ? -47.348 51.460 -73.644 1.00 50.88 ? 184 ALA C C 1 ATOM 4010 O O . ALA B 1 189 ? -47.174 52.582 -74.107 1.00 51.79 ? 184 ALA C O 1 ATOM 4011 C CB . ALA B 1 189 ? -46.228 49.553 -74.797 1.00 55.95 ? 184 ALA C CB 1 ATOM 4012 N N . ALA B 1 190 ? -48.510 51.057 -73.162 1.00 49.38 ? 185 ALA C N 1 ATOM 4013 C CA . ALA B 1 190 ? -49.681 51.942 -73.198 1.00 53.71 ? 185 ALA C CA 1 ATOM 4014 C C . ALA B 1 190 ? -49.490 53.163 -72.316 1.00 52.56 ? 185 ALA C C 1 ATOM 4015 O O . ALA B 1 190 ? -49.810 54.275 -72.719 1.00 58.38 ? 185 ALA C O 1 ATOM 4016 C CB . ALA B 1 190 ? -50.942 51.184 -72.773 1.00 52.54 ? 185 ALA C CB 1 ATOM 4017 N N . GLU B 1 191 ? -48.986 52.949 -71.103 1.00 53.74 ? 186 GLU C N 1 ATOM 4018 C CA . GLU B 1 191 ? -48.766 54.049 -70.149 1.00 48.69 ? 186 GLU C CA 1 ATOM 4019 C C . GLU B 1 191 ? -47.718 54.982 -70.721 1.00 47.06 ? 186 GLU C C 1 ATOM 4020 O O . GLU B 1 191 ? -47.851 56.201 -70.634 1.00 43.60 ? 186 GLU C O 1 ATOM 4021 C CB . GLU B 1 191 ? -48.330 53.486 -68.801 1.00 49.53 ? 186 GLU C CB 1 ATOM 4022 C CG . GLU B 1 191 ? -47.984 54.521 -67.751 1.00 50.99 ? 186 GLU C CG 1 ATOM 4023 C CD . GLU B 1 191 ? -47.697 53.901 -66.394 1.00 56.88 ? 186 GLU C CD 1 ATOM 4024 O OE1 . GLU B 1 191 ? -48.630 53.296 -65.799 1.00 68.08 ? 186 GLU C OE1 1 ATOM 4025 O OE2 . GLU B 1 191 ? -46.531 53.987 -65.929 1.00 50.65 ? 186 GLU C OE2 1 ATOM 4026 N N . GLN B 1 192 ? -46.679 54.385 -71.318 1.00 45.41 ? 187 GLN C N 1 ATOM 4027 C CA . GLN B 1 192 ? -45.580 55.133 -71.938 1.00 47.11 ? 187 GLN C CA 1 ATOM 4028 C C . GLN B 1 192 ? -46.091 56.115 -72.996 1.00 50.11 ? 187 GLN C C 1 ATOM 4029 O O . GLN B 1 192 ? -45.753 57.305 -72.963 1.00 50.02 ? 187 GLN C O 1 ATOM 4030 C CB . GLN B 1 192 ? -44.565 54.172 -72.555 1.00 46.42 ? 187 GLN C CB 1 ATOM 4031 C CG . GLN B 1 192 ? -43.335 54.846 -73.184 1.00 48.34 ? 187 GLN C CG 1 ATOM 4032 C CD . GLN B 1 192 ? -42.481 55.644 -72.201 1.00 48.31 ? 187 GLN C CD 1 ATOM 4033 O OE1 . GLN B 1 192 ? -42.424 55.347 -70.988 1.00 45.69 ? 187 GLN C OE1 1 ATOM 4034 N NE2 . GLN B 1 192 ? -41.788 56.654 -72.723 1.00 46.74 ? 187 GLN C NE2 1 ATOM 4035 N N . THR B 1 193 ? -46.910 55.635 -73.931 1.00 50.56 ? 188 THR C N 1 ATOM 4036 C CA . THR B 1 193 ? -47.460 56.531 -74.959 1.00 56.03 ? 188 THR C CA 1 ATOM 4037 C C . THR B 1 193 ? -48.481 57.465 -74.338 1.00 50.53 ? 188 THR C C 1 ATOM 4038 O O . THR B 1 193 ? -48.577 58.630 -74.676 1.00 51.20 ? 188 THR C O 1 ATOM 4039 C CB . THR B 1 193 ? -48.046 55.786 -76.191 1.00 62.68 ? 188 THR C CB 1 ATOM 4040 O OG1 . THR B 1 193 ? -49.045 54.866 -75.784 1.00 61.40 ? 188 THR C OG1 1 ATOM 4041 C CG2 . THR B 1 193 ? -46.966 54.996 -76.917 1.00 66.83 ? 188 THR C CG2 1 ATOM 4042 N N . ASN B 1 194 ? -49.199 56.972 -73.361 1.00 53.76 ? 189 ASN C N 1 ATOM 4043 C CA . ASN B 1 194 ? -50.162 57.818 -72.668 1.00 55.12 ? 189 ASN C CA 1 ATOM 4044 C C . ASN B 1 194 ? -49.574 59.050 -72.011 1.00 52.16 ? 189 ASN C C 1 ATOM 4045 O O . ASN B 1 194 ? -50.203 60.105 -71.983 1.00 57.74 ? 189 ASN C O 1 ATOM 4046 C CB . ASN B 1 194 ? -50.828 57.017 -71.592 1.00 63.20 ? 189 ASN C CB 1 ATOM 4047 C CG . ASN B 1 194 ? -52.292 57.196 -71.606 1.00 73.72 ? 189 ASN C CG 1 ATOM 4048 O OD1 . ASN B 1 194 ? -53.008 56.392 -72.210 1.00 83.54 ? 189 ASN C OD1 1 ATOM 4049 N ND2 . ASN B 1 194 ? -52.761 58.284 -70.984 1.00 80.08 ? 189 ASN C ND2 1 ATOM 4050 N N . LEU B 1 195 ? -48.380 58.896 -71.445 1.00 51.45 ? 190 LEU C N 1 ATOM 4051 C CA . LEU B 1 195 ? -47.696 59.994 -70.715 1.00 47.13 ? 190 LEU C CA 1 ATOM 4052 C C . LEU B 1 195 ? -46.740 60.787 -71.585 1.00 44.25 ? 190 LEU C C 1 ATOM 4053 O O . LEU B 1 195 ? -46.637 61.990 -71.422 1.00 39.07 ? 190 LEU C O 1 ATOM 4054 C CB . LEU B 1 195 ? -46.897 59.440 -69.552 1.00 46.04 ? 190 LEU C CB 1 ATOM 4055 C CG . LEU B 1 195 ? -47.709 58.780 -68.442 1.00 48.12 ? 190 LEU C CG 1 ATOM 4056 C CD1 . LEU B 1 195 ? -46.725 58.182 -67.469 1.00 50.73 ? 190 LEU C CD1 1 ATOM 4057 C CD2 . LEU B 1 195 ? -48.600 59.759 -67.737 1.00 47.61 ? 190 LEU C CD2 1 ATOM 4058 N N . TYR B 1 196 ? -46.044 60.109 -72.505 1.00 42.38 ? 191 TYR C N 1 ATOM 4059 C CA . TYR B 1 196 ? -44.935 60.731 -73.240 1.00 44.07 ? 191 TYR C CA 1 ATOM 4060 C C . TYR B 1 196 ? -44.972 60.601 -74.760 1.00 43.98 ? 191 TYR C C 1 ATOM 4061 O O . TYR B 1 196 ? -44.083 61.110 -75.445 1.00 46.55 ? 191 TYR C O 1 ATOM 4062 C CB . TYR B 1 196 ? -43.597 60.131 -72.739 1.00 46.94 ? 191 TYR C CB 1 ATOM 4063 C CG . TYR B 1 196 ? -43.451 60.071 -71.229 1.00 41.05 ? 191 TYR C CG 1 ATOM 4064 C CD1 . TYR B 1 196 ? -43.390 61.226 -70.486 1.00 37.55 ? 191 TYR C CD1 1 ATOM 4065 C CD2 . TYR B 1 196 ? -43.398 58.845 -70.560 1.00 41.90 ? 191 TYR C CD2 1 ATOM 4066 C CE1 . TYR B 1 196 ? -43.286 61.194 -69.117 1.00 39.48 ? 191 TYR C CE1 1 ATOM 4067 C CE2 . TYR B 1 196 ? -43.288 58.793 -69.171 1.00 39.55 ? 191 TYR C CE2 1 ATOM 4068 C CZ . TYR B 1 196 ? -43.224 59.981 -68.463 1.00 37.73 ? 191 TYR C CZ 1 ATOM 4069 O OH . TYR B 1 196 ? -43.108 59.995 -67.119 1.00 32.75 ? 191 TYR C OH 1 ATOM 4070 N N . LYS B 1 197 ? -45.955 59.874 -75.275 1.00 45.41 ? 192 LYS C N 1 ATOM 4071 C CA . LYS B 1 197 ? -46.111 59.656 -76.696 1.00 50.09 ? 192 LYS C CA 1 ATOM 4072 C C . LYS B 1 197 ? -45.017 58.760 -77.285 1.00 49.23 ? 192 LYS C C 1 ATOM 4073 O O . LYS B 1 197 ? -45.274 57.656 -77.779 1.00 51.56 ? 192 LYS C O 1 ATOM 4074 C CB . LYS B 1 197 ? -46.140 61.010 -77.415 1.00 57.04 ? 192 LYS C CB 1 ATOM 4075 C CG . LYS B 1 197 ? -46.321 60.929 -78.914 1.00 58.34 ? 192 LYS C CG 1 ATOM 4076 C CD . LYS B 1 197 ? -47.735 60.497 -79.259 1.00 64.15 ? 192 LYS C CD 1 ATOM 4077 C CE . LYS B 1 197 ? -48.048 60.705 -80.725 1.00 67.76 ? 192 LYS C CE 1 ATOM 4078 N NZ . LYS B 1 197 ? -48.991 59.645 -81.123 1.00 71.03 ? 192 LYS C NZ 1 ATOM 4079 N N . ASN B 1 198 ? -43.795 59.231 -77.200 1.00 47.76 ? 193 ASN C N 1 ATOM 4080 C CA . ASN B 1 198 ? -42.646 58.518 -77.756 1.00 48.06 ? 193 ASN C CA 1 ATOM 4081 C C . ASN B 1 198 ? -42.393 57.247 -76.984 1.00 48.63 ? 193 ASN C C 1 ATOM 4082 O O . ASN B 1 198 ? -42.305 57.272 -75.775 1.00 51.69 ? 193 ASN C O 1 ATOM 4083 C CB . ASN B 1 198 ? -41.413 59.427 -77.711 1.00 46.36 ? 193 ASN C CB 1 ATOM 4084 C CG . ASN B 1 198 ? -41.699 60.775 -78.310 1.00 44.06 ? 193 ASN C CG 1 ATOM 4085 O OD1 . ASN B 1 198 ? -42.306 60.846 -79.369 1.00 53.20 ? 193 ASN C OD1 1 ATOM 4086 N ND2 . ASN B 1 198 ? -41.274 61.848 -77.651 1.00 44.68 ? 193 ASN C ND2 1 ATOM 4087 N N . PRO B 1 199 ? -42.296 56.115 -77.673 1.00 55.33 ? 194 PRO C N 1 ATOM 4088 C CA . PRO B 1 199 ? -42.160 54.833 -76.963 1.00 54.51 ? 194 PRO C CA 1 ATOM 4089 C C . PRO B 1 199 ? -40.767 54.527 -76.466 1.00 52.55 ? 194 PRO C C 1 ATOM 4090 O O . PRO B 1 199 ? -40.616 53.920 -75.418 1.00 52.57 ? 194 PRO C O 1 ATOM 4091 C CB . PRO B 1 199 ? -42.552 53.805 -78.050 1.00 59.16 ? 194 PRO C CB 1 ATOM 4092 C CG . PRO B 1 199 ? -42.201 54.461 -79.346 1.00 55.35 ? 194 PRO C CG 1 ATOM 4093 C CD . PRO B 1 199 ? -42.591 55.909 -79.107 1.00 60.39 ? 194 PRO C CD 1 ATOM 4094 N N . THR B 1 200 ? -39.772 54.935 -77.239 1.00 51.87 ? 195 THR C N 1 ATOM 4095 C CA . THR B 1 200 ? -38.383 54.665 -76.965 1.00 54.21 ? 195 THR C CA 1 ATOM 4096 C C . THR B 1 200 ? -37.689 55.977 -76.552 1.00 51.09 ? 195 THR C C 1 ATOM 4097 O O . THR B 1 200 ? -37.406 56.815 -77.389 1.00 44.60 ? 195 THR C O 1 ATOM 4098 C CB . THR B 1 200 ? -37.702 54.040 -78.227 1.00 58.23 ? 195 THR C CB 1 ATOM 4099 O OG1 . THR B 1 200 ? -38.305 52.773 -78.508 1.00 58.85 ? 195 THR C OG1 1 ATOM 4100 C CG2 . THR B 1 200 ? -36.169 53.826 -78.038 1.00 54.09 ? 195 THR C CG2 1 ATOM 4101 N N . THR B 1 201 ? -37.377 56.117 -75.267 1.00 46.50 ? 196 THR C N 1 ATOM 4102 C CA . THR B 1 201 ? -36.916 57.392 -74.757 1.00 40.55 ? 196 THR C CA 1 ATOM 4103 C C . THR B 1 201 ? -35.618 57.286 -73.999 1.00 40.76 ? 196 THR C C 1 ATOM 4104 O O . THR B 1 201 ? -35.098 56.184 -73.730 1.00 39.09 ? 196 THR C O 1 ATOM 4105 C CB . THR B 1 201 ? -37.957 58.034 -73.848 1.00 38.59 ? 196 THR C CB 1 ATOM 4106 O OG1 . THR B 1 201 ? -38.197 57.188 -72.730 1.00 37.03 ? 196 THR C OG1 1 ATOM 4107 C CG2 . THR B 1 201 ? -39.280 58.201 -74.597 1.00 44.15 ? 196 THR C CG2 1 ATOM 4108 N N . TYR B 1 202 ? -35.081 58.463 -73.690 1.00 41.18 ? 197 TYR C N 1 ATOM 4109 C CA . TYR B 1 202 ? -33.781 58.592 -73.034 1.00 45.09 ? 197 TYR C CA 1 ATOM 4110 C C . TYR B 1 202 ? -33.687 59.952 -72.363 1.00 41.04 ? 197 TYR C C 1 ATOM 4111 O O . TYR B 1 202 ? -34.442 60.864 -72.672 1.00 44.07 ? 197 TYR C O 1 ATOM 4112 C CB . TYR B 1 202 ? -32.608 58.417 -74.065 1.00 46.59 ? 197 TYR C CB 1 ATOM 4113 C CG . TYR B 1 202 ? -32.534 59.537 -75.063 1.00 45.77 ? 197 TYR C CG 1 ATOM 4114 C CD1 . TYR B 1 202 ? -33.319 59.510 -76.208 1.00 49.30 ? 197 TYR C CD1 1 ATOM 4115 C CD2 . TYR B 1 202 ? -31.732 60.661 -74.833 1.00 49.52 ? 197 TYR C CD2 1 ATOM 4116 C CE1 . TYR B 1 202 ? -33.302 60.555 -77.128 1.00 51.65 ? 197 TYR C CE1 1 ATOM 4117 C CE2 . TYR B 1 202 ? -31.708 61.716 -75.745 1.00 55.92 ? 197 TYR C CE2 1 ATOM 4118 C CZ . TYR B 1 202 ? -32.499 61.650 -76.893 1.00 52.62 ? 197 TYR C CZ 1 ATOM 4119 O OH . TYR B 1 202 ? -32.506 62.654 -77.795 1.00 51.53 ? 197 TYR C OH 1 ATOM 4120 N N . ILE B 1 203 ? -32.735 60.066 -71.458 1.00 42.92 ? 198 ILE C N 1 ATOM 4121 C CA . ILE B 1 203 ? -32.281 61.347 -70.952 1.00 43.19 ? 198 ILE C CA 1 ATOM 4122 C C . ILE B 1 203 ? -30.762 61.422 -71.017 1.00 44.38 ? 198 ILE C C 1 ATOM 4123 O O . ILE B 1 203 ? -30.079 60.489 -70.550 1.00 43.04 ? 198 ILE C O 1 ATOM 4124 C CB . ILE B 1 203 ? -32.685 61.563 -69.501 1.00 41.67 ? 198 ILE C CB 1 ATOM 4125 C CG1 . ILE B 1 203 ? -34.186 61.505 -69.360 1.00 42.47 ? 198 ILE C CG1 1 ATOM 4126 C CG2 . ILE B 1 203 ? -32.155 62.896 -68.981 1.00 42.12 ? 198 ILE C CG2 1 ATOM 4127 C CD1 . ILE B 1 203 ? -34.602 61.073 -67.965 1.00 45.93 ? 198 ILE C CD1 1 ATOM 4128 N N . SER B 1 204 ? -30.235 62.528 -71.566 1.00 41.74 ? 199 SER C N 1 ATOM 4129 C CA . SER B 1 204 ? -28.787 62.750 -71.569 1.00 41.64 ? 199 SER C CA 1 ATOM 4130 C C . SER B 1 204 ? -28.454 63.939 -70.747 1.00 40.58 ? 199 SER C C 1 ATOM 4131 O O . SER B 1 204 ? -29.125 64.955 -70.840 1.00 41.26 ? 199 SER C O 1 ATOM 4132 C CB . SER B 1 204 ? -28.250 62.962 -72.986 1.00 43.67 ? 199 SER C CB 1 ATOM 4133 O OG . SER B 1 204 ? -28.351 61.761 -73.741 1.00 46.64 ? 199 SER C OG 1 ATOM 4134 N N . VAL B 1 205 ? -27.389 63.834 -69.951 1.00 39.85 ? 200 VAL C N 1 ATOM 4135 C CA . VAL B 1 205 ? -26.988 64.930 -69.076 1.00 39.99 ? 200 VAL C CA 1 ATOM 4136 C C . VAL B 1 205 ? -25.496 65.082 -69.179 1.00 40.22 ? 200 VAL C C 1 ATOM 4137 O O . VAL B 1 205 ? -24.755 64.116 -69.032 1.00 42.80 ? 200 VAL C O 1 ATOM 4138 C CB . VAL B 1 205 ? -27.401 64.662 -67.627 1.00 40.21 ? 200 VAL C CB 1 ATOM 4139 C CG1 . VAL B 1 205 ? -27.271 65.917 -66.770 1.00 42.92 ? 200 VAL C CG1 1 ATOM 4140 C CG2 . VAL B 1 205 ? -28.825 64.145 -67.563 1.00 39.49 ? 200 VAL C CG2 1 ATOM 4141 N N . GLY B 1 206 ? -25.059 66.302 -69.467 1.00 43.94 ? 201 GLY C N 1 ATOM 4142 C CA . GLY B 1 206 ? -23.640 66.611 -69.628 1.00 45.30 ? 201 GLY C CA 1 ATOM 4143 C C . GLY B 1 206 ? -23.231 67.887 -68.913 1.00 47.35 ? 201 GLY C C 1 ATOM 4144 O O . GLY B 1 206 ? -23.969 68.875 -68.938 1.00 50.42 ? 201 GLY C O 1 ATOM 4145 N N . THR B 1 207 ? -22.064 67.859 -68.277 1.00 44.25 ? 202 THR C N 1 ATOM 4146 C CA . THR B 1 207 ? -21.413 69.059 -67.744 1.00 45.60 ? 202 THR C CA 1 ATOM 4147 C C . THR B 1 207 ? -19.938 69.022 -68.190 1.00 47.26 ? 202 THR C C 1 ATOM 4148 O O . THR B 1 207 ? -19.610 68.430 -69.207 1.00 51.52 ? 202 THR C O 1 ATOM 4149 C CB . THR B 1 207 ? -21.505 69.143 -66.189 1.00 46.07 ? 202 THR C CB 1 ATOM 4150 O OG1 . THR B 1 207 ? -20.671 68.153 -65.568 1.00 45.11 ? 202 THR C OG1 1 ATOM 4151 C CG2 . THR B 1 207 ? -22.920 68.972 -65.719 1.00 44.27 ? 202 THR C CG2 1 ATOM 4152 N N . SER B 1 208 ? -19.031 69.624 -67.438 1.00 49.59 ? 203 SER C N 1 ATOM 4153 C CA . SER B 1 208 ? -17.621 69.478 -67.782 1.00 49.72 ? 203 SER C CA 1 ATOM 4154 C C . SER B 1 208 ? -17.068 68.148 -67.323 1.00 47.64 ? 203 SER C C 1 ATOM 4155 O O . SER B 1 208 ? -16.073 67.677 -67.855 1.00 53.09 ? 203 SER C O 1 ATOM 4156 C CB . SER B 1 208 ? -16.804 70.653 -67.246 1.00 52.25 ? 203 SER C CB 1 ATOM 4157 O OG . SER B 1 208 ? -16.759 70.651 -65.846 1.00 55.44 ? 203 SER C OG 1 ATOM 4158 N N . THR B 1 209 ? -17.735 67.523 -66.369 1.00 49.24 ? 204 THR C N 1 ATOM 4159 C CA . THR B 1 209 ? -17.308 66.205 -65.838 1.00 49.94 ? 204 THR C CA 1 ATOM 4160 C C . THR B 1 209 ? -18.332 65.090 -66.031 1.00 50.24 ? 204 THR C C 1 ATOM 4161 O O . THR B 1 209 ? -17.980 63.923 -66.175 1.00 47.09 ? 204 THR C O 1 ATOM 4162 C CB . THR B 1 209 ? -17.016 66.292 -64.330 1.00 47.74 ? 204 THR C CB 1 ATOM 4163 O OG1 . THR B 1 209 ? -18.124 66.914 -63.646 1.00 47.02 ? 204 THR C OG1 1 ATOM 4164 C CG2 . THR B 1 209 ? -15.760 67.134 -64.114 1.00 49.11 ? 204 THR C CG2 1 ATOM 4165 N N . LEU B 1 210 ? -19.603 65.462 -66.041 1.00 49.42 ? 205 LEU C N 1 ATOM 4166 C CA . LEU B 1 210 ? -20.677 64.495 -66.078 1.00 45.11 ? 205 LEU C CA 1 ATOM 4167 C C . LEU B 1 210 ? -20.980 64.120 -67.513 1.00 45.04 ? 205 LEU C C 1 ATOM 4168 O O . LEU B 1 210 ? -20.990 64.957 -68.409 1.00 42.66 ? 205 LEU C O 1 ATOM 4169 C CB . LEU B 1 210 ? -21.917 65.086 -65.441 1.00 44.34 ? 205 LEU C CB 1 ATOM 4170 C CG . LEU B 1 210 ? -23.110 64.146 -65.305 1.00 47.06 ? 205 LEU C CG 1 ATOM 4171 C CD1 . LEU B 1 210 ? -22.800 63.070 -64.291 1.00 44.17 ? 205 LEU C CD1 1 ATOM 4172 C CD2 . LEU B 1 210 ? -24.362 64.941 -64.895 1.00 46.03 ? 205 LEU C CD2 1 ATOM 4173 N N . ASN B 1 211 ? -21.253 62.853 -67.733 1.00 44.92 ? 206 ASN C N 1 ATOM 4174 C CA . ASN B 1 211 ? -21.573 62.378 -69.069 1.00 42.88 ? 206 ASN C CA 1 ATOM 4175 C C . ASN B 1 211 ? -22.548 61.217 -68.926 1.00 40.54 ? 206 ASN C C 1 ATOM 4176 O O . ASN B 1 211 ? -22.147 60.081 -68.964 1.00 42.39 ? 206 ASN C O 1 ATOM 4177 C CB . ASN B 1 211 ? -20.294 61.918 -69.769 1.00 38.87 ? 206 ASN C CB 1 ATOM 4178 C CG . ASN B 1 211 ? -20.528 61.524 -71.221 1.00 38.73 ? 206 ASN C CG 1 ATOM 4179 O OD1 . ASN B 1 211 ? -21.529 61.897 -71.831 1.00 39.49 ? 206 ASN C OD1 1 ATOM 4180 N ND2 . ASN B 1 211 ? -19.588 60.782 -71.788 1.00 39.91 ? 206 ASN C ND2 1 ATOM 4181 N N . GLN B 1 212 ? -23.825 61.518 -68.772 1.00 40.91 ? 207 GLN C N 1 ATOM 4182 C CA . GLN B 1 212 ? -24.793 60.508 -68.316 1.00 42.25 ? 207 GLN C CA 1 ATOM 4183 C C . GLN B 1 212 ? -25.814 60.230 -69.386 1.00 41.03 ? 207 GLN C C 1 ATOM 4184 O O . GLN B 1 212 ? -26.240 61.121 -70.093 1.00 44.24 ? 207 GLN C O 1 ATOM 4185 C CB . GLN B 1 212 ? -25.489 61.012 -67.044 1.00 40.89 ? 207 GLN C CB 1 ATOM 4186 C CG . GLN B 1 212 ? -26.541 60.130 -66.447 1.00 42.40 ? 207 GLN C CG 1 ATOM 4187 C CD . GLN B 1 212 ? -27.139 60.738 -65.194 1.00 43.69 ? 207 GLN C CD 1 ATOM 4188 O OE1 . GLN B 1 212 ? -28.225 61.300 -65.238 1.00 44.91 ? 207 GLN C OE1 1 ATOM 4189 N NE2 . GLN B 1 212 ? -26.409 60.659 -64.078 1.00 42.04 ? 207 GLN C NE2 1 ATOM 4190 N N . ARG B 1 213 ? -26.255 58.992 -69.441 1.00 41.28 ? 208 ARG C N 1 ATOM 4191 C CA . ARG B 1 213 ? -27.431 58.652 -70.210 1.00 42.82 ? 208 ARG C CA 1 ATOM 4192 C C . ARG B 1 213 ? -28.375 57.730 -69.442 1.00 42.96 ? 208 ARG C C 1 ATOM 4193 O O . ARG B 1 213 ? -27.974 56.648 -69.024 1.00 38.89 ? 208 ARG C O 1 ATOM 4194 C CB . ARG B 1 213 ? -26.996 57.980 -71.472 1.00 47.43 ? 208 ARG C CB 1 ATOM 4195 C CG . ARG B 1 213 ? -28.096 57.800 -72.486 1.00 53.57 ? 208 ARG C CG 1 ATOM 4196 C CD . ARG B 1 213 ? -27.631 56.794 -73.505 1.00 65.57 ? 208 ARG C CD 1 ATOM 4197 N NE . ARG B 1 213 ? -28.731 56.354 -74.338 1.00 67.72 ? 208 ARG C NE 1 ATOM 4198 C CZ . ARG B 1 213 ? -29.246 57.082 -75.288 1.00 61.13 ? 208 ARG C CZ 1 ATOM 4199 N NH1 . ARG B 1 213 ? -28.769 58.308 -75.518 1.00 65.11 ? 208 ARG C NH1 1 ATOM 4200 N NH2 . ARG B 1 213 ? -30.262 56.591 -75.985 1.00 61.80 ? 208 ARG C NH2 1 ATOM 4201 N N . LEU B 1 214 ? -29.642 58.127 -69.313 1.00 41.84 ? 209 LEU C N 1 ATOM 4202 C CA . LEU B 1 214 ? -30.615 57.328 -68.581 1.00 38.38 ? 209 LEU C CA 1 ATOM 4203 C C . LEU B 1 214 ? -31.663 56.829 -69.541 1.00 46.18 ? 209 LEU C C 1 ATOM 4204 O O . LEU B 1 214 ? -32.098 57.558 -70.448 1.00 48.58 ? 209 LEU C O 1 ATOM 4205 C CB . LEU B 1 214 ? -31.294 58.136 -67.484 1.00 37.15 ? 209 LEU C CB 1 ATOM 4206 C CG . LEU B 1 214 ? -30.377 58.876 -66.524 1.00 35.69 ? 209 LEU C CG 1 ATOM 4207 C CD1 . LEU B 1 214 ? -31.152 59.833 -65.660 1.00 38.24 ? 209 LEU C CD1 1 ATOM 4208 C CD2 . LEU B 1 214 ? -29.658 57.876 -65.671 1.00 38.39 ? 209 LEU C CD2 1 ATOM 4209 N N . VAL B 1 215 ? -32.077 55.577 -69.324 1.00 47.34 ? 210 VAL C N 1 ATOM 4210 C CA . VAL B 1 215 ? -33.070 54.912 -70.134 1.00 47.27 ? 210 VAL C CA 1 ATOM 4211 C C . VAL B 1 215 ? -34.121 54.281 -69.208 1.00 46.08 ? 210 VAL C C 1 ATOM 4212 O O . VAL B 1 215 ? -33.766 53.546 -68.319 1.00 50.09 ? 210 VAL C O 1 ATOM 4213 C CB . VAL B 1 215 ? -32.420 53.808 -71.009 1.00 51.14 ? 210 VAL C CB 1 ATOM 4214 C CG1 . VAL B 1 215 ? -33.481 53.074 -71.851 1.00 50.11 ? 210 VAL C CG1 1 ATOM 4215 C CG2 . VAL B 1 215 ? -31.368 54.418 -71.931 1.00 52.87 ? 210 VAL C CG2 1 ATOM 4216 N N . PRO B 1 216 ? -35.416 54.563 -69.431 1.00 41.12 ? 211 PRO C N 1 ATOM 4217 C CA . PRO B 1 216 ? -36.453 53.922 -68.654 1.00 43.98 ? 211 PRO C CA 1 ATOM 4218 C C . PRO B 1 216 ? -36.479 52.391 -68.815 1.00 44.06 ? 211 PRO C C 1 ATOM 4219 O O . PRO B 1 216 ? -36.211 51.863 -69.894 1.00 43.18 ? 211 PRO C O 1 ATOM 4220 C CB . PRO B 1 216 ? -37.739 54.511 -69.220 1.00 45.78 ? 211 PRO C CB 1 ATOM 4221 C CG . PRO B 1 216 ? -37.288 55.775 -69.887 1.00 44.60 ? 211 PRO C CG 1 ATOM 4222 C CD . PRO B 1 216 ? -35.978 55.428 -70.470 1.00 40.80 ? 211 PRO C CD 1 ATOM 4223 N N . LYS B 1 217 ? -36.823 51.725 -67.725 1.00 42.50 ? 212 LYS C N 1 ATOM 4224 C CA . LYS B 1 217 ? -36.981 50.275 -67.668 1.00 42.98 ? 212 LYS C CA 1 ATOM 4225 C C . LYS B 1 217 ? -38.453 50.025 -67.513 1.00 44.54 ? 212 LYS C C 1 ATOM 4226 O O . LYS B 1 217 ? -39.055 50.179 -66.432 1.00 44.69 ? 212 LYS C O 1 ATOM 4227 C CB . LYS B 1 217 ? -36.215 49.678 -66.514 1.00 43.98 ? 212 LYS C CB 1 ATOM 4228 C CG . LYS B 1 217 ? -34.712 49.688 -66.737 1.00 44.33 ? 212 LYS C CG 1 ATOM 4229 C CD . LYS B 1 217 ? -33.969 49.189 -65.508 1.00 46.11 ? 212 LYS C CD 1 ATOM 4230 C CE . LYS B 1 217 ? -33.213 50.316 -64.862 1.00 47.35 ? 212 LYS C CE 1 ATOM 4231 N NZ . LYS B 1 217 ? -32.737 49.930 -63.501 1.00 50.85 ? 212 LYS C NZ 1 ATOM 4232 N N . ILE B 1 218 ? -39.045 49.669 -68.631 1.00 45.17 ? 213 ILE C N 1 ATOM 4233 C CA . ILE B 1 218 ? -40.478 49.500 -68.705 1.00 45.82 ? 213 ILE C CA 1 ATOM 4234 C C . ILE B 1 218 ? -40.744 48.034 -68.413 1.00 43.78 ? 213 ILE C C 1 ATOM 4235 O O . ILE B 1 218 ? -40.520 47.207 -69.254 1.00 41.85 ? 213 ILE C O 1 ATOM 4236 C CB . ILE B 1 218 ? -40.994 49.881 -70.087 1.00 43.89 ? 213 ILE C CB 1 ATOM 4237 C CG1 . ILE B 1 218 ? -40.745 51.361 -70.302 1.00 45.05 ? 213 ILE C CG1 1 ATOM 4238 C CG2 . ILE B 1 218 ? -42.474 49.558 -70.210 1.00 43.60 ? 213 ILE C CG2 1 ATOM 4239 C CD1 . ILE B 1 218 ? -41.105 51.844 -71.682 1.00 45.79 ? 213 ILE C CD1 1 ATOM 4240 N N . ALA B 1 219 ? -41.248 47.756 -67.218 1.00 45.62 ? 214 ALA C N 1 ATOM 4241 C CA . ALA B 1 219 ? -41.384 46.401 -66.701 1.00 43.21 ? 214 ALA C CA 1 ATOM 4242 C C . ALA B 1 219 ? -42.385 46.306 -65.538 1.00 40.60 ? 214 ALA C C 1 ATOM 4243 O O . ALA B 1 219 ? -42.783 47.309 -64.999 1.00 45.58 ? 214 ALA C O 1 ATOM 4244 C CB . ALA B 1 219 ? -40.032 45.921 -66.225 1.00 40.91 ? 214 ALA C CB 1 ATOM 4245 N N . THR B 1 220 ? -42.741 45.083 -65.157 1.00 38.28 ? 215 THR C N 1 ATOM 4246 C CA . THR B 1 220 ? -43.660 44.826 -64.077 1.00 33.95 ? 215 THR C CA 1 ATOM 4247 C C . THR B 1 220 ? -42.931 44.799 -62.760 1.00 33.24 ? 215 THR C C 1 ATOM 4248 O O . THR B 1 220 ? -42.015 44.038 -62.583 1.00 36.32 ? 215 THR C O 1 ATOM 4249 C CB . THR B 1 220 ? -44.398 43.483 -64.301 1.00 33.21 ? 215 THR C CB 1 ATOM 4250 O OG1 . THR B 1 220 ? -45.097 43.538 -65.532 1.00 36.47 ? 215 THR C OG1 1 ATOM 4251 C CG2 . THR B 1 220 ? -45.435 43.223 -63.232 1.00 34.38 ? 215 THR C CG2 1 ATOM 4252 N N . ARG B 1 221 ? -43.451 45.551 -61.799 1.00 35.06 ? 216 ARG C N 1 ATOM 4253 C CA . ARG B 1 221 ? -42.926 45.656 -60.449 1.00 35.03 ? 216 ARG C CA 1 ATOM 4254 C C . ARG B 1 221 ? -44.059 45.582 -59.417 1.00 37.38 ? 216 ARG C C 1 ATOM 4255 O O . ARG B 1 221 ? -45.219 45.676 -59.757 1.00 39.74 ? 216 ARG C O 1 ATOM 4256 C CB . ARG B 1 221 ? -42.188 46.964 -60.285 1.00 36.73 ? 216 ARG C CB 1 ATOM 4257 C CG . ARG B 1 221 ? -40.928 47.071 -61.147 1.00 36.93 ? 216 ARG C CG 1 ATOM 4258 C CD . ARG B 1 221 ? -40.388 48.474 -61.177 1.00 36.61 ? 216 ARG C CD 1 ATOM 4259 N NE . ARG B 1 221 ? -41.252 49.286 -62.025 1.00 39.38 ? 216 ARG C NE 1 ATOM 4260 C CZ . ARG B 1 221 ? -40.995 49.635 -63.284 1.00 41.85 ? 216 ARG C CZ 1 ATOM 4261 N NH1 . ARG B 1 221 ? -39.862 49.310 -63.905 1.00 44.08 ? 216 ARG C NH1 1 ATOM 4262 N NH2 . ARG B 1 221 ? -41.874 50.367 -63.931 1.00 47.88 ? 216 ARG C NH2 1 ATOM 4263 N N . SER B 1 222 ? -43.723 45.372 -58.145 1.00 38.97 ? 217 SER C N 1 ATOM 4264 C CA . SER B 1 222 ? -44.736 45.337 -57.101 1.00 38.47 ? 217 SER C CA 1 ATOM 4265 C C . SER B 1 222 ? -45.235 46.729 -56.835 1.00 39.05 ? 217 SER C C 1 ATOM 4266 O O . SER B 1 222 ? -44.571 47.695 -57.197 1.00 45.53 ? 217 SER C O 1 ATOM 4267 C CB . SER B 1 222 ? -44.157 44.694 -55.840 1.00 40.37 ? 217 SER C CB 1 ATOM 4268 O OG . SER B 1 222 ? -43.743 43.359 -56.123 1.00 48.92 ? 217 SER C OG 1 ATOM 4269 N N . GLN B 1 223 ? -46.375 46.857 -56.157 1.00 43.85 ? 218 GLN C N 1 ATOM 4270 C CA . GLN B 1 223 ? -46.901 48.188 -55.756 1.00 45.60 ? 218 GLN C CA 1 ATOM 4271 C C . GLN B 1 223 ? -46.160 48.684 -54.540 1.00 37.90 ? 218 GLN C C 1 ATOM 4272 O O . GLN B 1 223 ? -46.030 47.972 -53.606 1.00 40.96 ? 218 GLN C O 1 ATOM 4273 C CB . GLN B 1 223 ? -48.392 48.176 -55.365 1.00 48.18 ? 218 GLN C CB 1 ATOM 4274 C CG . GLN B 1 223 ? -49.367 47.752 -56.439 1.00 57.36 ? 218 GLN C CG 1 ATOM 4275 C CD . GLN B 1 223 ? -50.801 48.351 -56.315 1.00 66.06 ? 218 GLN C CD 1 ATOM 4276 O OE1 . GLN B 1 223 ? -51.327 48.578 -55.221 1.00 64.29 ? 218 GLN C OE1 1 ATOM 4277 N NE2 . GLN B 1 223 ? -51.409 48.617 -57.463 1.00 67.60 ? 218 GLN C NE2 1 ATOM 4278 N N . VAL B 1 224 ? -45.753 49.947 -54.548 1.00 43.36 ? 219 VAL C N 1 ATOM 4279 C CA . VAL B 1 224 ? -45.283 50.648 -53.347 1.00 42.68 ? 219 VAL C CA 1 ATOM 4280 C C . VAL B 1 224 ? -45.949 52.019 -53.336 1.00 42.73 ? 219 VAL C C 1 ATOM 4281 O O . VAL B 1 224 ? -45.976 52.685 -54.371 1.00 47.85 ? 219 VAL C O 1 ATOM 4282 C CB . VAL B 1 224 ? -43.749 50.803 -53.332 1.00 40.58 ? 219 VAL C CB 1 ATOM 4283 C CG1 . VAL B 1 224 ? -43.287 51.501 -52.064 1.00 39.42 ? 219 VAL C CG1 1 ATOM 4284 C CG2 . VAL B 1 224 ? -43.078 49.439 -53.427 1.00 40.46 ? 219 VAL C CG2 1 ATOM 4285 N N . ASN B 1 225 ? -46.492 52.413 -52.172 1.00 43.73 ? 220 ASN C N 1 ATOM 4286 C CA . ASN B 1 225 ? -47.343 53.613 -52.033 1.00 45.21 ? 220 ASN C CA 1 ATOM 4287 C C . ASN B 1 225 ? -48.350 53.716 -53.169 1.00 39.13 ? 220 ASN C C 1 ATOM 4288 O O . ASN B 1 225 ? -48.558 54.771 -53.713 1.00 44.28 ? 220 ASN C O 1 ATOM 4289 C CB . ASN B 1 225 ? -46.514 54.927 -51.959 1.00 48.49 ? 220 ASN C CB 1 ATOM 4290 C CG . ASN B 1 225 ? -45.389 54.874 -50.918 1.00 54.19 ? 220 ASN C CG 1 ATOM 4291 O OD1 . ASN B 1 225 ? -44.266 55.432 -51.107 1.00 55.02 ? 220 ASN C OD1 1 ATOM 4292 N ND2 . ASN B 1 225 ? -45.676 54.227 -49.806 1.00 56.06 ? 220 ASN C ND2 1 ATOM 4293 N N . GLY B 1 226 ? -48.941 52.599 -53.535 1.00 41.57 ? 221 GLY C N 1 ATOM 4294 C CA . GLY B 1 226 ? -49.967 52.537 -54.583 1.00 39.46 ? 221 GLY C CA 1 ATOM 4295 C C . GLY B 1 226 ? -49.448 52.489 -56.009 1.00 40.02 ? 221 GLY C C 1 ATOM 4296 O O . GLY B 1 226 ? -50.230 52.415 -56.931 1.00 44.85 ? 221 GLY C O 1 ATOM 4297 N N . GLN B 1 227 ? -48.132 52.511 -56.205 1.00 38.36 ? 222 GLN C N 1 ATOM 4298 C CA . GLN B 1 227 ? -47.569 52.675 -57.555 1.00 40.32 ? 222 GLN C CA 1 ATOM 4299 C C . GLN B 1 227 ? -46.638 51.556 -57.984 1.00 37.58 ? 222 GLN C C 1 ATOM 4300 O O . GLN B 1 227 ? -45.880 51.051 -57.171 1.00 32.97 ? 222 GLN C O 1 ATOM 4301 C CB . GLN B 1 227 ? -46.777 53.972 -57.615 1.00 43.56 ? 222 GLN C CB 1 ATOM 4302 C CG . GLN B 1 227 ? -47.575 55.215 -57.216 1.00 44.51 ? 222 GLN C CG 1 ATOM 4303 C CD . GLN B 1 227 ? -48.763 55.450 -58.088 1.00 44.21 ? 222 GLN C CD 1 ATOM 4304 O OE1 . GLN B 1 227 ? -49.839 55.739 -57.609 1.00 49.63 ? 222 GLN C OE1 1 ATOM 4305 N NE2 . GLN B 1 227 ? -48.594 55.275 -59.372 1.00 50.40 ? 222 GLN C NE2 1 ATOM 4306 N N . ARG B 1 228 ? -46.719 51.171 -59.256 1.00 34.94 ? 223 ARG C N 1 ATOM 4307 C CA . ARG B 1 228 ? -45.816 50.188 -59.815 1.00 38.61 ? 223 ARG C CA 1 ATOM 4308 C C . ARG B 1 228 ? -44.676 50.854 -60.559 1.00 36.40 ? 223 ARG C C 1 ATOM 4309 O O . ARG B 1 228 ? -43.634 50.242 -60.830 1.00 37.37 ? 223 ARG C O 1 ATOM 4310 C CB . ARG B 1 228 ? -46.562 49.212 -60.724 1.00 43.86 ? 223 ARG C CB 1 ATOM 4311 C CG . ARG B 1 228 ? -47.617 48.405 -59.976 1.00 46.42 ? 223 ARG C CG 1 ATOM 4312 C CD . ARG B 1 228 ? -48.471 47.492 -60.869 1.00 53.39 ? 223 ARG C CD 1 ATOM 4313 N NE . ARG B 1 228 ? -48.120 46.147 -60.530 1.00 58.67 ? 223 ARG C NE 1 ATOM 4314 C CZ . ARG B 1 228 ? -48.723 45.369 -59.632 1.00 66.20 ? 223 ARG C CZ 1 ATOM 4315 N NH1 . ARG B 1 228 ? -49.839 45.749 -59.001 1.00 63.35 ? 223 ARG C NH1 1 ATOM 4316 N NH2 . ARG B 1 228 ? -48.191 44.174 -59.376 1.00 66.06 ? 223 ARG C NH2 1 ATOM 4317 N N . GLY B 1 229 ? -44.848 52.120 -60.877 1.00 34.88 ? 224 GLY C N 1 ATOM 4318 C CA . GLY B 1 229 ? -43.758 52.931 -61.460 1.00 32.57 ? 224 GLY C CA 1 ATOM 4319 C C . GLY B 1 229 ? -42.665 53.279 -60.465 1.00 31.63 ? 224 GLY C C 1 ATOM 4320 O O . GLY B 1 229 ? -42.824 53.085 -59.240 1.00 27.53 ? 224 GLY C O 1 ATOM 4321 N N . ARG B 1 230 ? -41.563 53.803 -60.989 1.00 29.69 ? 225 ARG C N 1 ATOM 4322 C CA . ARG B 1 230 ? -40.491 54.186 -60.141 1.00 32.41 ? 225 ARG C CA 1 ATOM 4323 C C . ARG B 1 230 ? -39.863 55.432 -60.674 1.00 30.40 ? 225 ARG C C 1 ATOM 4324 O O . ARG B 1 230 ? -39.898 55.660 -61.864 1.00 29.99 ? 225 ARG C O 1 ATOM 4325 C CB . ARG B 1 230 ? -39.434 53.073 -60.079 1.00 34.73 ? 225 ARG C CB 1 ATOM 4326 C CG . ARG B 1 230 ? -39.892 51.750 -59.468 1.00 35.24 ? 225 ARG C CG 1 ATOM 4327 C CD . ARG B 1 230 ? -40.092 51.841 -57.958 1.00 35.56 ? 225 ARG C CD 1 ATOM 4328 N NE . ARG B 1 230 ? -40.488 50.538 -57.410 1.00 38.35 ? 225 ARG C NE 1 ATOM 4329 C CZ . ARG B 1 230 ? -41.731 50.072 -57.321 1.00 37.12 ? 225 ARG C CZ 1 ATOM 4330 N NH1 . ARG B 1 230 ? -42.767 50.777 -57.737 1.00 36.29 ? 225 ARG C NH1 1 ATOM 4331 N NH2 . ARG B 1 230 ? -41.926 48.865 -56.835 1.00 42.06 ? 225 ARG C NH2 1 ATOM 4332 N N . MET B 1 231 ? -39.239 56.188 -59.778 1.00 31.27 ? 226 MET C N 1 ATOM 4333 C CA . MET B 1 231 ? -38.443 57.322 -60.166 1.00 34.34 ? 226 MET C CA 1 ATOM 4334 C C . MET B 1 231 ? -37.070 57.266 -59.559 1.00 36.31 ? 226 MET C C 1 ATOM 4335 O O . MET B 1 231 ? -36.929 57.198 -58.348 1.00 37.24 ? 226 MET C O 1 ATOM 4336 C CB . MET B 1 231 ? -39.129 58.593 -59.779 1.00 39.99 ? 226 MET C CB 1 ATOM 4337 C CG . MET B 1 231 ? -40.287 58.838 -60.745 1.00 41.88 ? 226 MET C CG 1 ATOM 4338 S SD . MET B 1 231 ? -41.126 60.360 -60.390 1.00 41.89 ? 226 MET C SD 1 ATOM 4339 C CE . MET B 1 231 ? -42.410 60.284 -61.625 1.00 43.05 ? 226 MET C CE 1 ATOM 4340 N N . ASP B 1 232 ? -36.059 57.283 -60.426 1.00 34.75 ? 227 ASP C N 1 ATOM 4341 C CA . ASP B 1 232 ? -34.672 57.222 -60.026 1.00 36.21 ? 227 ASP C CA 1 ATOM 4342 C C . ASP B 1 232 ? -34.106 58.617 -60.201 1.00 36.51 ? 227 ASP C C 1 ATOM 4343 O O . ASP B 1 232 ? -34.062 59.175 -61.314 1.00 39.80 ? 227 ASP C O 1 ATOM 4344 C CB . ASP B 1 232 ? -33.870 56.193 -60.876 1.00 35.20 ? 227 ASP C CB 1 ATOM 4345 C CG . ASP B 1 232 ? -34.194 54.739 -60.530 1.00 35.85 ? 227 ASP C CG 1 ATOM 4346 O OD1 . ASP B 1 232 ? -34.783 54.446 -59.485 1.00 33.44 ? 227 ASP C OD1 1 ATOM 4347 O OD2 . ASP B 1 232 ? -33.875 53.849 -61.353 1.00 42.52 ? 227 ASP C OD2 1 ATOM 4348 N N . PHE B 1 233 ? -33.644 59.170 -59.101 1.00 37.32 ? 228 PHE C N 1 ATOM 4349 C CA . PHE B 1 233 ? -33.099 60.504 -59.081 1.00 35.62 ? 228 PHE C CA 1 ATOM 4350 C C . PHE B 1 233 ? -31.584 60.469 -59.062 1.00 35.53 ? 228 PHE C C 1 ATOM 4351 O O . PHE B 1 233 ? -30.974 59.509 -58.581 1.00 38.17 ? 228 PHE C O 1 ATOM 4352 C CB . PHE B 1 233 ? -33.657 61.249 -57.887 1.00 37.24 ? 228 PHE C CB 1 ATOM 4353 C CG . PHE B 1 233 ? -35.095 61.621 -58.056 1.00 40.34 ? 228 PHE C CG 1 ATOM 4354 C CD1 . PHE B 1 233 ? -36.083 60.839 -57.511 1.00 43.50 ? 228 PHE C CD1 1 ATOM 4355 C CD2 . PHE B 1 233 ? -35.465 62.719 -58.835 1.00 41.12 ? 228 PHE C CD2 1 ATOM 4356 C CE1 . PHE B 1 233 ? -37.401 61.168 -57.681 1.00 44.09 ? 228 PHE C CE1 1 ATOM 4357 C CE2 . PHE B 1 233 ? -36.777 63.058 -59.003 1.00 38.56 ? 228 PHE C CE2 1 ATOM 4358 C CZ . PHE B 1 233 ? -37.749 62.297 -58.414 1.00 40.72 ? 228 PHE C CZ 1 ATOM 4359 N N . PHE B 1 234 ? -30.992 61.519 -59.635 1.00 34.46 ? 229 PHE C N 1 ATOM 4360 C CA . PHE B 1 234 ? -29.542 61.641 -59.787 1.00 33.96 ? 229 PHE C CA 1 ATOM 4361 C C . PHE B 1 234 ? -29.157 63.061 -59.459 1.00 37.22 ? 229 PHE C C 1 ATOM 4362 O O . PHE B 1 234 ? -30.016 63.957 -59.469 1.00 40.33 ? 229 PHE C O 1 ATOM 4363 C CB . PHE B 1 234 ? -29.111 61.261 -61.210 1.00 33.83 ? 229 PHE C CB 1 ATOM 4364 C CG . PHE B 1 234 ? -29.337 59.816 -61.541 1.00 33.44 ? 229 PHE C CG 1 ATOM 4365 C CD1 . PHE B 1 234 ? -30.568 59.370 -61.980 1.00 37.06 ? 229 PHE C CD1 1 ATOM 4366 C CD2 . PHE B 1 234 ? -28.313 58.881 -61.412 1.00 37.27 ? 229 PHE C CD2 1 ATOM 4367 C CE1 . PHE B 1 234 ? -30.796 57.998 -62.243 1.00 36.00 ? 229 PHE C CE1 1 ATOM 4368 C CE2 . PHE B 1 234 ? -28.523 57.520 -61.693 1.00 34.57 ? 229 PHE C CE2 1 ATOM 4369 C CZ . PHE B 1 234 ? -29.771 57.084 -62.098 1.00 33.64 ? 229 PHE C CZ 1 ATOM 4370 N N . TRP B 1 235 ? -27.884 63.295 -59.166 1.00 37.61 ? 230 TRP C N 1 ATOM 4371 C CA . TRP B 1 235 ? -27.443 64.639 -58.809 1.00 40.47 ? 230 TRP C CA 1 ATOM 4372 C C . TRP B 1 235 ? -26.045 64.953 -59.303 1.00 41.28 ? 230 TRP C C 1 ATOM 4373 O O . TRP B 1 235 ? -25.325 64.063 -59.700 1.00 38.11 ? 230 TRP C O 1 ATOM 4374 C CB . TRP B 1 235 ? -27.512 64.825 -57.281 1.00 40.81 ? 230 TRP C CB 1 ATOM 4375 C CG . TRP B 1 235 ? -26.700 63.833 -56.508 1.00 41.76 ? 230 TRP C CG 1 ATOM 4376 C CD1 . TRP B 1 235 ? -27.036 62.532 -56.224 1.00 40.36 ? 230 TRP C CD1 1 ATOM 4377 C CD2 . TRP B 1 235 ? -25.425 64.046 -55.937 1.00 40.96 ? 230 TRP C CD2 1 ATOM 4378 N NE1 . TRP B 1 235 ? -26.056 61.928 -55.500 1.00 40.06 ? 230 TRP C NE1 1 ATOM 4379 C CE2 . TRP B 1 235 ? -25.039 62.829 -55.313 1.00 42.57 ? 230 TRP C CE2 1 ATOM 4380 C CE3 . TRP B 1 235 ? -24.568 65.146 -55.869 1.00 43.70 ? 230 TRP C CE3 1 ATOM 4381 C CZ2 . TRP B 1 235 ? -23.825 62.684 -54.632 1.00 37.61 ? 230 TRP C CZ2 1 ATOM 4382 C CZ3 . TRP B 1 235 ? -23.351 65.001 -55.209 1.00 40.77 ? 230 TRP C CZ3 1 ATOM 4383 C CH2 . TRP B 1 235 ? -23.005 63.780 -54.583 1.00 39.69 ? 230 TRP C CH2 1 ATOM 4384 N N . THR B 1 236 ? -25.686 66.233 -59.253 1.00 43.04 ? 231 THR C N 1 ATOM 4385 C CA . THR B 1 236 ? -24.331 66.662 -59.520 1.00 43.61 ? 231 THR C CA 1 ATOM 4386 C C . THR B 1 236 ? -24.055 67.999 -58.878 1.00 43.43 ? 231 THR C C 1 ATOM 4387 O O . THR B 1 236 ? -24.956 68.716 -58.517 1.00 42.77 ? 231 THR C O 1 ATOM 4388 C CB . THR B 1 236 ? -24.075 66.775 -61.036 1.00 44.89 ? 231 THR C CB 1 ATOM 4389 O OG1 . THR B 1 236 ? -22.673 66.889 -61.291 1.00 43.67 ? 231 THR C OG1 1 ATOM 4390 C CG2 . THR B 1 236 ? -24.760 67.968 -61.623 1.00 41.82 ? 231 THR C CG2 1 ATOM 4391 N N . ILE B 1 237 ? -22.780 68.308 -58.741 1.00 45.88 ? 232 ILE C N 1 ATOM 4392 C CA . ILE B 1 237 ? -22.326 69.618 -58.254 1.00 44.22 ? 232 ILE C CA 1 ATOM 4393 C C . ILE B 1 237 ? -21.844 70.360 -59.501 1.00 44.00 ? 232 ILE C C 1 ATOM 4394 O O . ILE B 1 237 ? -20.833 70.001 -60.093 1.00 42.92 ? 232 ILE C O 1 ATOM 4395 C CB . ILE B 1 237 ? -21.151 69.501 -57.251 1.00 41.94 ? 232 ILE C CB 1 ATOM 4396 C CG1 . ILE B 1 237 ? -21.540 68.681 -56.043 1.00 41.81 ? 232 ILE C CG1 1 ATOM 4397 C CG2 . ILE B 1 237 ? -20.701 70.858 -56.779 1.00 45.53 ? 232 ILE C CG2 1 ATOM 4398 C CD1 . ILE B 1 237 ? -22.820 69.124 -55.385 1.00 43.75 ? 232 ILE C CD1 1 ATOM 4399 N N . LEU B 1 238 ? -22.584 71.384 -59.889 1.00 46.34 ? 233 LEU C N 1 ATOM 4400 C CA . LEU B 1 238 ? -22.231 72.177 -61.048 1.00 48.79 ? 233 LEU C CA 1 ATOM 4401 C C . LEU B 1 238 ? -21.370 73.331 -60.572 1.00 50.44 ? 233 LEU C C 1 ATOM 4402 O O . LEU B 1 238 ? -21.841 74.170 -59.797 1.00 46.84 ? 233 LEU C O 1 ATOM 4403 C CB . LEU B 1 238 ? -23.491 72.693 -61.736 1.00 47.91 ? 233 LEU C CB 1 ATOM 4404 C CG . LEU B 1 238 ? -23.261 73.449 -63.046 1.00 47.04 ? 233 LEU C CG 1 ATOM 4405 C CD1 . LEU B 1 238 ? -22.627 72.537 -64.081 1.00 48.46 ? 233 LEU C CD1 1 ATOM 4406 C CD2 . LEU B 1 238 ? -24.557 74.009 -63.584 1.00 43.50 ? 233 LEU C CD2 1 ATOM 4407 N N . LYS B 1 239 ? -20.114 73.359 -61.014 1.00 55.12 ? 234 LYS C N 1 ATOM 4408 C CA . LYS B 1 239 ? -19.137 74.358 -60.539 1.00 54.86 ? 234 LYS C CA 1 ATOM 4409 C C . LYS B 1 239 ? -19.485 75.734 -61.070 1.00 53.87 ? 234 LYS C C 1 ATOM 4410 O O . LYS B 1 239 ? -20.143 75.850 -62.115 1.00 48.12 ? 234 LYS C O 1 ATOM 4411 C CB . LYS B 1 239 ? -17.729 74.037 -61.008 1.00 59.49 ? 234 LYS C CB 1 ATOM 4412 C CG . LYS B 1 239 ? -17.160 72.714 -60.562 1.00 67.14 ? 234 LYS C CG 1 ATOM 4413 C CD . LYS B 1 239 ? -16.974 72.702 -59.067 1.00 77.92 ? 234 LYS C CD 1 ATOM 4414 C CE . LYS B 1 239 ? -15.617 72.123 -58.729 1.00 91.33 ? 234 LYS C CE 1 ATOM 4415 N NZ . LYS B 1 239 ? -15.410 72.203 -57.258 1.00 102.12 ? 234 LYS C NZ 1 ATOM 4416 N N . PRO B 1 240 ? -19.006 76.791 -60.382 1.00 58.55 ? 235 PRO C N 1 ATOM 4417 C CA . PRO B 1 240 ? -19.359 78.150 -60.774 1.00 62.04 ? 235 PRO C CA 1 ATOM 4418 C C . PRO B 1 240 ? -19.267 78.535 -62.241 1.00 61.48 ? 235 PRO C C 1 ATOM 4419 O O . PRO B 1 240 ? -20.205 79.147 -62.720 1.00 74.77 ? 235 PRO C O 1 ATOM 4420 C CB . PRO B 1 240 ? -18.482 79.016 -59.885 1.00 60.84 ? 235 PRO C CB 1 ATOM 4421 C CG . PRO B 1 240 ? -18.413 78.230 -58.632 1.00 59.32 ? 235 PRO C CG 1 ATOM 4422 C CD . PRO B 1 240 ? -18.285 76.802 -59.099 1.00 58.63 ? 235 PRO C CD 1 ATOM 4423 N N . ASN B 1 241 ? -18.290 78.215 -63.046 1.00 58.65 ? 236 ASN C N 1 ATOM 4424 C CA . ASN B 1 241 ? -18.645 78.700 -64.423 1.00 61.68 ? 236 ASN C CA 1 ATOM 4425 C C . ASN B 1 241 ? -19.014 77.666 -65.463 1.00 54.92 ? 236 ASN C C 1 ATOM 4426 O O . ASN B 1 241 ? -18.949 77.903 -66.652 1.00 48.77 ? 236 ASN C O 1 ATOM 4427 C CB . ASN B 1 241 ? -17.694 79.772 -64.958 1.00 74.26 ? 236 ASN C CB 1 ATOM 4428 C CG . ASN B 1 241 ? -18.269 81.161 -64.773 1.00 81.67 ? 236 ASN C CG 1 ATOM 4429 O OD1 . ASN B 1 241 ? -18.963 81.655 -65.651 1.00 91.37 ? 236 ASN C OD1 1 ATOM 4430 N ND2 . ASN B 1 241 ? -18.074 81.746 -63.594 1.00 79.77 ? 236 ASN C ND2 1 ATOM 4431 N N . ASP B 1 242 ? -19.506 76.536 -64.984 1.00 58.35 ? 237 ASP C N 1 ATOM 4432 C CA . ASP B 1 242 ? -19.853 75.419 -65.844 1.00 56.52 ? 237 ASP C CA 1 ATOM 4433 C C . ASP B 1 242 ? -21.330 75.471 -66.192 1.00 51.62 ? 237 ASP C C 1 ATOM 4434 O O . ASP B 1 242 ? -22.118 76.233 -65.626 1.00 50.99 ? 237 ASP C O 1 ATOM 4435 C CB . ASP B 1 242 ? -19.504 74.135 -65.124 1.00 55.59 ? 237 ASP C CB 1 ATOM 4436 C CG . ASP B 1 242 ? -19.341 72.952 -66.051 1.00 61.50 ? 237 ASP C CG 1 ATOM 4437 O OD1 . ASP B 1 242 ? -19.272 73.124 -67.303 1.00 54.51 ? 237 ASP C OD1 1 ATOM 4438 O OD2 . ASP B 1 242 ? -19.296 71.822 -65.488 1.00 64.08 ? 237 ASP C OD2 1 ATOM 4439 N N . ALA B 1 243 ? -21.710 74.704 -67.191 1.00 53.80 ? 238 ALA C N 1 ATOM 4440 C CA . ALA B 1 243 ? -23.113 74.597 -67.565 1.00 50.86 ? 238 ALA C CA 1 ATOM 4441 C C . ALA B 1 243 ? -23.472 73.121 -67.635 1.00 47.75 ? 238 ALA C C 1 ATOM 4442 O O . ALA B 1 243 ? -22.615 72.280 -67.907 1.00 45.56 ? 238 ALA C O 1 ATOM 4443 C CB . ALA B 1 243 ? -23.358 75.254 -68.903 1.00 51.53 ? 238 ALA C CB 1 ATOM 4444 N N . ILE B 1 244 ? -24.752 72.852 -67.432 1.00 42.66 ? 239 ILE C N 1 ATOM 4445 C CA . ILE B 1 244 ? -25.309 71.530 -67.478 1.00 42.67 ? 239 ILE C CA 1 ATOM 4446 C C . ILE B 1 244 ? -26.227 71.439 -68.686 1.00 46.33 ? 239 ILE C C 1 ATOM 4447 O O . ILE B 1 244 ? -27.024 72.347 -68.932 1.00 44.39 ? 239 ILE C O 1 ATOM 4448 C CB . ILE B 1 244 ? -26.089 71.199 -66.181 1.00 42.51 ? 239 ILE C CB 1 ATOM 4449 C CG1 . ILE B 1 244 ? -26.602 69.749 -66.191 1.00 44.05 ? 239 ILE C CG1 1 ATOM 4450 C CG2 . ILE B 1 244 ? -27.257 72.151 -65.934 1.00 40.45 ? 239 ILE C CG2 1 ATOM 4451 C CD1 . ILE B 1 244 ? -26.831 69.201 -64.782 1.00 46.79 ? 239 ILE C CD1 1 ATOM 4452 N N . HIS B 1 245 ? -26.135 70.340 -69.425 1.00 46.92 ? 240 HIS C N 1 ATOM 4453 C CA . HIS B 1 245 ? -26.886 70.189 -70.684 1.00 49.69 ? 240 HIS C CA 1 ATOM 4454 C C . HIS B 1 245 ? -27.795 68.946 -70.644 1.00 49.62 ? 240 HIS C C 1 ATOM 4455 O O . HIS B 1 245 ? -27.310 67.816 -70.587 1.00 47.99 ? 240 HIS C O 1 ATOM 4456 C CB . HIS B 1 245 ? -25.947 70.101 -71.887 1.00 49.97 ? 240 HIS C CB 1 ATOM 4457 C CG . HIS B 1 245 ? -24.910 71.174 -71.918 1.00 55.51 ? 240 HIS C CG 1 ATOM 4458 N ND1 . HIS B 1 245 ? -25.064 72.339 -72.630 1.00 54.14 ? 240 HIS C ND1 1 ATOM 4459 C CD2 . HIS B 1 245 ? -23.708 71.264 -71.301 1.00 60.50 ? 240 HIS C CD2 1 ATOM 4460 C CE1 . HIS B 1 245 ? -23.997 73.094 -72.465 1.00 56.83 ? 240 HIS C CE1 1 ATOM 4461 N NE2 . HIS B 1 245 ? -23.162 72.467 -71.659 1.00 61.19 ? 240 HIS C NE2 1 ATOM 4462 N N . PHE B 1 246 ? -29.099 69.192 -70.722 1.00 49.12 ? 241 PHE C N 1 ATOM 4463 C CA . PHE B 1 246 ? -30.109 68.177 -70.677 1.00 46.07 ? 241 PHE C CA 1 ATOM 4464 C C . PHE B 1 246 ? -30.666 67.957 -72.067 1.00 49.49 ? 241 PHE C C 1 ATOM 4465 O O . PHE B 1 246 ? -30.863 68.912 -72.794 1.00 53.29 ? 241 PHE C O 1 ATOM 4466 C CB . PHE B 1 246 ? -31.253 68.620 -69.780 1.00 42.86 ? 241 PHE C CB 1 ATOM 4467 C CG . PHE B 1 246 ? -30.918 68.613 -68.322 1.00 42.38 ? 241 PHE C CG 1 ATOM 4468 C CD1 . PHE B 1 246 ? -30.923 67.428 -67.607 1.00 41.92 ? 241 PHE C CD1 1 ATOM 4469 C CD2 . PHE B 1 246 ? -30.628 69.787 -67.662 1.00 41.26 ? 241 PHE C CD2 1 ATOM 4470 C CE1 . PHE B 1 246 ? -30.644 67.415 -66.247 1.00 40.56 ? 241 PHE C CE1 1 ATOM 4471 C CE2 . PHE B 1 246 ? -30.293 69.795 -66.323 1.00 42.73 ? 241 PHE C CE2 1 ATOM 4472 C CZ . PHE B 1 246 ? -30.298 68.600 -65.609 1.00 44.05 ? 241 PHE C CZ 1 ATOM 4473 N N . GLU B 1 247 ? -30.966 66.704 -72.390 1.00 46.19 ? 242 GLU C N 1 ATOM 4474 C CA . GLU B 1 247 ? -31.673 66.351 -73.577 1.00 46.62 ? 242 GLU C CA 1 ATOM 4475 C C . GLU B 1 247 ? -32.542 65.130 -73.275 1.00 47.58 ? 242 GLU C C 1 ATOM 4476 O O . GLU B 1 247 ? -32.060 64.124 -72.734 1.00 52.59 ? 242 GLU C O 1 ATOM 4477 C CB . GLU B 1 247 ? -30.701 66.060 -74.741 1.00 47.75 ? 242 GLU C CB 1 ATOM 4478 C CG . GLU B 1 247 ? -31.386 65.565 -76.014 1.00 55.50 ? 242 GLU C CG 1 ATOM 4479 C CD . GLU B 1 247 ? -30.432 65.286 -77.189 1.00 61.59 ? 242 GLU C CD 1 ATOM 4480 O OE1 . GLU B 1 247 ? -29.522 66.081 -77.455 1.00 66.64 ? 242 GLU C OE1 1 ATOM 4481 O OE2 . GLU B 1 247 ? -30.623 64.290 -77.903 1.00 60.95 ? 242 GLU C OE2 1 ATOM 4482 N N . SER B 1 248 ? -33.817 65.195 -73.652 1.00 45.32 ? 243 SER C N 1 ATOM 4483 C CA . SER B 1 248 ? -34.720 64.060 -73.440 1.00 42.99 ? 243 SER C CA 1 ATOM 4484 C C . SER B 1 248 ? -35.919 64.097 -74.324 1.00 43.96 ? 243 SER C C 1 ATOM 4485 O O . SER B 1 248 ? -36.394 65.162 -74.678 1.00 48.27 ? 243 SER C O 1 ATOM 4486 C CB . SER B 1 248 ? -35.248 64.035 -72.020 1.00 45.47 ? 243 SER C CB 1 ATOM 4487 O OG . SER B 1 248 ? -36.049 62.867 -71.833 1.00 39.73 ? 243 SER C OG 1 ATOM 4488 N N . ASN B 1 249 ? -36.380 62.920 -74.730 1.00 41.32 ? 244 ASN C N 1 ATOM 4489 C CA . ASN B 1 249 ? -37.634 62.831 -75.435 1.00 41.64 ? 244 ASN C CA 1 ATOM 4490 C C . ASN B 1 249 ? -38.661 62.060 -74.630 1.00 41.74 ? 244 ASN C C 1 ATOM 4491 O O . ASN B 1 249 ? -39.592 61.531 -75.193 1.00 46.15 ? 244 ASN C O 1 ATOM 4492 C CB . ASN B 1 249 ? -37.450 62.168 -76.771 1.00 43.60 ? 244 ASN C CB 1 ATOM 4493 C CG . ASN B 1 249 ? -37.066 60.727 -76.617 1.00 46.17 ? 244 ASN C CG 1 ATOM 4494 O OD1 . ASN B 1 249 ? -36.589 60.304 -75.560 1.00 47.99 ? 244 ASN C OD1 1 ATOM 4495 N ND2 . ASN B 1 249 ? -37.340 59.953 -77.634 1.00 45.57 ? 244 ASN C ND2 1 ATOM 4496 N N . GLY B 1 250 ? -38.529 62.042 -73.306 1.00 46.30 ? 245 GLY C N 1 ATOM 4497 C CA . GLY B 1 250 ? -39.547 61.427 -72.453 1.00 43.91 ? 245 GLY C CA 1 ATOM 4498 C C . GLY B 1 250 ? -39.039 60.981 -71.109 1.00 44.31 ? 245 GLY C C 1 ATOM 4499 O O . GLY B 1 250 ? -37.848 60.861 -70.903 1.00 42.87 ? 245 GLY C O 1 ATOM 4500 N N . ASN B 1 251 ? -39.965 60.765 -70.179 1.00 45.14 ? 246 ASN C N 1 ATOM 4501 C CA . ASN B 1 251 ? -39.653 60.190 -68.866 1.00 41.37 ? 246 ASN C CA 1 ATOM 4502 C C . ASN B 1 251 ? -38.724 61.017 -68.022 1.00 38.80 ? 246 ASN C C 1 ATOM 4503 O O . ASN B 1 251 ? -38.077 60.504 -67.112 1.00 38.29 ? 246 ASN C O 1 ATOM 4504 C CB . ASN B 1 251 ? -39.068 58.789 -69.037 1.00 42.63 ? 246 ASN C CB 1 ATOM 4505 C CG . ASN B 1 251 ? -39.923 57.910 -69.908 1.00 40.96 ? 246 ASN C CG 1 ATOM 4506 O OD1 . ASN B 1 251 ? -39.993 58.122 -71.119 1.00 42.51 ? 246 ASN C OD1 1 ATOM 4507 N ND2 . ASN B 1 251 ? -40.557 56.898 -69.314 1.00 40.37 ? 246 ASN C ND2 1 ATOM 4508 N N . PHE B 1 252 ? -38.659 62.310 -68.310 1.00 39.43 ? 247 PHE C N 1 ATOM 4509 C CA . PHE B 1 252 ? -37.718 63.206 -67.669 1.00 38.59 ? 247 PHE C CA 1 ATOM 4510 C C . PHE B 1 252 ? -38.409 63.954 -66.511 1.00 41.83 ? 247 PHE C C 1 ATOM 4511 O O . PHE B 1 252 ? -39.450 64.566 -66.673 1.00 46.90 ? 247 PHE C O 1 ATOM 4512 C CB . PHE B 1 252 ? -37.195 64.157 -68.736 1.00 39.12 ? 247 PHE C CB 1 ATOM 4513 C CG . PHE B 1 252 ? -36.195 65.206 -68.266 1.00 37.81 ? 247 PHE C CG 1 ATOM 4514 C CD1 . PHE B 1 252 ? -35.229 64.941 -67.306 1.00 38.09 ? 247 PHE C CD1 1 ATOM 4515 C CD2 . PHE B 1 252 ? -36.155 66.455 -68.908 1.00 40.06 ? 247 PHE C CD2 1 ATOM 4516 C CE1 . PHE B 1 252 ? -34.272 65.924 -66.969 1.00 39.50 ? 247 PHE C CE1 1 ATOM 4517 C CE2 . PHE B 1 252 ? -35.201 67.440 -68.578 1.00 38.78 ? 247 PHE C CE2 1 ATOM 4518 C CZ . PHE B 1 252 ? -34.265 67.182 -67.623 1.00 38.46 ? 247 PHE C CZ 1 ATOM 4519 N N . ILE B 1 253 ? -37.789 63.903 -65.339 1.00 43.10 ? 248 ILE C N 1 ATOM 4520 C CA . ILE B 1 253 ? -38.196 64.685 -64.193 1.00 41.25 ? 248 ILE C CA 1 ATOM 4521 C C . ILE B 1 253 ? -37.160 65.801 -64.020 1.00 38.85 ? 248 ILE C C 1 ATOM 4522 O O . ILE B 1 253 ? -36.058 65.562 -63.559 1.00 41.21 ? 248 ILE C O 1 ATOM 4523 C CB . ILE B 1 253 ? -38.261 63.815 -62.905 1.00 40.03 ? 248 ILE C CB 1 ATOM 4524 C CG1 . ILE B 1 253 ? -38.988 62.488 -63.155 1.00 41.69 ? 248 ILE C CG1 1 ATOM 4525 C CG2 . ILE B 1 253 ? -38.981 64.569 -61.806 1.00 40.66 ? 248 ILE C CG2 1 ATOM 4526 C CD1 . ILE B 1 253 ? -40.464 62.610 -63.539 1.00 40.19 ? 248 ILE C CD1 1 ATOM 4527 N N . ALA B 1 254 ? -37.544 67.017 -64.339 1.00 38.89 ? 249 ALA C N 1 ATOM 4528 C CA . ALA B 1 254 ? -36.607 68.086 -64.584 1.00 40.05 ? 249 ALA C CA 1 ATOM 4529 C C . ALA B 1 254 ? -36.333 68.921 -63.362 1.00 40.78 ? 249 ALA C C 1 ATOM 4530 O O . ALA B 1 254 ? -37.195 69.067 -62.518 1.00 38.96 ? 249 ALA C O 1 ATOM 4531 C CB . ALA B 1 254 ? -37.135 68.983 -65.695 1.00 44.02 ? 249 ALA C CB 1 ATOM 4532 N N . PRO B 1 255 ? -35.118 69.493 -63.271 1.00 39.49 ? 250 PRO C N 1 ATOM 4533 C CA . PRO B 1 255 ? -34.890 70.406 -62.194 1.00 41.59 ? 250 PRO C CA 1 ATOM 4534 C C . PRO B 1 255 ? -35.849 71.592 -62.362 1.00 47.37 ? 250 PRO C C 1 ATOM 4535 O O . PRO B 1 255 ? -36.216 71.931 -63.498 1.00 45.62 ? 250 PRO C O 1 ATOM 4536 C CB . PRO B 1 255 ? -33.461 70.892 -62.412 1.00 43.25 ? 250 PRO C CB 1 ATOM 4537 C CG . PRO B 1 255 ? -32.851 69.965 -63.405 1.00 44.39 ? 250 PRO C CG 1 ATOM 4538 C CD . PRO B 1 255 ? -33.990 69.440 -64.215 1.00 42.65 ? 250 PRO C CD 1 ATOM 4539 N N . GLU B 1 256 ? -36.264 72.154 -61.235 1.00 43.76 ? 251 GLU C N 1 ATOM 4540 C CA . GLU B 1 256 ? -36.894 73.429 -61.182 1.00 47.73 ? 251 GLU C CA 1 ATOM 4541 C C . GLU B 1 256 ? -36.073 74.295 -60.251 1.00 45.57 ? 251 GLU C C 1 ATOM 4542 O O . GLU B 1 256 ? -35.485 75.271 -60.665 1.00 44.32 ? 251 GLU C O 1 ATOM 4543 C CB . GLU B 1 256 ? -38.330 73.268 -60.714 1.00 52.56 ? 251 GLU C CB 1 ATOM 4544 C CG . GLU B 1 256 ? -39.202 74.523 -60.801 1.00 56.62 ? 251 GLU C CG 1 ATOM 4545 C CD . GLU B 1 256 ? -40.618 74.311 -60.268 1.00 61.10 ? 251 GLU C CD 1 ATOM 4546 O OE1 . GLU B 1 256 ? -41.098 73.156 -60.103 1.00 65.73 ? 251 GLU C OE1 1 ATOM 4547 O OE2 . GLU B 1 256 ? -41.277 75.321 -59.991 1.00 78.31 ? 251 GLU C OE2 1 ATOM 4548 N N . TYR B 1 257 ? -35.991 73.899 -58.992 1.00 50.53 ? 252 TYR C N 1 ATOM 4549 C CA . TYR B 1 257 ? -35.089 74.531 -58.041 1.00 48.22 ? 252 TYR C CA 1 ATOM 4550 C C . TYR B 1 257 ? -33.804 73.721 -57.854 1.00 45.17 ? 252 TYR C C 1 ATOM 4551 O O . TYR B 1 257 ? -33.729 72.558 -58.196 1.00 48.20 ? 252 TYR C O 1 ATOM 4552 C CB . TYR B 1 257 ? -35.758 74.650 -56.691 1.00 50.65 ? 252 TYR C CB 1 ATOM 4553 C CG . TYR B 1 257 ? -36.944 75.552 -56.664 1.00 48.76 ? 252 TYR C CG 1 ATOM 4554 C CD1 . TYR B 1 257 ? -36.839 76.844 -56.169 1.00 52.15 ? 252 TYR C CD1 1 ATOM 4555 C CD2 . TYR B 1 257 ? -38.209 75.076 -57.049 1.00 49.94 ? 252 TYR C CD2 1 ATOM 4556 C CE1 . TYR B 1 257 ? -37.964 77.668 -56.111 1.00 52.65 ? 252 TYR C CE1 1 ATOM 4557 C CE2 . TYR B 1 257 ? -39.334 75.882 -56.997 1.00 51.05 ? 252 TYR C CE2 1 ATOM 4558 C CZ . TYR B 1 257 ? -39.203 77.178 -56.547 1.00 50.53 ? 252 TYR C CZ 1 ATOM 4559 O OH . TYR B 1 257 ? -40.314 77.955 -56.539 1.00 55.08 ? 252 TYR C OH 1 ATOM 4560 N N . ALA B 1 258 ? -32.814 74.357 -57.247 1.00 43.47 ? 253 ALA C N 1 ATOM 4561 C CA . ALA B 1 258 ? -31.521 73.777 -57.026 1.00 43.09 ? 253 ALA C CA 1 ATOM 4562 C C . ALA B 1 258 ? -30.922 74.512 -55.841 1.00 41.62 ? 253 ALA C C 1 ATOM 4563 O O . ALA B 1 258 ? -31.572 75.358 -55.281 1.00 46.02 ? 253 ALA C O 1 ATOM 4564 C CB . ALA B 1 258 ? -30.656 73.938 -58.265 1.00 46.36 ? 253 ALA C CB 1 ATOM 4565 N N . TYR B 1 259 ? -29.716 74.164 -55.426 1.00 42.05 ? 254 TYR C N 1 ATOM 4566 C CA . TYR B 1 259 ? -29.206 74.709 -54.168 1.00 46.01 ? 254 TYR C CA 1 ATOM 4567 C C . TYR B 1 259 ? -27.782 75.239 -54.274 1.00 50.03 ? 254 TYR C C 1 ATOM 4568 O O . TYR B 1 259 ? -26.867 74.491 -54.610 1.00 47.43 ? 254 TYR C O 1 ATOM 4569 C CB . TYR B 1 259 ? -29.220 73.654 -53.067 1.00 45.82 ? 254 TYR C CB 1 ATOM 4570 C CG . TYR B 1 259 ? -30.588 73.043 -52.776 1.00 50.06 ? 254 TYR C CG 1 ATOM 4571 C CD1 . TYR B 1 259 ? -30.994 71.850 -53.388 1.00 48.02 ? 254 TYR C CD1 1 ATOM 4572 C CD2 . TYR B 1 259 ? -31.460 73.639 -51.873 1.00 47.28 ? 254 TYR C CD2 1 ATOM 4573 C CE1 . TYR B 1 259 ? -32.212 71.284 -53.090 1.00 43.85 ? 254 TYR C CE1 1 ATOM 4574 C CE2 . TYR B 1 259 ? -32.681 73.077 -51.596 1.00 45.43 ? 254 TYR C CE2 1 ATOM 4575 C CZ . TYR B 1 259 ? -33.040 71.906 -52.199 1.00 44.48 ? 254 TYR C CZ 1 ATOM 4576 O OH . TYR B 1 259 ? -34.236 71.371 -51.896 1.00 45.94 ? 254 TYR C OH 1 ATOM 4577 N N . LYS B 1 260 ? -27.602 76.523 -53.955 1.00 48.75 ? 255 LYS C N 1 ATOM 4578 C CA . LYS B 1 260 ? -26.267 77.056 -53.779 1.00 53.02 ? 255 LYS C CA 1 ATOM 4579 C C . LYS B 1 260 ? -25.662 76.422 -52.539 1.00 50.11 ? 255 LYS C C 1 ATOM 4580 O O . LYS B 1 260 ? -26.310 76.341 -51.489 1.00 49.22 ? 255 LYS C O 1 ATOM 4581 C CB . LYS B 1 260 ? -26.276 78.580 -53.630 1.00 61.47 ? 255 LYS C CB 1 ATOM 4582 C CG . LYS B 1 260 ? -26.924 79.281 -54.816 1.00 67.08 ? 255 LYS C CG 1 ATOM 4583 C CD . LYS B 1 260 ? -26.400 80.678 -55.057 1.00 71.16 ? 255 LYS C CD 1 ATOM 4584 C CE . LYS B 1 260 ? -26.773 81.632 -53.956 1.00 73.44 ? 255 LYS C CE 1 ATOM 4585 N NZ . LYS B 1 260 ? -25.943 82.845 -54.090 1.00 78.19 ? 255 LYS C NZ 1 ATOM 4586 N N . ILE B 1 261 ? -24.419 75.996 -52.645 1.00 46.44 ? 256 ILE C N 1 ATOM 4587 C CA . ILE B 1 261 ? -23.842 75.205 -51.577 1.00 55.54 ? 256 ILE C CA 1 ATOM 4588 C C . ILE B 1 261 ? -22.395 75.625 -51.395 1.00 52.58 ? 256 ILE C C 1 ATOM 4589 O O . ILE B 1 261 ? -21.682 75.815 -52.374 1.00 54.37 ? 256 ILE C O 1 ATOM 4590 C CB . ILE B 1 261 ? -24.032 73.696 -51.916 1.00 55.84 ? 256 ILE C CB 1 ATOM 4591 C CG1 . ILE B 1 261 ? -23.405 72.801 -50.900 1.00 58.45 ? 256 ILE C CG1 1 ATOM 4592 C CG2 . ILE B 1 261 ? -23.390 73.361 -53.236 1.00 61.25 ? 256 ILE C CG2 1 ATOM 4593 C CD1 . ILE B 1 261 ? -23.693 71.337 -51.149 1.00 62.81 ? 256 ILE C CD1 1 ATOM 4594 N N . VAL B 1 262 ? -21.986 75.844 -50.158 1.00 49.24 ? 257 VAL C N 1 ATOM 4595 C CA . VAL B 1 262 ? -20.573 76.067 -49.869 1.00 52.88 ? 257 VAL C CA 1 ATOM 4596 C C . VAL B 1 262 ? -20.181 75.092 -48.801 1.00 51.32 ? 257 VAL C C 1 ATOM 4597 O O . VAL B 1 262 ? -20.806 75.051 -47.771 1.00 50.38 ? 257 VAL C O 1 ATOM 4598 C CB . VAL B 1 262 ? -20.261 77.508 -49.408 1.00 55.19 ? 257 VAL C CB 1 ATOM 4599 C CG1 . VAL B 1 262 ? -18.809 77.655 -48.943 1.00 56.44 ? 257 VAL C CG1 1 ATOM 4600 C CG2 . VAL B 1 262 ? -20.479 78.471 -50.544 1.00 54.41 ? 257 VAL C CG2 1 ATOM 4601 N N . LYS B 1 263 ? -19.097 74.363 -49.037 1.00 58.52 ? 258 LYS C N 1 ATOM 4602 C CA . LYS B 1 263 ? -18.771 73.188 -48.244 1.00 63.42 ? 258 LYS C CA 1 ATOM 4603 C C . LYS B 1 263 ? -17.844 73.362 -47.023 1.00 68.18 ? 258 LYS C C 1 ATOM 4604 O O . LYS B 1 263 ? -18.310 73.227 -45.858 1.00 82.88 ? 258 LYS C O 1 ATOM 4605 C CB . LYS B 1 263 ? -18.249 72.075 -49.139 1.00 66.43 ? 258 LYS C CB 1 ATOM 4606 C CG . LYS B 1 263 ? -18.946 70.762 -48.851 1.00 67.13 ? 258 LYS C CG 1 ATOM 4607 C CD . LYS B 1 263 ? -18.702 70.236 -47.444 1.00 62.33 ? 258 LYS C CD 1 ATOM 4608 C CE . LYS B 1 263 ? -18.869 68.723 -47.413 1.00 60.71 ? 258 LYS C CE 1 ATOM 4609 N NZ . LYS B 1 263 ? -19.061 68.211 -46.029 1.00 61.91 ? 258 LYS C NZ 1 ATOM 4610 N N . LYS B 1 264 ? -16.555 73.589 -47.221 1.00 59.65 ? 259 LYS C N 1 ATOM 4611 C CA . LYS B 1 264 ? -15.694 73.769 -46.031 1.00 73.10 ? 259 LYS C CA 1 ATOM 4612 C C . LYS B 1 264 ? -15.532 72.395 -45.291 1.00 75.64 ? 259 LYS C C 1 ATOM 4613 O O . LYS B 1 264 ? -15.055 71.427 -45.896 1.00 88.74 ? 259 LYS C O 1 ATOM 4614 C CB . LYS B 1 264 ? -16.259 74.903 -45.142 1.00 74.71 ? 259 LYS C CB 1 ATOM 4615 C CG . LYS B 1 264 ? -15.234 75.812 -44.493 1.00 83.16 ? 259 LYS C CG 1 ATOM 4616 C CD . LYS B 1 264 ? -15.591 77.283 -44.686 1.00 85.66 ? 259 LYS C CD 1 ATOM 4617 C CE . LYS B 1 264 ? -15.430 77.691 -46.144 1.00 79.84 ? 259 LYS C CE 1 ATOM 4618 N NZ . LYS B 1 264 ? -15.938 79.062 -46.358 1.00 80.66 ? 259 LYS C NZ 1 ATOM 4619 N N . GLY B 1 265 ? -15.944 72.270 -44.036 1.00 65.47 ? 260 GLY C N 1 ATOM 4620 C CA . GLY B 1 265 ? -15.838 70.991 -43.339 1.00 61.84 ? 260 GLY C CA 1 ATOM 4621 C C . GLY B 1 265 ? -16.783 69.777 -43.521 1.00 57.05 ? 260 GLY C C 1 ATOM 4622 O O . GLY B 1 265 ? -17.789 69.790 -44.222 1.00 50.34 ? 260 GLY C O 1 ATOM 4623 N N . ASP B 1 266 ? -16.451 68.727 -42.787 1.00 59.84 ? 261 ASP C N 1 ATOM 4624 C CA . ASP B 1 266 ? -17.131 67.425 -42.828 1.00 60.22 ? 261 ASP C CA 1 ATOM 4625 C C . ASP B 1 266 ? -17.691 67.005 -41.464 1.00 56.24 ? 261 ASP C C 1 ATOM 4626 O O . ASP B 1 266 ? -17.175 67.375 -40.410 1.00 48.23 ? 261 ASP C O 1 ATOM 4627 C CB . ASP B 1 266 ? -16.156 66.339 -43.257 1.00 64.01 ? 261 ASP C CB 1 ATOM 4628 C CG . ASP B 1 266 ? -15.848 66.383 -44.736 1.00 78.21 ? 261 ASP C CG 1 ATOM 4629 O OD1 . ASP B 1 266 ? -16.758 66.018 -45.575 1.00 80.74 ? 261 ASP C OD1 1 ATOM 4630 O OD2 . ASP B 1 266 ? -14.679 66.757 -45.029 1.00 75.47 ? 261 ASP C OD2 1 ATOM 4631 N N . SER B 1 267 ? -18.749 66.197 -41.500 1.00 50.52 ? 262 SER C N 1 ATOM 4632 C CA . SER B 1 267 ? -19.425 65.761 -40.283 1.00 47.60 ? 262 SER C CA 1 ATOM 4633 C C . SER B 1 267 ? -20.022 64.391 -40.561 1.00 44.41 ? 262 SER C C 1 ATOM 4634 O O . SER B 1 267 ? -19.439 63.639 -41.307 1.00 43.90 ? 262 SER C O 1 ATOM 4635 C CB . SER B 1 267 ? -20.496 66.781 -39.949 1.00 46.54 ? 262 SER C CB 1 ATOM 4636 O OG . SER B 1 267 ? -20.951 66.564 -38.670 1.00 50.25 ? 262 SER C OG 1 ATOM 4637 N N . THR B 1 268 ? -21.209 64.092 -40.029 1.00 44.43 ? 263 THR C N 1 ATOM 4638 C CA . THR B 1 268 ? -21.948 62.901 -40.432 1.00 40.85 ? 263 THR C CA 1 ATOM 4639 C C . THR B 1 268 ? -23.420 63.058 -40.100 1.00 41.87 ? 263 THR C C 1 ATOM 4640 O O . THR B 1 268 ? -23.824 64.108 -39.644 1.00 42.39 ? 263 THR C O 1 ATOM 4641 C CB . THR B 1 268 ? -21.406 61.611 -39.784 1.00 39.25 ? 263 THR C CB 1 ATOM 4642 O OG1 . THR B 1 268 ? -21.939 60.466 -40.473 1.00 39.12 ? 263 THR C OG1 1 ATOM 4643 C CG2 . THR B 1 268 ? -21.804 61.532 -38.315 1.00 39.74 ? 263 THR C CG2 1 ATOM 4644 N N . ILE B 1 269 ? -24.222 62.027 -40.373 1.00 38.27 ? 264 ILE C N 1 ATOM 4645 C CA . ILE B 1 269 ? -25.635 62.053 -40.046 1.00 40.24 ? 264 ILE C CA 1 ATOM 4646 C C . ILE B 1 269 ? -25.842 61.425 -38.684 1.00 40.10 ? 264 ILE C C 1 ATOM 4647 O O . ILE B 1 269 ? -25.455 60.277 -38.474 1.00 41.71 ? 264 ILE C O 1 ATOM 4648 C CB . ILE B 1 269 ? -26.462 61.236 -41.057 1.00 40.15 ? 264 ILE C CB 1 ATOM 4649 C CG1 . ILE B 1 269 ? -26.162 61.688 -42.473 1.00 43.16 ? 264 ILE C CG1 1 ATOM 4650 C CG2 . ILE B 1 269 ? -27.939 61.340 -40.743 1.00 38.55 ? 264 ILE C CG2 1 ATOM 4651 C CD1 . ILE B 1 269 ? -26.453 63.154 -42.723 1.00 49.44 ? 264 ILE C CD1 1 ATOM 4652 N N . MET B 1 270 ? -26.488 62.149 -37.766 1.00 40.22 ? 265 MET C N 1 ATOM 4653 C CA . MET B 1 270 ? -26.814 61.598 -36.438 1.00 43.19 ? 265 MET C CA 1 ATOM 4654 C C . MET B 1 270 ? -28.258 61.070 -36.435 1.00 42.77 ? 265 MET C C 1 ATOM 4655 O O . MET B 1 270 ? -29.163 61.738 -36.910 1.00 43.51 ? 265 MET C O 1 ATOM 4656 C CB . MET B 1 270 ? -26.622 62.641 -35.343 1.00 45.81 ? 265 MET C CB 1 ATOM 4657 C CG . MET B 1 270 ? -27.133 62.188 -33.978 1.00 49.15 ? 265 MET C CG 1 ATOM 4658 S SD . MET B 1 270 ? -26.602 63.215 -32.599 1.00 52.09 ? 265 MET C SD 1 ATOM 4659 C CE . MET B 1 270 ? -24.833 63.005 -32.677 1.00 55.30 ? 265 MET C CE 1 ATOM 4660 N N . LYS B 1 271 ? -28.450 59.860 -35.918 1.00 40.97 ? 266 LYS C N 1 ATOM 4661 C CA . LYS B 1 271 ? -29.781 59.287 -35.744 1.00 44.47 ? 266 LYS C CA 1 ATOM 4662 C C . LYS B 1 271 ? -30.205 59.532 -34.294 1.00 45.41 ? 266 LYS C C 1 ATOM 4663 O O . LYS B 1 271 ? -29.559 59.044 -33.366 1.00 45.73 ? 266 LYS C O 1 ATOM 4664 C CB . LYS B 1 271 ? -29.810 57.782 -36.080 1.00 46.64 ? 266 LYS C CB 1 ATOM 4665 C CG . LYS B 1 271 ? -29.416 57.378 -37.523 1.00 46.76 ? 266 LYS C CG 1 ATOM 4666 C CD . LYS B 1 271 ? -30.247 58.079 -38.601 1.00 50.10 ? 266 LYS C CD 1 ATOM 4667 C CE . LYS B 1 271 ? -30.652 57.173 -39.772 1.00 55.42 ? 266 LYS C CE 1 ATOM 4668 N NZ . LYS B 1 271 ? -32.026 57.546 -40.374 1.00 58.67 ? 266 LYS C NZ 1 ATOM 4669 N N . SER B 1 272 ? -31.255 60.337 -34.114 1.00 46.85 ? 267 SER C N 1 ATOM 4670 C CA . SER B 1 272 ? -31.800 60.666 -32.787 1.00 51.48 ? 267 SER C CA 1 ATOM 4671 C C . SER B 1 272 ? -33.284 61.008 -32.898 1.00 52.02 ? 267 SER C C 1 ATOM 4672 O O . SER B 1 272 ? -33.725 61.565 -33.888 1.00 50.22 ? 267 SER C O 1 ATOM 4673 C CB . SER B 1 272 ? -31.099 61.883 -32.196 1.00 52.08 ? 267 SER C CB 1 ATOM 4674 O OG . SER B 1 272 ? -31.485 62.046 -30.842 1.00 56.45 ? 267 SER C OG 1 ATOM 4675 N N . GLU B 1 273 ? -34.044 60.725 -31.854 1.00 54.32 ? 268 GLU C N 1 ATOM 4676 C CA . GLU B 1 273 ? -35.465 61.106 -31.836 1.00 55.81 ? 268 GLU C CA 1 ATOM 4677 C C . GLU B 1 273 ? -35.673 62.439 -31.096 1.00 58.08 ? 268 GLU C C 1 ATOM 4678 O O . GLU B 1 273 ? -36.763 63.025 -31.114 1.00 56.22 ? 268 GLU C O 1 ATOM 4679 C CB . GLU B 1 273 ? -36.315 59.996 -31.237 1.00 58.92 ? 268 GLU C CB 1 ATOM 4680 C CG . GLU B 1 273 ? -36.057 58.606 -31.822 1.00 62.41 ? 268 GLU C CG 1 ATOM 4681 C CD . GLU B 1 273 ? -36.251 58.517 -33.339 1.00 67.94 ? 268 GLU C CD 1 ATOM 4682 O OE1 . GLU B 1 273 ? -37.355 58.845 -33.821 1.00 65.47 ? 268 GLU C OE1 1 ATOM 4683 O OE2 . GLU B 1 273 ? -35.288 58.101 -34.037 1.00 61.05 ? 268 GLU C OE2 1 ATOM 4684 N N . MET B 1 274 ? -34.614 62.924 -30.457 1.00 56.98 ? 269 MET C N 1 ATOM 4685 C CA . MET B 1 274 ? -34.702 64.143 -29.680 1.00 62.73 ? 269 MET C CA 1 ATOM 4686 C C . MET B 1 274 ? -34.927 65.401 -30.541 1.00 64.65 ? 269 MET C C 1 ATOM 4687 O O . MET B 1 274 ? -34.674 65.402 -31.728 1.00 64.73 ? 269 MET C O 1 ATOM 4688 C CB . MET B 1 274 ? -33.463 64.256 -28.787 1.00 65.85 ? 269 MET C CB 1 ATOM 4689 C CG . MET B 1 274 ? -33.395 63.141 -27.752 1.00 66.64 ? 269 MET C CG 1 ATOM 4690 S SD . MET B 1 274 ? -32.293 63.582 -26.418 1.00 72.55 ? 269 MET C SD 1 ATOM 4691 C CE . MET B 1 274 ? -30.823 64.182 -27.294 1.00 73.71 ? 269 MET C CE 1 ATOM 4692 N N . GLU B 1 275 ? -35.363 66.484 -29.918 1.00 71.08 ? 270 GLU C N 1 ATOM 4693 C CA . GLU B 1 275 ? -35.516 67.755 -30.598 1.00 75.10 ? 270 GLU C CA 1 ATOM 4694 C C . GLU B 1 275 ? -34.422 68.710 -30.113 1.00 67.25 ? 270 GLU C C 1 ATOM 4695 O O . GLU B 1 275 ? -33.713 68.478 -29.108 1.00 67.57 ? 270 GLU C O 1 ATOM 4696 C CB . GLU B 1 275 ? -36.913 68.344 -30.327 1.00 86.70 ? 270 GLU C CB 1 ATOM 4697 C CG . GLU B 1 275 ? -37.599 69.028 -31.532 1.00 98.44 ? 270 GLU C CG 1 ATOM 4698 C CD . GLU B 1 275 ? -38.663 68.182 -32.238 1.00 96.30 ? 270 GLU C CD 1 ATOM 4699 O OE1 . GLU B 1 275 ? -39.291 67.321 -31.589 1.00 91.41 ? 270 GLU C OE1 1 ATOM 4700 O OE2 . GLU B 1 275 ? -38.890 68.405 -33.455 1.00 103.20 ? 270 GLU C OE2 1 ATOM 4701 N N . TYR B 1 276 ? -34.303 69.819 -30.813 1.00 62.57 ? 271 TYR C N 1 ATOM 4702 C CA . TYR B 1 276 ? -33.348 70.862 -30.439 1.00 63.14 ? 271 TYR C CA 1 ATOM 4703 C C . TYR B 1 276 ? -33.514 71.316 -28.983 1.00 60.77 ? 271 TYR C C 1 ATOM 4704 O O . TYR B 1 276 ? -34.629 71.409 -28.502 1.00 58.58 ? 271 TYR C O 1 ATOM 4705 C CB . TYR B 1 276 ? -33.572 72.051 -31.354 1.00 61.17 ? 271 TYR C CB 1 ATOM 4706 C CG . TYR B 1 276 ? -32.532 73.110 -31.253 1.00 65.62 ? 271 TYR C CG 1 ATOM 4707 C CD1 . TYR B 1 276 ? -31.171 72.792 -31.247 1.00 68.55 ? 271 TYR C CD1 1 ATOM 4708 C CD2 . TYR B 1 276 ? -32.886 74.419 -31.185 1.00 63.42 ? 271 TYR C CD2 1 ATOM 4709 C CE1 . TYR B 1 276 ? -30.210 73.773 -31.176 1.00 67.00 ? 271 TYR C CE1 1 ATOM 4710 C CE2 . TYR B 1 276 ? -31.935 75.404 -31.113 1.00 68.50 ? 271 TYR C CE2 1 ATOM 4711 C CZ . TYR B 1 276 ? -30.603 75.075 -31.104 1.00 69.51 ? 271 TYR C CZ 1 ATOM 4712 O OH . TYR B 1 276 ? -29.675 76.077 -31.037 1.00 72.18 ? 271 TYR C OH 1 ATOM 4713 N N . GLY B 1 277 ? -32.405 71.581 -28.293 1.00 57.50 ? 272 GLY C N 1 ATOM 4714 C CA . GLY B 1 277 ? -32.437 72.000 -26.880 1.00 55.84 ? 272 GLY C CA 1 ATOM 4715 C C . GLY B 1 277 ? -31.838 73.369 -26.589 1.00 54.22 ? 272 GLY C C 1 ATOM 4716 O O . GLY B 1 277 ? -31.531 73.688 -25.441 1.00 63.53 ? 272 GLY C O 1 ATOM 4717 N N . HIS B 1 278 ? -31.646 74.179 -27.617 1.00 56.60 ? 273 HIS C N 1 ATOM 4718 C CA . HIS B 1 278 ? -31.257 75.571 -27.408 1.00 67.69 ? 273 HIS C CA 1 ATOM 4719 C C . HIS B 1 278 ? -30.019 75.697 -26.509 1.00 70.38 ? 273 HIS C C 1 ATOM 4720 O O . HIS B 1 278 ? -29.981 76.495 -25.589 1.00 74.68 ? 273 HIS C O 1 ATOM 4721 C CB . HIS B 1 278 ? -32.451 76.351 -26.822 1.00 70.20 ? 273 HIS C CB 1 ATOM 4722 C CG . HIS B 1 278 ? -33.710 76.205 -27.629 1.00 72.17 ? 273 HIS C CG 1 ATOM 4723 N ND1 . HIS B 1 278 ? -33.999 77.009 -28.719 1.00 74.64 ? 273 HIS C ND1 1 ATOM 4724 C CD2 . HIS B 1 278 ? -34.751 75.340 -27.512 1.00 70.29 ? 273 HIS C CD2 1 ATOM 4725 C CE1 . HIS B 1 278 ? -35.168 76.651 -29.232 1.00 71.36 ? 273 HIS C CE1 1 ATOM 4726 N NE2 . HIS B 1 278 ? -35.648 75.645 -28.515 1.00 70.36 ? 273 HIS C NE2 1 ATOM 4727 N N . CYS B 1 279 ? -29.026 74.867 -26.796 1.00 72.78 ? 274 CYS C N 1 ATOM 4728 C CA . CYS B 1 279 ? -27.787 74.722 -26.009 1.00 67.01 ? 274 CYS C CA 1 ATOM 4729 C C . CYS B 1 279 ? -26.625 74.686 -26.977 1.00 60.74 ? 274 CYS C C 1 ATOM 4730 O O . CYS B 1 279 ? -26.801 74.613 -28.191 1.00 62.26 ? 274 CYS C O 1 ATOM 4731 C CB . CYS B 1 279 ? -27.806 73.414 -25.201 1.00 66.63 ? 274 CYS C CB 1 ATOM 4732 S SG . CYS B 1 279 ? -28.428 71.973 -26.165 1.00 77.41 ? 274 CYS C SG 1 ATOM 4733 N N . ASN B 1 280 ? -25.422 74.741 -26.440 1.00 61.35 ? 275 ASN C N 1 ATOM 4734 C CA . ASN B 1 280 ? -24.213 74.638 -27.255 1.00 60.81 ? 275 ASN C CA 1 ATOM 4735 C C . ASN B 1 280 ? -23.275 73.607 -26.614 1.00 59.84 ? 275 ASN C C 1 ATOM 4736 O O . ASN B 1 280 ? -23.307 73.397 -25.403 1.00 57.70 ? 275 ASN C O 1 ATOM 4737 C CB . ASN B 1 280 ? -23.546 76.011 -27.425 1.00 60.25 ? 275 ASN C CB 1 ATOM 4738 C CG . ASN B 1 280 ? -22.317 75.951 -28.306 1.00 62.52 ? 275 ASN C CG 1 ATOM 4739 O OD1 . ASN B 1 280 ? -22.349 75.434 -29.417 1.00 61.59 ? 275 ASN C OD1 1 ATOM 4740 N ND2 . ASN B 1 280 ? -21.218 76.466 -27.806 1.00 68.24 ? 275 ASN C ND2 1 ATOM 4741 N N . THR B 1 281 ? -22.491 72.932 -27.444 1.00 59.24 ? 276 THR C N 1 ATOM 4742 C CA . THR B 1 281 ? -21.543 71.917 -26.976 1.00 60.04 ? 276 THR C CA 1 ATOM 4743 C C . THR B 1 281 ? -20.355 71.714 -27.937 1.00 56.54 ? 276 THR C C 1 ATOM 4744 O O . THR B 1 281 ? -20.387 72.144 -29.093 1.00 62.72 ? 276 THR C O 1 ATOM 4745 C CB . THR B 1 281 ? -22.264 70.574 -26.740 1.00 58.00 ? 276 THR C CB 1 ATOM 4746 O OG1 . THR B 1 281 ? -21.392 69.685 -26.071 1.00 53.27 ? 276 THR C OG1 1 ATOM 4747 C CG2 . THR B 1 281 ? -22.691 69.926 -28.059 1.00 59.54 ? 276 THR C CG2 1 ATOM 4748 N N . LYS B 1 282 ? -19.321 71.072 -27.429 1.00 56.70 ? 277 LYS C N 1 ATOM 4749 C CA . LYS B 1 282 ? -18.154 70.621 -28.208 1.00 58.36 ? 277 LYS C CA 1 ATOM 4750 C C . LYS B 1 282 ? -18.306 69.163 -28.629 1.00 48.46 ? 277 LYS C C 1 ATOM 4751 O O . LYS B 1 282 ? -17.624 68.697 -29.569 1.00 41.59 ? 277 LYS C O 1 ATOM 4752 C CB . LYS B 1 282 ? -16.888 70.751 -27.349 1.00 69.74 ? 277 LYS C CB 1 ATOM 4753 C CG . LYS B 1 282 ? -16.784 72.125 -26.690 1.00 93.46 ? 277 LYS C CG 1 ATOM 4754 C CD . LYS B 1 282 ? -15.407 72.616 -26.239 1.00 109.63 ? 277 LYS C CD 1 ATOM 4755 C CE . LYS B 1 282 ? -15.418 74.090 -25.792 1.00 112.10 ? 277 LYS C CE 1 ATOM 4756 N NZ . LYS B 1 282 ? -15.043 75.032 -26.895 1.00 106.46 ? 277 LYS C NZ 1 ATOM 4757 N N . CYS B 1 283 ? -19.209 68.452 -27.951 1.00 44.11 ? 278 CYS C N 1 ATOM 4758 C CA . CYS B 1 283 ? -19.354 66.986 -28.099 1.00 44.85 ? 278 CYS C CA 1 ATOM 4759 C C . CYS B 1 283 ? -20.791 66.535 -27.999 1.00 43.82 ? 278 CYS C C 1 ATOM 4760 O O . CYS B 1 283 ? -21.389 66.571 -26.928 1.00 43.95 ? 278 CYS C O 1 ATOM 4761 C CB . CYS B 1 283 ? -18.537 66.291 -27.016 1.00 44.60 ? 278 CYS C CB 1 ATOM 4762 S SG . CYS B 1 283 ? -18.674 64.503 -27.049 1.00 49.20 ? 278 CYS C SG 1 ATOM 4763 N N . GLN B 1 284 ? -21.380 66.131 -29.119 1.00 47.98 ? 279 GLN C N 1 ATOM 4764 C CA . GLN B 1 284 ? -22.794 65.697 -29.128 1.00 45.47 ? 279 GLN C CA 1 ATOM 4765 C C . GLN B 1 284 ? -22.911 64.204 -29.221 1.00 48.23 ? 279 GLN C C 1 ATOM 4766 O O . GLN B 1 284 ? -22.169 63.576 -29.996 1.00 48.18 ? 279 GLN C O 1 ATOM 4767 C CB . GLN B 1 284 ? -23.496 66.297 -30.332 1.00 46.11 ? 279 GLN C CB 1 ATOM 4768 C CG . GLN B 1 284 ? -25.003 66.107 -30.345 1.00 44.26 ? 279 GLN C CG 1 ATOM 4769 C CD . GLN B 1 284 ? -25.683 66.821 -29.179 1.00 42.94 ? 279 GLN C CD 1 ATOM 4770 O OE1 . GLN B 1 284 ? -25.553 68.026 -29.010 1.00 42.21 ? 279 GLN C OE1 1 ATOM 4771 N NE2 . GLN B 1 284 ? -26.431 66.068 -28.389 1.00 48.87 ? 279 GLN C NE2 1 ATOM 4772 N N . THR B 1 285 ? -23.845 63.638 -28.463 1.00 45.18 ? 280 THR C N 1 ATOM 4773 C CA . THR B 1 285 ? -24.236 62.245 -28.645 1.00 42.88 ? 280 THR C CA 1 ATOM 4774 C C . THR B 1 285 ? -25.718 62.207 -29.005 1.00 44.92 ? 280 THR C C 1 ATOM 4775 O O . THR B 1 285 ? -26.449 63.127 -28.725 1.00 48.23 ? 280 THR C O 1 ATOM 4776 C CB . THR B 1 285 ? -23.927 61.375 -27.400 1.00 44.08 ? 280 THR C CB 1 ATOM 4777 O OG1 . THR B 1 285 ? -25.023 61.373 -26.492 1.00 44.29 ? 280 THR C OG1 1 ATOM 4778 C CG2 . THR B 1 285 ? -22.685 61.889 -26.655 1.00 49.26 ? 280 THR C CG2 1 ATOM 4779 N N . PRO B 1 286 ? -26.196 61.098 -29.548 1.00 47.21 ? 281 PRO C N 1 ATOM 4780 C CA . PRO B 1 286 ? -27.604 61.034 -29.854 1.00 48.55 ? 281 PRO C CA 1 ATOM 4781 C C . PRO B 1 286 ? -28.558 61.048 -28.656 1.00 52.50 ? 281 PRO C C 1 ATOM 4782 O O . PRO B 1 286 ? -29.778 61.196 -28.876 1.00 61.19 ? 281 PRO C O 1 ATOM 4783 C CB . PRO B 1 286 ? -27.743 59.700 -30.599 1.00 47.89 ? 281 PRO C CB 1 ATOM 4784 C CG . PRO B 1 286 ? -26.361 59.301 -30.954 1.00 48.20 ? 281 PRO C CG 1 ATOM 4785 C CD . PRO B 1 286 ? -25.522 59.827 -29.834 1.00 47.24 ? 281 PRO C CD 1 ATOM 4786 N N . ILE B 1 287 ? -28.054 60.855 -27.431 1.00 48.25 ? 282 ILE C N 1 ATOM 4787 C CA . ILE B 1 287 ? -28.913 60.919 -26.217 1.00 44.69 ? 282 ILE C CA 1 ATOM 4788 C C . ILE B 1 287 ? -28.626 62.156 -25.362 1.00 49.94 ? 282 ILE C C 1 ATOM 4789 O O . ILE B 1 287 ? -29.274 62.378 -24.303 1.00 45.77 ? 282 ILE C O 1 ATOM 4790 C CB . ILE B 1 287 ? -28.808 59.660 -25.321 1.00 44.99 ? 282 ILE C CB 1 ATOM 4791 C CG1 . ILE B 1 287 ? -27.372 59.440 -24.801 1.00 45.26 ? 282 ILE C CG1 1 ATOM 4792 C CG2 . ILE B 1 287 ? -29.299 58.425 -26.080 1.00 44.60 ? 282 ILE C CG2 1 ATOM 4793 C CD1 . ILE B 1 287 ? -27.277 58.345 -23.762 1.00 44.03 ? 282 ILE C CD1 1 ATOM 4794 N N . GLY B 1 288 ? -27.693 62.978 -25.833 1.00 45.29 ? 283 GLY C N 1 ATOM 4795 C CA . GLY B 1 288 ? -27.365 64.218 -25.137 1.00 47.19 ? 283 GLY C CA 1 ATOM 4796 C C . GLY B 1 288 ? -25.922 64.661 -25.304 1.00 45.65 ? 283 GLY C C 1 ATOM 4797 O O . GLY B 1 288 ? -25.059 63.867 -25.649 1.00 44.96 ? 283 GLY C O 1 ATOM 4798 N N . ALA B 1 289 ? -25.687 65.942 -25.058 1.00 45.25 ? 284 ALA C N 1 ATOM 4799 C CA . ALA B 1 289 ? -24.368 66.563 -25.174 1.00 49.52 ? 284 ALA C CA 1 ATOM 4800 C C . ALA B 1 289 ? -23.512 66.340 -23.943 1.00 46.83 ? 284 ALA C C 1 ATOM 4801 O O . ALA B 1 289 ? -24.013 66.169 -22.853 1.00 44.48 ? 284 ALA C O 1 ATOM 4802 C CB . ALA B 1 289 ? -24.517 68.059 -25.426 1.00 50.16 ? 284 ALA C CB 1 ATOM 4803 N N . ILE B 1 290 ? -22.205 66.355 -24.142 1.00 48.46 ? 285 ILE C N 1 ATOM 4804 C CA . ILE B 1 290 ? -21.224 66.060 -23.076 1.00 52.72 ? 285 ILE C CA 1 ATOM 4805 C C . ILE B 1 290 ? -20.459 67.335 -22.878 1.00 53.71 ? 285 ILE C C 1 ATOM 4806 O O . ILE B 1 290 ? -20.048 67.952 -23.845 1.00 57.56 ? 285 ILE C O 1 ATOM 4807 C CB . ILE B 1 290 ? -20.202 64.931 -23.482 1.00 48.77 ? 285 ILE C CB 1 ATOM 4808 C CG1 . ILE B 1 290 ? -20.835 63.541 -23.442 1.00 49.54 ? 285 ILE C CG1 1 ATOM 4809 C CG2 . ILE B 1 290 ? -18.983 64.908 -22.575 1.00 46.27 ? 285 ILE C CG2 1 ATOM 4810 C CD1 . ILE B 1 290 ? -19.976 62.460 -24.098 1.00 51.12 ? 285 ILE C CD1 1 ATOM 4811 N N . ASN B 1 291 ? -20.221 67.705 -21.634 1.00 58.02 ? 286 ASN C N 1 ATOM 4812 C CA . ASN B 1 291 ? -19.420 68.908 -21.335 1.00 62.17 ? 286 ASN C CA 1 ATOM 4813 C C . ASN B 1 291 ? -18.435 68.512 -20.268 1.00 59.77 ? 286 ASN C C 1 ATOM 4814 O O . ASN B 1 291 ? -18.798 68.425 -19.093 1.00 56.51 ? 286 ASN C O 1 ATOM 4815 C CB . ASN B 1 291 ? -20.283 70.102 -20.871 1.00 62.30 ? 286 ASN C CB 1 ATOM 4816 C CG . ASN B 1 291 ? -19.442 71.306 -20.419 1.00 66.15 ? 286 ASN C CG 1 ATOM 4817 O OD1 . ASN B 1 291 ? -18.329 71.487 -20.884 1.00 62.39 ? 286 ASN C OD1 1 ATOM 4818 N ND2 . ASN B 1 291 ? -19.980 72.129 -19.492 1.00 82.07 ? 286 ASN C ND2 1 ATOM 4819 N N . SER B 1 292 ? -17.201 68.255 -20.687 1.00 57.63 ? 287 SER C N 1 ATOM 4820 C CA . SER B 1 292 ? -16.243 67.591 -19.822 1.00 57.09 ? 287 SER C CA 1 ATOM 4821 C C . SER B 1 292 ? -14.805 67.779 -20.271 1.00 56.03 ? 287 SER C C 1 ATOM 4822 O O . SER B 1 292 ? -14.517 67.913 -21.457 1.00 55.74 ? 287 SER C O 1 ATOM 4823 C CB . SER B 1 292 ? -16.551 66.093 -19.763 1.00 54.29 ? 287 SER C CB 1 ATOM 4824 O OG . SER B 1 292 ? -15.654 65.432 -18.895 1.00 56.24 ? 287 SER C OG 1 ATOM 4825 N N . SER B 1 293 ? -13.913 67.747 -19.290 1.00 53.97 ? 288 SER C N 1 ATOM 4826 C CA . SER B 1 293 ? -12.476 67.731 -19.533 1.00 57.12 ? 288 SER C CA 1 ATOM 4827 C C . SER B 1 293 ? -11.916 66.357 -19.277 1.00 48.77 ? 288 SER C C 1 ATOM 4828 O O . SER B 1 293 ? -10.725 66.156 -19.403 1.00 53.35 ? 288 SER C O 1 ATOM 4829 C CB . SER B 1 293 ? -11.782 68.747 -18.619 1.00 59.23 ? 288 SER C CB 1 ATOM 4830 O OG . SER B 1 293 ? -11.959 70.036 -19.149 1.00 67.00 ? 288 SER C OG 1 ATOM 4831 N N . MET B 1 294 ? -12.758 65.436 -18.830 1.00 48.20 ? 289 MET C N 1 ATOM 4832 C CA . MET B 1 294 ? -12.278 64.109 -18.485 1.00 51.37 ? 289 MET C CA 1 ATOM 4833 C C . MET B 1 294 ? -11.775 63.410 -19.737 1.00 53.42 ? 289 MET C C 1 ATOM 4834 O O . MET B 1 294 ? -12.258 63.669 -20.840 1.00 55.66 ? 289 MET C O 1 ATOM 4835 C CB . MET B 1 294 ? -13.357 63.296 -17.790 1.00 55.39 ? 289 MET C CB 1 ATOM 4836 C CG . MET B 1 294 ? -13.727 63.797 -16.386 1.00 61.57 ? 289 MET C CG 1 ATOM 4837 S SD . MET B 1 294 ? -12.266 64.275 -15.414 1.00 64.70 ? 289 MET C SD 1 ATOM 4838 C CE . MET B 1 294 ? -13.022 64.646 -13.817 1.00 70.02 ? 289 MET C CE 1 ATOM 4839 N N . PRO B 1 295 ? -10.766 62.559 -19.576 1.00 49.90 ? 290 PRO C N 1 ATOM 4840 C CA . PRO B 1 295 ? -10.177 61.853 -20.692 1.00 47.78 ? 290 PRO C CA 1 ATOM 4841 C C . PRO B 1 295 ? -11.019 60.675 -21.226 1.00 44.68 ? 290 PRO C C 1 ATOM 4842 O O . PRO B 1 295 ? -10.768 60.217 -22.323 1.00 45.01 ? 290 PRO C O 1 ATOM 4843 C CB . PRO B 1 295 ? -8.842 61.335 -20.089 1.00 47.06 ? 290 PRO C CB 1 ATOM 4844 C CG . PRO B 1 295 ? -9.139 61.137 -18.656 1.00 46.83 ? 290 PRO C CG 1 ATOM 4845 C CD . PRO B 1 295 ? -10.085 62.248 -18.301 1.00 50.21 ? 290 PRO C CD 1 ATOM 4846 N N . PHE B 1 296 ? -11.920 60.134 -20.416 1.00 47.36 ? 291 PHE C N 1 ATOM 4847 C CA . PHE B 1 296 ? -12.742 58.978 -20.791 1.00 46.15 ? 291 PHE C CA 1 ATOM 4848 C C . PHE B 1 296 ? -14.228 59.209 -20.523 1.00 47.22 ? 291 PHE C C 1 ATOM 4849 O O . PHE B 1 296 ? -14.603 60.062 -19.718 1.00 48.44 ? 291 PHE C O 1 ATOM 4850 C CB . PHE B 1 296 ? -12.287 57.743 -20.040 1.00 47.07 ? 291 PHE C CB 1 ATOM 4851 C CG . PHE B 1 296 ? -10.837 57.464 -20.187 1.00 48.46 ? 291 PHE C CG 1 ATOM 4852 C CD1 . PHE B 1 296 ? -10.329 57.074 -21.403 1.00 50.24 ? 291 PHE C CD1 1 ATOM 4853 C CD2 . PHE B 1 296 ? -9.963 57.663 -19.128 1.00 52.30 ? 291 PHE C CD2 1 ATOM 4854 C CE1 . PHE B 1 296 ? -8.979 56.846 -21.573 1.00 52.49 ? 291 PHE C CE1 1 ATOM 4855 C CE2 . PHE B 1 296 ? -8.616 57.435 -19.282 1.00 54.21 ? 291 PHE C CE2 1 ATOM 4856 C CZ . PHE B 1 296 ? -8.119 57.014 -20.507 1.00 54.96 ? 291 PHE C CZ 1 ATOM 4857 N N . HIS B 1 297 ? -15.067 58.503 -21.262 1.00 45.32 ? 292 HIS C N 1 ATOM 4858 C CA . HIS B 1 297 ? -16.507 58.557 -21.030 1.00 47.08 ? 292 HIS C CA 1 ATOM 4859 C C . HIS B 1 297 ? -17.153 57.235 -21.386 1.00 43.67 ? 292 HIS C C 1 ATOM 4860 O O . HIS B 1 297 ? -16.580 56.446 -22.110 1.00 43.40 ? 292 HIS C O 1 ATOM 4861 C CB . HIS B 1 297 ? -17.187 59.713 -21.793 1.00 47.46 ? 292 HIS C CB 1 ATOM 4862 C CG . HIS B 1 297 ? -17.401 59.443 -23.260 1.00 48.07 ? 292 HIS C CG 1 ATOM 4863 N ND1 . HIS B 1 297 ? -18.594 58.984 -23.777 1.00 43.65 ? 292 HIS C ND1 1 ATOM 4864 C CD2 . HIS B 1 297 ? -16.589 59.632 -24.327 1.00 45.52 ? 292 HIS C CD2 1 ATOM 4865 C CE1 . HIS B 1 297 ? -18.503 58.885 -25.089 1.00 41.36 ? 292 HIS C CE1 1 ATOM 4866 N NE2 . HIS B 1 297 ? -17.291 59.259 -25.444 1.00 43.61 ? 292 HIS C NE2 1 ATOM 4867 N N . ASN B 1 298 ? -18.358 57.008 -20.892 1.00 43.47 ? 293 ASN C N 1 ATOM 4868 C CA . ASN B 1 298 ? -19.073 55.777 -21.235 1.00 44.29 ? 293 ASN C CA 1 ATOM 4869 C C . ASN B 1 298 ? -20.510 56.002 -21.736 1.00 40.08 ? 293 ASN C C 1 ATOM 4870 O O . ASN B 1 298 ? -21.342 55.148 -21.640 1.00 44.74 ? 293 ASN C O 1 ATOM 4871 C CB . ASN B 1 298 ? -19.080 54.864 -20.031 1.00 43.15 ? 293 ASN C CB 1 ATOM 4872 C CG . ASN B 1 298 ? -19.937 55.393 -18.933 1.00 41.54 ? 293 ASN C CG 1 ATOM 4873 O OD1 . ASN B 1 298 ? -20.384 56.536 -18.976 1.00 42.58 ? 293 ASN C OD1 1 ATOM 4874 N ND2 . ASN B 1 298 ? -20.167 54.569 -17.927 1.00 44.32 ? 293 ASN C ND2 1 ATOM 4875 N N . ILE B 1 299 ? -20.783 57.175 -22.250 1.00 43.14 ? 294 ILE C N 1 ATOM 4876 C CA . ILE B 1 299 ? -22.154 57.584 -22.579 1.00 44.27 ? 294 ILE C CA 1 ATOM 4877 C C . ILE B 1 299 ? -22.732 56.915 -23.838 1.00 48.20 ? 294 ILE C C 1 ATOM 4878 O O . ILE B 1 299 ? -23.814 56.319 -23.776 1.00 49.98 ? 294 ILE C O 1 ATOM 4879 C CB . ILE B 1 299 ? -22.239 59.121 -22.636 1.00 42.90 ? 294 ILE C CB 1 ATOM 4880 C CG1 . ILE B 1 299 ? -22.050 59.613 -21.194 1.00 42.31 ? 294 ILE C CG1 1 ATOM 4881 C CG2 . ILE B 1 299 ? -23.596 59.600 -23.165 1.00 44.94 ? 294 ILE C CG2 1 ATOM 4882 C CD1 . ILE B 1 299 ? -21.200 60.828 -21.085 1.00 44.51 ? 294 ILE C CD1 1 ATOM 4883 N N . HIS B 1 300 ? -22.007 56.985 -24.951 1.00 44.57 ? 295 HIS C N 1 ATOM 4884 C CA . HIS B 1 300 ? -22.517 56.511 -26.221 1.00 45.34 ? 295 HIS C CA 1 ATOM 4885 C C . HIS B 1 300 ? -21.356 56.530 -27.219 1.00 45.04 ? 295 HIS C C 1 ATOM 4886 O O . HIS B 1 300 ? -20.546 57.445 -27.186 1.00 42.96 ? 295 HIS C O 1 ATOM 4887 C CB . HIS B 1 300 ? -23.600 57.487 -26.704 1.00 45.54 ? 295 HIS C CB 1 ATOM 4888 C CG . HIS B 1 300 ? -24.543 56.904 -27.705 1.00 52.03 ? 295 HIS C CG 1 ATOM 4889 N ND1 . HIS B 1 300 ? -24.229 56.781 -29.044 1.00 46.45 ? 295 HIS C ND1 1 ATOM 4890 C CD2 . HIS B 1 300 ? -25.815 56.448 -27.571 1.00 50.28 ? 295 HIS C CD2 1 ATOM 4891 C CE1 . HIS B 1 300 ? -25.255 56.253 -29.686 1.00 45.43 ? 295 HIS C CE1 1 ATOM 4892 N NE2 . HIS B 1 300 ? -26.232 56.052 -28.818 1.00 46.64 ? 295 HIS C NE2 1 ATOM 4893 N N . PRO B 1 301 ? -21.275 55.542 -28.116 1.00 38.74 ? 296 PRO C N 1 ATOM 4894 C CA . PRO B 1 301 ? -20.245 55.570 -29.144 1.00 33.33 ? 296 PRO C CA 1 ATOM 4895 C C . PRO B 1 301 ? -20.432 56.541 -30.322 1.00 35.58 ? 296 PRO C C 1 ATOM 4896 O O . PRO B 1 301 ? -19.452 56.957 -30.939 1.00 38.25 ? 296 PRO C O 1 ATOM 4897 C CB . PRO B 1 301 ? -20.281 54.145 -29.688 1.00 34.51 ? 296 PRO C CB 1 ATOM 4898 C CG . PRO B 1 301 ? -21.679 53.661 -29.448 1.00 35.03 ? 296 PRO C CG 1 ATOM 4899 C CD . PRO B 1 301 ? -22.019 54.264 -28.101 1.00 38.51 ? 296 PRO C CD 1 ATOM 4900 N N . LEU B 1 302 ? -21.665 56.883 -30.675 1.00 38.03 ? 297 LEU C N 1 ATOM 4901 C CA . LEU B 1 302 ? -21.932 57.652 -31.902 1.00 39.36 ? 297 LEU C CA 1 ATOM 4902 C C . LEU B 1 302 ? -21.878 59.162 -31.695 1.00 38.76 ? 297 LEU C C 1 ATOM 4903 O O . LEU B 1 302 ? -22.856 59.858 -31.935 1.00 39.19 ? 297 LEU C O 1 ATOM 4904 C CB . LEU B 1 302 ? -23.262 57.200 -32.556 1.00 38.48 ? 297 LEU C CB 1 ATOM 4905 C CG . LEU B 1 302 ? -23.411 55.681 -32.643 1.00 40.10 ? 297 LEU C CG 1 ATOM 4906 C CD1 . LEU B 1 302 ? -24.696 55.283 -33.342 1.00 41.04 ? 297 LEU C CD1 1 ATOM 4907 C CD2 . LEU B 1 302 ? -22.217 55.054 -33.358 1.00 40.13 ? 297 LEU C CD2 1 ATOM 4908 N N . THR B 1 303 ? -20.700 59.629 -31.306 1.00 35.86 ? 298 THR C N 1 ATOM 4909 C CA . THR B 1 303 ? -20.456 61.005 -30.981 1.00 35.90 ? 298 THR C CA 1 ATOM 4910 C C . THR B 1 303 ? -19.985 61.810 -32.181 1.00 35.63 ? 298 THR C C 1 ATOM 4911 O O . THR B 1 303 ? -19.354 61.310 -33.081 1.00 36.50 ? 298 THR C O 1 ATOM 4912 C CB . THR B 1 303 ? -19.364 61.146 -29.878 1.00 36.67 ? 298 THR C CB 1 ATOM 4913 O OG1 . THR B 1 303 ? -18.124 60.556 -30.304 1.00 36.15 ? 298 THR C OG1 1 ATOM 4914 C CG2 . THR B 1 303 ? -19.810 60.458 -28.629 1.00 38.46 ? 298 THR C CG2 1 ATOM 4915 N N . ILE B 1 304 ? -20.322 63.083 -32.174 1.00 40.83 ? 299 ILE C N 1 ATOM 4916 C CA . ILE B 1 304 ? -19.845 64.024 -33.179 1.00 44.04 ? 299 ILE C CA 1 ATOM 4917 C C . ILE B 1 304 ? -19.282 65.189 -32.439 1.00 43.48 ? 299 ILE C C 1 ATOM 4918 O O . ILE B 1 304 ? -19.983 65.800 -31.618 1.00 54.07 ? 299 ILE C O 1 ATOM 4919 C CB . ILE B 1 304 ? -20.975 64.535 -34.106 1.00 41.42 ? 299 ILE C CB 1 ATOM 4920 C CG1 . ILE B 1 304 ? -21.617 63.355 -34.832 1.00 41.96 ? 299 ILE C CG1 1 ATOM 4921 C CG2 . ILE B 1 304 ? -20.397 65.506 -35.104 1.00 42.58 ? 299 ILE C CG2 1 ATOM 4922 C CD1 . ILE B 1 304 ? -22.791 63.726 -35.688 1.00 42.54 ? 299 ILE C CD1 1 ATOM 4923 N N . GLY B 1 305 ? -18.034 65.497 -32.740 1.00 42.10 ? 300 GLY C N 1 ATOM 4924 C CA . GLY B 1 305 ? -17.318 66.542 -32.034 1.00 45.24 ? 300 GLY C CA 1 ATOM 4925 C C . GLY B 1 305 ? -16.015 66.061 -31.469 1.00 43.76 ? 300 GLY C C 1 ATOM 4926 O O . GLY B 1 305 ? -15.499 65.023 -31.873 1.00 41.68 ? 300 GLY C O 1 ATOM 4927 N N . GLU B 1 306 ? -15.506 66.829 -30.502 1.00 51.59 ? 301 GLU C N 1 ATOM 4928 C CA . GLU B 1 306 ? -14.244 66.535 -29.803 1.00 51.65 ? 301 GLU C CA 1 ATOM 4929 C C . GLU B 1 306 ? -14.579 66.009 -28.436 1.00 47.78 ? 301 GLU C C 1 ATOM 4930 O O . GLU B 1 306 ? -14.971 66.766 -27.559 1.00 46.22 ? 301 GLU C O 1 ATOM 4931 C CB . GLU B 1 306 ? -13.446 67.782 -29.611 1.00 54.26 ? 301 GLU C CB 1 ATOM 4932 C CG . GLU B 1 306 ? -13.198 68.545 -30.880 1.00 64.84 ? 301 GLU C CG 1 ATOM 4933 C CD . GLU B 1 306 ? -12.632 69.905 -30.568 1.00 72.54 ? 301 GLU C CD 1 ATOM 4934 O OE1 . GLU B 1 306 ? -11.508 69.934 -29.948 1.00 74.01 ? 301 GLU C OE1 1 ATOM 4935 O OE2 . GLU B 1 306 ? -13.361 70.890 -30.890 1.00 64.55 ? 301 GLU C OE2 1 ATOM 4936 N N . CYS B 1 307 ? -14.452 64.709 -28.282 1.00 43.24 ? 302 CYS C N 1 ATOM 4937 C CA . CYS B 1 307 ? -14.973 64.020 -27.122 1.00 45.88 ? 302 CYS C CA 1 ATOM 4938 C C . CYS B 1 307 ? -13.855 63.272 -26.378 1.00 47.22 ? 302 CYS C C 1 ATOM 4939 O O . CYS B 1 307 ? -12.776 63.051 -26.929 1.00 40.85 ? 302 CYS C O 1 ATOM 4940 C CB . CYS B 1 307 ? -16.034 63.026 -27.586 1.00 45.12 ? 302 CYS C CB 1 ATOM 4941 S SG . CYS B 1 307 ? -17.349 63.849 -28.509 1.00 51.08 ? 302 CYS C SG 1 ATOM 4942 N N . PRO B 1 308 ? -14.115 62.877 -25.128 1.00 45.81 ? 303 PRO C N 1 ATOM 4943 C CA . PRO B 1 308 ? -13.233 61.937 -24.458 1.00 46.18 ? 303 PRO C CA 1 ATOM 4944 C C . PRO B 1 308 ? -13.248 60.598 -25.158 1.00 42.53 ? 303 PRO C C 1 ATOM 4945 O O . PRO B 1 308 ? -14.070 60.356 -26.013 1.00 47.50 ? 303 PRO C O 1 ATOM 4946 C CB . PRO B 1 308 ? -13.833 61.813 -23.041 1.00 49.02 ? 303 PRO C CB 1 ATOM 4947 C CG . PRO B 1 308 ? -14.714 63.013 -22.885 1.00 50.25 ? 303 PRO C CG 1 ATOM 4948 C CD . PRO B 1 308 ? -15.185 63.386 -24.250 1.00 50.50 ? 303 PRO C CD 1 ATOM 4949 N N . LYS B 1 309 ? -12.366 59.727 -24.761 1.00 41.89 ? 304 LYS C N 1 ATOM 4950 C CA . LYS B 1 309 ? -12.251 58.421 -25.373 1.00 43.34 ? 304 LYS C CA 1 ATOM 4951 C C . LYS B 1 309 ? -13.306 57.494 -24.781 1.00 43.27 ? 304 LYS C C 1 ATOM 4952 O O . LYS B 1 309 ? -13.432 57.388 -23.551 1.00 43.75 ? 304 LYS C O 1 ATOM 4953 C CB . LYS B 1 309 ? -10.825 57.860 -25.132 1.00 45.26 ? 304 LYS C CB 1 ATOM 4954 C CG . LYS B 1 309 ? -9.726 58.698 -25.790 1.00 51.37 ? 304 LYS C CG 1 ATOM 4955 C CD . LYS B 1 309 ? -10.072 58.925 -27.274 1.00 58.66 ? 304 LYS C CD 1 ATOM 4956 C CE . LYS B 1 309 ? -8.994 59.624 -28.082 1.00 57.24 ? 304 LYS C CE 1 ATOM 4957 N NZ . LYS B 1 309 ? -8.912 61.064 -27.718 1.00 58.80 ? 304 LYS C NZ 1 ATOM 4958 N N . TYR B 1 310 ? -14.061 56.825 -25.654 1.00 38.39 ? 305 TYR C N 1 ATOM 4959 C CA . TYR B 1 310 ? -15.156 55.969 -25.201 1.00 37.10 ? 305 TYR C CA 1 ATOM 4960 C C . TYR B 1 310 ? -14.619 54.667 -24.664 1.00 34.47 ? 305 TYR C C 1 ATOM 4961 O O . TYR B 1 310 ? -13.787 54.043 -25.315 1.00 35.65 ? 305 TYR C O 1 ATOM 4962 C CB . TYR B 1 310 ? -16.127 55.703 -26.367 1.00 36.45 ? 305 TYR C CB 1 ATOM 4963 C CG . TYR B 1 310 ? -17.365 54.894 -26.032 1.00 35.23 ? 305 TYR C CG 1 ATOM 4964 C CD1 . TYR B 1 310 ? -18.282 55.310 -25.065 1.00 38.27 ? 305 TYR C CD1 1 ATOM 4965 C CD2 . TYR B 1 310 ? -17.640 53.727 -26.719 1.00 36.10 ? 305 TYR C CD2 1 ATOM 4966 C CE1 . TYR B 1 310 ? -19.422 54.551 -24.797 1.00 37.72 ? 305 TYR C CE1 1 ATOM 4967 C CE2 . TYR B 1 310 ? -18.754 52.963 -26.458 1.00 34.32 ? 305 TYR C CE2 1 ATOM 4968 C CZ . TYR B 1 310 ? -19.632 53.343 -25.489 1.00 37.01 ? 305 TYR C CZ 1 ATOM 4969 O OH . TYR B 1 310 ? -20.755 52.523 -25.281 1.00 34.99 ? 305 TYR C OH 1 ATOM 4970 N N . VAL B 1 311 ? -15.111 54.252 -23.498 1.00 36.01 ? 306 VAL C N 1 ATOM 4971 C CA . VAL B 1 311 ? -14.709 52.979 -22.866 1.00 38.78 ? 306 VAL C CA 1 ATOM 4972 C C . VAL B 1 311 ? -15.872 52.212 -22.228 1.00 42.44 ? 306 VAL C C 1 ATOM 4973 O O . VAL B 1 311 ? -16.940 52.767 -21.968 1.00 45.18 ? 306 VAL C O 1 ATOM 4974 C CB . VAL B 1 311 ? -13.626 53.173 -21.779 1.00 40.06 ? 306 VAL C CB 1 ATOM 4975 C CG1 . VAL B 1 311 ? -12.404 53.884 -22.335 1.00 40.87 ? 306 VAL C CG1 1 ATOM 4976 C CG2 . VAL B 1 311 ? -14.160 53.976 -20.608 1.00 43.80 ? 306 VAL C CG2 1 ATOM 4977 N N . LYS B 1 312 ? -15.632 50.931 -21.971 1.00 41.64 ? 307 LYS C N 1 ATOM 4978 C CA . LYS B 1 312 ? -16.571 50.086 -21.270 1.00 43.50 ? 307 LYS C CA 1 ATOM 4979 C C . LYS B 1 312 ? -16.191 50.036 -19.782 1.00 48.06 ? 307 LYS C C 1 ATOM 4980 O O . LYS B 1 312 ? -15.442 49.157 -19.368 1.00 62.02 ? 307 LYS C O 1 ATOM 4981 C CB . LYS B 1 312 ? -16.530 48.697 -21.911 1.00 46.84 ? 307 LYS C CB 1 ATOM 4982 C CG . LYS B 1 312 ? -17.377 47.646 -21.193 1.00 54.31 ? 307 LYS C CG 1 ATOM 4983 C CD . LYS B 1 312 ? -17.597 46.386 -22.011 1.00 59.68 ? 307 LYS C CD 1 ATOM 4984 C CE . LYS B 1 312 ? -18.912 45.734 -21.615 1.00 67.64 ? 307 LYS C CE 1 ATOM 4985 N NZ . LYS B 1 312 ? -18.910 44.255 -21.785 1.00 73.63 ? 307 LYS C NZ 1 ATOM 4986 N N . SER B 1 313 ? -16.621 51.013 -18.992 1.00 50.64 ? 308 SER C N 1 ATOM 4987 C CA . SER B 1 313 ? -16.391 51.027 -17.510 1.00 52.31 ? 308 SER C CA 1 ATOM 4988 C C . SER B 1 313 ? -17.521 51.759 -16.837 1.00 57.08 ? 308 SER C C 1 ATOM 4989 O O . SER B 1 313 ? -18.162 52.627 -17.440 1.00 52.19 ? 308 SER C O 1 ATOM 4990 C CB . SER B 1 313 ? -15.150 51.792 -17.060 1.00 52.36 ? 308 SER C CB 1 ATOM 4991 O OG . SER B 1 313 ? -14.033 51.517 -17.849 1.00 66.40 ? 308 SER C OG 1 ATOM 4992 N N . ASN B 1 314 ? -17.704 51.468 -15.559 1.00 61.61 ? 309 ASN C N 1 ATOM 4993 C CA . ASN B 1 314 ? -18.648 52.222 -14.728 1.00 61.58 ? 309 ASN C CA 1 ATOM 4994 C C . ASN B 1 314 ? -17.988 53.344 -13.962 1.00 57.94 ? 309 ASN C C 1 ATOM 4995 O O . ASN B 1 314 ? -18.658 54.236 -13.461 1.00 57.37 ? 309 ASN C O 1 ATOM 4996 C CB . ASN B 1 314 ? -19.301 51.281 -13.737 1.00 60.61 ? 309 ASN C CB 1 ATOM 4997 C CG . ASN B 1 314 ? -19.882 50.075 -14.416 1.00 66.36 ? 309 ASN C CG 1 ATOM 4998 O OD1 . ASN B 1 314 ? -19.625 48.933 -14.015 1.00 66.74 ? 309 ASN C OD1 1 ATOM 4999 N ND2 . ASN B 1 314 ? -20.645 50.312 -15.487 1.00 62.16 ? 309 ASN C ND2 1 ATOM 5000 N N . LYS B 1 315 ? -16.664 53.287 -13.890 1.00 58.01 ? 310 LYS C N 1 ATOM 5001 C CA . LYS B 1 315 ? -15.934 53.811 -12.745 1.00 59.59 ? 310 LYS C CA 1 ATOM 5002 C C . LYS B 1 315 ? -14.441 53.798 -13.068 1.00 55.91 ? 310 LYS C C 1 ATOM 5003 O O . LYS B 1 315 ? -13.877 52.739 -13.271 1.00 53.38 ? 310 LYS C O 1 ATOM 5004 C CB . LYS B 1 315 ? -16.166 52.839 -11.588 1.00 63.70 ? 310 LYS C CB 1 ATOM 5005 C CG . LYS B 1 315 ? -16.319 53.422 -10.201 1.00 71.56 ? 310 LYS C CG 1 ATOM 5006 C CD . LYS B 1 315 ? -16.467 52.304 -9.154 1.00 77.20 ? 310 LYS C CD 1 ATOM 5007 C CE . LYS B 1 315 ? -15.234 51.410 -9.027 1.00 81.20 ? 310 LYS C CE 1 ATOM 5008 N NZ . LYS B 1 315 ? -15.417 50.234 -8.135 1.00 81.82 ? 310 LYS C NZ 1 ATOM 5009 N N . LEU B 1 316 ? -13.804 54.960 -13.093 1.00 51.49 ? 311 LEU C N 1 ATOM 5010 C CA . LEU B 1 316 ? -12.345 55.019 -13.097 1.00 49.41 ? 311 LEU C CA 1 ATOM 5011 C C . LEU B 1 316 ? -11.865 55.932 -11.960 1.00 45.05 ? 311 LEU C C 1 ATOM 5012 O O . LEU B 1 316 ? -11.692 57.140 -12.150 1.00 44.33 ? 311 LEU C O 1 ATOM 5013 C CB . LEU B 1 316 ? -11.814 55.506 -14.445 1.00 44.54 ? 311 LEU C CB 1 ATOM 5014 C CG . LEU B 1 316 ? -12.016 54.580 -15.643 1.00 42.25 ? 311 LEU C CG 1 ATOM 5015 C CD1 . LEU B 1 316 ? -11.563 55.318 -16.877 1.00 41.25 ? 311 LEU C CD1 1 ATOM 5016 C CD2 . LEU B 1 316 ? -11.256 53.283 -15.537 1.00 41.60 ? 311 LEU C CD2 1 ATOM 5017 N N . VAL B 1 317 ? -11.643 55.351 -10.792 1.00 40.44 ? 312 VAL C N 1 ATOM 5018 C CA . VAL B 1 317 ? -11.406 56.157 -9.571 1.00 44.09 ? 312 VAL C CA 1 ATOM 5019 C C . VAL B 1 317 ? -9.984 56.153 -9.118 1.00 43.58 ? 312 VAL C C 1 ATOM 5020 O O . VAL B 1 317 ? -9.434 55.114 -8.766 1.00 41.27 ? 312 VAL C O 1 ATOM 5021 C CB . VAL B 1 317 ? -12.260 55.689 -8.397 1.00 49.75 ? 312 VAL C CB 1 ATOM 5022 C CG1 . VAL B 1 317 ? -12.136 56.659 -7.241 1.00 51.41 ? 312 VAL C CG1 1 ATOM 5023 C CG2 . VAL B 1 317 ? -13.724 55.603 -8.842 1.00 54.70 ? 312 VAL C CG2 1 ATOM 5024 N N . LEU B 1 318 ? -9.375 57.323 -9.199 1.00 44.96 ? 313 LEU C N 1 ATOM 5025 C CA . LEU B 1 318 ? -8.027 57.523 -8.703 1.00 47.78 ? 313 LEU C CA 1 ATOM 5026 C C . LEU B 1 318 ? -8.050 57.895 -7.212 1.00 52.05 ? 313 LEU C C 1 ATOM 5027 O O . LEU B 1 318 ? -8.780 58.804 -6.807 1.00 53.80 ? 313 LEU C O 1 ATOM 5028 C CB . LEU B 1 318 ? -7.326 58.677 -9.445 1.00 44.29 ? 313 LEU C CB 1 ATOM 5029 C CG . LEU B 1 318 ? -6.908 58.415 -10.871 1.00 44.44 ? 313 LEU C CG 1 ATOM 5030 C CD1 . LEU B 1 318 ? -6.438 59.691 -11.523 1.00 43.88 ? 313 LEU C CD1 1 ATOM 5031 C CD2 . LEU B 1 318 ? -5.838 57.350 -10.969 1.00 45.76 ? 313 LEU C CD2 1 ATOM 5032 N N . ALA B 1 319 ? -7.220 57.225 -6.422 1.00 52.11 ? 314 ALA C N 1 ATOM 5033 C CA . ALA B 1 319 ? -6.915 57.694 -5.082 1.00 54.86 ? 314 ALA C CA 1 ATOM 5034 C C . ALA B 1 319 ? -6.176 59.027 -5.138 1.00 56.42 ? 314 ALA C C 1 ATOM 5035 O O . ALA B 1 319 ? -5.254 59.223 -5.930 1.00 56.36 ? 314 ALA C O 1 ATOM 5036 C CB . ALA B 1 319 ? -6.090 56.673 -4.319 1.00 51.48 ? 314 ALA C CB 1 ATOM 5037 N N . THR B 1 320 ? -6.622 59.947 -4.314 1.00 56.39 ? 315 THR C N 1 ATOM 5038 C CA . THR B 1 320 ? -5.901 61.184 -4.082 1.00 64.73 ? 315 THR C CA 1 ATOM 5039 C C . THR B 1 320 ? -5.388 61.239 -2.635 1.00 64.81 ? 315 THR C C 1 ATOM 5040 O O . THR B 1 320 ? -4.314 61.760 -2.381 1.00 61.46 ? 315 THR C O 1 ATOM 5041 C CB . THR B 1 320 ? -6.764 62.418 -4.404 1.00 70.85 ? 315 THR C CB 1 ATOM 5042 O OG1 . THR B 1 320 ? -8.117 62.206 -3.961 1.00 72.78 ? 315 THR C OG1 1 ATOM 5043 C CG2 . THR B 1 320 ? -6.758 62.655 -5.900 1.00 70.62 ? 315 THR C CG2 1 ATOM 5044 N N . GLY B 1 321 ? -6.145 60.671 -1.702 1.00 61.65 ? 316 GLY C N 1 ATOM 5045 C CA . GLY B 1 321 ? -5.764 60.679 -0.301 1.00 61.79 ? 316 GLY C CA 1 ATOM 5046 C C . GLY B 1 321 ? -5.089 59.410 0.181 1.00 61.12 ? 316 GLY C C 1 ATOM 5047 O O . GLY B 1 321 ? -4.482 58.695 -0.588 1.00 65.51 ? 316 GLY C O 1 ATOM 5048 N N . LEU B 1 322 ? -5.211 59.145 1.475 1.00 61.16 ? 317 LEU C N 1 ATOM 5049 C CA . LEU B 1 322 ? -4.502 58.061 2.166 1.00 63.22 ? 317 LEU C CA 1 ATOM 5050 C C . LEU B 1 322 ? -5.433 56.906 2.420 1.00 57.32 ? 317 LEU C C 1 ATOM 5051 O O . LEU B 1 322 ? -6.645 57.097 2.360 1.00 67.05 ? 317 LEU C O 1 ATOM 5052 C CB . LEU B 1 322 ? -3.997 58.606 3.522 1.00 69.57 ? 317 LEU C CB 1 ATOM 5053 C CG . LEU B 1 322 ? -3.202 59.916 3.370 1.00 72.65 ? 317 LEU C CG 1 ATOM 5054 C CD1 . LEU B 1 322 ? -4.010 61.185 3.635 1.00 79.18 ? 317 LEU C CD1 1 ATOM 5055 C CD2 . LEU B 1 322 ? -2.007 59.870 4.293 1.00 75.33 ? 317 LEU C CD2 1 ATOM 5056 N N . ARG B 1 323 ? -4.910 55.738 2.774 1.00 54.72 ? 318 ARG C N 1 ATOM 5057 C CA . ARG B 1 323 ? -5.788 54.688 3.367 1.00 62.51 ? 318 ARG C CA 1 ATOM 5058 C C . ARG B 1 323 ? -6.492 55.175 4.634 1.00 68.29 ? 318 ARG C C 1 ATOM 5059 O O . ARG B 1 323 ? -5.883 55.861 5.446 1.00 72.67 ? 318 ARG C O 1 ATOM 5060 C CB . ARG B 1 323 ? -5.072 53.426 3.803 1.00 61.61 ? 318 ARG C CB 1 ATOM 5061 C CG . ARG B 1 323 ? -3.963 52.996 2.922 1.00 60.76 ? 318 ARG C CG 1 ATOM 5062 C CD . ARG B 1 323 ? -3.460 51.661 3.383 1.00 62.45 ? 318 ARG C CD 1 ATOM 5063 N NE . ARG B 1 323 ? -2.624 51.129 2.322 1.00 64.02 ? 318 ARG C NE 1 ATOM 5064 C CZ . ARG B 1 323 ? -2.960 50.115 1.545 1.00 66.42 ? 318 ARG C CZ 1 ATOM 5065 N NH1 . ARG B 1 323 ? -4.104 49.461 1.728 1.00 68.79 ? 318 ARG C NH1 1 ATOM 5066 N NH2 . ARG B 1 323 ? -2.127 49.732 0.587 1.00 65.20 ? 318 ARG C NH2 1 ATOM 5067 N N . ASN B 1 324 ? -7.738 54.741 4.811 1.00 75.34 ? 319 ASN C N 1 ATOM 5068 C CA . ASN B 1 324 ? -8.635 55.217 5.856 1.00 76.48 ? 319 ASN C CA 1 ATOM 5069 C C . ASN B 1 324 ? -9.143 54.038 6.714 1.00 77.76 ? 319 ASN C C 1 ATOM 5070 O O . ASN B 1 324 ? -8.383 53.134 7.074 1.00 76.07 ? 319 ASN C O 1 ATOM 5071 C CB . ASN B 1 324 ? -9.821 55.922 5.201 1.00 75.53 ? 319 ASN C CB 1 ATOM 5072 C CG . ASN B 1 324 ? -10.472 56.972 6.095 1.00 77.52 ? 319 ASN C CG 1 ATOM 5073 O OD1 . ASN B 1 324 ? -9.844 57.522 7.001 1.00 86.53 ? 319 ASN C OD1 1 ATOM 5074 N ND2 . ASN B 1 324 ? -11.729 57.298 5.798 1.00 71.59 ? 319 ASN C ND2 1 ATOM 5075 N N . SER C 1 5 ? 37.648 68.356 13.409 1.00 103.37 ? 0 SER E N 1 ATOM 5076 C CA . SER C 1 5 ? 36.938 67.108 13.831 1.00 105.62 ? 0 SER E CA 1 ATOM 5077 C C . SER C 1 5 ? 36.390 66.329 12.612 1.00 109.90 ? 0 SER E C 1 ATOM 5078 O O . SER C 1 5 ? 35.614 66.872 11.824 1.00 112.34 ? 0 SER E O 1 ATOM 5079 C CB . SER C 1 5 ? 35.800 67.452 14.787 1.00 101.20 ? 0 SER E CB 1 ATOM 5080 O OG . SER C 1 5 ? 35.254 66.275 15.327 1.00 95.37 ? 0 SER E OG 1 ATOM 5081 N N . ASP C 1 6 ? 36.777 65.055 12.501 1.00 104.75 ? 1 ASP E N 1 ATOM 5082 C CA . ASP C 1 6 ? 36.637 64.260 11.262 1.00 107.29 ? 1 ASP E CA 1 ATOM 5083 C C . ASP C 1 6 ? 35.183 63.895 10.823 1.00 111.85 ? 1 ASP E C 1 ATOM 5084 O O . ASP C 1 6 ? 34.356 63.526 11.652 1.00 120.46 ? 1 ASP E O 1 ATOM 5085 C CB . ASP C 1 6 ? 37.501 62.991 11.378 1.00 101.25 ? 1 ASP E CB 1 ATOM 5086 C CG . ASP C 1 6 ? 39.007 63.298 11.497 1.00 99.33 ? 1 ASP E CG 1 ATOM 5087 O OD1 . ASP C 1 6 ? 39.415 64.470 11.290 1.00 88.23 ? 1 ASP E OD1 1 ATOM 5088 O OD2 . ASP C 1 6 ? 39.785 62.360 11.797 1.00 84.11 ? 1 ASP E OD2 1 ATOM 5089 N N . GLN C 1 7 ? 34.907 63.991 9.512 1.00 112.08 ? 2 GLN E N 1 ATOM 5090 C CA . GLN C 1 7 ? 33.561 63.776 8.901 1.00 104.77 ? 2 GLN E CA 1 ATOM 5091 C C . GLN C 1 7 ? 33.558 62.989 7.577 1.00 101.13 ? 2 GLN E C 1 ATOM 5092 O O . GLN C 1 7 ? 34.378 63.243 6.691 1.00 96.62 ? 2 GLN E O 1 ATOM 5093 C CB . GLN C 1 7 ? 32.897 65.115 8.568 1.00 104.60 ? 2 GLN E CB 1 ATOM 5094 C CG . GLN C 1 7 ? 31.899 65.630 9.572 1.00 103.53 ? 2 GLN E CG 1 ATOM 5095 C CD . GLN C 1 7 ? 31.157 66.811 9.008 1.00 108.49 ? 2 GLN E CD 1 ATOM 5096 O OE1 . GLN C 1 7 ? 30.288 66.653 8.137 1.00 109.51 ? 2 GLN E OE1 1 ATOM 5097 N NE2 . GLN C 1 7 ? 31.500 67.997 9.472 1.00 103.79 ? 2 GLN E NE2 1 ATOM 5098 N N . ILE C 1 8 ? 32.601 62.073 7.422 1.00 96.77 ? 3 ILE E N 1 ATOM 5099 C CA . ILE C 1 8 ? 32.330 61.463 6.105 1.00 90.71 ? 3 ILE E CA 1 ATOM 5100 C C . ILE C 1 8 ? 30.889 61.752 5.652 1.00 89.77 ? 3 ILE E C 1 ATOM 5101 O O . ILE C 1 8 ? 29.937 61.667 6.429 1.00 90.51 ? 3 ILE E O 1 ATOM 5102 C CB . ILE C 1 8 ? 32.680 59.948 6.063 1.00 79.20 ? 3 ILE E CB 1 ATOM 5103 C CG1 . ILE C 1 8 ? 32.795 59.486 4.613 1.00 80.24 ? 3 ILE E CG1 1 ATOM 5104 C CG2 . ILE C 1 8 ? 31.685 59.117 6.839 1.00 75.72 ? 3 ILE E CG2 1 ATOM 5105 C CD1 . ILE C 1 8 ? 33.425 58.111 4.447 1.00 80.45 ? 3 ILE E CD1 1 ATOM 5106 N N . CYS C 1 9 ? 30.745 62.119 4.390 1.00 90.49 ? 4 CYS E N 1 ATOM 5107 C CA . CYS C 1 9 ? 29.431 62.427 3.830 1.00 98.37 ? 4 CYS E CA 1 ATOM 5108 C C . CYS C 1 9 ? 29.115 61.478 2.685 1.00 99.05 ? 4 CYS E C 1 ATOM 5109 O O . CYS C 1 9 ? 30.018 60.984 2.001 1.00 107.53 ? 4 CYS E O 1 ATOM 5110 C CB . CYS C 1 9 ? 29.385 63.868 3.306 1.00 100.46 ? 4 CYS E CB 1 ATOM 5111 S SG . CYS C 1 9 ? 29.684 65.142 4.552 1.00 105.96 ? 4 CYS E SG 1 ATOM 5112 N N . ILE C 1 10 ? 27.827 61.246 2.463 1.00 92.02 ? 5 ILE E N 1 ATOM 5113 C CA . ILE C 1 10 ? 27.362 60.517 1.284 1.00 79.05 ? 5 ILE E CA 1 ATOM 5114 C C . ILE C 1 10 ? 26.662 61.486 0.363 1.00 73.24 ? 5 ILE E C 1 ATOM 5115 O O . ILE C 1 10 ? 25.857 62.295 0.805 1.00 71.66 ? 5 ILE E O 1 ATOM 5116 C CB . ILE C 1 10 ? 26.429 59.375 1.670 1.00 80.88 ? 5 ILE E CB 1 ATOM 5117 C CG1 . ILE C 1 10 ? 27.245 58.163 2.109 1.00 78.61 ? 5 ILE E CG1 1 ATOM 5118 C CG2 . ILE C 1 10 ? 25.541 58.980 0.505 1.00 88.83 ? 5 ILE E CG2 1 ATOM 5119 C CD1 . ILE C 1 10 ? 27.739 58.266 3.529 1.00 80.50 ? 5 ILE E CD1 1 ATOM 5120 N N . GLY C 1 11 ? 26.969 61.399 -0.923 1.00 75.99 ? 6 GLY E N 1 ATOM 5121 C CA . GLY C 1 11 ? 26.466 62.367 -1.910 1.00 74.90 ? 6 GLY E CA 1 ATOM 5122 C C . GLY C 1 11 ? 26.412 61.830 -3.333 1.00 72.64 ? 6 GLY E C 1 ATOM 5123 O O . GLY C 1 11 ? 26.606 60.629 -3.582 1.00 61.19 ? 6 GLY E O 1 ATOM 5124 N N . TYR C 1 12 ? 26.139 62.729 -4.268 1.00 72.38 ? 7 TYR E N 1 ATOM 5125 C CA . TYR C 1 12 ? 25.914 62.326 -5.631 1.00 73.08 ? 7 TYR E CA 1 ATOM 5126 C C . TYR C 1 12 ? 26.312 63.394 -6.613 1.00 73.44 ? 7 TYR E C 1 ATOM 5127 O O . TYR C 1 12 ? 26.463 64.560 -6.258 1.00 79.88 ? 7 TYR E O 1 ATOM 5128 C CB . TYR C 1 12 ? 24.439 61.936 -5.834 1.00 75.25 ? 7 TYR E CB 1 ATOM 5129 C CG . TYR C 1 12 ? 23.417 63.023 -5.500 1.00 73.71 ? 7 TYR E CG 1 ATOM 5130 C CD1 . TYR C 1 12 ? 22.938 63.178 -4.214 1.00 71.31 ? 7 TYR E CD1 1 ATOM 5131 C CD2 . TYR C 1 12 ? 22.916 63.859 -6.487 1.00 78.72 ? 7 TYR E CD2 1 ATOM 5132 C CE1 . TYR C 1 12 ? 22.005 64.155 -3.918 1.00 72.28 ? 7 TYR E CE1 1 ATOM 5133 C CE2 . TYR C 1 12 ? 21.981 64.834 -6.201 1.00 80.04 ? 7 TYR E CE2 1 ATOM 5134 C CZ . TYR C 1 12 ? 21.531 64.981 -4.914 1.00 76.04 ? 7 TYR E CZ 1 ATOM 5135 O OH . TYR C 1 12 ? 20.589 65.953 -4.644 1.00 76.81 ? 7 TYR E OH 1 ATOM 5136 N N . HIS C 1 13 ? 26.426 62.969 -7.865 1.00 72.87 ? 8 HIS E N 1 ATOM 5137 C CA . HIS C 1 13 ? 26.939 63.797 -8.938 1.00 71.66 ? 8 HIS E CA 1 ATOM 5138 C C . HIS C 1 13 ? 26.101 65.035 -9.185 1.00 68.18 ? 8 HIS E C 1 ATOM 5139 O O . HIS C 1 13 ? 24.879 65.040 -8.986 1.00 69.06 ? 8 HIS E O 1 ATOM 5140 C CB . HIS C 1 13 ? 27.034 62.945 -10.206 1.00 75.42 ? 8 HIS E CB 1 ATOM 5141 C CG . HIS C 1 13 ? 27.577 63.667 -11.405 1.00 84.85 ? 8 HIS E CG 1 ATOM 5142 N ND1 . HIS C 1 13 ? 28.924 63.881 -11.604 1.00 86.27 ? 8 HIS E ND1 1 ATOM 5143 C CD2 . HIS C 1 13 ? 26.954 64.177 -12.497 1.00 92.67 ? 8 HIS E CD2 1 ATOM 5144 C CE1 . HIS C 1 13 ? 29.105 64.511 -12.753 1.00 91.84 ? 8 HIS E CE1 1 ATOM 5145 N NE2 . HIS C 1 13 ? 27.926 64.705 -13.314 1.00 91.45 ? 8 HIS E NE2 1 ATOM 5146 N N . ALA C 1 14 ? 26.759 66.071 -9.683 1.00 63.24 ? 9 ALA E N 1 ATOM 5147 C CA . ALA C 1 14 ? 26.066 67.261 -10.188 1.00 65.51 ? 9 ALA E CA 1 ATOM 5148 C C . ALA C 1 14 ? 26.893 67.902 -11.307 1.00 66.25 ? 9 ALA E C 1 ATOM 5149 O O . ALA C 1 14 ? 28.084 67.641 -11.410 1.00 68.44 ? 9 ALA E O 1 ATOM 5150 C CB . ALA C 1 14 ? 25.796 68.238 -9.070 1.00 63.48 ? 9 ALA E CB 1 ATOM 5151 N N . ASN C 1 15 ? 26.257 68.726 -12.142 1.00 66.32 ? 10 ASN E N 1 ATOM 5152 C CA . ASN C 1 15 ? 26.946 69.353 -13.279 1.00 70.11 ? 10 ASN E CA 1 ATOM 5153 C C . ASN C 1 15 ? 26.205 70.619 -13.722 1.00 73.70 ? 10 ASN E C 1 ATOM 5154 O O . ASN C 1 15 ? 25.326 71.073 -12.992 1.00 76.78 ? 10 ASN E O 1 ATOM 5155 C CB . ASN C 1 15 ? 27.171 68.356 -14.411 1.00 72.86 ? 10 ASN E CB 1 ATOM 5156 C CG . ASN C 1 15 ? 25.877 67.838 -15.012 1.00 77.45 ? 10 ASN E CG 1 ATOM 5157 O OD1 . ASN C 1 15 ? 24.780 68.351 -14.758 1.00 80.36 ? 10 ASN E OD1 1 ATOM 5158 N ND2 . ASN C 1 15 ? 26.005 66.814 -15.829 1.00 78.73 ? 10 ASN E ND2 1 ATOM 5159 N N . ASN C 1 16 ? 26.570 71.222 -14.855 1.00 79.90 ? 11 ASN E N 1 ATOM 5160 C CA . ASN C 1 16 ? 25.893 72.464 -15.294 1.00 89.35 ? 11 ASN E CA 1 ATOM 5161 C C . ASN C 1 16 ? 24.972 72.228 -16.504 1.00 90.73 ? 11 ASN E C 1 ATOM 5162 O O . ASN C 1 16 ? 24.710 73.124 -17.305 1.00 84.49 ? 11 ASN E O 1 ATOM 5163 C CB . ASN C 1 16 ? 26.853 73.681 -15.480 1.00 98.43 ? 11 ASN E CB 1 ATOM 5164 C CG . ASN C 1 16 ? 28.205 73.322 -16.093 1.00 99.98 ? 11 ASN E CG 1 ATOM 5165 O OD1 . ASN C 1 16 ? 28.302 72.432 -16.935 1.00 108.95 ? 11 ASN E OD1 1 ATOM 5166 N ND2 . ASN C 1 16 ? 29.250 74.039 -15.682 1.00 96.30 ? 11 ASN E ND2 1 ATOM 5167 N N . SER C 1 17 ? 24.461 71.002 -16.595 1.00 92.19 ? 12 SER E N 1 ATOM 5168 C CA . SER C 1 17 ? 23.323 70.694 -17.469 1.00 84.64 ? 12 SER E CA 1 ATOM 5169 C C . SER C 1 17 ? 22.087 71.473 -17.045 1.00 76.29 ? 12 SER E C 1 ATOM 5170 O O . SER C 1 17 ? 21.766 71.548 -15.872 1.00 69.08 ? 12 SER E O 1 ATOM 5171 C CB . SER C 1 17 ? 23.018 69.187 -17.466 1.00 81.32 ? 12 SER E CB 1 ATOM 5172 O OG . SER C 1 17 ? 21.654 68.940 -17.718 1.00 70.57 ? 12 SER E OG 1 ATOM 5173 N N . THR C 1 18 ? 21.400 72.030 -18.031 1.00 80.39 ? 13 THR E N 1 ATOM 5174 C CA . THR C 1 18 ? 20.095 72.664 -17.838 1.00 84.41 ? 13 THR E CA 1 ATOM 5175 C C . THR C 1 18 ? 18.907 71.807 -18.330 1.00 81.68 ? 13 THR E C 1 ATOM 5176 O O . THR C 1 18 ? 17.763 72.216 -18.159 1.00 85.66 ? 13 THR E O 1 ATOM 5177 C CB . THR C 1 18 ? 20.036 74.008 -18.571 1.00 87.18 ? 13 THR E CB 1 ATOM 5178 O OG1 . THR C 1 18 ? 20.771 73.899 -19.804 1.00 82.84 ? 13 THR E OG1 1 ATOM 5179 C CG2 . THR C 1 18 ? 20.610 75.120 -17.697 1.00 87.98 ? 13 THR E CG2 1 ATOM 5180 N N . GLU C 1 19 ? 19.191 70.646 -18.929 1.00 77.26 ? 14 GLU E N 1 ATOM 5181 C CA . GLU C 1 19 ? 18.177 69.682 -19.361 1.00 76.91 ? 14 GLU E CA 1 ATOM 5182 C C . GLU C 1 19 ? 17.091 69.563 -18.317 1.00 73.00 ? 14 GLU E C 1 ATOM 5183 O O . GLU C 1 19 ? 17.362 69.396 -17.131 1.00 75.98 ? 14 GLU E O 1 ATOM 5184 C CB . GLU C 1 19 ? 18.793 68.291 -19.607 1.00 83.64 ? 14 GLU E CB 1 ATOM 5185 C CG . GLU C 1 19 ? 19.665 68.153 -20.858 1.00 96.39 ? 14 GLU E CG 1 ATOM 5186 C CD . GLU C 1 19 ? 18.908 68.346 -22.175 1.00 113.08 ? 14 GLU E CD 1 ATOM 5187 O OE1 . GLU C 1 19 ? 17.844 67.700 -22.403 1.00 118.26 ? 14 GLU E OE1 1 ATOM 5188 O OE2 . GLU C 1 19 ? 19.395 69.149 -23.005 1.00 123.87 ? 14 GLU E OE2 1 ATOM 5189 N N . GLN C 1 20 ? 15.853 69.636 -18.775 1.00 74.21 ? 15 GLN E N 1 ATOM 5190 C CA . GLN C 1 20 ? 14.671 69.539 -17.918 1.00 69.07 ? 15 GLN E CA 1 ATOM 5191 C C . GLN C 1 20 ? 13.788 68.370 -18.389 1.00 64.56 ? 15 GLN E C 1 ATOM 5192 O O . GLN C 1 20 ? 13.842 67.939 -19.525 1.00 57.18 ? 15 GLN E O 1 ATOM 5193 C CB . GLN C 1 20 ? 13.874 70.828 -17.965 1.00 69.25 ? 15 GLN E CB 1 ATOM 5194 C CG . GLN C 1 20 ? 14.338 71.843 -16.953 1.00 81.44 ? 15 GLN E CG 1 ATOM 5195 C CD . GLN C 1 20 ? 13.533 73.136 -17.026 1.00 87.80 ? 15 GLN E CD 1 ATOM 5196 O OE1 . GLN C 1 20 ? 12.366 73.160 -16.675 1.00 91.97 ? 15 GLN E OE1 1 ATOM 5197 N NE2 . GLN C 1 20 ? 14.152 74.214 -17.505 1.00 90.46 ? 15 GLN E NE2 1 ATOM 5198 N N . VAL C 1 21 ? 12.954 67.893 -17.490 1.00 63.35 ? 16 VAL E N 1 ATOM 5199 C CA . VAL C 1 21 ? 12.272 66.623 -17.642 1.00 56.71 ? 16 VAL E CA 1 ATOM 5200 C C . VAL C 1 21 ? 11.022 66.733 -16.792 1.00 58.27 ? 16 VAL E C 1 ATOM 5201 O O . VAL C 1 21 ? 11.051 67.391 -15.740 1.00 59.05 ? 16 VAL E O 1 ATOM 5202 C CB . VAL C 1 21 ? 13.215 65.495 -17.162 1.00 55.38 ? 16 VAL E CB 1 ATOM 5203 C CG1 . VAL C 1 21 ? 12.599 64.632 -16.086 1.00 52.45 ? 16 VAL E CG1 1 ATOM 5204 C CG2 . VAL C 1 21 ? 13.772 64.680 -18.324 1.00 56.19 ? 16 VAL E CG2 1 ATOM 5205 N N . ASP C 1 22 ? 9.914 66.159 -17.253 1.00 53.13 ? 17 ASP E N 1 ATOM 5206 C CA . ASP C 1 22 ? 8.746 66.126 -16.431 1.00 51.88 ? 17 ASP E CA 1 ATOM 5207 C C . ASP C 1 22 ? 8.626 64.730 -15.861 1.00 50.09 ? 17 ASP E C 1 ATOM 5208 O O . ASP C 1 22 ? 9.146 63.745 -16.408 1.00 47.55 ? 17 ASP E O 1 ATOM 5209 C CB . ASP C 1 22 ? 7.483 66.536 -17.194 1.00 58.06 ? 17 ASP E CB 1 ATOM 5210 C CG . ASP C 1 22 ? 7.444 68.024 -17.551 1.00 66.15 ? 17 ASP E CG 1 ATOM 5211 O OD1 . ASP C 1 22 ? 8.375 68.785 -17.204 1.00 79.33 ? 17 ASP E OD1 1 ATOM 5212 O OD2 . ASP C 1 22 ? 6.456 68.446 -18.195 1.00 81.98 ? 17 ASP E OD2 1 ATOM 5213 N N . THR C 1 23 ? 7.881 64.666 -14.772 1.00 48.03 ? 18 THR E N 1 ATOM 5214 C CA . THR C 1 23 ? 7.577 63.466 -14.032 1.00 51.68 ? 18 THR E CA 1 ATOM 5215 C C . THR C 1 23 ? 6.033 63.468 -13.886 1.00 56.06 ? 18 THR E C 1 ATOM 5216 O O . THR C 1 23 ? 5.393 64.512 -14.071 1.00 56.06 ? 18 THR E O 1 ATOM 5217 C CB . THR C 1 23 ? 8.319 63.571 -12.679 1.00 55.36 ? 18 THR E CB 1 ATOM 5218 O OG1 . THR C 1 23 ? 9.644 63.056 -12.821 1.00 61.08 ? 18 THR E OG1 1 ATOM 5219 C CG2 . THR C 1 23 ? 7.636 62.863 -11.561 1.00 52.50 ? 18 THR E CG2 1 ATOM 5220 N N . ILE C 1 24 ? 5.418 62.346 -13.535 1.00 55.48 ? 19 ILE E N 1 ATOM 5221 C CA . ILE C 1 24 ? 3.971 62.366 -13.317 1.00 60.20 ? 19 ILE E CA 1 ATOM 5222 C C . ILE C 1 24 ? 3.527 63.271 -12.127 1.00 63.10 ? 19 ILE E C 1 ATOM 5223 O O . ILE C 1 24 ? 2.427 63.821 -12.123 1.00 67.07 ? 19 ILE E O 1 ATOM 5224 C CB . ILE C 1 24 ? 3.397 60.934 -13.223 1.00 63.84 ? 19 ILE E CB 1 ATOM 5225 C CG1 . ILE C 1 24 ? 1.938 60.895 -13.713 1.00 67.11 ? 19 ILE E CG1 1 ATOM 5226 C CG2 . ILE C 1 24 ? 3.463 60.413 -11.819 1.00 67.27 ? 19 ILE E CG2 1 ATOM 5227 C CD1 . ILE C 1 24 ? 1.448 59.495 -14.024 1.00 72.35 ? 19 ILE E CD1 1 ATOM 5228 N N . MET C 1 25 ? 4.383 63.421 -11.129 1.00 64.45 ? 20 MET E N 1 ATOM 5229 C CA . MET C 1 25 ? 4.117 64.309 -10.002 1.00 62.81 ? 20 MET E CA 1 ATOM 5230 C C . MET C 1 25 ? 4.841 65.640 -9.984 1.00 57.40 ? 20 MET E C 1 ATOM 5231 O O . MET C 1 25 ? 4.494 66.488 -9.183 1.00 59.48 ? 20 MET E O 1 ATOM 5232 C CB . MET C 1 25 ? 4.402 63.567 -8.712 1.00 62.38 ? 20 MET E CB 1 ATOM 5233 C CG . MET C 1 25 ? 3.450 62.410 -8.546 1.00 60.88 ? 20 MET E CG 1 ATOM 5234 S SD . MET C 1 25 ? 3.200 62.009 -6.829 1.00 65.30 ? 20 MET E SD 1 ATOM 5235 C CE . MET C 1 25 ? 4.903 61.515 -6.497 1.00 66.27 ? 20 MET E CE 1 ATOM 5236 N N . GLU C 1 26 ? 5.814 65.834 -10.862 1.00 58.12 ? 21 GLU E N 1 ATOM 5237 C CA . GLU C 1 26 ? 6.582 67.075 -10.890 1.00 57.41 ? 21 GLU E CA 1 ATOM 5238 C C . GLU C 1 26 ? 6.898 67.493 -12.310 1.00 57.53 ? 21 GLU E C 1 ATOM 5239 O O . GLU C 1 26 ? 7.281 66.677 -13.128 1.00 59.66 ? 21 GLU E O 1 ATOM 5240 C CB . GLU C 1 26 ? 7.913 66.893 -10.163 1.00 62.55 ? 21 GLU E CB 1 ATOM 5241 C CG . GLU C 1 26 ? 7.827 66.533 -8.684 1.00 66.47 ? 21 GLU E CG 1 ATOM 5242 C CD . GLU C 1 26 ? 9.204 66.280 -8.035 1.00 74.51 ? 21 GLU E CD 1 ATOM 5243 O OE1 . GLU C 1 26 ? 10.031 67.229 -7.976 1.00 66.45 ? 21 GLU E OE1 1 ATOM 5244 O OE2 . GLU C 1 26 ? 9.454 65.134 -7.583 1.00 75.58 ? 21 GLU E OE2 1 ATOM 5245 N N . LYS C 1 27 ? 6.834 68.789 -12.562 1.00 58.23 ? 22 LYS E N 1 ATOM 5246 C CA . LYS C 1 27 ? 7.249 69.366 -13.821 1.00 58.21 ? 22 LYS E CA 1 ATOM 5247 C C . LYS C 1 27 ? 8.546 70.154 -13.739 1.00 63.73 ? 22 LYS E C 1 ATOM 5248 O O . LYS C 1 27 ? 8.979 70.584 -12.673 1.00 67.07 ? 22 LYS E O 1 ATOM 5249 C CB . LYS C 1 27 ? 6.179 70.294 -14.294 1.00 62.94 ? 22 LYS E CB 1 ATOM 5250 C CG . LYS C 1 27 ? 4.835 69.615 -14.452 1.00 69.95 ? 22 LYS E CG 1 ATOM 5251 C CD . LYS C 1 27 ? 3.941 70.470 -15.328 1.00 76.70 ? 22 LYS E CD 1 ATOM 5252 C CE . LYS C 1 27 ? 2.521 69.986 -15.341 1.00 76.67 ? 22 LYS E CE 1 ATOM 5253 N NZ . LYS C 1 27 ? 1.645 71.137 -15.653 1.00 81.11 ? 22 LYS E NZ 1 ATOM 5254 N N . ASN C 1 28 ? 9.185 70.333 -14.887 1.00 67.76 ? 23 ASN E N 1 ATOM 5255 C CA . ASN C 1 28 ? 10.345 71.229 -15.000 1.00 71.48 ? 23 ASN E CA 1 ATOM 5256 C C . ASN C 1 28 ? 11.445 70.887 -13.964 1.00 70.15 ? 23 ASN E C 1 ATOM 5257 O O . ASN C 1 28 ? 11.969 71.748 -13.291 1.00 70.44 ? 23 ASN E O 1 ATOM 5258 C CB . ASN C 1 28 ? 9.892 72.703 -14.939 1.00 73.15 ? 23 ASN E CB 1 ATOM 5259 C CG . ASN C 1 28 ? 9.122 73.148 -16.196 1.00 85.14 ? 23 ASN E CG 1 ATOM 5260 O OD1 . ASN C 1 28 ? 8.884 72.325 -17.091 1.00 92.32 ? 23 ASN E OD1 1 ATOM 5261 N ND2 . ASN C 1 28 ? 8.716 74.461 -16.253 1.00 97.05 ? 23 ASN E ND2 1 ATOM 5262 N N . VAL C 1 29 ? 11.789 69.599 -13.882 1.00 63.50 ? 24 VAL E N 1 ATOM 5263 C CA . VAL C 1 29 ? 12.843 69.098 -13.019 1.00 58.84 ? 24 VAL E CA 1 ATOM 5264 C C . VAL C 1 29 ? 14.163 69.012 -13.768 1.00 61.38 ? 24 VAL E C 1 ATOM 5265 O O . VAL C 1 29 ? 14.323 68.230 -14.709 1.00 70.31 ? 24 VAL E O 1 ATOM 5266 C CB . VAL C 1 29 ? 12.512 67.690 -12.494 1.00 57.57 ? 24 VAL E CB 1 ATOM 5267 C CG1 . VAL C 1 29 ? 13.673 67.120 -11.692 1.00 56.72 ? 24 VAL E CG1 1 ATOM 5268 C CG2 . VAL C 1 29 ? 11.251 67.735 -11.639 1.00 57.36 ? 24 VAL E CG2 1 ATOM 5269 N N . THR C 1 30 ? 15.137 69.778 -13.321 1.00 64.46 ? 25 THR E N 1 ATOM 5270 C CA . THR C 1 30 ? 16.434 69.815 -13.971 1.00 64.88 ? 25 THR E CA 1 ATOM 5271 C C . THR C 1 30 ? 17.200 68.546 -13.607 1.00 60.68 ? 25 THR E C 1 ATOM 5272 O O . THR C 1 30 ? 17.207 68.114 -12.457 1.00 62.66 ? 25 THR E O 1 ATOM 5273 C CB . THR C 1 30 ? 17.253 71.059 -13.548 1.00 68.84 ? 25 THR E CB 1 ATOM 5274 O OG1 . THR C 1 30 ? 16.451 72.228 -13.684 1.00 68.15 ? 25 THR E OG1 1 ATOM 5275 C CG2 . THR C 1 30 ? 18.500 71.211 -14.418 1.00 71.24 ? 25 THR E CG2 1 ATOM 5276 N N . VAL C 1 31 ? 17.838 67.953 -14.601 1.00 55.53 ? 26 VAL E N 1 ATOM 5277 C CA . VAL C 1 31 ? 18.574 66.730 -14.393 1.00 54.95 ? 26 VAL E CA 1 ATOM 5278 C C . VAL C 1 31 ? 19.956 66.808 -15.011 1.00 56.04 ? 26 VAL E C 1 ATOM 5279 O O . VAL C 1 31 ? 20.290 67.726 -15.760 1.00 62.82 ? 26 VAL E O 1 ATOM 5280 C CB . VAL C 1 31 ? 17.810 65.471 -14.929 1.00 55.71 ? 26 VAL E CB 1 ATOM 5281 C CG1 . VAL C 1 31 ? 16.479 65.331 -14.217 1.00 55.71 ? 26 VAL E CG1 1 ATOM 5282 C CG2 . VAL C 1 31 ? 17.633 65.522 -16.454 1.00 53.08 ? 26 VAL E CG2 1 ATOM 5283 N N . THR C 1 32 ? 20.719 65.782 -14.711 1.00 59.76 ? 27 THR E N 1 ATOM 5284 C CA . THR C 1 32 ? 22.124 65.710 -14.982 1.00 67.26 ? 27 THR E CA 1 ATOM 5285 C C . THR C 1 32 ? 22.357 65.309 -16.450 1.00 73.43 ? 27 THR E C 1 ATOM 5286 O O . THR C 1 32 ? 23.194 65.903 -17.155 1.00 63.77 ? 27 THR E O 1 ATOM 5287 C CB . THR C 1 32 ? 22.698 64.727 -13.935 1.00 68.74 ? 27 THR E CB 1 ATOM 5288 O OG1 . THR C 1 32 ? 23.429 65.468 -12.956 1.00 88.05 ? 27 THR E OG1 1 ATOM 5289 C CG2 . THR C 1 32 ? 23.561 63.671 -14.500 1.00 73.72 ? 27 THR E CG2 1 ATOM 5290 N N . HIS C 1 33 ? 21.602 64.292 -16.882 1.00 76.02 ? 28 HIS E N 1 ATOM 5291 C CA . HIS C 1 33 ? 21.626 63.760 -18.249 1.00 76.14 ? 28 HIS E CA 1 ATOM 5292 C C . HIS C 1 33 ? 20.200 63.364 -18.640 1.00 71.78 ? 28 HIS E C 1 ATOM 5293 O O . HIS C 1 33 ? 19.390 63.026 -17.794 1.00 64.14 ? 28 HIS E O 1 ATOM 5294 C CB . HIS C 1 33 ? 22.522 62.511 -18.364 1.00 80.97 ? 28 HIS E CB 1 ATOM 5295 C CG . HIS C 1 33 ? 23.902 62.689 -17.804 1.00 91.02 ? 28 HIS E CG 1 ATOM 5296 N ND1 . HIS C 1 33 ? 24.374 61.960 -16.732 1.00 89.15 ? 28 HIS E ND1 1 ATOM 5297 C CD2 . HIS C 1 33 ? 24.913 63.514 -18.173 1.00 93.35 ? 28 HIS E CD2 1 ATOM 5298 C CE1 . HIS C 1 33 ? 25.615 62.326 -16.466 1.00 87.44 ? 28 HIS E CE1 1 ATOM 5299 N NE2 . HIS C 1 33 ? 25.965 63.266 -17.327 1.00 91.36 ? 28 HIS E NE2 1 ATOM 5300 N N . ALA C 1 34 ? 19.912 63.397 -19.935 1.00 69.65 ? 29 ALA E N 1 ATOM 5301 C CA . ALA C 1 34 ? 18.587 63.073 -20.443 1.00 62.57 ? 29 ALA E CA 1 ATOM 5302 C C . ALA C 1 34 ? 18.667 62.623 -21.878 1.00 62.96 ? 29 ALA E C 1 ATOM 5303 O O . ALA C 1 34 ? 19.593 62.997 -22.601 1.00 54.65 ? 29 ALA E O 1 ATOM 5304 C CB . ALA C 1 34 ? 17.669 64.270 -20.356 1.00 60.67 ? 29 ALA E CB 1 ATOM 5305 N N . GLN C 1 35 ? 17.672 61.840 -22.282 1.00 60.67 ? 30 GLN E N 1 ATOM 5306 C CA . GLN C 1 35 ? 17.594 61.328 -23.643 1.00 61.63 ? 30 GLN E CA 1 ATOM 5307 C C . GLN C 1 35 ? 16.178 61.467 -24.237 1.00 61.58 ? 30 GLN E C 1 ATOM 5308 O O . GLN C 1 35 ? 15.197 60.959 -23.662 1.00 55.66 ? 30 GLN E O 1 ATOM 5309 C CB . GLN C 1 35 ? 18.028 59.873 -23.656 1.00 66.32 ? 30 GLN E CB 1 ATOM 5310 C CG . GLN C 1 35 ? 18.953 59.542 -24.800 1.00 75.85 ? 30 GLN E CG 1 ATOM 5311 C CD . GLN C 1 35 ? 19.186 58.068 -24.926 1.00 83.15 ? 30 GLN E CD 1 ATOM 5312 O OE1 . GLN C 1 35 ? 19.684 57.424 -23.994 1.00 88.83 ? 30 GLN E OE1 1 ATOM 5313 N NE2 . GLN C 1 35 ? 18.819 57.514 -26.073 1.00 90.09 ? 30 GLN E NE2 1 ATOM 5314 N N . ASP C 1 36 ? 16.102 62.149 -25.384 1.00 60.80 ? 31 ASP E N 1 ATOM 5315 C CA . ASP C 1 36 ? 14.854 62.343 -26.123 1.00 61.82 ? 31 ASP E CA 1 ATOM 5316 C C . ASP C 1 36 ? 14.608 61.170 -27.057 1.00 57.45 ? 31 ASP E C 1 ATOM 5317 O O . ASP C 1 36 ? 15.474 60.836 -27.847 1.00 54.69 ? 31 ASP E O 1 ATOM 5318 C CB . ASP C 1 36 ? 14.883 63.621 -26.951 1.00 61.81 ? 31 ASP E CB 1 ATOM 5319 C CG . ASP C 1 36 ? 13.480 64.136 -27.260 1.00 67.91 ? 31 ASP E CG 1 ATOM 5320 O OD1 . ASP C 1 36 ? 12.542 63.327 -27.423 1.00 60.65 ? 31 ASP E OD1 1 ATOM 5321 O OD2 . ASP C 1 36 ? 13.306 65.371 -27.311 1.00 80.46 ? 31 ASP E OD2 1 ATOM 5322 N N . ILE C 1 37 ? 13.449 60.522 -26.922 1.00 54.09 ? 32 ILE E N 1 ATOM 5323 C CA . ILE C 1 37 ? 13.122 59.343 -27.745 1.00 51.72 ? 32 ILE E CA 1 ATOM 5324 C C . ILE C 1 37 ? 12.184 59.663 -28.913 1.00 53.26 ? 32 ILE E C 1 ATOM 5325 O O . ILE C 1 37 ? 11.628 58.758 -29.522 1.00 58.88 ? 32 ILE E O 1 ATOM 5326 C CB . ILE C 1 37 ? 12.545 58.172 -26.924 1.00 47.12 ? 32 ILE E CB 1 ATOM 5327 C CG1 . ILE C 1 37 ? 11.283 58.573 -26.172 1.00 46.39 ? 32 ILE E CG1 1 ATOM 5328 C CG2 . ILE C 1 37 ? 13.600 57.633 -25.995 1.00 48.85 ? 32 ILE E CG2 1 ATOM 5329 C CD1 . ILE C 1 37 ? 10.601 57.411 -25.452 1.00 50.86 ? 32 ILE E CD1 1 ATOM 5330 N N . LEU C 1 38 ? 12.005 60.947 -29.192 1.00 51.55 ? 33 LEU E N 1 ATOM 5331 C CA . LEU C 1 38 ? 11.192 61.414 -30.288 1.00 49.29 ? 33 LEU E CA 1 ATOM 5332 C C . LEU C 1 38 ? 12.083 61.831 -31.416 1.00 54.43 ? 33 LEU E C 1 ATOM 5333 O O . LEU C 1 38 ? 12.924 62.714 -31.268 1.00 61.97 ? 33 LEU E O 1 ATOM 5334 C CB . LEU C 1 38 ? 10.339 62.601 -29.861 1.00 46.67 ? 33 LEU E CB 1 ATOM 5335 C CG . LEU C 1 38 ? 9.381 63.136 -30.918 1.00 47.78 ? 33 LEU E CG 1 ATOM 5336 C CD1 . LEU C 1 38 ? 8.381 62.086 -31.387 1.00 48.36 ? 33 LEU E CD1 1 ATOM 5337 C CD2 . LEU C 1 38 ? 8.632 64.335 -30.343 1.00 47.85 ? 33 LEU E CD2 1 ATOM 5338 N N . GLU C 1 39 ? 11.912 61.159 -32.548 1.00 57.49 ? 34 GLU E N 1 ATOM 5339 C CA . GLU C 1 39 ? 12.594 61.533 -33.783 1.00 51.06 ? 34 GLU E CA 1 ATOM 5340 C C . GLU C 1 39 ? 11.919 62.759 -34.394 1.00 51.35 ? 34 GLU E C 1 ATOM 5341 O O . GLU C 1 39 ? 10.724 62.750 -34.697 1.00 46.87 ? 34 GLU E O 1 ATOM 5342 C CB . GLU C 1 39 ? 12.579 60.359 -34.772 1.00 52.23 ? 34 GLU E CB 1 ATOM 5343 C CG . GLU C 1 39 ? 13.418 60.605 -35.998 1.00 56.09 ? 34 GLU E CG 1 ATOM 5344 C CD . GLU C 1 39 ? 14.836 61.056 -35.643 1.00 54.87 ? 34 GLU E CD 1 ATOM 5345 O OE1 . GLU C 1 39 ? 15.180 62.231 -35.934 1.00 52.90 ? 34 GLU E OE1 1 ATOM 5346 O OE2 . GLU C 1 39 ? 15.577 60.242 -35.044 1.00 52.29 ? 34 GLU E OE2 1 ATOM 5347 N N . LYS C 1 40 ? 12.691 63.823 -34.537 1.00 55.87 ? 35 LYS E N 1 ATOM 5348 C CA . LYS C 1 40 ? 12.209 65.110 -35.044 1.00 55.86 ? 35 LYS E CA 1 ATOM 5349 C C . LYS C 1 40 ? 12.826 65.510 -36.384 1.00 50.52 ? 35 LYS E C 1 ATOM 5350 O O . LYS C 1 40 ? 12.433 66.503 -36.971 1.00 49.18 ? 35 LYS E O 1 ATOM 5351 C CB . LYS C 1 40 ? 12.544 66.208 -34.043 1.00 62.04 ? 35 LYS E CB 1 ATOM 5352 C CG . LYS C 1 40 ? 11.564 66.346 -32.905 1.00 70.11 ? 35 LYS E CG 1 ATOM 5353 C CD . LYS C 1 40 ? 12.215 66.994 -31.698 1.00 70.31 ? 35 LYS E CD 1 ATOM 5354 C CE . LYS C 1 40 ? 12.982 65.907 -30.996 1.00 73.00 ? 35 LYS E CE 1 ATOM 5355 N NZ . LYS C 1 40 ? 13.372 66.177 -29.609 1.00 77.31 ? 35 LYS E NZ 1 ATOM 5356 N N . THR C 1 41 ? 13.807 64.767 -36.853 1.00 49.26 ? 36 THR E N 1 ATOM 5357 C CA . THR C 1 41 ? 14.544 65.199 -38.017 1.00 51.21 ? 36 THR E CA 1 ATOM 5358 C C . THR C 1 41 ? 14.399 64.246 -39.171 1.00 49.22 ? 36 THR E C 1 ATOM 5359 O O . THR C 1 41 ? 14.162 63.059 -39.018 1.00 46.29 ? 36 THR E O 1 ATOM 5360 C CB . THR C 1 41 ? 16.058 65.285 -37.761 1.00 51.07 ? 36 THR E CB 1 ATOM 5361 O OG1 . THR C 1 41 ? 16.614 63.967 -37.848 1.00 52.58 ? 36 THR E OG1 1 ATOM 5362 C CG2 . THR C 1 41 ? 16.321 65.869 -36.388 1.00 52.37 ? 36 THR E CG2 1 ATOM 5363 N N . HIS C 1 42 ? 14.614 64.816 -40.339 1.00 51.79 ? 37 HIS E N 1 ATOM 5364 C CA . HIS C 1 42 ? 14.628 64.105 -41.565 1.00 51.69 ? 37 HIS E CA 1 ATOM 5365 C C . HIS C 1 42 ? 15.588 64.793 -42.522 1.00 51.05 ? 37 HIS E C 1 ATOM 5366 O O . HIS C 1 42 ? 15.913 65.977 -42.391 1.00 52.58 ? 37 HIS E O 1 ATOM 5367 C CB . HIS C 1 42 ? 13.218 64.128 -42.152 1.00 53.90 ? 37 HIS E CB 1 ATOM 5368 C CG . HIS C 1 42 ? 12.701 65.507 -42.378 1.00 52.02 ? 37 HIS E CG 1 ATOM 5369 N ND1 . HIS C 1 42 ? 12.931 66.195 -43.547 1.00 51.04 ? 37 HIS E ND1 1 ATOM 5370 C CD2 . HIS C 1 42 ? 11.970 66.329 -41.586 1.00 51.99 ? 37 HIS E CD2 1 ATOM 5371 C CE1 . HIS C 1 42 ? 12.337 67.375 -43.483 1.00 54.41 ? 37 HIS E CE1 1 ATOM 5372 N NE2 . HIS C 1 42 ? 11.750 67.483 -42.302 1.00 56.06 ? 37 HIS E NE2 1 ATOM 5373 N N . ASN C 1 43 ? 15.961 64.046 -43.542 1.00 50.95 ? 38 ASN E N 1 ATOM 5374 C CA . ASN C 1 43 ? 16.971 64.465 -44.480 1.00 53.35 ? 38 ASN E CA 1 ATOM 5375 C C . ASN C 1 43 ? 16.491 65.386 -45.630 1.00 53.50 ? 38 ASN E C 1 ATOM 5376 O O . ASN C 1 43 ? 17.252 65.679 -46.535 1.00 49.84 ? 38 ASN E O 1 ATOM 5377 C CB . ASN C 1 43 ? 17.639 63.243 -45.072 1.00 52.84 ? 38 ASN E CB 1 ATOM 5378 C CG . ASN C 1 43 ? 16.815 62.602 -46.143 1.00 54.74 ? 38 ASN E CG 1 ATOM 5379 O OD1 . ASN C 1 43 ? 15.730 63.065 -46.472 1.00 56.19 ? 38 ASN E OD1 1 ATOM 5380 N ND2 . ASN C 1 43 ? 17.307 61.515 -46.672 1.00 54.78 ? 38 ASN E ND2 1 ATOM 5381 N N . GLY C 1 44 ? 15.238 65.823 -45.600 1.00 54.93 ? 39 GLY E N 1 ATOM 5382 C CA . GLY C 1 44 ? 14.718 66.769 -46.593 1.00 53.87 ? 39 GLY E CA 1 ATOM 5383 C C . GLY C 1 44 ? 14.560 66.260 -48.030 1.00 54.46 ? 39 GLY E C 1 ATOM 5384 O O . GLY C 1 44 ? 14.226 67.028 -48.925 1.00 58.35 ? 39 GLY E O 1 ATOM 5385 N N . LYS C 1 45 ? 14.779 64.971 -48.263 1.00 55.01 ? 40 LYS E N 1 ATOM 5386 C CA . LYS C 1 45 ? 14.853 64.438 -49.623 1.00 58.09 ? 40 LYS E CA 1 ATOM 5387 C C . LYS C 1 45 ? 13.969 63.219 -49.877 1.00 54.67 ? 40 LYS E C 1 ATOM 5388 O O . LYS C 1 45 ? 13.521 62.542 -48.940 1.00 54.31 ? 40 LYS E O 1 ATOM 5389 C CB . LYS C 1 45 ? 16.309 64.132 -49.930 1.00 69.58 ? 40 LYS E CB 1 ATOM 5390 C CG . LYS C 1 45 ? 17.131 65.415 -50.010 1.00 81.23 ? 40 LYS E CG 1 ATOM 5391 C CD . LYS C 1 45 ? 18.595 65.156 -50.347 1.00 101.07 ? 40 LYS E CD 1 ATOM 5392 C CE . LYS C 1 45 ? 19.385 64.806 -49.095 1.00 114.89 ? 40 LYS E CE 1 ATOM 5393 N NZ . LYS C 1 45 ? 20.771 64.350 -49.396 1.00 119.85 ? 40 LYS E NZ 1 ATOM 5394 N N . LEU C 1 46 ? 13.712 62.945 -51.151 1.00 52.19 ? 41 LEU E N 1 ATOM 5395 C CA . LEU C 1 46 ? 13.096 61.667 -51.569 1.00 46.87 ? 41 LEU E CA 1 ATOM 5396 C C . LEU C 1 46 ? 14.140 60.647 -51.936 1.00 40.60 ? 41 LEU E C 1 ATOM 5397 O O . LEU C 1 46 ? 14.981 60.873 -52.789 1.00 47.81 ? 41 LEU E O 1 ATOM 5398 C CB . LEU C 1 46 ? 12.220 61.835 -52.785 1.00 49.15 ? 41 LEU E CB 1 ATOM 5399 C CG . LEU C 1 46 ? 10.984 62.739 -52.755 1.00 52.73 ? 41 LEU E CG 1 ATOM 5400 C CD1 . LEU C 1 46 ? 10.329 62.668 -54.116 1.00 54.04 ? 41 LEU E CD1 1 ATOM 5401 C CD2 . LEU C 1 46 ? 10.006 62.368 -51.662 1.00 53.57 ? 41 LEU E CD2 1 ATOM 5402 N N . CYS C 1 47 ? 14.022 59.488 -51.340 1.00 42.90 ? 42 CYS E N 1 ATOM 5403 C CA . CYS C 1 47 ? 14.992 58.444 -51.429 1.00 43.74 ? 42 CYS E CA 1 ATOM 5404 C C . CYS C 1 47 ? 14.437 57.150 -51.941 1.00 44.24 ? 42 CYS E C 1 ATOM 5405 O O . CYS C 1 47 ? 13.238 56.925 -51.946 1.00 43.59 ? 42 CYS E O 1 ATOM 5406 C CB . CYS C 1 47 ? 15.533 58.168 -50.026 1.00 51.59 ? 42 CYS E CB 1 ATOM 5407 S SG . CYS C 1 47 ? 16.249 59.612 -49.199 1.00 54.33 ? 42 CYS E SG 1 ATOM 5408 N N . ASP C 1 48 ? 15.360 56.267 -52.315 1.00 45.22 ? 43 ASP E N 1 ATOM 5409 C CA . ASP C 1 48 ? 15.065 54.873 -52.541 1.00 42.32 ? 43 ASP E CA 1 ATOM 5410 C C . ASP C 1 48 ? 14.536 54.289 -51.250 1.00 43.41 ? 43 ASP E C 1 ATOM 5411 O O . ASP C 1 48 ? 14.870 54.735 -50.167 1.00 41.66 ? 43 ASP E O 1 ATOM 5412 C CB . ASP C 1 48 ? 16.328 54.045 -52.928 1.00 44.84 ? 43 ASP E CB 1 ATOM 5413 C CG . ASP C 1 48 ? 17.032 54.542 -54.215 1.00 43.75 ? 43 ASP E CG 1 ATOM 5414 O OD1 . ASP C 1 48 ? 16.518 55.451 -54.878 1.00 39.38 ? 43 ASP E OD1 1 ATOM 5415 O OD2 . ASP C 1 48 ? 18.122 54.018 -54.544 1.00 47.29 ? 43 ASP E OD2 1 ATOM 5416 N N . LEU C 1 49 ? 13.770 53.223 -51.386 1.00 41.63 ? 44 LEU E N 1 ATOM 5417 C CA . LEU C 1 49 ? 13.215 52.553 -50.267 1.00 44.18 ? 44 LEU E CA 1 ATOM 5418 C C . LEU C 1 49 ? 13.783 51.157 -50.271 1.00 43.40 ? 44 LEU E C 1 ATOM 5419 O O . LEU C 1 49 ? 13.456 50.379 -51.159 1.00 42.38 ? 44 LEU E O 1 ATOM 5420 C CB . LEU C 1 49 ? 11.695 52.454 -50.447 1.00 48.82 ? 44 LEU E CB 1 ATOM 5421 C CG . LEU C 1 49 ? 10.714 52.894 -49.364 1.00 48.28 ? 44 LEU E CG 1 ATOM 5422 C CD1 . LEU C 1 49 ? 9.422 52.105 -49.578 1.00 48.59 ? 44 LEU E CD1 1 ATOM 5423 C CD2 . LEU C 1 49 ? 11.230 52.761 -47.930 1.00 45.74 ? 44 LEU E CD2 1 ATOM 5424 N N . ASN C 1 50 ? 14.619 50.836 -49.289 1.00 43.41 ? 45 ASN E N 1 ATOM 5425 C CA . ASN C 1 50 ? 15.280 49.525 -49.255 1.00 45.01 ? 45 ASN E CA 1 ATOM 5426 C C . ASN C 1 50 ? 15.999 49.167 -50.578 1.00 39.81 ? 45 ASN E C 1 ATOM 5427 O O . ASN C 1 50 ? 15.861 48.077 -51.139 1.00 35.30 ? 45 ASN E O 1 ATOM 5428 C CB . ASN C 1 50 ? 14.286 48.432 -48.843 1.00 43.55 ? 45 ASN E CB 1 ATOM 5429 C CG . ASN C 1 50 ? 13.603 48.753 -47.537 1.00 48.58 ? 45 ASN E CG 1 ATOM 5430 O OD1 . ASN C 1 50 ? 14.235 48.997 -46.514 1.00 53.58 ? 45 ASN E OD1 1 ATOM 5431 N ND2 . ASN C 1 50 ? 12.291 48.745 -47.561 1.00 54.05 ? 45 ASN E ND2 1 ATOM 5432 N N . GLY C 1 51 ? 16.726 50.130 -51.094 1.00 39.76 ? 46 GLY E N 1 ATOM 5433 C CA . GLY C 1 51 ? 17.494 49.913 -52.299 1.00 43.32 ? 46 GLY E CA 1 ATOM 5434 C C . GLY C 1 51 ? 16.783 50.120 -53.607 1.00 46.23 ? 46 GLY E C 1 ATOM 5435 O O . GLY C 1 51 ? 17.437 50.139 -54.639 1.00 51.34 ? 46 GLY E O 1 ATOM 5436 N N . VAL C 1 52 ? 15.459 50.265 -53.632 1.00 51.46 ? 47 VAL E N 1 ATOM 5437 C CA . VAL C 1 52 ? 14.825 50.540 -54.939 1.00 47.98 ? 47 VAL E CA 1 ATOM 5438 C C . VAL C 1 52 ? 14.187 51.927 -55.082 1.00 45.86 ? 47 VAL E C 1 ATOM 5439 O O . VAL C 1 52 ? 13.502 52.454 -54.199 1.00 47.20 ? 47 VAL E O 1 ATOM 5440 C CB . VAL C 1 52 ? 14.010 49.352 -55.538 1.00 50.20 ? 47 VAL E CB 1 ATOM 5441 C CG1 . VAL C 1 52 ? 13.946 48.161 -54.618 1.00 48.15 ? 47 VAL E CG1 1 ATOM 5442 C CG2 . VAL C 1 52 ? 12.653 49.790 -56.048 1.00 52.81 ? 47 VAL E CG2 1 ATOM 5443 N N . LYS C 1 53 ? 14.474 52.515 -56.221 1.00 45.33 ? 48 LYS E N 1 ATOM 5444 C CA . LYS C 1 53 ? 14.144 53.902 -56.503 1.00 53.08 ? 48 LYS E CA 1 ATOM 5445 C C . LYS C 1 53 ? 12.633 54.092 -56.689 1.00 51.52 ? 48 LYS E C 1 ATOM 5446 O O . LYS C 1 53 ? 11.973 53.213 -57.190 1.00 51.52 ? 48 LYS E O 1 ATOM 5447 C CB . LYS C 1 53 ? 14.913 54.360 -57.769 1.00 57.51 ? 48 LYS E CB 1 ATOM 5448 C CG . LYS C 1 53 ? 14.915 55.871 -58.007 1.00 62.98 ? 48 LYS E CG 1 ATOM 5449 C CD . LYS C 1 53 ? 15.649 56.278 -59.295 1.00 71.74 ? 48 LYS E CD 1 ATOM 5450 C CE . LYS C 1 53 ? 14.972 57.469 -59.999 1.00 75.36 ? 48 LYS E CE 1 ATOM 5451 N NZ . LYS C 1 53 ? 15.890 58.585 -60.345 1.00 79.36 ? 48 LYS E NZ 1 ATOM 5452 N N . PRO C 1 54 ? 12.093 55.256 -56.280 1.00 50.98 ? 49 PRO E N 1 ATOM 5453 C CA . PRO C 1 54 ? 10.725 55.550 -56.648 1.00 51.10 ? 49 PRO E CA 1 ATOM 5454 C C . PRO C 1 54 ? 10.576 55.916 -58.113 1.00 48.23 ? 49 PRO E C 1 ATOM 5455 O O . PRO C 1 54 ? 11.539 56.246 -58.772 1.00 50.39 ? 49 PRO E O 1 ATOM 5456 C CB . PRO C 1 54 ? 10.368 56.750 -55.765 1.00 49.02 ? 49 PRO E CB 1 ATOM 5457 C CG . PRO C 1 54 ? 11.656 57.403 -55.486 1.00 51.30 ? 49 PRO E CG 1 ATOM 5458 C CD . PRO C 1 54 ? 12.664 56.310 -55.432 1.00 50.55 ? 49 PRO E CD 1 ATOM 5459 N N . LEU C 1 55 ? 9.340 55.874 -58.577 1.00 46.12 ? 50 LEU E N 1 ATOM 5460 C CA . LEU C 1 55 ? 8.949 56.392 -59.854 1.00 45.79 ? 50 LEU E CA 1 ATOM 5461 C C . LEU C 1 55 ? 8.485 57.792 -59.574 1.00 51.13 ? 50 LEU E C 1 ATOM 5462 O O . LEU C 1 55 ? 7.459 58.014 -58.917 1.00 49.72 ? 50 LEU E O 1 ATOM 5463 C CB . LEU C 1 55 ? 7.799 55.586 -60.449 1.00 48.72 ? 50 LEU E CB 1 ATOM 5464 C CG . LEU C 1 55 ? 7.225 56.068 -61.773 1.00 47.58 ? 50 LEU E CG 1 ATOM 5465 C CD1 . LEU C 1 55 ? 8.318 56.122 -62.821 1.00 47.43 ? 50 LEU E CD1 1 ATOM 5466 C CD2 . LEU C 1 55 ? 6.122 55.139 -62.264 1.00 47.52 ? 50 LEU E CD2 1 ATOM 5467 N N . ILE C 1 56 ? 9.242 58.768 -60.071 1.00 56.46 ? 51 ILE E N 1 ATOM 5468 C CA . ILE C 1 56 ? 8.944 60.173 -59.795 1.00 56.00 ? 51 ILE E CA 1 ATOM 5469 C C . ILE C 1 56 ? 8.353 60.775 -61.042 1.00 51.02 ? 51 ILE E C 1 ATOM 5470 O O . ILE C 1 56 ? 9.033 60.890 -62.042 1.00 46.58 ? 51 ILE E O 1 ATOM 5471 C CB . ILE C 1 56 ? 10.211 60.925 -59.362 1.00 60.04 ? 51 ILE E CB 1 ATOM 5472 C CG1 . ILE C 1 56 ? 10.715 60.325 -58.061 1.00 61.34 ? 51 ILE E CG1 1 ATOM 5473 C CG2 . ILE C 1 56 ? 9.901 62.394 -59.145 1.00 61.28 ? 51 ILE E CG2 1 ATOM 5474 C CD1 . ILE C 1 56 ? 11.919 61.004 -57.487 1.00 60.64 ? 51 ILE E CD1 1 ATOM 5475 N N . LEU C 1 57 ? 7.096 61.172 -60.968 1.00 50.94 ? 52 LEU E N 1 ATOM 5476 C CA . LEU C 1 57 ? 6.353 61.511 -62.179 1.00 57.55 ? 52 LEU E CA 1 ATOM 5477 C C . LEU C 1 57 ? 6.395 62.962 -62.571 1.00 61.76 ? 52 LEU E C 1 ATOM 5478 O O . LEU C 1 57 ? 6.077 63.279 -63.711 1.00 71.87 ? 52 LEU E O 1 ATOM 5479 C CB . LEU C 1 57 ? 4.912 61.011 -62.109 1.00 52.64 ? 52 LEU E CB 1 ATOM 5480 C CG . LEU C 1 57 ? 4.805 59.501 -62.276 1.00 50.94 ? 52 LEU E CG 1 ATOM 5481 C CD1 . LEU C 1 57 ? 3.363 59.080 -62.159 1.00 49.13 ? 52 LEU E CD1 1 ATOM 5482 C CD2 . LEU C 1 57 ? 5.377 59.038 -63.601 1.00 52.24 ? 52 LEU E CD2 1 ATOM 5483 N N . LYS C 1 58 ? 6.800 63.834 -61.665 1.00 63.93 ? 53 LYS E N 1 ATOM 5484 C CA . LYS C 1 58 ? 7.074 65.235 -62.030 1.00 74.23 ? 53 LYS E CA 1 ATOM 5485 C C . LYS C 1 58 ? 5.768 65.997 -62.374 1.00 71.98 ? 53 LYS E C 1 ATOM 5486 O O . LYS C 1 58 ? 4.897 66.116 -61.537 1.00 78.40 ? 53 LYS E O 1 ATOM 5487 C CB . LYS C 1 58 ? 8.114 65.304 -63.171 1.00 84.22 ? 53 LYS E CB 1 ATOM 5488 C CG . LYS C 1 58 ? 9.368 64.459 -62.942 1.00 91.99 ? 53 LYS E CG 1 ATOM 5489 C CD . LYS C 1 58 ? 10.677 65.073 -63.449 1.00 99.32 ? 53 LYS E CD 1 ATOM 5490 C CE . LYS C 1 58 ? 10.942 64.767 -64.926 1.00 106.74 ? 53 LYS E CE 1 ATOM 5491 N NZ . LYS C 1 58 ? 11.739 65.850 -65.589 1.00 100.91 ? 53 LYS E NZ 1 ATOM 5492 N N . ASP C 1 59 ? 5.595 66.472 -63.602 1.00 66.52 ? 54 ASP E N 1 ATOM 5493 C CA . ASP C 1 59 ? 4.361 67.183 -63.977 1.00 64.68 ? 54 ASP E CA 1 ATOM 5494 C C . ASP C 1 59 ? 3.260 66.264 -64.597 1.00 59.24 ? 54 ASP E C 1 ATOM 5495 O O . ASP C 1 59 ? 2.293 66.753 -65.178 1.00 52.67 ? 54 ASP E O 1 ATOM 5496 C CB . ASP C 1 59 ? 4.714 68.324 -64.934 1.00 70.52 ? 54 ASP E CB 1 ATOM 5497 C CG . ASP C 1 59 ? 5.588 67.872 -66.119 1.00 81.08 ? 54 ASP E CG 1 ATOM 5498 O OD1 . ASP C 1 59 ? 5.945 66.667 -66.231 1.00 85.32 ? 54 ASP E OD1 1 ATOM 5499 O OD2 . ASP C 1 59 ? 5.931 68.743 -66.958 1.00 103.69 ? 54 ASP E OD2 1 ATOM 5500 N N . CYS C 1 60 ? 3.435 64.944 -64.515 1.00 53.58 ? 55 CYS E N 1 ATOM 5501 C CA . CYS C 1 60 ? 2.436 64.007 -65.043 1.00 55.72 ? 55 CYS E CA 1 ATOM 5502 C C . CYS C 1 60 ? 1.735 63.236 -63.971 1.00 49.71 ? 55 CYS E C 1 ATOM 5503 O O . CYS C 1 60 ? 2.299 62.909 -62.936 1.00 45.68 ? 55 CYS E O 1 ATOM 5504 C CB . CYS C 1 60 ? 3.036 63.018 -66.024 1.00 58.03 ? 55 CYS E CB 1 ATOM 5505 S SG . CYS C 1 60 ? 3.694 63.882 -67.439 1.00 72.59 ? 55 CYS E SG 1 ATOM 5506 N N . SER C 1 61 ? 0.474 62.972 -64.239 1.00 44.39 ? 56 SER E N 1 ATOM 5507 C CA . SER C 1 61 ? -0.281 62.031 -63.447 1.00 41.79 ? 56 SER E CA 1 ATOM 5508 C C . SER C 1 61 ? 0.044 60.611 -63.924 1.00 38.69 ? 56 SER E C 1 ATOM 5509 O O . SER C 1 61 ? 0.581 60.407 -65.015 1.00 37.11 ? 56 SER E O 1 ATOM 5510 C CB . SER C 1 61 ? -1.762 62.297 -63.616 1.00 39.00 ? 56 SER E CB 1 ATOM 5511 O OG . SER C 1 61 ? -2.140 61.877 -64.900 1.00 37.01 ? 56 SER E OG 1 ATOM 5512 N N . VAL C 1 62 ? -0.293 59.620 -63.116 1.00 37.99 ? 57 VAL E N 1 ATOM 5513 C CA . VAL C 1 62 ? -0.100 58.197 -63.524 1.00 35.98 ? 57 VAL E CA 1 ATOM 5514 C C . VAL C 1 62 ? -0.837 57.979 -64.833 1.00 37.85 ? 57 VAL E C 1 ATOM 5515 O O . VAL C 1 62 ? -0.375 57.258 -65.702 1.00 45.19 ? 57 VAL E O 1 ATOM 5516 C CB . VAL C 1 62 ? -0.616 57.244 -62.452 1.00 34.32 ? 57 VAL E CB 1 ATOM 5517 C CG1 . VAL C 1 62 ? -0.652 55.799 -62.926 1.00 34.83 ? 57 VAL E CG1 1 ATOM 5518 C CG2 . VAL C 1 62 ? 0.238 57.373 -61.201 1.00 33.72 ? 57 VAL E CG2 1 ATOM 5519 N N . ALA C 1 63 ? -2.005 58.589 -64.983 1.00 38.62 ? 58 ALA E N 1 ATOM 5520 C CA . ALA C 1 63 ? -2.796 58.366 -66.209 1.00 40.04 ? 58 ALA E CA 1 ATOM 5521 C C . ALA C 1 63 ? -2.100 58.919 -67.464 1.00 38.55 ? 58 ALA E C 1 ATOM 5522 O O . ALA C 1 63 ? -2.053 58.253 -68.509 1.00 35.94 ? 58 ALA E O 1 ATOM 5523 C CB . ALA C 1 63 ? -4.194 58.940 -66.072 1.00 37.85 ? 58 ALA E CB 1 ATOM 5524 N N . GLY C 1 64 ? -1.569 60.122 -67.331 1.00 39.06 ? 59 GLY E N 1 ATOM 5525 C CA . GLY C 1 64 ? -0.905 60.774 -68.430 1.00 41.21 ? 59 GLY E CA 1 ATOM 5526 C C . GLY C 1 64 ? 0.354 60.023 -68.819 1.00 41.61 ? 59 GLY E C 1 ATOM 5527 O O . GLY C 1 64 ? 0.606 59.787 -69.990 1.00 42.26 ? 59 GLY E O 1 ATOM 5528 N N . TRP C 1 65 ? 1.120 59.613 -67.817 1.00 40.02 ? 60 TRP E N 1 ATOM 5529 C CA . TRP C 1 65 ? 2.267 58.740 -68.027 1.00 41.70 ? 60 TRP E CA 1 ATOM 5530 C C . TRP C 1 65 ? 1.887 57.400 -68.705 1.00 42.92 ? 60 TRP E C 1 ATOM 5531 O O . TRP C 1 65 ? 2.471 57.011 -69.715 1.00 44.57 ? 60 TRP E O 1 ATOM 5532 C CB . TRP C 1 65 ? 2.950 58.518 -66.690 1.00 44.78 ? 60 TRP E CB 1 ATOM 5533 C CG . TRP C 1 65 ? 3.959 57.477 -66.708 1.00 47.90 ? 60 TRP E CG 1 ATOM 5534 C CD1 . TRP C 1 65 ? 5.138 57.497 -67.371 1.00 51.63 ? 60 TRP E CD1 1 ATOM 5535 C CD2 . TRP C 1 65 ? 3.883 56.209 -66.050 1.00 50.73 ? 60 TRP E CD2 1 ATOM 5536 N NE1 . TRP C 1 65 ? 5.812 56.314 -67.173 1.00 55.48 ? 60 TRP E NE1 1 ATOM 5537 C CE2 . TRP C 1 65 ? 5.054 55.497 -66.377 1.00 50.63 ? 60 TRP E CE2 1 ATOM 5538 C CE3 . TRP C 1 65 ? 2.936 55.609 -65.223 1.00 52.79 ? 60 TRP E CE3 1 ATOM 5539 C CZ2 . TRP C 1 65 ? 5.320 54.239 -65.880 1.00 52.97 ? 60 TRP E CZ2 1 ATOM 5540 C CZ3 . TRP C 1 65 ? 3.196 54.343 -64.732 1.00 53.16 ? 60 TRP E CZ3 1 ATOM 5541 C CH2 . TRP C 1 65 ? 4.375 53.667 -65.067 1.00 56.11 ? 60 TRP E CH2 1 ATOM 5542 N N . LEU C 1 66 ? 0.872 56.718 -68.191 1.00 41.54 ? 61 LEU E N 1 ATOM 5543 C CA . LEU C 1 66 ? 0.502 55.399 -68.719 1.00 44.14 ? 61 LEU E CA 1 ATOM 5544 C C . LEU C 1 66 ? -0.002 55.444 -70.129 1.00 41.40 ? 61 LEU E C 1 ATOM 5545 O O . LEU C 1 66 ? 0.408 54.651 -70.985 1.00 37.11 ? 61 LEU E O 1 ATOM 5546 C CB . LEU C 1 66 ? -0.637 54.776 -67.916 1.00 48.54 ? 61 LEU E CB 1 ATOM 5547 C CG . LEU C 1 66 ? -0.377 53.859 -66.760 1.00 50.05 ? 61 LEU E CG 1 ATOM 5548 C CD1 . LEU C 1 66 ? -1.737 53.284 -66.381 1.00 52.37 ? 61 LEU E CD1 1 ATOM 5549 C CD2 . LEU C 1 66 ? 0.582 52.739 -67.126 1.00 50.95 ? 61 LEU E CD2 1 ATOM 5550 N N . LEU C 1 67 ? -0.935 56.353 -70.362 1.00 38.78 ? 62 LEU E N 1 ATOM 5551 C CA . LEU C 1 67 ? -1.480 56.509 -71.714 1.00 40.21 ? 62 LEU E CA 1 ATOM 5552 C C . LEU C 1 67 ? -0.527 57.195 -72.703 1.00 41.65 ? 62 LEU E C 1 ATOM 5553 O O . LEU C 1 67 ? -0.701 57.083 -73.918 1.00 45.32 ? 62 LEU E O 1 ATOM 5554 C CB . LEU C 1 67 ? -2.792 57.281 -71.651 1.00 40.13 ? 62 LEU E CB 1 ATOM 5555 C CG . LEU C 1 67 ? -3.949 56.518 -71.000 1.00 39.38 ? 62 LEU E CG 1 ATOM 5556 C CD1 . LEU C 1 67 ? -5.077 57.452 -70.618 1.00 38.82 ? 62 LEU E CD1 1 ATOM 5557 C CD2 . LEU C 1 67 ? -4.444 55.408 -71.922 1.00 40.69 ? 62 LEU E CD2 1 ATOM 5558 N N . GLY C 1 68 ? 0.478 57.888 -72.187 1.00 42.76 ? 63 GLY E N 1 ATOM 5559 C CA . GLY C 1 68 ? 1.441 58.598 -73.009 1.00 45.96 ? 63 GLY E CA 1 ATOM 5560 C C . GLY C 1 68 ? 0.979 59.943 -73.515 1.00 43.61 ? 63 GLY E C 1 ATOM 5561 O O . GLY C 1 68 ? 1.247 60.272 -74.666 1.00 42.08 ? 63 GLY E O 1 ATOM 5562 N N . ASN C 1 69 ? 0.329 60.716 -72.651 1.00 42.73 ? 64 ASN E N 1 ATOM 5563 C CA . ASN C 1 69 ? 0.138 62.159 -72.858 1.00 46.52 ? 64 ASN E CA 1 ATOM 5564 C C . ASN C 1 69 ? 1.417 62.787 -73.443 1.00 50.48 ? 64 ASN E C 1 ATOM 5565 O O . ASN C 1 69 ? 2.509 62.639 -72.882 1.00 49.48 ? 64 ASN E O 1 ATOM 5566 C CB . ASN C 1 69 ? -0.195 62.858 -71.533 1.00 45.27 ? 64 ASN E CB 1 ATOM 5567 C CG . ASN C 1 69 ? -0.485 64.368 -71.687 1.00 44.10 ? 64 ASN E CG 1 ATOM 5568 O OD1 . ASN C 1 69 ? 0.116 65.044 -72.501 1.00 42.72 ? 64 ASN E OD1 1 ATOM 5569 N ND2 . ASN C 1 69 ? -1.410 64.882 -70.883 1.00 44.18 ? 64 ASN E ND2 1 ATOM 5570 N N . PRO C 1 70 ? 1.305 63.449 -74.592 1.00 51.70 ? 65 PRO E N 1 ATOM 5571 C CA . PRO C 1 70 ? 2.576 63.802 -75.238 1.00 57.56 ? 65 PRO E CA 1 ATOM 5572 C C . PRO C 1 70 ? 3.438 64.829 -74.461 1.00 57.82 ? 65 PRO E C 1 ATOM 5573 O O . PRO C 1 70 ? 4.620 64.905 -74.713 1.00 58.82 ? 65 PRO E O 1 ATOM 5574 C CB . PRO C 1 70 ? 2.163 64.297 -76.634 1.00 54.01 ? 65 PRO E CB 1 ATOM 5575 C CG . PRO C 1 70 ? 0.697 64.499 -76.578 1.00 58.41 ? 65 PRO E CG 1 ATOM 5576 C CD . PRO C 1 70 ? 0.141 63.667 -75.458 1.00 54.51 ? 65 PRO E CD 1 ATOM 5577 N N . MET C 1 71 ? 2.880 65.561 -73.505 1.00 64.86 ? 66 MET E N 1 ATOM 5578 C CA . MET C 1 71 ? 3.731 66.346 -72.586 1.00 69.63 ? 66 MET E CA 1 ATOM 5579 C C . MET C 1 71 ? 4.440 65.511 -71.516 1.00 72.59 ? 66 MET E C 1 ATOM 5580 O O . MET C 1 71 ? 5.125 66.028 -70.649 1.00 66.29 ? 66 MET E O 1 ATOM 5581 C CB . MET C 1 71 ? 2.954 67.487 -71.934 1.00 79.92 ? 66 MET E CB 1 ATOM 5582 C CG . MET C 1 71 ? 3.562 68.863 -72.252 1.00 91.52 ? 66 MET E CG 1 ATOM 5583 S SD . MET C 1 71 ? 3.327 69.448 -73.952 1.00 97.93 ? 66 MET E SD 1 ATOM 5584 C CE . MET C 1 71 ? 1.806 70.390 -73.672 1.00 100.81 ? 66 MET E CE 1 ATOM 5585 N N . CYS C 1 72 ? 4.291 64.197 -71.579 1.00 80.85 ? 67 CYS E N 1 ATOM 5586 C CA . CYS C 1 72 ? 4.999 63.310 -70.658 1.00 84.79 ? 67 CYS E CA 1 ATOM 5587 C C . CYS C 1 72 ? 6.161 62.588 -71.406 1.00 92.93 ? 67 CYS E C 1 ATOM 5588 O O . CYS C 1 72 ? 6.526 61.464 -71.115 1.00 75.99 ? 67 CYS E O 1 ATOM 5589 C CB . CYS C 1 72 ? 3.983 62.364 -69.965 1.00 78.51 ? 67 CYS E CB 1 ATOM 5590 S SG . CYS C 1 72 ? 2.620 63.173 -69.006 1.00 67.55 ? 67 CYS E SG 1 ATOM 5591 N N . ASP C 1 73 ? 6.791 63.311 -72.328 1.00 121.20 ? 68 ASP E N 1 ATOM 5592 C CA . ASP C 1 73 ? 7.831 62.748 -73.211 1.00 142.84 ? 68 ASP E CA 1 ATOM 5593 C C . ASP C 1 73 ? 9.172 62.426 -72.531 1.00 155.39 ? 68 ASP E C 1 ATOM 5594 O O . ASP C 1 73 ? 10.194 62.374 -73.200 1.00 162.51 ? 68 ASP E O 1 ATOM 5595 C CB . ASP C 1 73 ? 8.083 63.713 -74.401 1.00 142.63 ? 68 ASP E CB 1 ATOM 5596 C CG . ASP C 1 73 ? 7.899 63.045 -75.777 1.00 138.17 ? 68 ASP E CG 1 ATOM 5597 O OD1 . ASP C 1 73 ? 6.743 62.779 -76.186 1.00 132.45 ? 68 ASP E OD1 1 ATOM 5598 O OD2 . ASP C 1 73 ? 8.910 62.821 -76.475 1.00 129.45 ? 68 ASP E OD2 1 ATOM 5599 N N . GLU C 1 74 ? 9.161 62.168 -71.230 1.00 156.21 ? 69 GLU E N 1 ATOM 5600 C CA . GLU C 1 74 ? 10.373 62.104 -70.439 1.00 156.70 ? 69 GLU E CA 1 ATOM 5601 C C . GLU C 1 74 ? 10.641 60.661 -69.992 1.00 166.38 ? 69 GLU E C 1 ATOM 5602 O O . GLU C 1 74 ? 11.206 60.458 -68.920 1.00 168.68 ? 69 GLU E O 1 ATOM 5603 C CB . GLU C 1 74 ? 10.216 63.081 -69.254 1.00 149.80 ? 69 GLU E CB 1 ATOM 5604 C CG . GLU C 1 74 ? 9.313 64.268 -69.604 1.00 145.54 ? 69 GLU E CG 1 ATOM 5605 C CD . GLU C 1 74 ? 9.102 65.244 -68.465 1.00 135.55 ? 69 GLU E CD 1 ATOM 5606 O OE1 . GLU C 1 74 ? 10.102 65.664 -67.860 1.00 121.81 ? 69 GLU E OE1 1 ATOM 5607 O OE2 . GLU C 1 74 ? 7.932 65.599 -68.188 1.00 121.86 ? 69 GLU E OE2 1 ATOM 5608 N N . PHE C 1 75 ? 10.292 59.673 -70.838 1.00 170.99 ? 70 PHE E N 1 ATOM 5609 C CA . PHE C 1 75 ? 10.294 58.237 -70.442 1.00 174.74 ? 70 PHE E CA 1 ATOM 5610 C C . PHE C 1 75 ? 11.724 57.686 -70.230 1.00 172.83 ? 70 PHE E C 1 ATOM 5611 O O . PHE C 1 75 ? 12.232 56.908 -71.045 1.00 175.43 ? 70 PHE E O 1 ATOM 5612 C CB . PHE C 1 75 ? 9.467 57.362 -71.451 1.00 170.64 ? 70 PHE E CB 1 ATOM 5613 C CG . PHE C 1 75 ? 8.938 56.015 -70.907 1.00 175.22 ? 70 PHE E CG 1 ATOM 5614 C CD1 . PHE C 1 75 ? 7.610 55.864 -70.444 1.00 166.85 ? 70 PHE E CD1 1 ATOM 5615 C CD2 . PHE C 1 75 ? 9.737 54.871 -70.942 1.00 176.63 ? 70 PHE E CD2 1 ATOM 5616 C CE1 . PHE C 1 75 ? 7.132 54.629 -69.986 1.00 149.49 ? 70 PHE E CE1 1 ATOM 5617 C CE2 . PHE C 1 75 ? 9.260 53.639 -70.480 1.00 170.97 ? 70 PHE E CE2 1 ATOM 5618 C CZ . PHE C 1 75 ? 7.958 53.515 -70.002 1.00 154.65 ? 70 PHE E CZ 1 ATOM 5619 N N . ILE C 1 76 ? 12.369 58.104 -69.132 1.00 162.19 ? 71 ILE E N 1 ATOM 5620 C CA . ILE C 1 76 ? 13.528 57.395 -68.582 1.00 145.96 ? 71 ILE E CA 1 ATOM 5621 C C . ILE C 1 76 ? 12.870 56.078 -68.147 1.00 140.95 ? 71 ILE E C 1 ATOM 5622 O O . ILE C 1 76 ? 11.764 56.060 -67.580 1.00 130.53 ? 71 ILE E O 1 ATOM 5623 C CB . ILE C 1 76 ? 14.236 58.191 -67.432 1.00 135.16 ? 71 ILE E CB 1 ATOM 5624 C CG1 . ILE C 1 76 ? 14.953 59.461 -67.966 1.00 124.73 ? 71 ILE E CG1 1 ATOM 5625 C CG2 . ILE C 1 76 ? 15.182 57.306 -66.619 1.00 123.27 ? 71 ILE E CG2 1 ATOM 5626 C CD1 . ILE C 1 76 ? 16.450 59.362 -68.243 1.00 120.28 ? 71 ILE E CD1 1 ATOM 5627 N N . ARG C 1 77 ? 13.523 54.977 -68.481 1.00 129.88 ? 72 ARG E N 1 ATOM 5628 C CA . ARG C 1 77 ? 12.867 53.688 -68.576 1.00 118.08 ? 72 ARG E CA 1 ATOM 5629 C C . ARG C 1 77 ? 13.095 52.895 -67.273 1.00 110.13 ? 72 ARG E C 1 ATOM 5630 O O . ARG C 1 77 ? 13.926 51.983 -67.230 1.00 115.50 ? 72 ARG E O 1 ATOM 5631 C CB . ARG C 1 77 ? 13.469 52.984 -69.786 1.00 113.43 ? 72 ARG E CB 1 ATOM 5632 C CG . ARG C 1 77 ? 12.835 51.676 -70.199 1.00 115.72 ? 72 ARG E CG 1 ATOM 5633 C CD . ARG C 1 77 ? 13.900 50.677 -70.627 1.00 123.54 ? 72 ARG E CD 1 ATOM 5634 N NE . ARG C 1 77 ? 13.377 49.531 -71.373 1.00 131.30 ? 72 ARG E NE 1 ATOM 5635 C CZ . ARG C 1 77 ? 13.218 48.290 -70.897 1.00 131.17 ? 72 ARG E CZ 1 ATOM 5636 N NH1 . ARG C 1 77 ? 13.519 47.968 -69.635 1.00 134.52 ? 72 ARG E NH1 1 ATOM 5637 N NH2 . ARG C 1 77 ? 12.745 47.348 -71.708 1.00 128.20 ? 72 ARG E NH2 1 ATOM 5638 N N . VAL C 1 78 ? 12.377 53.266 -66.208 1.00 87.20 ? 73 VAL E N 1 ATOM 5639 C CA . VAL C 1 78 ? 12.509 52.573 -64.900 1.00 75.60 ? 73 VAL E CA 1 ATOM 5640 C C . VAL C 1 78 ? 11.797 51.210 -64.995 1.00 67.70 ? 73 VAL E C 1 ATOM 5641 O O . VAL C 1 78 ? 10.580 51.161 -65.117 1.00 71.77 ? 73 VAL E O 1 ATOM 5642 C CB . VAL C 1 78 ? 11.961 53.401 -63.705 1.00 63.60 ? 73 VAL E CB 1 ATOM 5643 N N . PRO C 1 79 ? 12.546 50.096 -64.968 1.00 60.46 ? 74 PRO E N 1 ATOM 5644 C CA . PRO C 1 79 ? 11.887 48.782 -65.035 1.00 56.68 ? 74 PRO E CA 1 ATOM 5645 C C . PRO C 1 79 ? 11.312 48.252 -63.689 1.00 58.94 ? 74 PRO E C 1 ATOM 5646 O O . PRO C 1 79 ? 10.565 47.253 -63.698 1.00 59.94 ? 74 PRO E O 1 ATOM 5647 C CB . PRO C 1 79 ? 13.010 47.849 -65.512 1.00 53.74 ? 74 PRO E CB 1 ATOM 5648 C CG . PRO C 1 79 ? 14.241 48.466 -64.962 1.00 55.36 ? 74 PRO E CG 1 ATOM 5649 C CD . PRO C 1 79 ? 14.013 49.962 -64.959 1.00 58.53 ? 74 PRO E CD 1 ATOM 5650 N N . GLU C 1 80 ? 11.680 48.864 -62.562 1.00 51.73 ? 75 GLU E N 1 ATOM 5651 C CA . GLU C 1 80 ? 11.055 48.540 -61.271 1.00 51.04 ? 75 GLU E CA 1 ATOM 5652 C C . GLU C 1 80 ? 11.082 49.762 -60.371 1.00 46.54 ? 75 GLU E C 1 ATOM 5653 O O . GLU C 1 80 ? 11.901 50.641 -60.558 1.00 46.03 ? 75 GLU E O 1 ATOM 5654 C CB . GLU C 1 80 ? 11.723 47.343 -60.590 1.00 51.68 ? 75 GLU E CB 1 ATOM 5655 C CG . GLU C 1 80 ? 13.119 47.574 -60.026 1.00 62.48 ? 75 GLU E CG 1 ATOM 5656 C CD . GLU C 1 80 ? 13.567 46.498 -58.987 1.00 75.90 ? 75 GLU E CD 1 ATOM 5657 O OE1 . GLU C 1 80 ? 14.808 46.337 -58.821 1.00 65.02 ? 75 GLU E OE1 1 ATOM 5658 O OE2 . GLU C 1 80 ? 12.711 45.848 -58.293 1.00 72.21 ? 75 GLU E OE2 1 ATOM 5659 N N . TRP C 1 81 ? 10.165 49.811 -59.410 1.00 45.32 ? 76 TRP E N 1 ATOM 5660 C CA . TRP C 1 81 ? 10.108 50.916 -58.452 1.00 40.31 ? 76 TRP E CA 1 ATOM 5661 C C . TRP C 1 81 ? 9.384 50.506 -57.207 1.00 39.99 ? 76 TRP E C 1 ATOM 5662 O O . TRP C 1 81 ? 8.702 49.479 -57.186 1.00 38.52 ? 76 TRP E O 1 ATOM 5663 C CB . TRP C 1 81 ? 9.454 52.164 -59.045 1.00 42.25 ? 76 TRP E CB 1 ATOM 5664 C CG . TRP C 1 81 ? 8.028 51.981 -59.493 1.00 42.78 ? 76 TRP E CG 1 ATOM 5665 C CD1 . TRP C 1 81 ? 6.917 52.116 -58.746 1.00 39.31 ? 76 TRP E CD1 1 ATOM 5666 C CD2 . TRP C 1 81 ? 7.592 51.653 -60.813 1.00 41.32 ? 76 TRP E CD2 1 ATOM 5667 N NE1 . TRP C 1 81 ? 5.796 51.885 -59.512 1.00 38.32 ? 76 TRP E NE1 1 ATOM 5668 C CE2 . TRP C 1 81 ? 6.191 51.577 -60.783 1.00 38.33 ? 76 TRP E CE2 1 ATOM 5669 C CE3 . TRP C 1 81 ? 8.255 51.401 -62.015 1.00 40.75 ? 76 TRP E CE3 1 ATOM 5670 C CZ2 . TRP C 1 81 ? 5.437 51.264 -61.897 1.00 38.07 ? 76 TRP E CZ2 1 ATOM 5671 C CZ3 . TRP C 1 81 ? 7.483 51.089 -63.138 1.00 44.16 ? 76 TRP E CZ3 1 ATOM 5672 C CH2 . TRP C 1 81 ? 6.095 51.026 -63.063 1.00 40.23 ? 76 TRP E CH2 1 ATOM 5673 N N . SER C 1 82 ? 9.607 51.263 -56.137 1.00 36.82 ? 77 SER E N 1 ATOM 5674 C CA . SER C 1 82 ? 9.123 50.867 -54.835 1.00 34.45 ? 77 SER E CA 1 ATOM 5675 C C . SER C 1 82 ? 7.874 51.669 -54.442 1.00 36.13 ? 77 SER E C 1 ATOM 5676 O O . SER C 1 82 ? 7.066 51.206 -53.620 1.00 37.00 ? 77 SER E O 1 ATOM 5677 C CB . SER C 1 82 ? 10.210 51.096 -53.796 1.00 34.63 ? 77 SER E CB 1 ATOM 5678 O OG . SER C 1 82 ? 10.686 52.421 -53.896 1.00 36.46 ? 77 SER E OG 1 ATOM 5679 N N . TYR C 1 83 ? 7.788 52.901 -54.928 1.00 33.98 ? 78 TYR E N 1 ATOM 5680 C CA . TYR C 1 83 ? 6.607 53.728 -54.708 1.00 34.93 ? 78 TYR E CA 1 ATOM 5681 C C . TYR C 1 83 ? 6.517 54.734 -55.834 1.00 36.29 ? 78 TYR E C 1 ATOM 5682 O O . TYR C 1 83 ? 7.468 54.876 -56.582 1.00 36.58 ? 78 TYR E O 1 ATOM 5683 C CB . TYR C 1 83 ? 6.591 54.401 -53.329 1.00 34.38 ? 78 TYR E CB 1 ATOM 5684 C CG . TYR C 1 83 ? 7.732 55.346 -52.991 1.00 38.60 ? 78 TYR E CG 1 ATOM 5685 C CD1 . TYR C 1 83 ? 8.998 54.880 -52.645 1.00 39.72 ? 78 TYR E CD1 1 ATOM 5686 C CD2 . TYR C 1 83 ? 7.515 56.716 -52.923 1.00 40.97 ? 78 TYR E CD2 1 ATOM 5687 C CE1 . TYR C 1 83 ? 10.030 55.759 -52.325 1.00 37.59 ? 78 TYR E CE1 1 ATOM 5688 C CE2 . TYR C 1 83 ? 8.520 57.585 -52.581 1.00 40.36 ? 78 TYR E CE2 1 ATOM 5689 C CZ . TYR C 1 83 ? 9.783 57.114 -52.300 1.00 39.07 ? 78 TYR E CZ 1 ATOM 5690 O OH . TYR C 1 83 ? 10.767 58.050 -51.977 1.00 45.20 ? 78 TYR E OH 1 ATOM 5691 N N . ILE C 1 84 ? 5.359 55.357 -56.008 1.00 35.74 ? 79 ILE E N 1 ATOM 5692 C CA . ILE C 1 84 ? 5.203 56.399 -56.992 1.00 37.55 ? 79 ILE E CA 1 ATOM 5693 C C . ILE C 1 84 ? 5.038 57.755 -56.303 1.00 40.75 ? 79 ILE E C 1 ATOM 5694 O O . ILE C 1 84 ? 4.316 57.865 -55.307 1.00 40.09 ? 79 ILE E O 1 ATOM 5695 C CB . ILE C 1 84 ? 3.949 56.173 -57.865 1.00 40.58 ? 79 ILE E CB 1 ATOM 5696 C CG1 . ILE C 1 84 ? 4.054 54.847 -58.615 1.00 43.70 ? 79 ILE E CG1 1 ATOM 5697 C CG2 . ILE C 1 84 ? 3.757 57.339 -58.832 1.00 39.18 ? 79 ILE E CG2 1 ATOM 5698 C CD1 . ILE C 1 84 ? 2.961 54.587 -59.623 1.00 44.50 ? 79 ILE E CD1 1 ATOM 5699 N N . VAL C 1 85 ? 5.696 58.783 -56.846 1.00 40.93 ? 80 VAL E N 1 ATOM 5700 C CA . VAL C 1 85 ? 5.578 60.155 -56.343 1.00 39.91 ? 80 VAL E CA 1 ATOM 5701 C C . VAL C 1 85 ? 4.929 60.985 -57.410 1.00 40.31 ? 80 VAL E C 1 ATOM 5702 O O . VAL C 1 85 ? 5.432 61.027 -58.500 1.00 47.34 ? 80 VAL E O 1 ATOM 5703 C CB . VAL C 1 85 ? 6.956 60.758 -56.047 1.00 43.37 ? 80 VAL E CB 1 ATOM 5704 C CG1 . VAL C 1 85 ? 6.851 62.224 -55.615 1.00 43.59 ? 80 VAL E CG1 1 ATOM 5705 C CG2 . VAL C 1 85 ? 7.678 59.945 -54.987 1.00 45.08 ? 80 VAL E CG2 1 ATOM 5706 N N . GLU C 1 86 ? 3.823 61.620 -57.067 1.00 38.37 ? 81 GLU E N 1 ATOM 5707 C CA . GLU C 1 86 ? 3.100 62.534 -57.903 1.00 40.82 ? 81 GLU E CA 1 ATOM 5708 C C . GLU C 1 86 ? 3.141 63.901 -57.205 1.00 44.89 ? 81 GLU E C 1 ATOM 5709 O O . GLU C 1 86 ? 3.109 63.977 -55.977 1.00 47.26 ? 81 GLU E O 1 ATOM 5710 C CB . GLU C 1 86 ? 1.617 62.102 -57.996 1.00 42.60 ? 81 GLU E CB 1 ATOM 5711 C CG . GLU C 1 86 ? 1.149 61.520 -59.322 1.00 44.06 ? 81 GLU E CG 1 ATOM 5712 C CD . GLU C 1 86 ? -0.323 61.138 -59.357 1.00 45.97 ? 81 GLU E CD 1 ATOM 5713 O OE1 . GLU C 1 86 ? -1.085 61.354 -58.404 1.00 45.50 ? 81 GLU E OE1 1 ATOM 5714 O OE2 . GLU C 1 86 ? -0.754 60.655 -60.407 1.00 51.36 ? 81 GLU E OE2 1 ATOM 5715 N N . ARG C 1 87 ? 3.105 64.978 -57.962 1.00 46.03 ? 82 ARG E N 1 ATOM 5716 C CA . ARG C 1 87 ? 2.838 66.306 -57.377 1.00 53.71 ? 82 ARG E CA 1 ATOM 5717 C C . ARG C 1 87 ? 1.386 66.441 -56.982 1.00 53.45 ? 82 ARG E C 1 ATOM 5718 O O . ARG C 1 87 ? 0.543 65.674 -57.439 1.00 57.51 ? 82 ARG E O 1 ATOM 5719 C CB . ARG C 1 87 ? 3.223 67.393 -58.359 1.00 59.32 ? 82 ARG E CB 1 ATOM 5720 C CG . ARG C 1 87 ? 4.730 67.469 -58.462 1.00 65.31 ? 82 ARG E CG 1 ATOM 5721 C CD . ARG C 1 87 ? 5.214 68.515 -59.431 1.00 78.46 ? 82 ARG E CD 1 ATOM 5722 N NE . ARG C 1 87 ? 6.686 68.579 -59.403 1.00 88.42 ? 82 ARG E NE 1 ATOM 5723 C CZ . ARG C 1 87 ? 7.431 69.291 -60.243 1.00 91.25 ? 82 ARG E CZ 1 ATOM 5724 N NH1 . ARG C 1 87 ? 6.859 69.964 -61.249 1.00 92.15 ? 82 ARG E NH1 1 ATOM 5725 N NH2 . ARG C 1 87 ? 8.752 69.305 -60.092 1.00 91.76 ? 82 ARG E NH2 1 ATOM 5726 N N . ALA C 1 88 ? 1.091 67.379 -56.094 1.00 56.67 ? 83 ALA E N 1 ATOM 5727 C CA . ALA C 1 88 ? -0.289 67.569 -55.635 1.00 60.86 ? 83 ALA E CA 1 ATOM 5728 C C . ALA C 1 88 ? -1.248 67.747 -56.818 1.00 56.53 ? 83 ALA E C 1 ATOM 5729 O O . ALA C 1 88 ? -2.316 67.192 -56.833 1.00 54.73 ? 83 ALA E O 1 ATOM 5730 C CB . ALA C 1 88 ? -0.380 68.752 -54.683 1.00 62.36 ? 83 ALA E CB 1 ATOM 5731 N N . ASN C 1 89 ? -0.828 68.524 -57.798 1.00 58.27 ? 84 ASN E N 1 ATOM 5732 C CA . ASN C 1 89 ? -1.607 68.756 -58.993 1.00 61.08 ? 84 ASN E CA 1 ATOM 5733 C C . ASN C 1 89 ? -0.750 68.647 -60.213 1.00 61.29 ? 84 ASN E C 1 ATOM 5734 O O . ASN C 1 89 ? -0.234 69.645 -60.688 1.00 67.15 ? 84 ASN E O 1 ATOM 5735 C CB . ASN C 1 89 ? -2.255 70.120 -58.958 1.00 60.94 ? 84 ASN E CB 1 ATOM 5736 C CG . ASN C 1 89 ? -3.332 70.177 -57.932 1.00 65.30 ? 84 ASN E CG 1 ATOM 5737 O OD1 . ASN C 1 89 ? -4.398 69.560 -58.091 1.00 70.31 ? 84 ASN E OD1 1 ATOM 5738 N ND2 . ASN C 1 89 ? -3.042 70.843 -56.817 1.00 65.13 ? 84 ASN E ND2 1 ATOM 5739 N N . PRO C 1 90 ? -0.617 67.426 -60.732 1.00 59.05 ? 85 PRO E N 1 ATOM 5740 C CA . PRO C 1 90 ? 0.114 67.300 -61.961 1.00 60.06 ? 85 PRO E CA 1 ATOM 5741 C C . PRO C 1 90 ? -0.603 68.117 -63.008 1.00 59.74 ? 85 PRO E C 1 ATOM 5742 O O . PRO C 1 90 ? -1.828 68.132 -63.048 1.00 62.01 ? 85 PRO E O 1 ATOM 5743 C CB . PRO C 1 90 ? 0.044 65.797 -62.278 1.00 59.99 ? 85 PRO E CB 1 ATOM 5744 C CG . PRO C 1 90 ? -0.423 65.135 -61.018 1.00 60.46 ? 85 PRO E CG 1 ATOM 5745 C CD . PRO C 1 90 ? -1.199 66.159 -60.267 1.00 56.24 ? 85 PRO E CD 1 ATOM 5746 N N . ALA C 1 91 ? 0.168 68.763 -63.859 1.00 63.17 ? 86 ALA E N 1 ATOM 5747 C CA . ALA C 1 91 ? -0.375 69.588 -64.927 1.00 67.10 ? 86 ALA E CA 1 ATOM 5748 C C . ALA C 1 91 ? -0.803 68.724 -66.100 1.00 61.15 ? 86 ALA E C 1 ATOM 5749 O O . ALA C 1 91 ? -1.725 69.073 -66.831 1.00 63.15 ? 86 ALA E O 1 ATOM 5750 C CB . ALA C 1 91 ? 0.670 70.597 -65.386 1.00 72.44 ? 86 ALA E CB 1 ATOM 5751 N N . ASN C 1 92 ? -0.107 67.616 -66.310 1.00 53.87 ? 87 ASN E N 1 ATOM 5752 C CA . ASN C 1 92 ? -0.392 66.767 -67.464 1.00 57.85 ? 87 ASN E CA 1 ATOM 5753 C C . ASN C 1 92 ? -1.090 65.436 -67.096 1.00 56.42 ? 87 ASN E C 1 ATOM 5754 O O . ASN C 1 92 ? -0.517 64.569 -66.444 1.00 55.37 ? 87 ASN E O 1 ATOM 5755 C CB . ASN C 1 92 ? 0.890 66.522 -68.236 1.00 55.29 ? 87 ASN E CB 1 ATOM 5756 C CG . ASN C 1 92 ? 1.603 67.810 -68.588 1.00 57.41 ? 87 ASN E CG 1 ATOM 5757 O OD1 . ASN C 1 92 ? 2.756 67.996 -68.232 1.00 56.19 ? 87 ASN E OD1 1 ATOM 5758 N ND2 . ASN C 1 92 ? 0.928 68.690 -69.320 1.00 52.40 ? 87 ASN E ND2 1 ATOM 5759 N N . ASP C 1 93 ? -2.335 65.317 -67.525 1.00 55.53 ? 88 ASP E N 1 ATOM 5760 C CA . ASP C 1 93 ? -3.188 64.236 -67.099 1.00 55.56 ? 88 ASP E CA 1 ATOM 5761 C C . ASP C 1 93 ? -3.955 63.733 -68.342 1.00 52.07 ? 88 ASP E C 1 ATOM 5762 O O . ASP C 1 93 ? -3.318 63.191 -69.256 1.00 51.29 ? 88 ASP E O 1 ATOM 5763 C CB . ASP C 1 93 ? -4.045 64.716 -65.922 1.00 57.40 ? 88 ASP E CB 1 ATOM 5764 C CG . ASP C 1 93 ? -4.997 63.651 -65.387 1.00 58.46 ? 88 ASP E CG 1 ATOM 5765 O OD1 . ASP C 1 93 ? -4.558 62.553 -65.002 1.00 57.47 ? 88 ASP E OD1 1 ATOM 5766 O OD2 . ASP C 1 93 ? -6.217 63.926 -65.389 1.00 73.18 ? 88 ASP E OD2 1 ATOM 5767 N N . LEU C 1 94 ? -5.274 63.878 -68.425 1.00 48.07 ? 89 LEU E N 1 ATOM 5768 C CA . LEU C 1 94 ? -5.960 63.414 -69.617 1.00 48.06 ? 89 LEU E CA 1 ATOM 5769 C C . LEU C 1 94 ? -6.103 64.605 -70.520 1.00 49.41 ? 89 LEU E C 1 ATOM 5770 O O . LEU C 1 94 ? -7.023 65.402 -70.367 1.00 55.31 ? 89 LEU E O 1 ATOM 5771 C CB . LEU C 1 94 ? -7.313 62.804 -69.293 1.00 50.82 ? 89 LEU E CB 1 ATOM 5772 C CG . LEU C 1 94 ? -7.275 61.549 -68.437 1.00 48.42 ? 89 LEU E CG 1 ATOM 5773 C CD1 . LEU C 1 94 ? -8.684 61.205 -67.994 1.00 48.95 ? 89 LEU E CD1 1 ATOM 5774 C CD2 . LEU C 1 94 ? -6.650 60.393 -69.178 1.00 47.79 ? 89 LEU E CD2 1 ATOM 5775 N N . CYS C 1 95 ? -5.158 64.736 -71.448 1.00 49.65 ? 90 CYS E N 1 ATOM 5776 C CA . CYS C 1 95 ? -5.088 65.902 -72.312 1.00 48.96 ? 90 CYS E CA 1 ATOM 5777 C C . CYS C 1 95 ? -6.406 65.989 -73.087 1.00 43.29 ? 90 CYS E C 1 ATOM 5778 O O . CYS C 1 95 ? -7.049 67.013 -73.111 1.00 45.83 ? 90 CYS E O 1 ATOM 5779 C CB . CYS C 1 95 ? -3.837 65.867 -73.217 1.00 47.09 ? 90 CYS E CB 1 ATOM 5780 S SG . CYS C 1 95 ? -3.608 64.376 -74.232 1.00 51.87 ? 90 CYS E SG 1 ATOM 5781 N N . TYR C 1 96 ? -6.816 64.886 -73.672 1.00 45.21 ? 91 TYR E N 1 ATOM 5782 C CA . TYR C 1 96 ? -8.159 64.784 -74.223 1.00 47.37 ? 91 TYR E CA 1 ATOM 5783 C C . TYR C 1 96 ? -9.044 64.367 -73.055 1.00 47.52 ? 91 TYR E C 1 ATOM 5784 O O . TYR C 1 96 ? -8.812 63.350 -72.433 1.00 44.52 ? 91 TYR E O 1 ATOM 5785 C CB . TYR C 1 96 ? -8.247 63.777 -75.370 1.00 47.35 ? 91 TYR E CB 1 ATOM 5786 C CG . TYR C 1 96 ? -9.471 64.023 -76.222 1.00 49.41 ? 91 TYR E CG 1 ATOM 5787 C CD1 . TYR C 1 96 ? -9.394 64.717 -77.415 1.00 50.26 ? 91 TYR E CD1 1 ATOM 5788 C CD2 . TYR C 1 96 ? -10.720 63.593 -75.796 1.00 51.70 ? 91 TYR E CD2 1 ATOM 5789 C CE1 . TYR C 1 96 ? -10.539 64.960 -78.171 1.00 53.54 ? 91 TYR E CE1 1 ATOM 5790 C CE2 . TYR C 1 96 ? -11.863 63.825 -76.529 1.00 53.74 ? 91 TYR E CE2 1 ATOM 5791 C CZ . TYR C 1 96 ? -11.778 64.504 -77.710 1.00 53.29 ? 91 TYR E CZ 1 ATOM 5792 O OH . TYR C 1 96 ? -12.930 64.699 -78.405 1.00 53.66 ? 91 TYR E OH 1 ATOM 5793 N N . PRO C 1 97 ? -10.049 65.176 -72.722 1.00 50.19 ? 92 PRO E N 1 ATOM 5794 C CA . PRO C 1 97 ? -10.776 64.961 -71.463 1.00 47.24 ? 92 PRO E CA 1 ATOM 5795 C C . PRO C 1 97 ? -11.624 63.706 -71.439 1.00 46.73 ? 92 PRO E C 1 ATOM 5796 O O . PRO C 1 97 ? -12.033 63.195 -72.501 1.00 42.14 ? 92 PRO E O 1 ATOM 5797 C CB . PRO C 1 97 ? -11.675 66.186 -71.375 1.00 49.32 ? 92 PRO E CB 1 ATOM 5798 C CG . PRO C 1 97 ? -11.911 66.570 -72.796 1.00 49.64 ? 92 PRO E CG 1 ATOM 5799 C CD . PRO C 1 97 ? -10.603 66.296 -73.497 1.00 50.44 ? 92 PRO E CD 1 ATOM 5800 N N . GLY C 1 98 ? -11.876 63.203 -70.229 1.00 43.26 ? 93 GLY E N 1 ATOM 5801 C CA . GLY C 1 98 ? -12.660 61.978 -70.067 1.00 43.05 ? 93 GLY E CA 1 ATOM 5802 C C . GLY C 1 98 ? -12.412 61.270 -68.755 1.00 43.75 ? 93 GLY E C 1 ATOM 5803 O O . GLY C 1 98 ? -12.380 61.911 -67.702 1.00 41.25 ? 93 GLY E O 1 ATOM 5804 N N . ASN C 1 99 ? -12.224 59.949 -68.821 1.00 40.33 ? 94 ASN E N 1 ATOM 5805 C CA . ASN C 1 99 ? -11.971 59.148 -67.629 1.00 42.29 ? 94 ASN E CA 1 ATOM 5806 C C . ASN C 1 99 ? -11.043 57.976 -67.893 1.00 39.17 ? 94 ASN E C 1 ATOM 5807 O O . ASN C 1 99 ? -10.930 57.510 -69.010 1.00 35.70 ? 94 ASN E O 1 ATOM 5808 C CB . ASN C 1 99 ? -13.282 58.558 -67.074 1.00 44.38 ? 94 ASN E CB 1 ATOM 5809 C CG . ASN C 1 99 ? -14.294 59.621 -66.695 1.00 44.57 ? 94 ASN E CG 1 ATOM 5810 O OD1 . ASN C 1 99 ? -15.299 59.851 -67.402 1.00 45.12 ? 94 ASN E OD1 1 ATOM 5811 N ND2 . ASN C 1 99 ? -14.027 60.290 -65.582 1.00 41.66 ? 94 ASN E ND2 1 ATOM 5812 N N . LEU C 1 100 ? -10.449 57.489 -66.812 1.00 35.89 ? 95 LEU E N 1 ATOM 5813 C CA . LEU C 1 100 ? -9.815 56.208 -66.778 1.00 35.04 ? 95 LEU E CA 1 ATOM 5814 C C . LEU C 1 100 ? -10.571 55.430 -65.729 1.00 36.51 ? 95 LEU E C 1 ATOM 5815 O O . LEU C 1 100 ? -10.551 55.782 -64.535 1.00 30.68 ? 95 LEU E O 1 ATOM 5816 C CB . LEU C 1 100 ? -8.390 56.332 -66.326 1.00 35.81 ? 95 LEU E CB 1 ATOM 5817 C CG . LEU C 1 100 ? -7.357 55.441 -66.932 1.00 39.69 ? 95 LEU E CG 1 ATOM 5818 C CD1 . LEU C 1 100 ? -6.071 55.519 -66.128 1.00 43.21 ? 95 LEU E CD1 1 ATOM 5819 C CD2 . LEU C 1 100 ? -7.825 54.033 -67.006 1.00 41.52 ? 95 LEU E CD2 1 ATOM 5820 N N . ASN C 1 101 ? -11.176 54.328 -66.164 1.00 35.59 ? 96 ASN E N 1 ATOM 5821 C CA . ASN C 1 101 ? -11.944 53.503 -65.278 1.00 33.92 ? 96 ASN E CA 1 ATOM 5822 C C . ASN C 1 101 ? -11.092 52.886 -64.160 1.00 34.46 ? 96 ASN E C 1 ATOM 5823 O O . ASN C 1 101 ? -9.959 52.495 -64.359 1.00 31.92 ? 96 ASN E O 1 ATOM 5824 C CB . ASN C 1 101 ? -12.638 52.421 -66.076 1.00 35.21 ? 96 ASN E CB 1 ATOM 5825 C CG . ASN C 1 101 ? -13.777 51.807 -65.324 1.00 38.63 ? 96 ASN E CG 1 ATOM 5826 O OD1 . ASN C 1 101 ? -14.671 52.516 -64.845 1.00 37.55 ? 96 ASN E OD1 1 ATOM 5827 N ND2 . ASN C 1 101 ? -13.740 50.482 -65.167 1.00 37.22 ? 96 ASN E ND2 1 ATOM 5828 N N . ASP C 1 102 ? -11.672 52.775 -62.973 1.00 33.61 ? 97 ASP E N 1 ATOM 5829 C CA . ASP C 1 102 ? -10.984 52.191 -61.827 1.00 34.93 ? 97 ASP E CA 1 ATOM 5830 C C . ASP C 1 102 ? -9.606 52.773 -61.636 1.00 32.49 ? 97 ASP E C 1 ATOM 5831 O O . ASP C 1 102 ? -8.645 52.064 -61.301 1.00 31.76 ? 97 ASP E O 1 ATOM 5832 C CB . ASP C 1 102 ? -10.898 50.651 -61.958 1.00 39.89 ? 97 ASP E CB 1 ATOM 5833 C CG . ASP C 1 102 ? -12.201 49.957 -61.600 1.00 41.34 ? 97 ASP E CG 1 ATOM 5834 O OD1 . ASP C 1 102 ? -12.942 50.481 -60.755 1.00 51.20 ? 97 ASP E OD1 1 ATOM 5835 O OD2 . ASP C 1 102 ? -12.515 48.904 -62.177 1.00 48.81 ? 97 ASP E OD2 1 ATOM 5836 N N . TYR C 1 103 ? -9.516 54.076 -61.791 1.00 30.88 ? 98 TYR E N 1 ATOM 5837 C CA . TYR C 1 103 ? -8.214 54.722 -61.815 1.00 31.42 ? 98 TYR E CA 1 ATOM 5838 C C . TYR C 1 103 ? -7.485 54.511 -60.517 1.00 31.69 ? 98 TYR E C 1 ATOM 5839 O O . TYR C 1 103 ? -6.266 54.208 -60.516 1.00 30.11 ? 98 TYR E O 1 ATOM 5840 C CB . TYR C 1 103 ? -8.359 56.196 -62.049 1.00 33.32 ? 98 TYR E CB 1 ATOM 5841 C CG . TYR C 1 103 ? -7.094 57.009 -62.186 1.00 35.29 ? 98 TYR E CG 1 ATOM 5842 C CD1 . TYR C 1 103 ? -5.965 56.502 -62.800 1.00 36.63 ? 98 TYR E CD1 1 ATOM 5843 C CD2 . TYR C 1 103 ? -7.079 58.351 -61.776 1.00 37.27 ? 98 TYR E CD2 1 ATOM 5844 C CE1 . TYR C 1 103 ? -4.821 57.280 -62.950 1.00 35.76 ? 98 TYR E CE1 1 ATOM 5845 C CE2 . TYR C 1 103 ? -5.963 59.132 -61.920 1.00 38.27 ? 98 TYR E CE2 1 ATOM 5846 C CZ . TYR C 1 103 ? -4.838 58.600 -62.512 1.00 39.21 ? 98 TYR E CZ 1 ATOM 5847 O OH . TYR C 1 103 ? -3.741 59.412 -62.614 1.00 40.18 ? 98 TYR E OH 1 ATOM 5848 N N . GLU C 1 104 ? -8.208 54.629 -59.401 1.00 29.89 ? 99 GLU E N 1 ATOM 5849 C CA . GLU C 1 104 ? -7.524 54.576 -58.087 1.00 30.51 ? 99 GLU E CA 1 ATOM 5850 C C . GLU C 1 104 ? -6.985 53.186 -57.782 1.00 29.45 ? 99 GLU E C 1 ATOM 5851 O O . GLU C 1 104 ? -5.904 53.054 -57.198 1.00 27.23 ? 99 GLU E O 1 ATOM 5852 C CB . GLU C 1 104 ? -8.400 55.058 -56.965 1.00 33.12 ? 99 GLU E CB 1 ATOM 5853 C CG . GLU C 1 104 ? -8.850 56.528 -57.115 1.00 39.19 ? 99 GLU E CG 1 ATOM 5854 C CD . GLU C 1 104 ? -10.032 56.744 -58.099 1.00 40.87 ? 99 GLU E CD 1 ATOM 5855 O OE1 . GLU C 1 104 ? -10.713 55.793 -58.497 1.00 42.93 ? 99 GLU E OE1 1 ATOM 5856 O OE2 . GLU C 1 104 ? -10.279 57.897 -58.495 1.00 59.00 ? 99 GLU E OE2 1 ATOM 5857 N N . GLU C 1 105 ? -7.714 52.151 -58.218 1.00 28.27 ? 100 GLU E N 1 ATOM 5858 C CA . GLU C 1 105 ? -7.267 50.769 -58.018 1.00 27.93 ? 100 GLU E CA 1 ATOM 5859 C C . GLU C 1 105 ? -6.095 50.484 -58.931 1.00 27.25 ? 100 GLU E C 1 ATOM 5860 O O . GLU C 1 105 ? -5.154 49.829 -58.554 1.00 24.75 ? 100 GLU E O 1 ATOM 5861 C CB . GLU C 1 105 ? -8.425 49.788 -58.277 1.00 29.66 ? 100 GLU E CB 1 ATOM 5862 C CG . GLU C 1 105 ? -9.445 49.707 -57.124 1.00 29.10 ? 100 GLU E CG 1 ATOM 5863 C CD . GLU C 1 105 ? -8.895 48.993 -55.871 1.00 29.03 ? 100 GLU E CD 1 ATOM 5864 O OE1 . GLU C 1 105 ? -8.190 47.935 -55.981 1.00 29.80 ? 100 GLU E OE1 1 ATOM 5865 O OE2 . GLU C 1 105 ? -9.116 49.523 -54.767 1.00 26.14 ? 100 GLU E OE2 1 ATOM 5866 N N . LEU C 1 106 ? -6.141 51.019 -60.144 1.00 28.26 ? 101 LEU E N 1 ATOM 5867 C CA . LEU C 1 106 ? -4.987 50.887 -61.035 1.00 29.32 ? 101 LEU E CA 1 ATOM 5868 C C . LEU C 1 106 ? -3.731 51.508 -60.410 1.00 30.54 ? 101 LEU E C 1 ATOM 5869 O O . LEU C 1 106 ? -2.633 50.942 -60.470 1.00 33.09 ? 101 LEU E O 1 ATOM 5870 C CB . LEU C 1 106 ? -5.293 51.548 -62.386 1.00 31.97 ? 101 LEU E CB 1 ATOM 5871 C CG . LEU C 1 106 ? -4.169 51.538 -63.427 1.00 30.94 ? 101 LEU E CG 1 ATOM 5872 C CD1 . LEU C 1 106 ? -3.763 50.135 -63.717 1.00 33.38 ? 101 LEU E CD1 1 ATOM 5873 C CD2 . LEU C 1 106 ? -4.675 52.168 -64.710 1.00 31.89 ? 101 LEU E CD2 1 ATOM 5874 N N . LYS C 1 107 ? -3.866 52.704 -59.851 1.00 31.56 ? 102 LYS E N 1 ATOM 5875 C CA . LYS C 1 107 ? -2.712 53.374 -59.278 1.00 34.25 ? 102 LYS E CA 1 ATOM 5876 C C . LYS C 1 107 ? -2.183 52.564 -58.150 1.00 36.02 ? 102 LYS E C 1 ATOM 5877 O O . LYS C 1 107 ? -0.970 52.508 -57.919 1.00 35.08 ? 102 LYS E O 1 ATOM 5878 C CB . LYS C 1 107 ? -3.060 54.774 -58.795 1.00 38.33 ? 102 LYS E CB 1 ATOM 5879 C CG . LYS C 1 107 ? -3.211 55.740 -59.955 1.00 40.76 ? 102 LYS E CG 1 ATOM 5880 C CD . LYS C 1 107 ? -3.167 57.162 -59.518 1.00 44.58 ? 102 LYS E CD 1 ATOM 5881 C CE . LYS C 1 107 ? -4.492 57.641 -58.944 1.00 48.72 ? 102 LYS E CE 1 ATOM 5882 N NZ . LYS C 1 107 ? -4.258 59.002 -58.369 1.00 54.80 ? 102 LYS E NZ 1 ATOM 5883 N N . HIS C 1 108 ? -3.108 51.970 -57.413 1.00 36.09 ? 103 HIS E N 1 ATOM 5884 C CA . HIS C 1 108 ? -2.719 51.149 -56.278 1.00 36.60 ? 103 HIS E CA 1 ATOM 5885 C C . HIS C 1 108 ? -1.990 49.889 -56.715 1.00 33.10 ? 103 HIS E C 1 ATOM 5886 O O . HIS C 1 108 ? -0.981 49.498 -56.118 1.00 35.30 ? 103 HIS E O 1 ATOM 5887 C CB . HIS C 1 108 ? -3.910 50.762 -55.447 1.00 33.67 ? 103 HIS E CB 1 ATOM 5888 C CG . HIS C 1 108 ? -3.520 50.299 -54.096 1.00 33.26 ? 103 HIS E CG 1 ATOM 5889 N ND1 . HIS C 1 108 ? -3.451 48.966 -53.765 1.00 35.16 ? 103 HIS E ND1 1 ATOM 5890 C CD2 . HIS C 1 108 ? -3.078 50.979 -53.020 1.00 31.22 ? 103 HIS E CD2 1 ATOM 5891 C CE1 . HIS C 1 108 ? -3.109 48.857 -52.498 1.00 31.23 ? 103 HIS E CE1 1 ATOM 5892 N NE2 . HIS C 1 108 ? -2.842 50.059 -52.037 1.00 31.62 ? 103 HIS E NE2 1 ATOM 5893 N N . LEU C 1 109 ? -2.486 49.291 -57.772 1.00 32.67 ? 104 LEU E N 1 ATOM 5894 C CA . LEU C 1 109 ? -1.787 48.192 -58.427 1.00 36.30 ? 104 LEU E CA 1 ATOM 5895 C C . LEU C 1 109 ? -0.363 48.604 -58.889 1.00 36.84 ? 104 LEU E C 1 ATOM 5896 O O . LEU C 1 109 ? 0.617 47.882 -58.679 1.00 39.53 ? 104 LEU E O 1 ATOM 5897 C CB . LEU C 1 109 ? -2.587 47.756 -59.632 1.00 38.12 ? 104 LEU E CB 1 ATOM 5898 C CG . LEU C 1 109 ? -2.531 46.338 -60.198 1.00 40.40 ? 104 LEU E CG 1 ATOM 5899 C CD1 . LEU C 1 109 ? -2.379 46.346 -61.709 1.00 40.18 ? 104 LEU E CD1 1 ATOM 5900 C CD2 . LEU C 1 109 ? -1.494 45.446 -59.589 1.00 44.05 ? 104 LEU E CD2 1 ATOM 5901 N N . LEU C 1 110 ? -0.243 49.771 -59.490 1.00 36.29 ? 105 LEU E N 1 ATOM 5902 C CA . LEU C 1 110 ? 1.067 50.205 -60.015 1.00 40.21 ? 105 LEU E CA 1 ATOM 5903 C C . LEU C 1 110 ? 1.960 50.897 -58.971 1.00 36.57 ? 105 LEU E C 1 ATOM 5904 O O . LEU C 1 110 ? 3.077 51.266 -59.284 1.00 39.02 ? 105 LEU E O 1 ATOM 5905 C CB . LEU C 1 110 ? 0.872 51.207 -61.153 1.00 40.64 ? 105 LEU E CB 1 ATOM 5906 C CG . LEU C 1 110 ? 0.149 50.657 -62.367 1.00 40.22 ? 105 LEU E CG 1 ATOM 5907 C CD1 . LEU C 1 110 ? -0.244 51.751 -63.321 1.00 43.18 ? 105 LEU E CD1 1 ATOM 5908 C CD2 . LEU C 1 110 ? 1.041 49.677 -63.080 1.00 39.83 ? 105 LEU E CD2 1 ATOM 5909 N N . SER C 1 111 ? 1.512 51.008 -57.731 1.00 34.22 ? 106 SER E N 1 ATOM 5910 C CA . SER C 1 111 ? 2.265 51.772 -56.769 1.00 33.25 ? 106 SER E CA 1 ATOM 5911 C C . SER C 1 111 ? 3.677 51.169 -56.587 1.00 35.18 ? 106 SER E C 1 ATOM 5912 O O . SER C 1 111 ? 4.676 51.870 -56.526 1.00 37.83 ? 106 SER E O 1 ATOM 5913 C CB . SER C 1 111 ? 1.518 51.839 -55.472 1.00 30.94 ? 106 SER E CB 1 ATOM 5914 O OG . SER C 1 111 ? 1.447 50.565 -54.870 1.00 33.52 ? 106 SER E OG 1 ATOM 5915 N N . ARG C 1 112 ? 3.742 49.860 -56.515 1.00 36.85 ? 107 ARG E N 1 ATOM 5916 C CA . ARG C 1 112 ? 5.000 49.128 -56.475 1.00 37.33 ? 107 ARG E CA 1 ATOM 5917 C C . ARG C 1 112 ? 5.005 47.962 -57.465 1.00 37.38 ? 107 ARG E C 1 ATOM 5918 O O . ARG C 1 112 ? 4.143 47.099 -57.432 1.00 40.32 ? 107 ARG E O 1 ATOM 5919 C CB . ARG C 1 112 ? 5.266 48.589 -55.075 1.00 40.51 ? 107 ARG E CB 1 ATOM 5920 C CG . ARG C 1 112 ? 6.525 47.727 -55.002 1.00 42.23 ? 107 ARG E CG 1 ATOM 5921 C CD . ARG C 1 112 ? 6.563 46.904 -53.746 1.00 48.41 ? 107 ARG E CD 1 ATOM 5922 N NE . ARG C 1 112 ? 7.401 47.472 -52.712 1.00 64.60 ? 107 ARG E NE 1 ATOM 5923 C CZ . ARG C 1 112 ? 7.334 47.145 -51.423 1.00 82.91 ? 107 ARG E CZ 1 ATOM 5924 N NH1 . ARG C 1 112 ? 6.425 46.271 -50.980 1.00 73.33 ? 107 ARG E NH1 1 ATOM 5925 N NH2 . ARG C 1 112 ? 8.174 47.727 -50.572 1.00 98.14 ? 107 ARG E NH2 1 ATOM 5926 N N . ILE C 1 113 ? 6.051 47.911 -58.277 1.00 38.27 ? 108 ILE E N 1 ATOM 5927 C CA . ILE C 1 113 ? 6.128 47.027 -59.420 1.00 40.03 ? 108 ILE E CA 1 ATOM 5928 C C . ILE C 1 113 ? 7.554 46.461 -59.512 1.00 44.53 ? 108 ILE E C 1 ATOM 5929 O O . ILE C 1 113 ? 8.545 47.191 -59.430 1.00 49.59 ? 108 ILE E O 1 ATOM 5930 C CB . ILE C 1 113 ? 5.713 47.770 -60.724 1.00 38.13 ? 108 ILE E CB 1 ATOM 5931 C CG1 . ILE C 1 113 ? 4.221 48.047 -60.716 1.00 41.94 ? 108 ILE E CG1 1 ATOM 5932 C CG2 . ILE C 1 113 ? 6.006 46.943 -61.951 1.00 42.16 ? 108 ILE E CG2 1 ATOM 5933 C CD1 . ILE C 1 113 ? 3.297 46.824 -60.834 1.00 40.09 ? 108 ILE E CD1 1 ATOM 5934 N N . ASN C 1 114 ? 7.626 45.154 -59.688 1.00 45.95 ? 109 ASN E N 1 ATOM 5935 C CA . ASN C 1 114 ? 8.876 44.429 -59.657 1.00 45.09 ? 109 ASN E CA 1 ATOM 5936 C C . ASN C 1 114 ? 9.502 44.422 -61.051 1.00 45.99 ? 109 ASN E C 1 ATOM 5937 O O . ASN C 1 114 ? 10.717 44.478 -61.162 1.00 43.48 ? 109 ASN E O 1 ATOM 5938 C CB . ASN C 1 114 ? 8.631 43.012 -59.115 1.00 48.91 ? 109 ASN E CB 1 ATOM 5939 C CG . ASN C 1 114 ? 9.878 42.137 -59.129 1.00 54.21 ? 109 ASN E CG 1 ATOM 5940 O OD1 . ASN C 1 114 ? 9.959 41.133 -59.858 1.00 53.20 ? 109 ASN E OD1 1 ATOM 5941 N ND2 . ASN C 1 114 ? 10.862 42.520 -58.339 1.00 56.87 ? 109 ASN E ND2 1 ATOM 5942 N N . HIS C 1 115 ? 8.679 44.330 -62.100 1.00 41.62 ? 110 HIS E N 1 ATOM 5943 C CA . HIS C 1 115 ? 9.152 44.429 -63.471 1.00 42.37 ? 110 HIS E CA 1 ATOM 5944 C C . HIS C 1 115 ? 8.094 45.102 -64.336 1.00 45.60 ? 110 HIS E C 1 ATOM 5945 O O . HIS C 1 115 ? 6.948 44.686 -64.308 1.00 46.81 ? 110 HIS E O 1 ATOM 5946 C CB . HIS C 1 115 ? 9.504 43.058 -64.099 1.00 43.00 ? 110 HIS E CB 1 ATOM 5947 C CG . HIS C 1 115 ? 9.997 43.156 -65.506 1.00 49.77 ? 110 HIS E CG 1 ATOM 5948 N ND1 . HIS C 1 115 ? 11.230 43.686 -65.826 1.00 57.89 ? 110 HIS E ND1 1 ATOM 5949 C CD2 . HIS C 1 115 ? 9.408 42.845 -66.685 1.00 56.65 ? 110 HIS E CD2 1 ATOM 5950 C CE1 . HIS C 1 115 ? 11.394 43.654 -67.139 1.00 61.64 ? 110 HIS E CE1 1 ATOM 5951 N NE2 . HIS C 1 115 ? 10.304 43.142 -67.684 1.00 58.25 ? 110 HIS E NE2 1 ATOM 5952 N N . PHE C 1 116 ? 8.510 46.095 -65.131 1.00 45.05 ? 111 PHE E N 1 ATOM 5953 C CA . PHE C 1 116 ? 7.604 46.856 -65.935 1.00 46.89 ? 111 PHE E CA 1 ATOM 5954 C C . PHE C 1 116 ? 8.279 47.099 -67.254 1.00 48.30 ? 111 PHE E C 1 ATOM 5955 O O . PHE C 1 116 ? 9.352 47.662 -67.300 1.00 57.61 ? 111 PHE E O 1 ATOM 5956 C CB . PHE C 1 116 ? 7.274 48.188 -65.252 1.00 47.49 ? 111 PHE E CB 1 ATOM 5957 C CG . PHE C 1 116 ? 6.069 48.897 -65.818 1.00 44.55 ? 111 PHE E CG 1 ATOM 5958 C CD1 . PHE C 1 116 ? 4.800 48.416 -65.604 1.00 47.36 ? 111 PHE E CD1 1 ATOM 5959 C CD2 . PHE C 1 116 ? 6.205 50.064 -66.547 1.00 50.78 ? 111 PHE E CD2 1 ATOM 5960 C CE1 . PHE C 1 116 ? 3.677 49.086 -66.115 1.00 47.70 ? 111 PHE E CE1 1 ATOM 5961 C CE2 . PHE C 1 116 ? 5.097 50.741 -67.072 1.00 49.02 ? 111 PHE E CE2 1 ATOM 5962 C CZ . PHE C 1 116 ? 3.829 50.256 -66.833 1.00 47.40 ? 111 PHE E CZ 1 ATOM 5963 N N . GLU C 1 117 ? 7.653 46.666 -68.338 1.00 47.82 ? 112 GLU E N 1 ATOM 5964 C CA . GLU C 1 117 ? 8.242 46.835 -69.642 1.00 47.23 ? 112 GLU E CA 1 ATOM 5965 C C . GLU C 1 117 ? 7.199 47.135 -70.702 1.00 48.72 ? 112 GLU E C 1 ATOM 5966 O O . GLU C 1 117 ? 6.324 46.322 -70.973 1.00 44.85 ? 112 GLU E O 1 ATOM 5967 C CB . GLU C 1 117 ? 9.011 45.582 -70.036 1.00 50.89 ? 112 GLU E CB 1 ATOM 5968 C CG . GLU C 1 117 ? 9.808 45.745 -71.324 1.00 55.63 ? 112 GLU E CG 1 ATOM 5969 C CD . GLU C 1 117 ? 10.470 44.460 -71.807 1.00 55.92 ? 112 GLU E CD 1 ATOM 5970 O OE1 . GLU C 1 117 ? 10.496 43.457 -71.055 1.00 64.63 ? 112 GLU E OE1 1 ATOM 5971 O OE2 . GLU C 1 117 ? 11.016 44.476 -72.928 1.00 61.00 ? 112 GLU E OE2 1 ATOM 5972 N N . LYS C 1 118 ? 7.325 48.308 -71.300 1.00 49.29 ? 113 LYS E N 1 ATOM 5973 C CA . LYS C 1 118 ? 6.513 48.695 -72.433 1.00 55.48 ? 113 LYS E CA 1 ATOM 5974 C C . LYS C 1 118 ? 6.876 47.902 -73.703 1.00 52.09 ? 113 LYS E C 1 ATOM 5975 O O . LYS C 1 118 ? 8.007 47.857 -74.104 1.00 54.86 ? 113 LYS E O 1 ATOM 5976 C CB . LYS C 1 118 ? 6.644 50.206 -72.701 1.00 56.88 ? 113 LYS E CB 1 ATOM 5977 C CG . LYS C 1 118 ? 5.667 50.702 -73.779 1.00 62.91 ? 113 LYS E CG 1 ATOM 5978 C CD . LYS C 1 118 ? 5.296 52.182 -73.645 1.00 67.28 ? 113 LYS E CD 1 ATOM 5979 C CE . LYS C 1 118 ? 6.376 53.149 -74.134 1.00 70.03 ? 113 LYS E CE 1 ATOM 5980 N NZ . LYS C 1 118 ? 6.191 53.397 -75.576 1.00 71.66 ? 113 LYS E NZ 1 ATOM 5981 N N . ILE C 1 119 ? 5.882 47.274 -74.304 1.00 56.39 ? 114 ILE E N 1 ATOM 5982 C CA . ILE C 1 119 ? 6.038 46.535 -75.527 1.00 53.65 ? 114 ILE E CA 1 ATOM 5983 C C . ILE C 1 119 ? 4.944 46.903 -76.514 1.00 54.01 ? 114 ILE E C 1 ATOM 5984 O O . ILE C 1 119 ? 3.842 47.256 -76.162 1.00 56.05 ? 114 ILE E O 1 ATOM 5985 C CB . ILE C 1 119 ? 5.983 45.008 -75.325 1.00 56.57 ? 114 ILE E CB 1 ATOM 5986 C CG1 . ILE C 1 119 ? 4.686 44.552 -74.662 1.00 56.68 ? 114 ILE E CG1 1 ATOM 5987 C CG2 . ILE C 1 119 ? 7.140 44.538 -74.477 1.00 63.41 ? 114 ILE E CG2 1 ATOM 5988 C CD1 . ILE C 1 119 ? 4.451 43.051 -74.836 1.00 57.77 ? 114 ILE E CD1 1 ATOM 5989 N N . LEU C 1 120 ? 5.271 46.787 -77.781 1.00 56.87 ? 115 LEU E N 1 ATOM 5990 C CA . LEU C 1 120 ? 4.333 47.021 -78.823 1.00 53.77 ? 115 LEU E CA 1 ATOM 5991 C C . LEU C 1 120 ? 3.545 45.732 -78.967 1.00 53.83 ? 115 LEU E C 1 ATOM 5992 O O . LEU C 1 120 ? 4.128 44.672 -79.135 1.00 47.33 ? 115 LEU E O 1 ATOM 5993 C CB . LEU C 1 120 ? 5.065 47.366 -80.119 1.00 59.43 ? 115 LEU E CB 1 ATOM 5994 C CG . LEU C 1 120 ? 4.243 47.805 -81.345 1.00 58.96 ? 115 LEU E CG 1 ATOM 5995 C CD1 . LEU C 1 120 ? 3.401 49.035 -81.085 1.00 54.97 ? 115 LEU E CD1 1 ATOM 5996 C CD2 . LEU C 1 120 ? 5.200 48.096 -82.475 1.00 63.33 ? 115 LEU E CD2 1 ATOM 5997 N N . ILE C 1 121 ? 2.212 45.830 -78.942 1.00 51.53 ? 116 ILE E N 1 ATOM 5998 C CA . ILE C 1 121 ? 1.385 44.651 -79.166 1.00 50.79 ? 116 ILE E CA 1 ATOM 5999 C C . ILE C 1 121 ? 0.510 44.686 -80.426 1.00 49.65 ? 116 ILE E C 1 ATOM 6000 O O . ILE C 1 121 ? 0.183 43.633 -81.010 1.00 48.45 ? 116 ILE E O 1 ATOM 6001 C CB . ILE C 1 121 ? 0.504 44.332 -77.949 1.00 52.11 ? 116 ILE E CB 1 ATOM 6002 C CG1 . ILE C 1 121 ? -0.471 45.470 -77.643 1.00 52.96 ? 116 ILE E CG1 1 ATOM 6003 C CG2 . ILE C 1 121 ? 1.382 44.076 -76.757 1.00 51.81 ? 116 ILE E CG2 1 ATOM 6004 C CD1 . ILE C 1 121 ? -1.675 45.014 -76.842 1.00 53.30 ? 116 ILE E CD1 1 ATOM 6005 N N . ILE C 1 122 ? 0.138 45.869 -80.852 1.00 50.24 ? 117 ILE E N 1 ATOM 6006 C CA . ILE C 1 122 ? -0.597 46.008 -82.100 1.00 55.77 ? 117 ILE E CA 1 ATOM 6007 C C . ILE C 1 122 ? -0.015 47.168 -82.918 1.00 53.69 ? 117 ILE E C 1 ATOM 6008 O O . ILE C 1 122 ? -0.391 48.318 -82.715 1.00 50.66 ? 117 ILE E O 1 ATOM 6009 C CB . ILE C 1 122 ? -2.058 46.283 -81.850 1.00 55.12 ? 117 ILE E CB 1 ATOM 6010 C CG1 . ILE C 1 122 ? -2.649 45.143 -81.035 1.00 60.24 ? 117 ILE E CG1 1 ATOM 6011 C CG2 . ILE C 1 122 ? -2.781 46.452 -83.179 1.00 55.45 ? 117 ILE E CG2 1 ATOM 6012 C CD1 . ILE C 1 122 ? -4.070 45.403 -80.606 1.00 60.43 ? 117 ILE E CD1 1 ATOM 6013 N N . PRO C 1 123 ? 0.876 46.850 -83.872 1.00 54.43 ? 118 PRO E N 1 ATOM 6014 C CA . PRO C 1 123 ? 1.514 47.946 -84.583 1.00 54.47 ? 118 PRO E CA 1 ATOM 6015 C C . PRO C 1 123 ? 0.531 48.795 -85.382 1.00 52.08 ? 118 PRO E C 1 ATOM 6016 O O . PRO C 1 123 ? -0.425 48.270 -85.897 1.00 49.00 ? 118 PRO E O 1 ATOM 6017 C CB . PRO C 1 123 ? 2.526 47.246 -85.504 1.00 57.47 ? 118 PRO E CB 1 ATOM 6018 C CG . PRO C 1 123 ? 2.620 45.837 -85.051 1.00 56.20 ? 118 PRO E CG 1 ATOM 6019 C CD . PRO C 1 123 ? 1.357 45.521 -84.305 1.00 53.53 ? 118 PRO E CD 1 ATOM 6020 N N . LYS C 1 124 ? 0.777 50.103 -85.448 1.00 52.70 ? 119 LYS E N 1 ATOM 6021 C CA . LYS C 1 124 ? -0.028 51.030 -86.244 1.00 54.88 ? 119 LYS E CA 1 ATOM 6022 C C . LYS C 1 124 ? -0.215 50.577 -87.679 1.00 55.58 ? 119 LYS E C 1 ATOM 6023 O O . LYS C 1 124 ? -1.276 50.702 -88.234 1.00 57.59 ? 119 LYS E O 1 ATOM 6024 C CB . LYS C 1 124 ? 0.658 52.380 -86.342 1.00 57.64 ? 119 LYS E CB 1 ATOM 6025 C CG . LYS C 1 124 ? 0.288 53.376 -85.291 1.00 64.19 ? 119 LYS E CG 1 ATOM 6026 C CD . LYS C 1 124 ? 0.454 54.787 -85.822 1.00 70.40 ? 119 LYS E CD 1 ATOM 6027 C CE . LYS C 1 124 ? 0.211 55.803 -84.723 1.00 78.68 ? 119 LYS E CE 1 ATOM 6028 N NZ . LYS C 1 124 ? -0.176 57.120 -85.310 1.00 83.58 ? 119 LYS E NZ 1 ATOM 6029 N N . SER C 1 125 ? 0.852 50.060 -88.269 1.00 60.20 ? 120 SER E N 1 ATOM 6030 C CA . SER C 1 125 ? 0.882 49.708 -89.674 1.00 61.53 ? 120 SER E CA 1 ATOM 6031 C C . SER C 1 125 ? 0.029 48.480 -89.952 1.00 59.86 ? 120 SER E C 1 ATOM 6032 O O . SER C 1 125 ? -0.201 48.143 -91.091 1.00 65.71 ? 120 SER E O 1 ATOM 6033 C CB . SER C 1 125 ? 2.343 49.485 -90.121 1.00 63.47 ? 120 SER E CB 1 ATOM 6034 O OG . SER C 1 125 ? 2.968 48.472 -89.360 1.00 60.16 ? 120 SER E OG 1 ATOM 6035 N N . SER C 1 126 ? -0.486 47.837 -88.910 1.00 60.39 ? 121 SER E N 1 ATOM 6036 C CA . SER C 1 126 ? -1.375 46.685 -89.076 1.00 59.11 ? 121 SER E CA 1 ATOM 6037 C C . SER C 1 126 ? -2.785 47.072 -89.474 1.00 55.76 ? 121 SER E C 1 ATOM 6038 O O . SER C 1 126 ? -3.532 46.241 -89.961 1.00 62.01 ? 121 SER E O 1 ATOM 6039 C CB . SER C 1 126 ? -1.401 45.843 -87.788 1.00 55.57 ? 121 SER E CB 1 ATOM 6040 O OG . SER C 1 126 ? -2.179 46.482 -86.798 1.00 58.65 ? 121 SER E OG 1 ATOM 6041 N N . TRP C 1 127 ? -3.178 48.318 -89.242 1.00 56.52 ? 122 TRP E N 1 ATOM 6042 C CA . TRP C 1 127 ? -4.562 48.759 -89.544 1.00 63.42 ? 122 TRP E CA 1 ATOM 6043 C C . TRP C 1 127 ? -4.690 49.168 -91.031 1.00 64.89 ? 122 TRP E C 1 ATOM 6044 O O . TRP C 1 127 ? -4.556 50.338 -91.374 1.00 74.04 ? 122 TRP E O 1 ATOM 6045 C CB . TRP C 1 127 ? -4.977 49.928 -88.627 1.00 58.89 ? 122 TRP E CB 1 ATOM 6046 C CG . TRP C 1 127 ? -4.923 49.630 -87.162 1.00 59.22 ? 122 TRP E CG 1 ATOM 6047 C CD1 . TRP C 1 127 ? -3.990 50.072 -86.265 1.00 56.44 ? 122 TRP E CD1 1 ATOM 6048 C CD2 . TRP C 1 127 ? -5.841 48.833 -86.419 1.00 59.42 ? 122 TRP E CD2 1 ATOM 6049 N NE1 . TRP C 1 127 ? -4.276 49.605 -85.019 1.00 58.94 ? 122 TRP E NE1 1 ATOM 6050 C CE2 . TRP C 1 127 ? -5.404 48.830 -85.084 1.00 57.95 ? 122 TRP E CE2 1 ATOM 6051 C CE3 . TRP C 1 127 ? -6.996 48.128 -86.745 1.00 57.93 ? 122 TRP E CE3 1 ATOM 6052 C CZ2 . TRP C 1 127 ? -6.089 48.155 -84.070 1.00 52.30 ? 122 TRP E CZ2 1 ATOM 6053 C CZ3 . TRP C 1 127 ? -7.657 47.423 -85.730 1.00 53.43 ? 122 TRP E CZ3 1 ATOM 6054 C CH2 . TRP C 1 127 ? -7.201 47.459 -84.419 1.00 50.03 ? 122 TRP E CH2 1 ATOM 6055 N N . THR C 1 128 ? -4.955 48.198 -91.897 1.00 62.21 ? 123 THR E N 1 ATOM 6056 C CA . THR C 1 128 ? -4.950 48.458 -93.343 1.00 63.76 ? 123 THR E CA 1 ATOM 6057 C C . THR C 1 128 ? -6.219 49.158 -93.819 1.00 61.59 ? 123 THR E C 1 ATOM 6058 O O . THR C 1 128 ? -6.178 49.924 -94.763 1.00 58.38 ? 123 THR E O 1 ATOM 6059 C CB . THR C 1 128 ? -4.728 47.173 -94.211 1.00 65.76 ? 123 THR E CB 1 ATOM 6060 O OG1 . THR C 1 128 ? -5.811 46.258 -94.058 1.00 62.25 ? 123 THR E OG1 1 ATOM 6061 C CG2 . THR C 1 128 ? -3.381 46.468 -93.895 1.00 60.70 ? 123 THR E CG2 1 ATOM 6062 N N . ASN C 1 129 ? -7.343 48.881 -93.161 1.00 64.06 ? 124 ASN E N 1 ATOM 6063 C CA . ASN C 1 129 ? -8.645 49.395 -93.582 1.00 60.80 ? 124 ASN E CA 1 ATOM 6064 C C . ASN C 1 129 ? -9.169 50.574 -92.782 1.00 57.63 ? 124 ASN E C 1 ATOM 6065 O O . ASN C 1 129 ? -10.314 50.972 -92.991 1.00 57.02 ? 124 ASN E O 1 ATOM 6066 C CB . ASN C 1 129 ? -9.681 48.271 -93.579 1.00 64.04 ? 124 ASN E CB 1 ATOM 6067 C CG . ASN C 1 129 ? -9.306 47.141 -94.535 1.00 69.15 ? 124 ASN E CG 1 ATOM 6068 O OD1 . ASN C 1 129 ? -8.746 47.378 -95.593 1.00 76.69 ? 124 ASN E OD1 1 ATOM 6069 N ND2 . ASN C 1 129 ? -9.599 45.920 -94.152 1.00 71.41 ? 124 ASN E ND2 1 ATOM 6070 N N . HIS C 1 130 ? -8.339 51.142 -91.898 1.00 53.73 ? 125 HIS E N 1 ATOM 6071 C CA . HIS C 1 130 ? -8.727 52.326 -91.104 1.00 51.36 ? 125 HIS E CA 1 ATOM 6072 C C . HIS C 1 130 ? -7.611 53.358 -91.096 1.00 55.46 ? 125 HIS E C 1 ATOM 6073 O O . HIS C 1 130 ? -6.470 53.032 -91.326 1.00 58.53 ? 125 HIS E O 1 ATOM 6074 C CB . HIS C 1 130 ? -9.065 51.944 -89.666 1.00 46.73 ? 125 HIS E CB 1 ATOM 6075 C CG . HIS C 1 130 ? -10.141 50.913 -89.562 1.00 43.34 ? 125 HIS E CG 1 ATOM 6076 N ND1 . HIS C 1 130 ? -9.897 49.563 -89.734 1.00 42.81 ? 125 HIS E ND1 1 ATOM 6077 C CD2 . HIS C 1 130 ? -11.470 51.028 -89.319 1.00 42.35 ? 125 HIS E CD2 1 ATOM 6078 C CE1 . HIS C 1 130 ? -11.035 48.890 -89.611 1.00 43.28 ? 125 HIS E CE1 1 ATOM 6079 N NE2 . HIS C 1 130 ? -12.005 49.755 -89.351 1.00 42.34 ? 125 HIS E NE2 1 ATOM 6080 N N . GLU C 1 131 ? -7.976 54.609 -90.877 1.00 57.92 ? 126 GLU E N 1 ATOM 6081 C CA . GLU C 1 131 ? -7.019 55.716 -90.868 1.00 63.35 ? 126 GLU E CA 1 ATOM 6082 C C . GLU C 1 131 ? -6.349 55.740 -89.496 1.00 64.73 ? 126 GLU E C 1 ATOM 6083 O O . GLU C 1 131 ? -7.040 55.771 -88.474 1.00 67.65 ? 126 GLU E O 1 ATOM 6084 C CB . GLU C 1 131 ? -7.768 57.042 -91.040 1.00 70.21 ? 126 GLU E CB 1 ATOM 6085 C CG . GLU C 1 131 ? -7.287 58.016 -92.104 1.00 83.45 ? 126 GLU E CG 1 ATOM 6086 C CD . GLU C 1 131 ? -5.864 57.825 -92.571 1.00 87.87 ? 126 GLU E CD 1 ATOM 6087 O OE1 . GLU C 1 131 ? -4.898 58.102 -91.800 1.00 86.60 ? 126 GLU E OE1 1 ATOM 6088 O OE2 . GLU C 1 131 ? -5.752 57.394 -93.737 1.00 84.18 ? 126 GLU E OE2 1 ATOM 6089 N N . THR C 1 132 ? -5.027 55.768 -89.466 1.00 60.80 ? 127 THR E N 1 ATOM 6090 C CA . THR C 1 132 ? -4.282 55.763 -88.206 1.00 60.10 ? 127 THR E CA 1 ATOM 6091 C C . THR C 1 132 ? -3.500 57.040 -87.916 1.00 61.99 ? 127 THR E C 1 ATOM 6092 O O . THR C 1 132 ? -2.807 57.132 -86.904 1.00 53.71 ? 127 THR E O 1 ATOM 6093 C CB . THR C 1 132 ? -3.268 54.610 -88.184 1.00 60.03 ? 127 THR E CB 1 ATOM 6094 O OG1 . THR C 1 132 ? -2.261 54.841 -89.181 1.00 59.73 ? 127 THR E OG1 1 ATOM 6095 C CG2 . THR C 1 132 ? -3.948 53.278 -88.447 1.00 55.74 ? 127 THR E CG2 1 ATOM 6096 N N . SER C 1 133 ? -3.580 58.015 -88.816 1.00 63.56 ? 128 SER E N 1 ATOM 6097 C CA . SER C 1 133 ? -2.734 59.210 -88.719 1.00 61.14 ? 128 SER E CA 1 ATOM 6098 C C . SER C 1 133 ? -3.534 60.494 -88.516 1.00 62.27 ? 128 SER E C 1 ATOM 6099 O O . SER C 1 133 ? -2.933 61.564 -88.393 1.00 59.92 ? 128 SER E O 1 ATOM 6100 C CB . SER C 1 133 ? -1.904 59.342 -89.981 1.00 62.90 ? 128 SER E CB 1 ATOM 6101 O OG . SER C 1 133 ? -2.747 59.678 -91.071 1.00 67.89 ? 128 SER E OG 1 ATOM 6102 N N . LEU C 1 134 ? -4.875 60.383 -88.478 1.00 59.21 ? 129 LEU E N 1 ATOM 6103 C CA . LEU C 1 134 ? -5.778 61.537 -88.340 1.00 57.28 ? 129 LEU E CA 1 ATOM 6104 C C . LEU C 1 134 ? -6.359 61.757 -86.947 1.00 56.21 ? 129 LEU E C 1 ATOM 6105 O O . LEU C 1 134 ? -7.088 62.709 -86.739 1.00 58.81 ? 129 LEU E O 1 ATOM 6106 C CB . LEU C 1 134 ? -6.932 61.400 -89.344 1.00 62.61 ? 129 LEU E CB 1 ATOM 6107 C CG . LEU C 1 134 ? -6.803 62.117 -90.709 1.00 74.22 ? 129 LEU E CG 1 ATOM 6108 C CD1 . LEU C 1 134 ? -5.386 62.134 -91.276 1.00 76.97 ? 129 LEU E CD1 1 ATOM 6109 C CD2 . LEU C 1 134 ? -7.786 61.527 -91.723 1.00 73.96 ? 129 LEU E CD2 1 ATOM 6110 N N . GLY C 1 135 ? -6.095 60.853 -86.016 1.00 51.36 ? 130 GLY E N 1 ATOM 6111 C CA . GLY C 1 135 ? -6.647 60.963 -84.684 1.00 52.38 ? 130 GLY E CA 1 ATOM 6112 C C . GLY C 1 135 ? -5.733 61.763 -83.773 1.00 52.77 ? 130 GLY E C 1 ATOM 6113 O O . GLY C 1 135 ? -5.051 61.198 -82.928 1.00 59.85 ? 130 GLY E O 1 ATOM 6114 N N . VAL C 1 136 ? -5.729 63.079 -83.948 1.00 52.44 ? 131 VAL E N 1 ATOM 6115 C CA . VAL C 1 136 ? -4.892 63.989 -83.158 1.00 51.78 ? 131 VAL E CA 1 ATOM 6116 C C . VAL C 1 136 ? -5.755 65.164 -82.812 1.00 50.29 ? 131 VAL E C 1 ATOM 6117 O O . VAL C 1 136 ? -6.789 65.354 -83.422 1.00 46.92 ? 131 VAL E O 1 ATOM 6118 C CB . VAL C 1 136 ? -3.651 64.504 -83.911 1.00 56.48 ? 131 VAL E CB 1 ATOM 6119 C CG1 . VAL C 1 136 ? -2.690 63.361 -84.183 1.00 58.63 ? 131 VAL E CG1 1 ATOM 6120 C CG2 . VAL C 1 136 ? -4.026 65.223 -85.215 1.00 53.52 ? 131 VAL E CG2 1 ATOM 6121 N N . SER C 1 137 ? -5.355 65.939 -81.818 1.00 50.17 ? 132 SER E N 1 ATOM 6122 C CA . SER C 1 137 ? -6.219 66.990 -81.316 1.00 54.15 ? 132 SER E CA 1 ATOM 6123 C C . SER C 1 137 ? -5.391 68.099 -80.725 1.00 58.05 ? 132 SER E C 1 ATOM 6124 O O . SER C 1 137 ? -4.301 67.842 -80.177 1.00 61.27 ? 132 SER E O 1 ATOM 6125 C CB . SER C 1 137 ? -7.121 66.425 -80.225 1.00 52.69 ? 132 SER E CB 1 ATOM 6126 O OG . SER C 1 137 ? -7.872 67.443 -79.589 1.00 56.27 ? 132 SER E OG 1 ATOM 6127 N N . ALA C 1 138 ? -5.892 69.327 -80.861 1.00 59.14 ? 133 ALA E N 1 ATOM 6128 C CA . ALA C 1 138 ? -5.264 70.484 -80.211 1.00 61.40 ? 133 ALA E CA 1 ATOM 6129 C C . ALA C 1 138 ? -5.290 70.306 -78.715 1.00 57.59 ? 133 ALA E C 1 ATOM 6130 O O . ALA C 1 138 ? -4.538 70.973 -78.026 1.00 55.76 ? 133 ALA E O 1 ATOM 6131 C CB . ALA C 1 138 ? -5.961 71.789 -80.588 1.00 59.88 ? 133 ALA E CB 1 ATOM 6132 N N . ALA C 1 139 ? -6.158 69.434 -78.206 1.00 57.55 ? 134 ALA E N 1 ATOM 6133 C CA . ALA C 1 139 ? -6.171 69.169 -76.752 1.00 56.70 ? 134 ALA E CA 1 ATOM 6134 C C . ALA C 1 139 ? -4.926 68.412 -76.282 1.00 53.95 ? 134 ALA E C 1 ATOM 6135 O O . ALA C 1 139 ? -4.634 68.389 -75.094 1.00 54.59 ? 134 ALA E O 1 ATOM 6136 C CB . ALA C 1 139 ? -7.423 68.419 -76.346 1.00 55.11 ? 134 ALA E CB 1 ATOM 6137 N N . CYS C 1 140 ? -4.200 67.788 -77.209 1.00 51.60 ? 135 CYS E N 1 ATOM 6138 C CA . CYS C 1 140 ? -3.010 67.002 -76.893 1.00 50.16 ? 135 CYS E CA 1 ATOM 6139 C C . CYS C 1 140 ? -1.814 67.428 -77.741 1.00 51.51 ? 135 CYS E C 1 ATOM 6140 O O . CYS C 1 140 ? -1.368 66.676 -78.625 1.00 52.33 ? 135 CYS E O 1 ATOM 6141 C CB . CYS C 1 140 ? -3.304 65.514 -77.108 1.00 50.35 ? 135 CYS E CB 1 ATOM 6142 S SG . CYS C 1 140 ? -4.618 64.832 -76.050 1.00 55.77 ? 135 CYS E SG 1 ATOM 6143 N N . PRO C 1 141 ? -1.292 68.642 -77.492 1.00 52.46 ? 136 PRO E N 1 ATOM 6144 C CA . PRO C 1 141 ? -0.255 69.154 -78.376 1.00 52.99 ? 136 PRO E CA 1 ATOM 6145 C C . PRO C 1 141 ? 1.064 68.535 -78.059 1.00 52.74 ? 136 PRO E C 1 ATOM 6146 O O . PRO C 1 141 ? 1.292 68.141 -76.925 1.00 53.28 ? 136 PRO E O 1 ATOM 6147 C CB . PRO C 1 141 ? -0.217 70.650 -78.069 1.00 53.84 ? 136 PRO E CB 1 ATOM 6148 C CG . PRO C 1 141 ? -0.756 70.788 -76.688 1.00 54.05 ? 136 PRO E CG 1 ATOM 6149 C CD . PRO C 1 141 ? -1.746 69.660 -76.528 1.00 56.13 ? 136 PRO E CD 1 ATOM 6150 N N . TYR C 1 142 ? 1.900 68.416 -79.079 1.00 55.95 ? 137 TYR E N 1 ATOM 6151 C CA . TYR C 1 142 ? 3.331 68.176 -78.900 1.00 61.07 ? 137 TYR E CA 1 ATOM 6152 C C . TYR C 1 142 ? 4.120 69.237 -79.665 1.00 64.34 ? 137 TYR E C 1 ATOM 6153 O O . TYR C 1 142 ? 3.904 69.438 -80.865 1.00 54.79 ? 137 TYR E O 1 ATOM 6154 C CB . TYR C 1 142 ? 3.735 66.817 -79.410 1.00 61.15 ? 137 TYR E CB 1 ATOM 6155 C CG . TYR C 1 142 ? 5.185 66.493 -79.192 1.00 68.16 ? 137 TYR E CG 1 ATOM 6156 C CD1 . TYR C 1 142 ? 5.788 66.619 -77.927 1.00 71.54 ? 137 TYR E CD1 1 ATOM 6157 C CD2 . TYR C 1 142 ? 5.960 66.025 -80.236 1.00 72.67 ? 137 TYR E CD2 1 ATOM 6158 C CE1 . TYR C 1 142 ? 7.135 66.303 -77.726 1.00 73.62 ? 137 TYR E CE1 1 ATOM 6159 C CE2 . TYR C 1 142 ? 7.301 65.703 -80.053 1.00 77.27 ? 137 TYR E CE2 1 ATOM 6160 C CZ . TYR C 1 142 ? 7.894 65.845 -78.810 1.00 78.72 ? 137 TYR E CZ 1 ATOM 6161 O OH . TYR C 1 142 ? 9.240 65.508 -78.690 1.00 80.56 ? 137 TYR E OH 1 ATOM 6162 N N . GLN C 1 143 ? 5.021 69.924 -78.960 1.00 68.15 ? 138 GLN E N 1 ATOM 6163 C CA . GLN C 1 143 ? 5.815 70.983 -79.560 1.00 65.47 ? 138 GLN E CA 1 ATOM 6164 C C . GLN C 1 143 ? 4.848 72.001 -80.188 1.00 63.41 ? 138 GLN E C 1 ATOM 6165 O O . GLN C 1 143 ? 5.089 72.507 -81.268 1.00 63.83 ? 138 GLN E O 1 ATOM 6166 C CB . GLN C 1 143 ? 6.786 70.417 -80.588 1.00 70.45 ? 138 GLN E CB 1 ATOM 6167 C CG . GLN C 1 143 ? 7.957 69.711 -79.937 1.00 77.10 ? 138 GLN E CG 1 ATOM 6168 C CD . GLN C 1 143 ? 8.815 68.901 -80.895 1.00 84.84 ? 138 GLN E CD 1 ATOM 6169 O OE1 . GLN C 1 143 ? 8.372 68.489 -81.970 1.00 87.35 ? 138 GLN E OE1 1 ATOM 6170 N NE2 . GLN C 1 143 ? 10.061 68.671 -80.505 1.00 89.19 ? 138 GLN E NE2 1 ATOM 6171 N N . GLY C 1 144 ? 3.720 72.245 -79.514 1.00 64.66 ? 139 GLY E N 1 ATOM 6172 C CA . GLY C 1 144 ? 2.693 73.174 -79.999 1.00 67.57 ? 139 GLY E CA 1 ATOM 6173 C C . GLY C 1 144 ? 1.733 72.711 -81.096 1.00 69.70 ? 139 GLY E C 1 ATOM 6174 O O . GLY C 1 144 ? 0.660 73.302 -81.267 1.00 77.28 ? 139 GLY E O 1 ATOM 6175 N N . THR C 1 145 ? 2.104 71.649 -81.810 1.00 67.52 ? 140 THR E N 1 ATOM 6176 C CA . THR C 1 145 ? 1.286 71.012 -82.883 1.00 67.80 ? 140 THR E CA 1 ATOM 6177 C C . THR C 1 145 ? 0.254 69.901 -82.379 1.00 64.39 ? 140 THR E C 1 ATOM 6178 O O . THR C 1 145 ? 0.536 69.134 -81.475 1.00 58.71 ? 140 THR E O 1 ATOM 6179 C CB . THR C 1 145 ? 2.224 70.526 -84.049 1.00 68.32 ? 140 THR E CB 1 ATOM 6180 O OG1 . THR C 1 145 ? 1.529 69.623 -84.894 1.00 72.95 ? 140 THR E OG1 1 ATOM 6181 C CG2 . THR C 1 145 ? 3.474 69.809 -83.579 1.00 69.78 ? 140 THR E CG2 1 ATOM 6182 N N . PRO C 1 146 ? -0.949 69.803 -82.974 1.00 59.18 ? 141 PRO E N 1 ATOM 6183 C CA . PRO C 1 146 ? -1.858 68.749 -82.485 1.00 58.27 ? 141 PRO E CA 1 ATOM 6184 C C . PRO C 1 146 ? -1.314 67.323 -82.494 1.00 59.19 ? 141 PRO E C 1 ATOM 6185 O O . PRO C 1 146 ? -0.683 66.896 -83.447 1.00 57.19 ? 141 PRO E O 1 ATOM 6186 C CB . PRO C 1 146 ? -3.066 68.838 -83.417 1.00 56.17 ? 141 PRO E CB 1 ATOM 6187 C CG . PRO C 1 146 ? -3.024 70.260 -83.883 1.00 60.31 ? 141 PRO E CG 1 ATOM 6188 C CD . PRO C 1 146 ? -1.565 70.575 -84.050 1.00 60.06 ? 141 PRO E CD 1 ATOM 6189 N N . SER C 1 147 ? -1.587 66.588 -81.414 1.00 62.31 ? 142 SER E N 1 ATOM 6190 C CA . SER C 1 147 ? -1.119 65.213 -81.287 1.00 57.12 ? 142 SER E CA 1 ATOM 6191 C C . SER C 1 147 ? -2.107 64.361 -80.466 1.00 56.00 ? 142 SER E C 1 ATOM 6192 O O . SER C 1 147 ? -3.325 64.613 -80.471 1.00 54.41 ? 142 SER E O 1 ATOM 6193 C CB . SER C 1 147 ? 0.275 65.219 -80.675 1.00 55.70 ? 142 SER E CB 1 ATOM 6194 O OG . SER C 1 147 ? 0.895 63.965 -80.781 1.00 50.70 ? 142 SER E OG 1 ATOM 6195 N N . PHE C 1 148 ? -1.585 63.349 -79.785 1.00 51.77 ? 143 PHE E N 1 ATOM 6196 C CA . PHE C 1 148 ? -2.440 62.446 -79.066 1.00 55.14 ? 143 PHE E CA 1 ATOM 6197 C C . PHE C 1 148 ? -1.630 61.518 -78.198 1.00 53.43 ? 143 PHE E C 1 ATOM 6198 O O . PHE C 1 148 ? -0.418 61.370 -78.398 1.00 51.96 ? 143 PHE E O 1 ATOM 6199 C CB . PHE C 1 148 ? -3.263 61.616 -80.060 1.00 53.81 ? 143 PHE E CB 1 ATOM 6200 C CG . PHE C 1 148 ? -4.442 60.912 -79.440 1.00 53.10 ? 143 PHE E CG 1 ATOM 6201 C CD1 . PHE C 1 148 ? -5.552 61.640 -78.993 1.00 52.00 ? 143 PHE E CD1 1 ATOM 6202 C CD2 . PHE C 1 148 ? -4.472 59.529 -79.327 1.00 50.00 ? 143 PHE E CD2 1 ATOM 6203 C CE1 . PHE C 1 148 ? -6.664 60.995 -78.462 1.00 50.61 ? 143 PHE E CE1 1 ATOM 6204 C CE2 . PHE C 1 148 ? -5.580 58.885 -78.788 1.00 48.38 ? 143 PHE E CE2 1 ATOM 6205 C CZ . PHE C 1 148 ? -6.661 59.615 -78.348 1.00 49.11 ? 143 PHE E CZ 1 ATOM 6206 N N . PHE C 1 149 ? -2.318 60.893 -77.246 1.00 48.82 ? 144 PHE E N 1 ATOM 6207 C CA . PHE C 1 149 ? -1.723 59.878 -76.380 1.00 46.44 ? 144 PHE E CA 1 ATOM 6208 C C . PHE C 1 149 ? -0.933 58.937 -77.242 1.00 46.70 ? 144 PHE E C 1 ATOM 6209 O O . PHE C 1 149 ? -1.447 58.413 -78.211 1.00 46.94 ? 144 PHE E O 1 ATOM 6210 C CB . PHE C 1 149 ? -2.803 59.047 -75.681 1.00 43.56 ? 144 PHE E CB 1 ATOM 6211 C CG . PHE C 1 149 ? -3.698 59.842 -74.752 1.00 42.61 ? 144 PHE E CG 1 ATOM 6212 C CD1 . PHE C 1 149 ? -3.257 60.242 -73.501 1.00 42.24 ? 144 PHE E CD1 1 ATOM 6213 C CD2 . PHE C 1 149 ? -5.004 60.120 -75.105 1.00 42.60 ? 144 PHE E CD2 1 ATOM 6214 C CE1 . PHE C 1 149 ? -4.105 60.916 -72.625 1.00 40.78 ? 144 PHE E CE1 1 ATOM 6215 C CE2 . PHE C 1 149 ? -5.859 60.784 -74.241 1.00 42.17 ? 144 PHE E CE2 1 ATOM 6216 C CZ . PHE C 1 149 ? -5.413 61.184 -73.001 1.00 40.32 ? 144 PHE E CZ 1 ATOM 6217 N N . ARG C 1 150 ? 0.298 58.673 -76.865 1.00 47.78 ? 145 ARG E N 1 ATOM 6218 C CA . ARG C 1 150 ? 1.215 57.901 -77.708 1.00 53.30 ? 145 ARG E CA 1 ATOM 6219 C C . ARG C 1 150 ? 1.082 56.377 -77.618 1.00 49.56 ? 145 ARG E C 1 ATOM 6220 O O . ARG C 1 150 ? 1.634 55.693 -78.462 1.00 57.23 ? 145 ARG E O 1 ATOM 6221 C CB . ARG C 1 150 ? 2.675 58.350 -77.433 1.00 61.49 ? 145 ARG E CB 1 ATOM 6222 C CG . ARG C 1 150 ? 2.876 59.821 -77.814 1.00 73.19 ? 145 ARG E CG 1 ATOM 6223 C CD . ARG C 1 150 ? 4.056 60.540 -77.158 1.00 87.83 ? 145 ARG E CD 1 ATOM 6224 N NE . ARG C 1 150 ? 5.347 60.392 -77.849 1.00 105.81 ? 145 ARG E NE 1 ATOM 6225 C CZ . ARG C 1 150 ? 5.913 61.243 -78.731 1.00 118.81 ? 145 ARG E CZ 1 ATOM 6226 N NH1 . ARG C 1 150 ? 5.330 62.393 -79.105 1.00 113.93 ? 145 ARG E NH1 1 ATOM 6227 N NH2 . ARG C 1 150 ? 7.112 60.924 -79.255 1.00 124.18 ? 145 ARG E NH2 1 ATOM 6228 N N . ASN C 1 151 ? 0.399 55.847 -76.598 1.00 43.87 ? 146 ASN E N 1 ATOM 6229 C CA . ASN C 1 151 ? 0.295 54.409 -76.398 1.00 42.44 ? 146 ASN E CA 1 ATOM 6230 C C . ASN C 1 151 ? -1.001 53.748 -76.889 1.00 43.23 ? 146 ASN E C 1 ATOM 6231 O O . ASN C 1 151 ? -1.095 52.527 -76.926 1.00 46.01 ? 146 ASN E O 1 ATOM 6232 C CB . ASN C 1 151 ? 0.499 54.092 -74.954 1.00 42.57 ? 146 ASN E CB 1 ATOM 6233 C CG . ASN C 1 151 ? 1.841 54.565 -74.446 1.00 44.99 ? 146 ASN E CG 1 ATOM 6234 O OD1 . ASN C 1 151 ? 1.959 55.019 -73.317 1.00 44.57 ? 146 ASN E OD1 1 ATOM 6235 N ND2 . ASN C 1 151 ? 2.865 54.459 -75.285 1.00 45.50 ? 146 ASN E ND2 1 ATOM 6236 N N . VAL C 1 152 ? -1.929 54.552 -77.371 1.00 41.76 ? 147 VAL E N 1 ATOM 6237 C CA . VAL C 1 152 ? -3.133 54.063 -77.959 1.00 43.40 ? 147 VAL E CA 1 ATOM 6238 C C . VAL C 1 152 ? -3.353 54.845 -79.245 1.00 45.96 ? 147 VAL E C 1 ATOM 6239 O O . VAL C 1 152 ? -2.685 55.835 -79.466 1.00 49.67 ? 147 VAL E O 1 ATOM 6240 C CB . VAL C 1 152 ? -4.326 54.291 -77.033 1.00 46.33 ? 147 VAL E CB 1 ATOM 6241 C CG1 . VAL C 1 152 ? -4.224 53.407 -75.812 1.00 46.82 ? 147 VAL E CG1 1 ATOM 6242 C CG2 . VAL C 1 152 ? -4.435 55.760 -76.614 1.00 46.86 ? 147 VAL E CG2 1 ATOM 6243 N N . VAL C 1 153 ? -4.280 54.379 -80.094 1.00 51.98 ? 148 VAL E N 1 ATOM 6244 C CA . VAL C 1 153 ? -4.491 54.929 -81.445 1.00 49.60 ? 148 VAL E CA 1 ATOM 6245 C C . VAL C 1 153 ? -5.925 55.246 -81.689 1.00 48.33 ? 148 VAL E C 1 ATOM 6246 O O . VAL C 1 153 ? -6.782 54.363 -81.619 1.00 44.21 ? 148 VAL E O 1 ATOM 6247 C CB . VAL C 1 153 ? -4.120 53.937 -82.566 1.00 53.08 ? 148 VAL E CB 1 ATOM 6248 C CG1 . VAL C 1 153 ? -4.179 54.640 -83.901 1.00 56.82 ? 148 VAL E CG1 1 ATOM 6249 C CG2 . VAL C 1 153 ? -2.716 53.450 -82.391 1.00 61.20 ? 148 VAL E CG2 1 ATOM 6250 N N . TRP C 1 154 ? -6.179 56.493 -82.044 1.00 48.86 ? 149 TRP E N 1 ATOM 6251 C CA . TRP C 1 154 ? -7.544 56.956 -82.332 1.00 48.72 ? 149 TRP E CA 1 ATOM 6252 C C . TRP C 1 154 ? -7.857 56.702 -83.792 1.00 49.26 ? 149 TRP E C 1 ATOM 6253 O O . TRP C 1 154 ? -7.529 57.490 -84.630 1.00 48.63 ? 149 TRP E O 1 ATOM 6254 C CB . TRP C 1 154 ? -7.635 58.432 -82.002 1.00 46.13 ? 149 TRP E CB 1 ATOM 6255 C CG . TRP C 1 154 ? -8.925 59.051 -82.191 1.00 41.58 ? 149 TRP E CG 1 ATOM 6256 C CD1 . TRP C 1 154 ? -10.083 58.455 -82.546 1.00 42.39 ? 149 TRP E CD1 1 ATOM 6257 C CD2 . TRP C 1 154 ? -9.230 60.421 -81.942 1.00 41.79 ? 149 TRP E CD2 1 ATOM 6258 N NE1 . TRP C 1 154 ? -11.123 59.381 -82.540 1.00 44.06 ? 149 TRP E NE1 1 ATOM 6259 C CE2 . TRP C 1 154 ? -10.603 60.602 -82.189 1.00 45.76 ? 149 TRP E CE2 1 ATOM 6260 C CE3 . TRP C 1 154 ? -8.489 61.509 -81.509 1.00 45.23 ? 149 TRP E CE3 1 ATOM 6261 C CZ2 . TRP C 1 154 ? -11.235 61.844 -82.035 1.00 44.96 ? 149 TRP E CZ2 1 ATOM 6262 C CZ3 . TRP C 1 154 ? -9.140 62.761 -81.365 1.00 44.92 ? 149 TRP E CZ3 1 ATOM 6263 C CH2 . TRP C 1 154 ? -10.474 62.902 -81.624 1.00 42.56 ? 149 TRP E CH2 1 ATOM 6264 N N . LEU C 1 155 ? -8.431 55.539 -84.066 1.00 50.12 ? 150 LEU E N 1 ATOM 6265 C CA . LEU C 1 155 ? -8.741 55.131 -85.406 1.00 47.16 ? 150 LEU E CA 1 ATOM 6266 C C . LEU C 1 155 ? -9.872 55.941 -86.003 1.00 52.83 ? 150 LEU E C 1 ATOM 6267 O O . LEU C 1 155 ? -10.879 56.187 -85.365 1.00 52.11 ? 150 LEU E O 1 ATOM 6268 C CB . LEU C 1 155 ? -9.105 53.647 -85.457 1.00 45.50 ? 150 LEU E CB 1 ATOM 6269 C CG . LEU C 1 155 ? -8.013 52.660 -85.056 1.00 46.91 ? 150 LEU E CG 1 ATOM 6270 C CD1 . LEU C 1 155 ? -8.630 51.275 -85.014 1.00 49.07 ? 150 LEU E CD1 1 ATOM 6271 C CD2 . LEU C 1 155 ? -6.837 52.671 -86.013 1.00 48.50 ? 150 LEU E CD2 1 ATOM 6272 N N . ILE C 1 156 ? -9.715 56.260 -87.287 1.00 53.92 ? 151 ILE E N 1 ATOM 6273 C CA . ILE C 1 156 ? -10.694 57.035 -88.035 1.00 53.50 ? 151 ILE E CA 1 ATOM 6274 C C . ILE C 1 156 ? -11.133 56.252 -89.278 1.00 51.72 ? 151 ILE E C 1 ATOM 6275 O O . ILE C 1 156 ? -10.398 55.394 -89.777 1.00 52.52 ? 151 ILE E O 1 ATOM 6276 C CB . ILE C 1 156 ? -10.066 58.427 -88.372 1.00 54.57 ? 151 ILE E CB 1 ATOM 6277 C CG1 . ILE C 1 156 ? -9.853 59.234 -87.085 1.00 52.68 ? 151 ILE E CG1 1 ATOM 6278 C CG2 . ILE C 1 156 ? -10.909 59.249 -89.343 1.00 56.30 ? 151 ILE E CG2 1 ATOM 6279 C CD1 . ILE C 1 156 ? -11.119 59.562 -86.336 1.00 51.89 ? 151 ILE E CD1 1 ATOM 6280 N N . LYS C 1 157 ? -12.311 56.561 -89.808 1.00 55.13 ? 152 LYS E N 1 ATOM 6281 C CA . LYS C 1 157 ? -12.744 55.977 -91.102 1.00 63.81 ? 152 LYS E CA 1 ATOM 6282 C C . LYS C 1 157 ? -11.729 56.226 -92.237 1.00 66.07 ? 152 LYS E C 1 ATOM 6283 O O . LYS C 1 157 ? -11.022 57.226 -92.248 1.00 69.58 ? 152 LYS E O 1 ATOM 6284 C CB . LYS C 1 157 ? -14.108 56.513 -91.535 1.00 64.01 ? 152 LYS E CB 1 ATOM 6285 C CG . LYS C 1 157 ? -14.057 57.894 -92.139 1.00 66.51 ? 152 LYS E CG 1 ATOM 6286 C CD . LYS C 1 157 ? -15.457 58.371 -92.483 1.00 70.39 ? 152 LYS E CD 1 ATOM 6287 C CE . LYS C 1 157 ? -15.411 59.747 -93.134 1.00 70.73 ? 152 LYS E CE 1 ATOM 6288 N NZ . LYS C 1 157 ? -16.773 60.345 -93.225 1.00 72.77 ? 152 LYS E NZ 1 ATOM 6289 N N . LYS C 1 158 ? -11.692 55.313 -93.195 1.00 68.63 ? 153 LYS E N 1 ATOM 6290 C CA . LYS C 1 158 ? -10.796 55.416 -94.345 1.00 73.40 ? 153 LYS E CA 1 ATOM 6291 C C . LYS C 1 158 ? -11.609 55.229 -95.626 1.00 73.42 ? 153 LYS E C 1 ATOM 6292 O O . LYS C 1 158 ? -12.508 54.378 -95.691 1.00 66.11 ? 153 LYS E O 1 ATOM 6293 C CB . LYS C 1 158 ? -9.694 54.364 -94.280 1.00 73.29 ? 153 LYS E CB 1 ATOM 6294 C CG . LYS C 1 158 ? -8.588 54.585 -95.295 1.00 74.07 ? 153 LYS E CG 1 ATOM 6295 C CD . LYS C 1 158 ? -7.590 53.451 -95.281 1.00 73.87 ? 153 LYS E CD 1 ATOM 6296 C CE . LYS C 1 158 ? -6.613 53.598 -96.431 1.00 76.84 ? 153 LYS E CE 1 ATOM 6297 N NZ . LYS C 1 158 ? -5.452 52.680 -96.282 1.00 73.67 ? 153 LYS E NZ 1 ATOM 6298 N N . ASN C 1 159 ? -11.271 56.023 -96.645 1.00 78.14 ? 154 ASN E N 1 ATOM 6299 C CA . ASN C 1 159 ? -12.139 56.195 -97.798 1.00 76.59 ? 154 ASN E CA 1 ATOM 6300 C C . ASN C 1 159 ? -13.417 56.678 -97.147 1.00 75.90 ? 154 ASN E C 1 ATOM 6301 O O . ASN C 1 159 ? -13.330 57.581 -96.293 1.00 85.83 ? 154 ASN E O 1 ATOM 6302 C CB . ASN C 1 159 ? -12.172 54.905 -98.617 1.00 79.14 ? 154 ASN E CB 1 ATOM 6303 C CG . ASN C 1 159 ? -10.753 54.450 -98.987 1.00 79.69 ? 154 ASN E CG 1 ATOM 6304 O OD1 . ASN C 1 159 ? -10.346 53.321 -98.703 1.00 95.05 ? 154 ASN E OD1 1 ATOM 6305 N ND2 . ASN C 1 159 ? -9.962 55.366 -99.536 1.00 74.80 ? 154 ASN E ND2 1 ATOM 6306 N N . ASP C 1 160 ? -14.584 56.139 -97.416 1.00 68.49 ? 155 ASP E N 1 ATOM 6307 C CA . ASP C 1 160 ? -15.675 56.631 -96.582 1.00 73.49 ? 155 ASP E CA 1 ATOM 6308 C C . ASP C 1 160 ? -16.266 55.458 -95.812 1.00 74.44 ? 155 ASP E C 1 ATOM 6309 O O . ASP C 1 160 ? -17.489 55.293 -95.736 1.00 69.53 ? 155 ASP E O 1 ATOM 6310 C CB . ASP C 1 160 ? -16.718 57.412 -97.403 1.00 76.18 ? 155 ASP E CB 1 ATOM 6311 C CG . ASP C 1 160 ? -17.713 58.202 -96.524 1.00 81.20 ? 155 ASP E CG 1 ATOM 6312 O OD1 . ASP C 1 160 ? -18.880 58.354 -96.940 1.00 81.34 ? 155 ASP E OD1 1 ATOM 6313 O OD2 . ASP C 1 160 ? -17.345 58.661 -95.417 1.00 78.62 ? 155 ASP E OD2 1 ATOM 6314 N N . ALA C 1 161 ? -15.382 54.663 -95.205 1.00 69.06 ? 156 ALA E N 1 ATOM 6315 C CA . ALA C 1 161 ? -15.828 53.463 -94.501 1.00 65.83 ? 156 ALA E CA 1 ATOM 6316 C C . ALA C 1 161 ? -15.051 53.164 -93.210 1.00 63.22 ? 156 ALA E C 1 ATOM 6317 O O . ALA C 1 161 ? -13.889 53.529 -93.042 1.00 63.63 ? 156 ALA E O 1 ATOM 6318 C CB . ALA C 1 161 ? -15.791 52.258 -95.435 1.00 60.92 ? 156 ALA E CB 1 ATOM 6319 N N . TYR C 1 162 ? -15.736 52.484 -92.306 1.00 58.47 ? 157 TYR E N 1 ATOM 6320 C CA . TYR C 1 162 ? -15.154 51.950 -91.077 1.00 51.31 ? 157 TYR E CA 1 ATOM 6321 C C . TYR C 1 162 ? -15.721 50.521 -91.019 1.00 48.63 ? 157 TYR E C 1 ATOM 6322 O O . TYR C 1 162 ? -16.778 50.283 -90.455 1.00 43.92 ? 157 TYR E O 1 ATOM 6323 C CB . TYR C 1 162 ? -15.556 52.800 -89.874 1.00 45.52 ? 157 TYR E CB 1 ATOM 6324 C CG . TYR C 1 162 ? -14.765 52.569 -88.620 1.00 47.27 ? 157 TYR E CG 1 ATOM 6325 C CD1 . TYR C 1 162 ? -14.815 51.341 -87.934 1.00 46.78 ? 157 TYR E CD1 1 ATOM 6326 C CD2 . TYR C 1 162 ? -13.991 53.587 -88.065 1.00 47.88 ? 157 TYR E CD2 1 ATOM 6327 C CE1 . TYR C 1 162 ? -14.106 51.145 -86.758 1.00 43.84 ? 157 TYR E CE1 1 ATOM 6328 C CE2 . TYR C 1 162 ? -13.277 53.396 -86.884 1.00 49.83 ? 157 TYR E CE2 1 ATOM 6329 C CZ . TYR C 1 162 ? -13.353 52.176 -86.224 1.00 46.80 ? 157 TYR E CZ 1 ATOM 6330 O OH . TYR C 1 162 ? -12.624 51.995 -85.060 1.00 44.44 ? 157 TYR E OH 1 ATOM 6331 N N . PRO C 1 163 ? -15.066 49.584 -91.702 1.00 48.89 ? 158 PRO E N 1 ATOM 6332 C CA . PRO C 1 163 ? -15.447 48.179 -91.549 1.00 50.89 ? 158 PRO E CA 1 ATOM 6333 C C . PRO C 1 163 ? -15.210 47.692 -90.118 1.00 52.01 ? 158 PRO E C 1 ATOM 6334 O O . PRO C 1 163 ? -14.374 48.217 -89.383 1.00 53.33 ? 158 PRO E O 1 ATOM 6335 C CB . PRO C 1 163 ? -14.512 47.431 -92.513 1.00 52.41 ? 158 PRO E CB 1 ATOM 6336 C CG . PRO C 1 163 ? -13.372 48.352 -92.764 1.00 51.80 ? 158 PRO E CG 1 ATOM 6337 C CD . PRO C 1 163 ? -13.831 49.758 -92.477 1.00 50.35 ? 158 PRO E CD 1 ATOM 6338 N N . THR C 1 164 ? -15.950 46.675 -89.763 1.00 51.02 ? 159 THR E N 1 ATOM 6339 C CA . THR C 1 164 ? -15.995 46.195 -88.428 1.00 51.07 ? 159 THR E CA 1 ATOM 6340 C C . THR C 1 164 ? -14.693 45.520 -88.106 1.00 53.48 ? 159 THR E C 1 ATOM 6341 O O . THR C 1 164 ? -14.295 44.578 -88.780 1.00 57.89 ? 159 THR E O 1 ATOM 6342 C CB . THR C 1 164 ? -17.155 45.214 -88.282 1.00 49.95 ? 159 THR E CB 1 ATOM 6343 O OG1 . THR C 1 164 ? -18.377 45.947 -88.490 1.00 49.65 ? 159 THR E OG1 1 ATOM 6344 C CG2 . THR C 1 164 ? -17.148 44.601 -86.902 1.00 52.00 ? 159 THR E CG2 1 ATOM 6345 N N . ILE C 1 165 ? -14.046 46.008 -87.052 1.00 52.06 ? 160 ILE E N 1 ATOM 6346 C CA . ILE C 1 165 ? -12.793 45.460 -86.579 1.00 46.42 ? 160 ILE E CA 1 ATOM 6347 C C . ILE C 1 165 ? -13.075 44.182 -85.766 1.00 46.20 ? 160 ILE E C 1 ATOM 6348 O O . ILE C 1 165 ? -14.010 44.155 -84.975 1.00 43.20 ? 160 ILE E O 1 ATOM 6349 C CB . ILE C 1 165 ? -12.093 46.482 -85.695 1.00 48.75 ? 160 ILE E CB 1 ATOM 6350 C CG1 . ILE C 1 165 ? -11.611 47.663 -86.551 1.00 49.07 ? 160 ILE E CG1 1 ATOM 6351 C CG2 . ILE C 1 165 ? -10.920 45.840 -84.954 1.00 46.22 ? 160 ILE E CG2 1 ATOM 6352 C CD1 . ILE C 1 165 ? -11.356 48.940 -85.773 1.00 50.20 ? 160 ILE E CD1 1 ATOM 6353 N N . LYS C 1 166 ? -12.312 43.125 -86.025 1.00 44.48 ? 161 LYS E N 1 ATOM 6354 C CA . LYS C 1 166 ? -12.305 41.907 -85.194 1.00 46.75 ? 161 LYS E CA 1 ATOM 6355 C C . LYS C 1 166 ? -10.877 41.461 -85.068 1.00 48.58 ? 161 LYS E C 1 ATOM 6356 O O . LYS C 1 166 ? -10.318 40.899 -86.003 1.00 44.02 ? 161 LYS E O 1 ATOM 6357 C CB . LYS C 1 166 ? -13.081 40.740 -85.793 1.00 50.09 ? 161 LYS E CB 1 ATOM 6358 C CG . LYS C 1 166 ? -14.557 41.013 -85.976 1.00 55.99 ? 161 LYS E CG 1 ATOM 6359 C CD . LYS C 1 166 ? -15.313 39.824 -86.542 1.00 62.02 ? 161 LYS E CD 1 ATOM 6360 C CE . LYS C 1 166 ? -16.669 40.289 -87.077 1.00 74.42 ? 161 LYS E CE 1 ATOM 6361 N NZ . LYS C 1 166 ? -17.721 39.236 -87.030 1.00 78.81 ? 161 LYS E NZ 1 ATOM 6362 N N . ILE C 1 167 ? -10.267 41.707 -83.922 1.00 49.40 ? 162 ILE E N 1 ATOM 6363 C CA . ILE C 1 167 ? -8.868 41.299 -83.754 1.00 53.16 ? 162 ILE E CA 1 ATOM 6364 C C . ILE C 1 167 ? -8.723 40.642 -82.424 1.00 50.48 ? 162 ILE E C 1 ATOM 6365 O O . ILE C 1 167 ? -9.567 40.786 -81.556 1.00 46.50 ? 162 ILE E O 1 ATOM 6366 C CB . ILE C 1 167 ? -7.883 42.481 -83.866 1.00 49.27 ? 162 ILE E CB 1 ATOM 6367 C CG1 . ILE C 1 167 ? -8.225 43.514 -82.809 1.00 46.84 ? 162 ILE E CG1 1 ATOM 6368 C CG2 . ILE C 1 167 ? -7.977 43.110 -85.267 1.00 53.85 ? 162 ILE E CG2 1 ATOM 6369 C CD1 . ILE C 1 167 ? -7.083 44.455 -82.559 1.00 48.42 ? 162 ILE E CD1 1 ATOM 6370 N N . SER C 1 168 ? -7.653 39.895 -82.286 1.00 49.16 ? 163 SER E N 1 ATOM 6371 C CA . SER C 1 168 ? -7.333 39.353 -81.018 1.00 51.54 ? 163 SER E CA 1 ATOM 6372 C C . SER C 1 168 ? -5.827 39.399 -80.834 1.00 49.75 ? 163 SER E C 1 ATOM 6373 O O . SER C 1 168 ? -5.090 39.443 -81.803 1.00 46.37 ? 163 SER E O 1 ATOM 6374 C CB . SER C 1 168 ? -7.948 37.960 -80.843 1.00 53.72 ? 163 SER E CB 1 ATOM 6375 O OG . SER C 1 168 ? -7.326 37.022 -81.660 1.00 54.45 ? 163 SER E OG 1 ATOM 6376 N N . TYR C 1 169 ? -5.392 39.471 -79.583 1.00 48.76 ? 164 TYR E N 1 ATOM 6377 C CA . TYR C 1 169 ? -3.974 39.444 -79.240 1.00 45.99 ? 164 TYR E CA 1 ATOM 6378 C C . TYR C 1 169 ? -3.796 38.395 -78.144 1.00 43.96 ? 164 TYR E C 1 ATOM 6379 O O . TYR C 1 169 ? -4.454 38.439 -77.099 1.00 40.54 ? 164 TYR E O 1 ATOM 6380 C CB . TYR C 1 169 ? -3.481 40.820 -78.757 1.00 46.63 ? 164 TYR E CB 1 ATOM 6381 C CG . TYR C 1 169 ? -2.087 40.738 -78.231 1.00 50.78 ? 164 TYR E CG 1 ATOM 6382 C CD1 . TYR C 1 169 ? -0.987 40.778 -79.098 1.00 55.25 ? 164 TYR E CD1 1 ATOM 6383 C CD2 . TYR C 1 169 ? -1.846 40.527 -76.880 1.00 50.85 ? 164 TYR E CD2 1 ATOM 6384 C CE1 . TYR C 1 169 ? 0.313 40.642 -78.614 1.00 53.82 ? 164 TYR E CE1 1 ATOM 6385 C CE2 . TYR C 1 169 ? -0.554 40.380 -76.388 1.00 55.56 ? 164 TYR E CE2 1 ATOM 6386 C CZ . TYR C 1 169 ? 0.516 40.451 -77.246 1.00 57.61 ? 164 TYR E CZ 1 ATOM 6387 O OH . TYR C 1 169 ? 1.776 40.302 -76.723 1.00 69.87 ? 164 TYR E OH 1 ATOM 6388 N N . ASN C 1 170 ? -2.910 37.465 -78.406 1.00 42.62 ? 165 ASN E N 1 ATOM 6389 C CA . ASN C 1 170 ? -2.569 36.407 -77.471 1.00 47.85 ? 165 ASN E CA 1 ATOM 6390 C C . ASN C 1 170 ? -1.335 36.813 -76.666 1.00 46.49 ? 165 ASN E C 1 ATOM 6391 O O . ASN C 1 170 ? -0.310 37.169 -77.227 1.00 46.93 ? 165 ASN E O 1 ATOM 6392 C CB . ASN C 1 170 ? -2.308 35.121 -78.258 1.00 45.41 ? 165 ASN E CB 1 ATOM 6393 C CG . ASN C 1 170 ? -2.058 33.926 -77.385 1.00 51.09 ? 165 ASN E CG 1 ATOM 6394 O OD1 . ASN C 1 170 ? -1.335 33.980 -76.386 1.00 59.40 ? 165 ASN E OD1 1 ATOM 6395 N ND2 . ASN C 1 170 ? -2.644 32.822 -77.764 1.00 54.02 ? 165 ASN E ND2 1 ATOM 6396 N N . ASN C 1 171 ? -1.439 36.772 -75.342 1.00 47.79 ? 166 ASN E N 1 ATOM 6397 C CA . ASN C 1 171 ? -0.272 37.068 -74.525 1.00 48.93 ? 166 ASN E CA 1 ATOM 6398 C C . ASN C 1 171 ? 0.749 35.892 -74.530 1.00 49.97 ? 166 ASN E C 1 ATOM 6399 O O . ASN C 1 171 ? 0.751 35.044 -73.660 1.00 43.12 ? 166 ASN E O 1 ATOM 6400 C CB . ASN C 1 171 ? -0.660 37.478 -73.104 1.00 44.19 ? 166 ASN E CB 1 ATOM 6401 C CG . ASN C 1 171 ? 0.532 37.847 -72.265 1.00 42.69 ? 166 ASN E CG 1 ATOM 6402 O OD1 . ASN C 1 171 ? 1.675 37.930 -72.751 1.00 45.21 ? 166 ASN E OD1 1 ATOM 6403 N ND2 . ASN C 1 171 ? 0.294 38.066 -70.999 1.00 43.23 ? 166 ASN E ND2 1 ATOM 6404 N N . THR C 1 172 ? 1.654 35.895 -75.497 1.00 52.17 ? 167 THR E N 1 ATOM 6405 C CA . THR C 1 172 ? 2.688 34.848 -75.563 1.00 53.12 ? 167 THR E CA 1 ATOM 6406 C C . THR C 1 172 ? 3.903 35.135 -74.680 1.00 53.17 ? 167 THR E C 1 ATOM 6407 O O . THR C 1 172 ? 4.844 34.376 -74.667 1.00 52.73 ? 167 THR E O 1 ATOM 6408 C CB . THR C 1 172 ? 3.196 34.678 -76.986 1.00 49.77 ? 167 THR E CB 1 ATOM 6409 O OG1 . THR C 1 172 ? 3.701 35.931 -77.428 1.00 46.17 ? 167 THR E OG1 1 ATOM 6410 C CG2 . THR C 1 172 ? 2.083 34.243 -77.902 1.00 51.69 ? 167 THR E CG2 1 ATOM 6411 N N . ASN C 1 173 ? 3.884 36.240 -73.957 1.00 53.68 ? 168 ASN E N 1 ATOM 6412 C CA . ASN C 1 173 ? 4.949 36.539 -73.027 1.00 49.35 ? 168 ASN E CA 1 ATOM 6413 C C . ASN C 1 173 ? 4.744 35.666 -71.788 1.00 50.49 ? 168 ASN E C 1 ATOM 6414 O O . ASN C 1 173 ? 3.737 34.982 -71.650 1.00 58.41 ? 168 ASN E O 1 ATOM 6415 C CB . ASN C 1 173 ? 4.954 38.037 -72.679 1.00 49.32 ? 168 ASN E CB 1 ATOM 6416 C CG . ASN C 1 173 ? 4.941 38.937 -73.930 1.00 52.93 ? 168 ASN E CG 1 ATOM 6417 O OD1 . ASN C 1 173 ? 5.975 39.192 -74.506 1.00 61.35 ? 168 ASN E OD1 1 ATOM 6418 N ND2 . ASN C 1 173 ? 3.771 39.469 -74.308 1.00 55.02 ? 168 ASN E ND2 1 ATOM 6419 N N . GLN C 1 174 ? 5.699 35.691 -70.888 1.00 54.12 ? 169 GLN E N 1 ATOM 6420 C CA . GLN C 1 174 ? 5.635 34.898 -69.655 1.00 61.95 ? 169 GLN E CA 1 ATOM 6421 C C . GLN C 1 174 ? 5.093 35.744 -68.508 1.00 53.68 ? 169 GLN E C 1 ATOM 6422 O O . GLN C 1 174 ? 4.886 35.243 -67.418 1.00 51.07 ? 169 GLN E O 1 ATOM 6423 C CB . GLN C 1 174 ? 7.020 34.343 -69.287 1.00 68.45 ? 169 GLN E CB 1 ATOM 6424 C CG . GLN C 1 174 ? 7.256 32.886 -69.694 1.00 72.53 ? 169 GLN E CG 1 ATOM 6425 C CD . GLN C 1 174 ? 6.882 32.585 -71.141 1.00 86.91 ? 169 GLN E CD 1 ATOM 6426 O OE1 . GLN C 1 174 ? 7.145 33.388 -72.049 1.00 100.40 ? 169 GLN E OE1 1 ATOM 6427 N NE2 . GLN C 1 174 ? 6.258 31.421 -71.369 1.00 87.01 ? 169 GLN E NE2 1 ATOM 6428 N N . GLU C 1 175 ? 4.839 37.015 -68.782 1.00 49.54 ? 170 GLU E N 1 ATOM 6429 C CA . GLU C 1 175 ? 4.367 37.941 -67.790 1.00 45.99 ? 170 GLU E CA 1 ATOM 6430 C C . GLU C 1 175 ? 2.973 38.435 -68.106 1.00 43.41 ? 170 GLU E C 1 ATOM 6431 O O . GLU C 1 175 ? 2.584 38.536 -69.261 1.00 43.06 ? 170 GLU E O 1 ATOM 6432 C CB . GLU C 1 175 ? 5.306 39.127 -67.732 1.00 52.06 ? 170 GLU E CB 1 ATOM 6433 C CG . GLU C 1 175 ? 6.534 38.825 -66.919 1.00 61.62 ? 170 GLU E CG 1 ATOM 6434 C CD . GLU C 1 175 ? 7.808 39.313 -67.541 1.00 72.33 ? 170 GLU E CD 1 ATOM 6435 O OE1 . GLU C 1 175 ? 8.215 38.744 -68.590 1.00 94.68 ? 170 GLU E OE1 1 ATOM 6436 O OE2 . GLU C 1 175 ? 8.405 40.219 -66.951 1.00 72.26 ? 170 GLU E OE2 1 ATOM 6437 N N . ASP C 1 176 ? 2.225 38.750 -67.054 1.00 41.00 ? 171 ASP E N 1 ATOM 6438 C CA . ASP C 1 176 ? 0.986 39.496 -67.211 1.00 39.62 ? 171 ASP E CA 1 ATOM 6439 C C . ASP C 1 176 ? 1.184 40.726 -68.073 1.00 38.12 ? 171 ASP E C 1 ATOM 6440 O O . ASP C 1 176 ? 2.191 41.378 -67.989 1.00 35.61 ? 171 ASP E O 1 ATOM 6441 C CB . ASP C 1 176 ? 0.488 39.987 -65.861 1.00 38.29 ? 171 ASP E CB 1 ATOM 6442 C CG . ASP C 1 176 ? -0.089 38.866 -64.982 1.00 39.46 ? 171 ASP E CG 1 ATOM 6443 O OD1 . ASP C 1 176 ? -0.316 37.738 -65.453 1.00 39.29 ? 171 ASP E OD1 1 ATOM 6444 O OD2 . ASP C 1 176 ? -0.301 39.127 -63.779 1.00 42.63 ? 171 ASP E OD2 1 ATOM 6445 N N . LEU C 1 177 ? 0.141 41.114 -68.799 1.00 38.28 ? 172 LEU E N 1 ATOM 6446 C CA . LEU C 1 177 ? 0.151 42.313 -69.593 1.00 36.26 ? 172 LEU E CA 1 ATOM 6447 C C . LEU C 1 177 ? -0.946 43.300 -69.146 1.00 36.30 ? 172 LEU E C 1 ATOM 6448 O O . LEU C 1 177 ? -2.117 42.940 -69.024 1.00 39.37 ? 172 LEU E O 1 ATOM 6449 C CB . LEU C 1 177 ? -0.097 41.876 -71.008 1.00 41.52 ? 172 LEU E CB 1 ATOM 6450 C CG . LEU C 1 177 ? 0.770 42.340 -72.164 1.00 46.08 ? 172 LEU E CG 1 ATOM 6451 C CD1 . LEU C 1 177 ? 2.243 42.210 -71.870 1.00 46.53 ? 172 LEU E CD1 1 ATOM 6452 C CD2 . LEU C 1 177 ? 0.371 41.488 -73.362 1.00 46.86 ? 172 LEU E CD2 1 ATOM 6453 N N . LEU C 1 178 ? -0.574 44.544 -68.848 1.00 34.02 ? 173 LEU E N 1 ATOM 6454 C CA . LEU C 1 178 ? -1.554 45.595 -68.601 1.00 33.51 ? 173 LEU E CA 1 ATOM 6455 C C . LEU C 1 178 ? -1.916 46.190 -69.951 1.00 36.56 ? 173 LEU E C 1 ATOM 6456 O O . LEU C 1 178 ? -1.057 46.767 -70.625 1.00 42.35 ? 173 LEU E O 1 ATOM 6457 C CB . LEU C 1 178 ? -0.992 46.679 -67.685 1.00 31.72 ? 173 LEU E CB 1 ATOM 6458 C CG . LEU C 1 178 ? -1.713 48.019 -67.585 1.00 31.20 ? 173 LEU E CG 1 ATOM 6459 C CD1 . LEU C 1 178 ? -3.090 47.835 -67.035 1.00 32.88 ? 173 LEU E CD1 1 ATOM 6460 C CD2 . LEU C 1 178 ? -0.943 48.976 -66.667 1.00 32.27 ? 173 LEU E CD2 1 ATOM 6461 N N . ILE C 1 179 ? -3.175 46.055 -70.335 1.00 35.45 ? 174 ILE E N 1 ATOM 6462 C CA . ILE C 1 179 ? -3.664 46.594 -71.597 1.00 35.42 ? 174 ILE E CA 1 ATOM 6463 C C . ILE C 1 179 ? -4.706 47.651 -71.356 1.00 34.70 ? 174 ILE E C 1 ATOM 6464 O O . ILE C 1 179 ? -5.550 47.505 -70.486 1.00 50.25 ? 174 ILE E O 1 ATOM 6465 C CB . ILE C 1 179 ? -4.216 45.470 -72.492 1.00 33.63 ? 174 ILE E CB 1 ATOM 6466 C CG1 . ILE C 1 179 ? -3.170 44.368 -72.657 1.00 34.03 ? 174 ILE E CG1 1 ATOM 6467 C CG2 . ILE C 1 179 ? -4.635 46.013 -73.841 1.00 32.99 ? 174 ILE E CG2 1 ATOM 6468 C CD1 . ILE C 1 179 ? -3.611 43.227 -73.527 1.00 35.96 ? 174 ILE E CD1 1 ATOM 6469 N N . LEU C 1 180 ? -4.651 48.701 -72.156 1.00 38.45 ? 175 LEU E N 1 ATOM 6470 C CA . LEU C 1 180 ? -5.584 49.841 -72.132 1.00 40.26 ? 175 LEU E CA 1 ATOM 6471 C C . LEU C 1 180 ? -6.155 50.173 -73.505 1.00 39.30 ? 175 LEU E C 1 ATOM 6472 O O . LEU C 1 180 ? -5.458 50.067 -74.505 1.00 39.14 ? 175 LEU E O 1 ATOM 6473 C CB . LEU C 1 180 ? -4.917 51.123 -71.618 1.00 36.62 ? 175 LEU E CB 1 ATOM 6474 C CG . LEU C 1 180 ? -4.329 50.956 -70.214 1.00 38.68 ? 175 LEU E CG 1 ATOM 6475 C CD1 . LEU C 1 180 ? -2.808 50.969 -70.269 1.00 39.08 ? 175 LEU E CD1 1 ATOM 6476 C CD2 . LEU C 1 180 ? -4.783 52.065 -69.316 1.00 36.32 ? 175 LEU E CD2 1 ATOM 6477 N N . TRP C 1 181 ? -7.424 50.592 -73.504 1.00 37.82 ? 176 TRP E N 1 ATOM 6478 C CA . TRP C 1 181 ? -8.169 50.987 -74.710 1.00 38.74 ? 176 TRP E CA 1 ATOM 6479 C C . TRP C 1 181 ? -9.258 51.939 -74.243 1.00 37.75 ? 176 TRP E C 1 ATOM 6480 O O . TRP C 1 181 ? -9.431 52.131 -73.039 1.00 41.32 ? 176 TRP E O 1 ATOM 6481 C CB . TRP C 1 181 ? -8.821 49.795 -75.395 1.00 39.63 ? 176 TRP E CB 1 ATOM 6482 C CG . TRP C 1 181 ? -9.828 49.140 -74.528 1.00 42.48 ? 176 TRP E CG 1 ATOM 6483 C CD1 . TRP C 1 181 ? -11.162 49.374 -74.497 1.00 42.57 ? 176 TRP E CD1 1 ATOM 6484 C CD2 . TRP C 1 181 ? -9.562 48.162 -73.510 1.00 42.57 ? 176 TRP E CD2 1 ATOM 6485 N NE1 . TRP C 1 181 ? -11.751 48.585 -73.530 1.00 44.80 ? 176 TRP E NE1 1 ATOM 6486 C CE2 . TRP C 1 181 ? -10.790 47.826 -72.924 1.00 42.39 ? 176 TRP E CE2 1 ATOM 6487 C CE3 . TRP C 1 181 ? -8.407 47.532 -73.065 1.00 42.06 ? 176 TRP E CE3 1 ATOM 6488 C CZ2 . TRP C 1 181 ? -10.904 46.909 -71.893 1.00 46.38 ? 176 TRP E CZ2 1 ATOM 6489 C CZ3 . TRP C 1 181 ? -8.513 46.612 -72.038 1.00 48.85 ? 176 TRP E CZ3 1 ATOM 6490 C CH2 . TRP C 1 181 ? -9.759 46.305 -71.459 1.00 49.41 ? 176 TRP E CH2 1 ATOM 6491 N N . GLY C 1 182 ? -9.980 52.542 -75.180 1.00 36.50 ? 177 GLY E N 1 ATOM 6492 C CA . GLY C 1 182 ? -10.948 53.568 -74.846 1.00 34.22 ? 177 GLY E CA 1 ATOM 6493 C C . GLY C 1 182 ? -12.077 53.670 -75.836 1.00 35.13 ? 177 GLY E C 1 ATOM 6494 O O . GLY C 1 182 ? -12.061 53.030 -76.897 1.00 34.57 ? 177 GLY E O 1 ATOM 6495 N N . VAL C 1 183 ? -13.100 54.423 -75.436 1.00 36.48 ? 178 VAL E N 1 ATOM 6496 C CA . VAL C 1 183 ? -14.261 54.734 -76.281 1.00 36.96 ? 178 VAL E CA 1 ATOM 6497 C C . VAL C 1 183 ? -14.358 56.236 -76.372 1.00 40.65 ? 178 VAL E C 1 ATOM 6498 O O . VAL C 1 183 ? -14.146 56.955 -75.380 1.00 44.22 ? 178 VAL E O 1 ATOM 6499 C CB . VAL C 1 183 ? -15.594 54.165 -75.749 1.00 36.53 ? 178 VAL E CB 1 ATOM 6500 C CG1 . VAL C 1 183 ? -15.932 54.679 -74.350 1.00 38.35 ? 178 VAL E CG1 1 ATOM 6501 C CG2 . VAL C 1 183 ? -16.722 54.499 -76.691 1.00 35.84 ? 178 VAL E CG2 1 ATOM 6502 N N . HIS C 1 184 ? -14.616 56.702 -77.591 1.00 44.12 ? 179 HIS E N 1 ATOM 6503 C CA . HIS C 1 184 ? -14.781 58.127 -77.873 1.00 46.75 ? 179 HIS E CA 1 ATOM 6504 C C . HIS C 1 184 ? -16.239 58.455 -77.899 1.00 45.48 ? 179 HIS E C 1 ATOM 6505 O O . HIS C 1 184 ? -16.977 57.919 -78.709 1.00 44.01 ? 179 HIS E O 1 ATOM 6506 C CB . HIS C 1 184 ? -14.124 58.542 -79.206 1.00 47.55 ? 179 HIS E CB 1 ATOM 6507 C CG . HIS C 1 184 ? -14.379 59.967 -79.575 1.00 47.63 ? 179 HIS E CG 1 ATOM 6508 N ND1 . HIS C 1 184 ? -14.798 60.355 -80.832 1.00 50.10 ? 179 HIS E ND1 1 ATOM 6509 C CD2 . HIS C 1 184 ? -14.268 61.100 -78.846 1.00 49.25 ? 179 HIS E CD2 1 ATOM 6510 C CE1 . HIS C 1 184 ? -14.944 61.668 -80.857 1.00 50.82 ? 179 HIS E CE1 1 ATOM 6511 N NE2 . HIS C 1 184 ? -14.619 62.145 -79.668 1.00 51.24 ? 179 HIS E NE2 1 ATOM 6512 N N . HIS C 1 185 ? -16.639 59.339 -76.996 1.00 46.45 ? 180 HIS E N 1 ATOM 6513 C CA . HIS C 1 185 ? -17.980 59.905 -76.999 1.00 48.34 ? 180 HIS E CA 1 ATOM 6514 C C . HIS C 1 185 ? -18.009 61.146 -77.890 1.00 45.75 ? 180 HIS E C 1 ATOM 6515 O O . HIS C 1 185 ? -17.411 62.168 -77.548 1.00 45.25 ? 180 HIS E O 1 ATOM 6516 C CB . HIS C 1 185 ? -18.366 60.318 -75.587 1.00 50.10 ? 180 HIS E CB 1 ATOM 6517 C CG . HIS C 1 185 ? -18.325 59.201 -74.602 1.00 46.67 ? 180 HIS E CG 1 ATOM 6518 N ND1 . HIS C 1 185 ? -19.148 58.110 -74.690 1.00 43.65 ? 180 HIS E ND1 1 ATOM 6519 C CD2 . HIS C 1 185 ? -17.562 59.009 -73.505 1.00 47.84 ? 180 HIS E CD2 1 ATOM 6520 C CE1 . HIS C 1 185 ? -18.882 57.276 -73.709 1.00 45.11 ? 180 HIS E CE1 1 ATOM 6521 N NE2 . HIS C 1 185 ? -17.946 57.816 -72.954 1.00 47.42 ? 180 HIS E NE2 1 ATOM 6522 N N . SER C 1 186 ? -18.658 61.016 -79.044 1.00 47.78 ? 181 SER E N 1 ATOM 6523 C CA . SER C 1 186 ? -18.728 62.073 -80.033 1.00 47.02 ? 181 SER E CA 1 ATOM 6524 C C . SER C 1 186 ? -19.842 62.999 -79.622 1.00 48.05 ? 181 SER E C 1 ATOM 6525 O O . SER C 1 186 ? -20.589 62.674 -78.711 1.00 45.22 ? 181 SER E O 1 ATOM 6526 C CB . SER C 1 186 ? -18.991 61.507 -81.424 1.00 46.94 ? 181 SER E CB 1 ATOM 6527 O OG . SER C 1 186 ? -20.097 60.610 -81.438 1.00 46.69 ? 181 SER E OG 1 ATOM 6528 N N . ASN C 1 187 ? -19.942 64.153 -80.284 1.00 53.70 ? 182 ASN E N 1 ATOM 6529 C CA . ASN C 1 187 ? -20.853 65.251 -79.867 1.00 54.62 ? 182 ASN E CA 1 ATOM 6530 C C . ASN C 1 187 ? -22.228 65.327 -80.539 1.00 51.38 ? 182 ASN E C 1 ATOM 6531 O O . ASN C 1 187 ? -23.151 65.862 -79.970 1.00 49.99 ? 182 ASN E O 1 ATOM 6532 C CB . ASN C 1 187 ? -20.131 66.572 -80.034 1.00 59.11 ? 182 ASN E CB 1 ATOM 6533 C CG . ASN C 1 187 ? -18.880 66.636 -79.208 1.00 61.79 ? 182 ASN E CG 1 ATOM 6534 O OD1 . ASN C 1 187 ? -18.881 66.220 -78.054 1.00 72.65 ? 182 ASN E OD1 1 ATOM 6535 N ND2 . ASN C 1 187 ? -17.806 67.132 -79.784 1.00 63.12 ? 182 ASN E ND2 1 ATOM 6536 N N . ASN C 1 188 ? -22.348 64.762 -81.732 1.00 51.70 ? 183 ASN E N 1 ATOM 6537 C CA . ASN C 1 188 ? -23.599 64.744 -82.481 1.00 52.98 ? 183 ASN E CA 1 ATOM 6538 C C . ASN C 1 188 ? -23.486 63.833 -83.689 1.00 57.57 ? 183 ASN E C 1 ATOM 6539 O O . ASN C 1 188 ? -22.377 63.395 -84.058 1.00 62.84 ? 183 ASN E O 1 ATOM 6540 C CB . ASN C 1 188 ? -23.974 66.160 -82.957 1.00 59.47 ? 183 ASN E CB 1 ATOM 6541 C CG . ASN C 1 188 ? -22.854 66.842 -83.714 1.00 61.45 ? 183 ASN E CG 1 ATOM 6542 O OD1 . ASN C 1 188 ? -22.434 66.414 -84.801 1.00 61.35 ? 183 ASN E OD1 1 ATOM 6543 N ND2 . ASN C 1 188 ? -22.337 67.901 -83.124 1.00 60.29 ? 183 ASN E ND2 1 ATOM 6544 N N . ALA C 1 189 ? -24.623 63.594 -84.337 1.00 57.13 ? 184 ALA E N 1 ATOM 6545 C CA . ALA C 1 189 ? -24.694 62.690 -85.499 1.00 59.38 ? 184 ALA E CA 1 ATOM 6546 C C . ALA C 1 189 ? -23.741 63.047 -86.636 1.00 60.14 ? 184 ALA E C 1 ATOM 6547 O O . ALA C 1 189 ? -23.157 62.158 -87.258 1.00 60.92 ? 184 ALA E O 1 ATOM 6548 C CB . ALA C 1 189 ? -26.122 62.626 -86.029 1.00 58.59 ? 184 ALA E CB 1 ATOM 6549 N N . ALA C 1 190 ? -23.587 64.338 -86.913 1.00 60.94 ? 185 ALA E N 1 ATOM 6550 C CA . ALA C 1 190 ? -22.710 64.778 -88.013 1.00 66.64 ? 185 ALA E CA 1 ATOM 6551 C C . ALA C 1 190 ? -21.241 64.446 -87.742 1.00 64.32 ? 185 ALA E C 1 ATOM 6552 O O . ALA C 1 190 ? -20.557 63.926 -88.612 1.00 70.42 ? 185 ALA E O 1 ATOM 6553 C CB . ALA C 1 190 ? -22.860 66.273 -88.265 1.00 67.69 ? 185 ALA E CB 1 ATOM 6554 N N . GLU C 1 191 ? -20.786 64.722 -86.527 1.00 59.68 ? 186 GLU E N 1 ATOM 6555 C CA . GLU C 1 191 ? -19.424 64.422 -86.135 1.00 57.27 ? 186 GLU E CA 1 ATOM 6556 C C . GLU C 1 191 ? -19.189 62.915 -86.172 1.00 55.44 ? 186 GLU E C 1 ATOM 6557 O O . GLU C 1 191 ? -18.134 62.447 -86.653 1.00 53.94 ? 186 GLU E O 1 ATOM 6558 C CB . GLU C 1 191 ? -19.153 64.981 -84.750 1.00 64.17 ? 186 GLU E CB 1 ATOM 6559 C CG . GLU C 1 191 ? -17.769 64.681 -84.203 1.00 72.78 ? 186 GLU E CG 1 ATOM 6560 C CD . GLU C 1 191 ? -17.516 65.384 -82.887 1.00 81.16 ? 186 GLU E CD 1 ATOM 6561 O OE1 . GLU C 1 191 ? -17.487 66.639 -82.880 1.00 87.63 ? 186 GLU E OE1 1 ATOM 6562 O OE2 . GLU C 1 191 ? -17.358 64.671 -81.866 1.00 84.92 ? 186 GLU E OE2 1 ATOM 6563 N N . GLN C 1 192 ? -20.193 62.163 -85.711 1.00 50.21 ? 187 GLN E N 1 ATOM 6564 C CA . GLN C 1 192 ? -20.153 60.698 -85.708 1.00 47.75 ? 187 GLN E CA 1 ATOM 6565 C C . GLN C 1 192 ? -19.928 60.122 -87.107 1.00 50.52 ? 187 GLN E C 1 ATOM 6566 O O . GLN C 1 192 ? -19.009 59.303 -87.305 1.00 52.20 ? 187 GLN E O 1 ATOM 6567 C CB . GLN C 1 192 ? -21.443 60.130 -85.094 1.00 49.14 ? 187 GLN E CB 1 ATOM 6568 C CG . GLN C 1 192 ? -21.519 58.605 -84.955 1.00 46.86 ? 187 GLN E CG 1 ATOM 6569 C CD . GLN C 1 192 ? -20.426 58.026 -84.054 1.00 48.78 ? 187 GLN E CD 1 ATOM 6570 O OE1 . GLN C 1 192 ? -19.925 58.681 -83.118 1.00 48.26 ? 187 GLN E OE1 1 ATOM 6571 N NE2 . GLN C 1 192 ? -20.055 56.793 -84.337 1.00 44.42 ? 187 GLN E NE2 1 ATOM 6572 N N . THR C 1 193 ? -20.718 60.555 -88.089 1.00 53.42 ? 188 THR E N 1 ATOM 6573 C CA . THR C 1 193 ? -20.503 60.062 -89.475 1.00 56.98 ? 188 THR E CA 1 ATOM 6574 C C . THR C 1 193 ? -19.224 60.644 -90.036 1.00 51.95 ? 188 THR E C 1 ATOM 6575 O O . THR C 1 193 ? -18.481 60.005 -90.768 1.00 53.40 ? 188 THR E O 1 ATOM 6576 C CB . THR C 1 193 ? -21.699 60.318 -90.418 1.00 59.38 ? 188 THR E CB 1 ATOM 6577 O OG1 . THR C 1 193 ? -22.008 61.704 -90.431 1.00 69.64 ? 188 THR E OG1 1 ATOM 6578 C CG2 . THR C 1 193 ? -22.927 59.591 -89.923 1.00 62.72 ? 188 THR E CG2 1 ATOM 6579 N N . ASN C 1 194 ? -18.914 61.851 -89.646 1.00 56.04 ? 189 ASN E N 1 ATOM 6580 C CA . ASN C 1 194 ? -17.677 62.467 -90.128 1.00 62.07 ? 189 ASN E CA 1 ATOM 6581 C C . ASN C 1 194 ? -16.416 61.723 -89.763 1.00 63.23 ? 189 ASN E C 1 ATOM 6582 O O . ASN C 1 194 ? -15.466 61.692 -90.546 1.00 69.94 ? 189 ASN E O 1 ATOM 6583 C CB . ASN C 1 194 ? -17.561 63.843 -89.527 1.00 68.91 ? 189 ASN E CB 1 ATOM 6584 C CG . ASN C 1 194 ? -17.193 64.846 -90.533 1.00 76.63 ? 189 ASN E CG 1 ATOM 6585 O OD1 . ASN C 1 194 ? -18.074 65.533 -91.074 1.00 86.17 ? 189 ASN E OD1 1 ATOM 6586 N ND2 . ASN C 1 194 ? -15.895 64.916 -90.853 1.00 75.72 ? 189 ASN E ND2 1 ATOM 6587 N N . LEU C 1 195 ? -16.400 61.170 -88.543 1.00 59.99 ? 190 LEU E N 1 ATOM 6588 C CA . LEU C 1 195 ? -15.234 60.441 -88.016 1.00 57.58 ? 190 LEU E CA 1 ATOM 6589 C C . LEU C 1 195 ? -15.267 58.949 -88.279 1.00 53.37 ? 190 LEU E C 1 ATOM 6590 O O . LEU C 1 195 ? -14.237 58.351 -88.553 1.00 51.46 ? 190 LEU E O 1 ATOM 6591 C CB . LEU C 1 195 ? -15.127 60.630 -86.514 1.00 58.18 ? 190 LEU E CB 1 ATOM 6592 C CG . LEU C 1 195 ? -14.858 62.056 -86.051 1.00 57.24 ? 190 LEU E CG 1 ATOM 6593 C CD1 . LEU C 1 195 ? -14.916 62.046 -84.547 1.00 54.42 ? 190 LEU E CD1 1 ATOM 6594 C CD2 . LEU C 1 195 ? -13.504 62.576 -86.519 1.00 57.11 ? 190 LEU E CD2 1 ATOM 6595 N N . TYR C 1 196 ? -16.455 58.363 -88.212 1.00 51.46 ? 191 TYR E N 1 ATOM 6596 C CA . TYR C 1 196 ? -16.590 56.902 -88.214 1.00 54.07 ? 191 TYR E CA 1 ATOM 6597 C C . TYR C 1 196 ? -17.584 56.321 -89.218 1.00 55.71 ? 191 TYR E C 1 ATOM 6598 O O . TYR C 1 196 ? -17.711 55.095 -89.305 1.00 56.22 ? 191 TYR E O 1 ATOM 6599 C CB . TYR C 1 196 ? -16.999 56.417 -86.800 1.00 52.13 ? 191 TYR E CB 1 ATOM 6600 C CG . TYR C 1 196 ? -16.183 57.013 -85.683 1.00 46.21 ? 191 TYR E CG 1 ATOM 6601 C CD1 . TYR C 1 196 ? -14.830 56.727 -85.567 1.00 46.40 ? 191 TYR E CD1 1 ATOM 6602 C CD2 . TYR C 1 196 ? -16.754 57.875 -84.756 1.00 46.07 ? 191 TYR E CD2 1 ATOM 6603 C CE1 . TYR C 1 196 ? -14.057 57.279 -84.549 1.00 47.79 ? 191 TYR E CE1 1 ATOM 6604 C CE2 . TYR C 1 196 ? -15.989 58.431 -83.734 1.00 47.55 ? 191 TYR E CE2 1 ATOM 6605 C CZ . TYR C 1 196 ? -14.636 58.127 -83.645 1.00 45.34 ? 191 TYR E CZ 1 ATOM 6606 O OH . TYR C 1 196 ? -13.868 58.636 -82.652 1.00 42.61 ? 191 TYR E OH 1 ATOM 6607 N N . LYS C 1 197 ? -18.303 57.180 -89.941 1.00 56.45 ? 192 LYS E N 1 ATOM 6608 C CA . LYS C 1 197 ? -19.290 56.769 -90.934 1.00 60.81 ? 192 LYS E CA 1 ATOM 6609 C C . LYS C 1 197 ? -20.512 56.124 -90.293 1.00 59.67 ? 192 LYS E C 1 ATOM 6610 O O . LYS C 1 197 ? -21.623 56.635 -90.400 1.00 63.29 ? 192 LYS E O 1 ATOM 6611 C CB . LYS C 1 197 ? -18.647 55.799 -91.926 1.00 70.53 ? 192 LYS E CB 1 ATOM 6612 C CG . LYS C 1 197 ? -19.569 55.288 -93.021 1.00 72.51 ? 192 LYS E CG 1 ATOM 6613 C CD . LYS C 1 197 ? -19.860 56.387 -94.022 1.00 79.07 ? 192 LYS E CD 1 ATOM 6614 C CE . LYS C 1 197 ? -20.485 55.851 -95.293 1.00 83.08 ? 192 LYS E CE 1 ATOM 6615 N NZ . LYS C 1 197 ? -21.404 56.887 -95.815 1.00 89.37 ? 192 LYS E NZ 1 ATOM 6616 N N . ASN C 1 198 ? -20.283 55.013 -89.589 1.00 58.45 ? 193 ASN E N 1 ATOM 6617 C CA . ASN C 1 198 ? -21.359 54.256 -88.969 1.00 55.33 ? 193 ASN E CA 1 ATOM 6618 C C . ASN C 1 198 ? -21.968 55.060 -87.835 1.00 52.91 ? 193 ASN E C 1 ATOM 6619 O O . ASN C 1 198 ? -21.261 55.533 -86.987 1.00 57.39 ? 193 ASN E O 1 ATOM 6620 C CB . ASN C 1 198 ? -20.841 52.920 -88.481 1.00 52.52 ? 193 ASN E CB 1 ATOM 6621 C CG . ASN C 1 198 ? -20.096 52.169 -89.560 1.00 55.98 ? 193 ASN E CG 1 ATOM 6622 O OD1 . ASN C 1 198 ? -20.542 52.148 -90.710 1.00 59.96 ? 193 ASN E OD1 1 ATOM 6623 N ND2 . ASN C 1 198 ? -18.940 51.591 -89.227 1.00 51.75 ? 193 ASN E ND2 1 ATOM 6624 N N . PRO C 1 199 ? -23.283 55.273 -87.854 1.00 57.20 ? 194 PRO E N 1 ATOM 6625 C CA . PRO C 1 199 ? -23.917 56.095 -86.801 1.00 57.97 ? 194 PRO E CA 1 ATOM 6626 C C . PRO C 1 199 ? -24.109 55.413 -85.431 1.00 56.07 ? 194 PRO E C 1 ATOM 6627 O O . PRO C 1 199 ? -23.997 56.063 -84.413 1.00 51.40 ? 194 PRO E O 1 ATOM 6628 C CB . PRO C 1 199 ? -25.293 56.423 -87.410 1.00 53.87 ? 194 PRO E CB 1 ATOM 6629 C CG . PRO C 1 199 ? -25.583 55.257 -88.300 1.00 55.75 ? 194 PRO E CG 1 ATOM 6630 C CD . PRO C 1 199 ? -24.245 54.931 -88.923 1.00 58.75 ? 194 PRO E CD 1 ATOM 6631 N N . THR C 1 200 ? -24.421 54.125 -85.456 1.00 54.17 ? 195 THR E N 1 ATOM 6632 C CA . THR C 1 200 ? -24.710 53.351 -84.280 1.00 58.49 ? 195 THR E CA 1 ATOM 6633 C C . THR C 1 200 ? -23.553 52.365 -84.043 1.00 55.75 ? 195 THR E C 1 ATOM 6634 O O . THR C 1 200 ? -23.413 51.378 -84.758 1.00 49.86 ? 195 THR E O 1 ATOM 6635 C CB . THR C 1 200 ? -26.044 52.609 -84.482 1.00 61.43 ? 195 THR E CB 1 ATOM 6636 O OG1 . THR C 1 200 ? -27.091 53.581 -84.566 1.00 63.92 ? 195 THR E OG1 1 ATOM 6637 C CG2 . THR C 1 200 ? -26.355 51.647 -83.325 1.00 64.61 ? 195 THR E CG2 1 ATOM 6638 N N . THR C 1 201 ? -22.733 52.641 -83.039 1.00 50.56 ? 196 THR E N 1 ATOM 6639 C CA . THR C 1 201 ? -21.502 51.896 -82.877 1.00 48.58 ? 196 THR E CA 1 ATOM 6640 C C . THR C 1 201 ? -21.353 51.303 -81.498 1.00 47.33 ? 196 THR E C 1 ATOM 6641 O O . THR C 1 201 ? -22.122 51.603 -80.575 1.00 41.95 ? 196 THR E O 1 ATOM 6642 C CB . THR C 1 201 ? -20.281 52.775 -83.169 1.00 49.46 ? 196 THR E CB 1 ATOM 6643 O OG1 . THR C 1 201 ? -20.231 53.852 -82.239 1.00 45.87 ? 196 THR E OG1 1 ATOM 6644 C CG2 . THR C 1 201 ? -20.363 53.348 -84.588 1.00 50.69 ? 196 THR E CG2 1 ATOM 6645 N N . TYR C 1 202 ? -20.364 50.423 -81.384 1.00 44.65 ? 197 TYR E N 1 ATOM 6646 C CA . TYR C 1 202 ? -20.086 49.700 -80.157 1.00 42.89 ? 197 TYR E CA 1 ATOM 6647 C C . TYR C 1 202 ? -18.635 49.241 -80.143 1.00 42.98 ? 197 TYR E C 1 ATOM 6648 O O . TYR C 1 202 ? -17.943 49.242 -81.168 1.00 40.09 ? 197 TYR E O 1 ATOM 6649 C CB . TYR C 1 202 ? -20.996 48.473 -80.032 1.00 43.69 ? 197 TYR E CB 1 ATOM 6650 C CG . TYR C 1 202 ? -20.702 47.438 -81.082 1.00 44.47 ? 197 TYR E CG 1 ATOM 6651 C CD1 . TYR C 1 202 ? -21.281 47.529 -82.348 1.00 46.43 ? 197 TYR E CD1 1 ATOM 6652 C CD2 . TYR C 1 202 ? -19.822 46.388 -80.832 1.00 44.12 ? 197 TYR E CD2 1 ATOM 6653 C CE1 . TYR C 1 202 ? -21.014 46.597 -83.330 1.00 45.44 ? 197 TYR E CE1 1 ATOM 6654 C CE2 . TYR C 1 202 ? -19.541 45.455 -81.812 1.00 43.54 ? 197 TYR E CE2 1 ATOM 6655 C CZ . TYR C 1 202 ? -20.146 45.565 -83.062 1.00 46.54 ? 197 TYR E CZ 1 ATOM 6656 O OH . TYR C 1 202 ? -19.874 44.656 -84.079 1.00 50.43 ? 197 TYR E OH 1 ATOM 6657 N N . ILE C 1 203 ? -18.176 48.886 -78.950 1.00 41.00 ? 198 ILE E N 1 ATOM 6658 C CA . ILE C 1 203 ? -16.939 48.148 -78.780 1.00 40.65 ? 198 ILE E CA 1 ATOM 6659 C C . ILE C 1 203 ? -17.203 46.961 -77.856 1.00 37.66 ? 198 ILE E C 1 ATOM 6660 O O . ILE C 1 203 ? -17.756 47.129 -76.776 1.00 36.83 ? 198 ILE E O 1 ATOM 6661 C CB . ILE C 1 203 ? -15.850 49.001 -78.136 1.00 41.65 ? 198 ILE E CB 1 ATOM 6662 C CG1 . ILE C 1 203 ? -15.568 50.228 -78.983 1.00 43.19 ? 198 ILE E CG1 1 ATOM 6663 C CG2 . ILE C 1 203 ? -14.578 48.187 -77.920 1.00 38.58 ? 198 ILE E CG2 1 ATOM 6664 C CD1 . ILE C 1 203 ? -15.014 51.361 -78.137 1.00 45.55 ? 198 ILE E CD1 1 ATOM 6665 N N . SER C 1 204 ? -16.745 45.787 -78.260 1.00 36.18 ? 199 SER E N 1 ATOM 6666 C CA . SER C 1 204 ? -16.815 44.603 -77.403 1.00 37.90 ? 199 SER E CA 1 ATOM 6667 C C . SER C 1 204 ? -15.406 44.154 -77.065 1.00 37.45 ? 199 SER E C 1 ATOM 6668 O O . SER C 1 204 ? -14.540 44.080 -77.947 1.00 42.40 ? 199 SER E O 1 ATOM 6669 C CB . SER C 1 204 ? -17.546 43.453 -78.100 1.00 36.81 ? 199 SER E CB 1 ATOM 6670 O OG . SER C 1 204 ? -18.882 43.798 -78.301 1.00 41.87 ? 199 SER E OG 1 ATOM 6671 N N . VAL C 1 205 ? -15.191 43.790 -75.819 1.00 37.16 ? 200 VAL E N 1 ATOM 6672 C CA . VAL C 1 205 ? -13.879 43.327 -75.388 1.00 36.06 ? 200 VAL E CA 1 ATOM 6673 C C . VAL C 1 205 ? -14.072 42.080 -74.551 1.00 37.29 ? 200 VAL E C 1 ATOM 6674 O O . VAL C 1 205 ? -14.894 42.068 -73.633 1.00 38.10 ? 200 VAL E O 1 ATOM 6675 C CB . VAL C 1 205 ? -13.195 44.389 -74.564 1.00 36.82 ? 200 VAL E CB 1 ATOM 6676 C CG1 . VAL C 1 205 ? -11.725 44.058 -74.349 1.00 43.54 ? 200 VAL E CG1 1 ATOM 6677 C CG2 . VAL C 1 205 ? -13.312 45.739 -75.267 1.00 36.32 ? 200 VAL E CG2 1 ATOM 6678 N N . GLY C 1 206 ? -13.343 41.024 -74.898 1.00 34.83 ? 201 GLY E N 1 ATOM 6679 C CA . GLY C 1 206 ? -13.470 39.741 -74.226 1.00 34.16 ? 201 GLY E CA 1 ATOM 6680 C C . GLY C 1 206 ? -12.122 39.103 -73.947 1.00 32.70 ? 201 GLY E C 1 ATOM 6681 O O . GLY C 1 206 ? -11.240 39.143 -74.799 1.00 33.86 ? 201 GLY E O 1 ATOM 6682 N N . THR C 1 207 ? -11.974 38.533 -72.749 1.00 29.79 ? 202 THR E N 1 ATOM 6683 C CA . THR C 1 207 ? -10.842 37.678 -72.406 1.00 31.66 ? 202 THR E CA 1 ATOM 6684 C C . THR C 1 207 ? -11.404 36.407 -71.775 1.00 33.28 ? 202 THR E C 1 ATOM 6685 O O . THR C 1 207 ? -12.539 36.023 -72.059 1.00 34.31 ? 202 THR E O 1 ATOM 6686 C CB . THR C 1 207 ? -9.835 38.375 -71.451 1.00 33.41 ? 202 THR E CB 1 ATOM 6687 O OG1 . THR C 1 207 ? -10.388 38.517 -70.138 1.00 37.50 ? 202 THR E OG1 1 ATOM 6688 C CG2 . THR C 1 207 ? -9.453 39.755 -71.966 1.00 33.84 ? 202 THR E CG2 1 ATOM 6689 N N . SER C 1 208 ? -10.642 35.751 -70.918 1.00 32.76 ? 203 SER E N 1 ATOM 6690 C CA . SER C 1 208 ? -11.188 34.629 -70.220 1.00 33.97 ? 203 SER E CA 1 ATOM 6691 C C . SER C 1 208 ? -12.074 35.078 -69.067 1.00 35.45 ? 203 SER E C 1 ATOM 6692 O O . SER C 1 208 ? -12.945 34.316 -68.645 1.00 35.40 ? 203 SER E O 1 ATOM 6693 C CB . SER C 1 208 ? -10.083 33.691 -69.721 1.00 35.52 ? 203 SER E CB 1 ATOM 6694 O OG . SER C 1 208 ? -9.311 34.312 -68.759 1.00 34.91 ? 203 SER E OG 1 ATOM 6695 N N . THR C 1 209 ? -11.899 36.320 -68.613 1.00 35.45 ? 204 THR E N 1 ATOM 6696 C CA . THR C 1 209 ? -12.712 36.879 -67.519 1.00 36.43 ? 204 THR E CA 1 ATOM 6697 C C . THR C 1 209 ? -13.498 38.089 -67.929 1.00 39.82 ? 204 THR E C 1 ATOM 6698 O O . THR C 1 209 ? -14.573 38.347 -67.386 1.00 41.16 ? 204 THR E O 1 ATOM 6699 C CB . THR C 1 209 ? -11.841 37.295 -66.315 1.00 36.54 ? 204 THR E CB 1 ATOM 6700 O OG1 . THR C 1 209 ? -10.758 38.166 -66.746 1.00 33.87 ? 204 THR E OG1 1 ATOM 6701 C CG2 . THR C 1 209 ? -11.268 36.037 -65.659 1.00 33.55 ? 204 THR E CG2 1 ATOM 6702 N N . LEU C 1 210 ? -12.956 38.864 -68.866 1.00 38.96 ? 205 LEU E N 1 ATOM 6703 C CA . LEU C 1 210 ? -13.568 40.150 -69.200 1.00 35.82 ? 205 LEU E CA 1 ATOM 6704 C C . LEU C 1 210 ? -14.678 39.946 -70.193 1.00 32.87 ? 205 LEU E C 1 ATOM 6705 O O . LEU C 1 210 ? -14.541 39.159 -71.127 1.00 29.80 ? 205 LEU E O 1 ATOM 6706 C CB . LEU C 1 210 ? -12.525 41.072 -69.781 1.00 37.67 ? 205 LEU E CB 1 ATOM 6707 C CG . LEU C 1 210 ? -12.973 42.497 -70.101 1.00 38.81 ? 205 LEU E CG 1 ATOM 6708 C CD1 . LEU C 1 210 ? -13.250 43.250 -68.799 1.00 40.11 ? 205 LEU E CD1 1 ATOM 6709 C CD2 . LEU C 1 210 ? -11.898 43.203 -70.905 1.00 37.98 ? 205 LEU E CD2 1 ATOM 6710 N N . ASN C 1 211 ? -15.757 40.680 -70.041 1.00 30.95 ? 206 ASN E N 1 ATOM 6711 C CA . ASN C 1 211 ? -16.876 40.601 -71.029 1.00 32.45 ? 206 ASN E CA 1 ATOM 6712 C C . ASN C 1 211 ? -17.541 41.953 -71.121 1.00 33.41 ? 206 ASN E C 1 ATOM 6713 O O . ASN C 1 211 ? -18.549 42.200 -70.463 1.00 36.41 ? 206 ASN E O 1 ATOM 6714 C CB . ASN C 1 211 ? -17.886 39.567 -70.532 1.00 34.33 ? 206 ASN E CB 1 ATOM 6715 C CG . ASN C 1 211 ? -18.989 39.296 -71.523 1.00 33.47 ? 206 ASN E CG 1 ATOM 6716 O OD1 . ASN C 1 211 ? -18.891 39.622 -72.708 1.00 35.59 ? 206 ASN E OD1 1 ATOM 6717 N ND2 . ASN C 1 211 ? -20.022 38.623 -71.054 1.00 33.51 ? 206 ASN E ND2 1 ATOM 6718 N N . GLN C 1 212 ? -16.946 42.843 -71.889 1.00 31.45 ? 207 GLN E N 1 ATOM 6719 C CA . GLN C 1 212 ? -17.302 44.242 -71.846 1.00 32.28 ? 207 GLN E CA 1 ATOM 6720 C C . GLN C 1 212 ? -17.941 44.697 -73.112 1.00 33.16 ? 207 GLN E C 1 ATOM 6721 O O . GLN C 1 212 ? -17.621 44.193 -74.195 1.00 35.63 ? 207 GLN E O 1 ATOM 6722 C CB . GLN C 1 212 ? -16.040 45.063 -71.629 1.00 34.03 ? 207 GLN E CB 1 ATOM 6723 C CG . GLN C 1 212 ? -16.228 46.566 -71.589 1.00 35.52 ? 207 GLN E CG 1 ATOM 6724 C CD . GLN C 1 212 ? -14.915 47.243 -71.338 1.00 36.55 ? 207 GLN E CD 1 ATOM 6725 O OE1 . GLN C 1 212 ? -14.281 47.727 -72.271 1.00 39.63 ? 207 GLN E OE1 1 ATOM 6726 N NE2 . GLN C 1 212 ? -14.462 47.243 -70.084 1.00 37.82 ? 207 GLN E NE2 1 ATOM 6727 N N . ARG C 1 213 ? -18.862 45.649 -72.987 1.00 37.22 ? 208 ARG E N 1 ATOM 6728 C CA . ARG C 1 213 ? -19.452 46.306 -74.157 1.00 40.07 ? 208 ARG E CA 1 ATOM 6729 C C . ARG C 1 213 ? -19.605 47.795 -73.946 1.00 38.81 ? 208 ARG E C 1 ATOM 6730 O O . ARG C 1 213 ? -20.251 48.229 -72.996 1.00 42.05 ? 208 ARG E O 1 ATOM 6731 C CB . ARG C 1 213 ? -20.804 45.722 -74.454 1.00 42.80 ? 208 ARG E CB 1 ATOM 6732 C CG . ARG C 1 213 ? -21.355 46.155 -75.796 1.00 49.01 ? 208 ARG E CG 1 ATOM 6733 C CD . ARG C 1 213 ? -22.839 45.854 -75.802 1.00 54.03 ? 208 ARG E CD 1 ATOM 6734 N NE . ARG C 1 213 ? -23.476 46.496 -76.930 1.00 59.96 ? 208 ARG E NE 1 ATOM 6735 C CZ . ARG C 1 213 ? -23.350 46.077 -78.174 1.00 59.25 ? 208 ARG E CZ 1 ATOM 6736 N NH1 . ARG C 1 213 ? -22.605 44.999 -78.463 1.00 57.17 ? 208 ARG E NH1 1 ATOM 6737 N NH2 . ARG C 1 213 ? -23.973 46.748 -79.127 1.00 62.02 ? 208 ARG E NH2 1 ATOM 6738 N N . LEU C 1 214 ? -19.001 48.569 -74.813 1.00 37.14 ? 209 LEU E N 1 ATOM 6739 C CA . LEU C 1 214 ? -19.016 50.002 -74.640 1.00 38.77 ? 209 LEU E CA 1 ATOM 6740 C C . LEU C 1 214 ? -19.816 50.581 -75.784 1.00 40.83 ? 209 LEU E C 1 ATOM 6741 O O . LEU C 1 214 ? -19.670 50.139 -76.942 1.00 37.38 ? 209 LEU E O 1 ATOM 6742 C CB . LEU C 1 214 ? -17.604 50.588 -74.646 1.00 36.85 ? 209 LEU E CB 1 ATOM 6743 C CG . LEU C 1 214 ? -16.602 49.969 -73.665 1.00 36.36 ? 209 LEU E CG 1 ATOM 6744 C CD1 . LEU C 1 214 ? -15.172 50.446 -73.941 1.00 34.73 ? 209 LEU E CD1 1 ATOM 6745 C CD2 . LEU C 1 214 ? -17.013 50.315 -72.252 1.00 38.93 ? 209 LEU E CD2 1 ATOM 6746 N N . VAL C 1 215 ? -20.614 51.600 -75.445 1.00 41.18 ? 210 VAL E N 1 ATOM 6747 C CA . VAL C 1 215 ? -21.426 52.320 -76.399 1.00 44.06 ? 210 VAL E CA 1 ATOM 6748 C C . VAL C 1 215 ? -21.206 53.812 -76.207 1.00 42.86 ? 210 VAL E C 1 ATOM 6749 O O . VAL C 1 215 ? -21.309 54.316 -75.117 1.00 44.85 ? 210 VAL E O 1 ATOM 6750 C CB . VAL C 1 215 ? -22.907 51.984 -76.192 1.00 46.07 ? 210 VAL E CB 1 ATOM 6751 C CG1 . VAL C 1 215 ? -23.774 52.737 -77.178 1.00 48.46 ? 210 VAL E CG1 1 ATOM 6752 C CG2 . VAL C 1 215 ? -23.150 50.478 -76.354 1.00 46.70 ? 210 VAL E CG2 1 ATOM 6753 N N . PRO C 1 216 ? -20.932 54.531 -77.285 1.00 46.38 ? 211 PRO E N 1 ATOM 6754 C CA . PRO C 1 216 ? -20.750 55.964 -77.178 1.00 46.54 ? 211 PRO E CA 1 ATOM 6755 C C . PRO C 1 216 ? -22.009 56.680 -76.747 1.00 45.76 ? 211 PRO E C 1 ATOM 6756 O O . PRO C 1 216 ? -23.122 56.261 -77.106 1.00 41.42 ? 211 PRO E O 1 ATOM 6757 C CB . PRO C 1 216 ? -20.374 56.377 -78.599 1.00 45.27 ? 211 PRO E CB 1 ATOM 6758 C CG . PRO C 1 216 ? -19.837 55.132 -79.201 1.00 46.39 ? 211 PRO E CG 1 ATOM 6759 C CD . PRO C 1 216 ? -20.683 54.057 -78.648 1.00 47.27 ? 211 PRO E CD 1 ATOM 6760 N N . LYS C 1 217 ? -21.809 57.747 -75.980 1.00 45.01 ? 212 LYS E N 1 ATOM 6761 C CA . LYS C 1 217 ? -22.874 58.618 -75.499 1.00 48.83 ? 212 LYS E CA 1 ATOM 6762 C C . LYS C 1 217 ? -22.745 59.896 -76.275 1.00 46.93 ? 212 LYS E C 1 ATOM 6763 O O . LYS C 1 217 ? -21.910 60.745 -75.981 1.00 46.88 ? 212 LYS E O 1 ATOM 6764 C CB . LYS C 1 217 ? -22.779 58.870 -73.994 1.00 48.53 ? 212 LYS E CB 1 ATOM 6765 C CG . LYS C 1 217 ? -23.181 57.655 -73.174 1.00 55.47 ? 212 LYS E CG 1 ATOM 6766 C CD . LYS C 1 217 ? -23.064 57.910 -71.684 1.00 56.50 ? 212 LYS E CD 1 ATOM 6767 C CE . LYS C 1 217 ? -21.936 57.094 -71.094 1.00 62.68 ? 212 LYS E CE 1 ATOM 6768 N NZ . LYS C 1 217 ? -21.659 57.512 -69.695 1.00 63.17 ? 212 LYS E NZ 1 ATOM 6769 N N . ILE C 1 218 ? -23.586 60.005 -77.282 1.00 47.57 ? 213 ILE E N 1 ATOM 6770 C CA . ILE C 1 218 ? -23.535 61.104 -78.196 1.00 49.01 ? 213 ILE E CA 1 ATOM 6771 C C . ILE C 1 218 ? -24.470 62.156 -77.660 1.00 48.90 ? 213 ILE E C 1 ATOM 6772 O O . ILE C 1 218 ? -25.682 62.005 -77.763 1.00 47.09 ? 213 ILE E O 1 ATOM 6773 C CB . ILE C 1 218 ? -23.974 60.675 -79.592 1.00 53.19 ? 213 ILE E CB 1 ATOM 6774 C CG1 . ILE C 1 218 ? -22.979 59.669 -80.110 1.00 50.92 ? 213 ILE E CG1 1 ATOM 6775 C CG2 . ILE C 1 218 ? -24.058 61.885 -80.524 1.00 57.50 ? 213 ILE E CG2 1 ATOM 6776 C CD1 . ILE C 1 218 ? -23.349 59.079 -81.446 1.00 52.79 ? 213 ILE E CD1 1 ATOM 6777 N N . ALA C 1 219 ? -23.900 63.213 -77.090 1.00 47.28 ? 214 ALA E N 1 ATOM 6778 C CA . ALA C 1 219 ? -24.670 64.193 -76.336 1.00 47.12 ? 214 ALA E CA 1 ATOM 6779 C C . ALA C 1 219 ? -23.914 65.499 -76.185 1.00 48.58 ? 214 ALA E C 1 ATOM 6780 O O . ALA C 1 219 ? -22.709 65.561 -76.424 1.00 57.18 ? 214 ALA E O 1 ATOM 6781 C CB . ALA C 1 219 ? -24.992 63.628 -74.974 1.00 43.62 ? 214 ALA E CB 1 ATOM 6782 N N . THR C 1 220 ? -24.606 66.521 -75.703 1.00 49.72 ? 215 THR E N 1 ATOM 6783 C CA . THR C 1 220 ? -24.003 67.835 -75.443 1.00 52.20 ? 215 THR E CA 1 ATOM 6784 C C . THR C 1 220 ? -23.353 67.944 -74.062 1.00 50.49 ? 215 THR E C 1 ATOM 6785 O O . THR C 1 220 ? -23.990 67.659 -73.061 1.00 51.98 ? 215 THR E O 1 ATOM 6786 C CB . THR C 1 220 ? -25.070 68.942 -75.560 1.00 50.16 ? 215 THR E CB 1 ATOM 6787 O OG1 . THR C 1 220 ? -25.632 68.872 -76.862 1.00 47.74 ? 215 THR E OG1 1 ATOM 6788 C CG2 . THR C 1 220 ? -24.458 70.317 -75.404 1.00 50.79 ? 215 THR E CG2 1 ATOM 6789 N N . ARG C 1 221 ? -22.103 68.394 -74.043 1.00 49.26 ? 216 ARG E N 1 ATOM 6790 C CA . ARG C 1 221 ? -21.294 68.540 -72.835 1.00 48.03 ? 216 ARG E CA 1 ATOM 6791 C C . ARG C 1 221 ? -20.553 69.880 -72.856 1.00 50.77 ? 216 ARG E C 1 ATOM 6792 O O . ARG C 1 221 ? -20.453 70.529 -73.886 1.00 49.16 ? 216 ARG E O 1 ATOM 6793 C CB . ARG C 1 221 ? -20.276 67.407 -72.741 1.00 46.88 ? 216 ARG E CB 1 ATOM 6794 C CG . ARG C 1 221 ? -20.895 66.019 -72.528 1.00 47.53 ? 216 ARG E CG 1 ATOM 6795 C CD . ARG C 1 221 ? -19.889 64.888 -72.698 1.00 49.27 ? 216 ARG E CD 1 ATOM 6796 N NE . ARG C 1 221 ? -19.591 64.724 -74.111 1.00 49.95 ? 216 ARG E NE 1 ATOM 6797 C CZ . ARG C 1 221 ? -20.115 63.817 -74.915 1.00 49.27 ? 216 ARG E CZ 1 ATOM 6798 N NH1 . ARG C 1 221 ? -20.931 62.875 -74.483 1.00 51.20 ? 216 ARG E NH1 1 ATOM 6799 N NH2 . ARG C 1 221 ? -19.773 63.833 -76.184 1.00 56.11 ? 216 ARG E NH2 1 ATOM 6800 N N . SER C 1 222 ? -20.021 70.298 -71.717 1.00 51.99 ? 217 SER E N 1 ATOM 6801 C CA . SER C 1 222 ? -19.259 71.536 -71.653 1.00 52.03 ? 217 SER E CA 1 ATOM 6802 C C . SER C 1 222 ? -17.863 71.341 -72.262 1.00 56.18 ? 217 SER E C 1 ATOM 6803 O O . SER C 1 222 ? -17.450 70.212 -72.470 1.00 59.99 ? 217 SER E O 1 ATOM 6804 C CB . SER C 1 222 ? -19.181 71.996 -70.226 1.00 50.39 ? 217 SER E CB 1 ATOM 6805 O OG . SER C 1 222 ? -20.500 72.220 -69.753 1.00 55.38 ? 217 SER E OG 1 ATOM 6806 N N . GLN C 1 223 ? -17.163 72.429 -72.576 1.00 59.22 ? 218 GLN E N 1 ATOM 6807 C CA . GLN C 1 223 ? -15.811 72.330 -73.143 1.00 62.25 ? 218 GLN E CA 1 ATOM 6808 C C . GLN C 1 223 ? -14.837 72.106 -72.035 1.00 56.91 ? 218 GLN E C 1 ATOM 6809 O O . GLN C 1 223 ? -14.901 72.785 -71.029 1.00 54.08 ? 218 GLN E O 1 ATOM 6810 C CB . GLN C 1 223 ? -15.346 73.621 -73.832 1.00 68.13 ? 218 GLN E CB 1 ATOM 6811 C CG . GLN C 1 223 ? -16.158 74.066 -75.024 1.00 77.77 ? 218 GLN E CG 1 ATOM 6812 C CD . GLN C 1 223 ? -15.316 74.824 -76.036 1.00 87.24 ? 218 GLN E CD 1 ATOM 6813 O OE1 . GLN C 1 223 ? -14.354 75.519 -75.685 1.00 93.75 ? 218 GLN E OE1 1 ATOM 6814 N NE2 . GLN C 1 223 ? -15.668 74.686 -77.306 1.00 93.29 ? 218 GLN E NE2 1 ATOM 6815 N N . VAL C 1 224 ? -13.909 71.183 -72.246 1.00 54.36 ? 219 VAL E N 1 ATOM 6816 C CA . VAL C 1 224 ? -12.742 71.026 -71.390 1.00 51.35 ? 219 VAL E CA 1 ATOM 6817 C C . VAL C 1 224 ? -11.545 70.847 -72.309 1.00 54.74 ? 219 VAL E C 1 ATOM 6818 O O . VAL C 1 224 ? -11.611 70.075 -73.275 1.00 49.82 ? 219 VAL E O 1 ATOM 6819 C CB . VAL C 1 224 ? -12.868 69.815 -70.456 1.00 51.93 ? 219 VAL E CB 1 ATOM 6820 C CG1 . VAL C 1 224 ? -11.634 69.691 -69.568 1.00 49.46 ? 219 VAL E CG1 1 ATOM 6821 C CG2 . VAL C 1 224 ? -14.127 69.934 -69.581 1.00 50.51 ? 219 VAL E CG2 1 ATOM 6822 N N . ASN C 1 225 ? -10.461 71.578 -72.013 1.00 59.35 ? 220 ASN E N 1 ATOM 6823 C CA . ASN C 1 225 ? -9.282 71.683 -72.899 1.00 56.93 ? 220 ASN E CA 1 ATOM 6824 C C . ASN C 1 225 ? -9.702 71.877 -74.344 1.00 55.06 ? 220 ASN E C 1 ATOM 6825 O O . ASN C 1 225 ? -9.132 71.277 -75.237 1.00 55.78 ? 220 ASN E O 1 ATOM 6826 C CB . ASN C 1 225 ? -8.346 70.452 -72.780 1.00 57.20 ? 220 ASN E CB 1 ATOM 6827 C CG . ASN C 1 225 ? -7.962 70.121 -71.337 1.00 56.55 ? 220 ASN E CG 1 ATOM 6828 O OD1 . ASN C 1 225 ? -7.784 68.937 -70.946 1.00 54.64 ? 220 ASN E OD1 1 ATOM 6829 N ND2 . ASN C 1 225 ? -7.807 71.150 -70.544 1.00 56.49 ? 220 ASN E ND2 1 ATOM 6830 N N . GLY C 1 226 ? -10.710 72.720 -74.570 1.00 55.89 ? 221 GLY E N 1 ATOM 6831 C CA . GLY C 1 226 ? -11.170 73.041 -75.911 1.00 51.81 ? 221 GLY E CA 1 ATOM 6832 C C . GLY C 1 226 ? -12.111 72.032 -76.552 1.00 55.81 ? 221 GLY E C 1 ATOM 6833 O O . GLY C 1 226 ? -12.545 72.243 -77.685 1.00 59.26 ? 221 GLY E O 1 ATOM 6834 N N . GLN C 1 227 ? -12.476 70.968 -75.836 1.00 54.30 ? 222 GLN E N 1 ATOM 6835 C CA . GLN C 1 227 ? -13.236 69.862 -76.438 1.00 57.24 ? 222 GLN E CA 1 ATOM 6836 C C . GLN C 1 227 ? -14.528 69.545 -75.722 1.00 53.53 ? 222 GLN E C 1 ATOM 6837 O O . GLN C 1 227 ? -14.577 69.545 -74.503 1.00 49.72 ? 222 GLN E O 1 ATOM 6838 C CB . GLN C 1 227 ? -12.383 68.589 -76.422 1.00 59.16 ? 222 GLN E CB 1 ATOM 6839 C CG . GLN C 1 227 ? -11.040 68.751 -77.100 1.00 59.47 ? 222 GLN E CG 1 ATOM 6840 C CD . GLN C 1 227 ? -11.169 69.141 -78.562 1.00 58.27 ? 222 GLN E CD 1 ATOM 6841 O OE1 . GLN C 1 227 ? -10.445 69.995 -79.046 1.00 53.48 ? 222 GLN E OE1 1 ATOM 6842 N NE2 . GLN C 1 227 ? -12.078 68.498 -79.268 1.00 59.71 ? 222 GLN E NE2 1 ATOM 6843 N N . ARG C 1 228 ? -15.548 69.189 -76.492 1.00 53.70 ? 223 ARG E N 1 ATOM 6844 C CA . ARG C 1 228 ? -16.819 68.725 -75.922 1.00 53.67 ? 223 ARG E CA 1 ATOM 6845 C C . ARG C 1 228 ? -16.908 67.192 -75.915 1.00 50.00 ? 223 ARG E C 1 ATOM 6846 O O . ARG C 1 228 ? -17.735 66.614 -75.208 1.00 48.44 ? 223 ARG E O 1 ATOM 6847 C CB . ARG C 1 228 ? -18.011 69.344 -76.661 1.00 53.78 ? 223 ARG E CB 1 ATOM 6848 C CG . ARG C 1 228 ? -18.007 70.856 -76.564 1.00 60.01 ? 223 ARG E CG 1 ATOM 6849 C CD . ARG C 1 228 ? -19.067 71.554 -77.399 1.00 63.13 ? 223 ARG E CD 1 ATOM 6850 N NE . ARG C 1 228 ? -19.986 72.119 -76.434 1.00 71.47 ? 223 ARG E NE 1 ATOM 6851 C CZ . ARG C 1 228 ? -19.966 73.361 -75.951 1.00 71.58 ? 223 ARG E CZ 1 ATOM 6852 N NH1 . ARG C 1 228 ? -19.121 74.273 -76.401 1.00 67.90 ? 223 ARG E NH1 1 ATOM 6853 N NH2 . ARG C 1 228 ? -20.856 73.681 -75.010 1.00 78.22 ? 223 ARG E NH2 1 ATOM 6854 N N . GLY C 1 229 ? -16.070 66.547 -76.716 1.00 48.52 ? 224 GLY E N 1 ATOM 6855 C CA . GLY C 1 229 ? -15.982 65.103 -76.717 1.00 47.04 ? 224 GLY E CA 1 ATOM 6856 C C . GLY C 1 229 ? -15.292 64.578 -75.454 1.00 47.54 ? 224 GLY E C 1 ATOM 6857 O O . GLY C 1 229 ? -14.688 65.330 -74.656 1.00 44.86 ? 224 GLY E O 1 ATOM 6858 N N . ARG C 1 230 ? -15.405 63.283 -75.254 1.00 45.02 ? 225 ARG E N 1 ATOM 6859 C CA . ARG C 1 230 ? -14.794 62.666 -74.101 1.00 43.32 ? 225 ARG E CA 1 ATOM 6860 C C . ARG C 1 230 ? -14.273 61.326 -74.509 1.00 41.31 ? 225 ARG E C 1 ATOM 6861 O O . ARG C 1 230 ? -14.760 60.716 -75.470 1.00 39.09 ? 225 ARG E O 1 ATOM 6862 C CB . ARG C 1 230 ? -15.792 62.453 -72.976 1.00 40.54 ? 225 ARG E CB 1 ATOM 6863 C CG . ARG C 1 230 ? -16.378 63.719 -72.403 1.00 42.66 ? 225 ARG E CG 1 ATOM 6864 C CD . ARG C 1 230 ? -15.378 64.478 -71.570 1.00 41.24 ? 225 ARG E CD 1 ATOM 6865 N NE . ARG C 1 230 ? -16.019 65.648 -70.979 1.00 46.29 ? 225 ARG E NE 1 ATOM 6866 C CZ . ARG C 1 230 ? -16.106 66.860 -71.540 1.00 51.03 ? 225 ARG E CZ 1 ATOM 6867 N NH1 . ARG C 1 230 ? -15.595 67.124 -72.741 1.00 51.22 ? 225 ARG E NH1 1 ATOM 6868 N NH2 . ARG C 1 230 ? -16.729 67.833 -70.889 1.00 55.67 ? 225 ARG E NH2 1 ATOM 6869 N N . MET C 1 231 ? -13.244 60.898 -73.805 1.00 41.30 ? 226 MET E N 1 ATOM 6870 C CA . MET C 1 231 ? -12.722 59.569 -73.994 1.00 43.49 ? 226 MET E CA 1 ATOM 6871 C C . MET C 1 231 ? -12.650 58.830 -72.675 1.00 40.00 ? 226 MET E C 1 ATOM 6872 O O . MET C 1 231 ? -11.989 59.270 -71.780 1.00 37.75 ? 226 MET E O 1 ATOM 6873 C CB . MET C 1 231 ? -11.355 59.659 -74.662 1.00 47.97 ? 226 MET E CB 1 ATOM 6874 C CG . MET C 1 231 ? -11.528 59.981 -76.130 1.00 47.22 ? 226 MET E CG 1 ATOM 6875 S SD . MET C 1 231 ? -9.982 60.002 -76.980 1.00 53.95 ? 226 MET E SD 1 ATOM 6876 C CE . MET C 1 231 ? -10.559 60.415 -78.611 1.00 56.16 ? 226 MET E CE 1 ATOM 6877 N N . ASP C 1 232 ? -13.322 57.699 -72.616 1.00 39.46 ? 227 ASP E N 1 ATOM 6878 C CA . ASP C 1 232 ? -13.345 56.856 -71.446 1.00 41.07 ? 227 ASP E CA 1 ATOM 6879 C C . ASP C 1 232 ? -12.431 55.669 -71.717 1.00 42.18 ? 227 ASP E C 1 ATOM 6880 O O . ASP C 1 232 ? -12.643 54.898 -72.645 1.00 44.19 ? 227 ASP E O 1 ATOM 6881 C CB . ASP C 1 232 ? -14.764 56.382 -71.134 1.00 41.01 ? 227 ASP E CB 1 ATOM 6882 C CG . ASP C 1 232 ? -15.671 57.504 -70.603 1.00 44.54 ? 227 ASP E CG 1 ATOM 6883 O OD1 . ASP C 1 232 ? -15.168 58.571 -70.174 1.00 48.66 ? 227 ASP E OD1 1 ATOM 6884 O OD2 . ASP C 1 232 ? -16.910 57.295 -70.580 1.00 43.15 ? 227 ASP E OD2 1 ATOM 6885 N N . PHE C 1 233 ? -11.395 55.544 -70.895 1.00 39.86 ? 228 PHE E N 1 ATOM 6886 C CA . PHE C 1 233 ? -10.409 54.494 -71.047 1.00 39.91 ? 228 PHE E CA 1 ATOM 6887 C C . PHE C 1 233 ? -10.701 53.366 -70.035 1.00 39.36 ? 228 PHE E C 1 ATOM 6888 O O . PHE C 1 233 ? -11.225 53.613 -68.943 1.00 41.03 ? 228 PHE E O 1 ATOM 6889 C CB . PHE C 1 233 ? -9.010 55.081 -70.863 1.00 38.34 ? 228 PHE E CB 1 ATOM 6890 C CG . PHE C 1 233 ? -8.571 55.918 -72.021 1.00 38.86 ? 228 PHE E CG 1 ATOM 6891 C CD1 . PHE C 1 233 ? -8.699 57.294 -71.995 1.00 40.38 ? 228 PHE E CD1 1 ATOM 6892 C CD2 . PHE C 1 233 ? -8.082 55.320 -73.159 1.00 38.07 ? 228 PHE E CD2 1 ATOM 6893 C CE1 . PHE C 1 233 ? -8.315 58.060 -73.074 1.00 40.22 ? 228 PHE E CE1 1 ATOM 6894 C CE2 . PHE C 1 233 ? -7.710 56.081 -74.237 1.00 38.51 ? 228 PHE E CE2 1 ATOM 6895 C CZ . PHE C 1 233 ? -7.811 57.452 -74.196 1.00 37.81 ? 228 PHE E CZ 1 ATOM 6896 N N . PHE C 1 234 ? -10.323 52.160 -70.409 1.00 34.83 ? 229 PHE E N 1 ATOM 6897 C CA . PHE C 1 234 ? -10.538 50.967 -69.602 1.00 33.90 ? 229 PHE E CA 1 ATOM 6898 C C . PHE C 1 234 ? -9.290 50.088 -69.679 1.00 33.73 ? 229 PHE E C 1 ATOM 6899 O O . PHE C 1 234 ? -8.454 50.277 -70.562 1.00 33.60 ? 229 PHE E O 1 ATOM 6900 C CB . PHE C 1 234 ? -11.761 50.193 -70.118 1.00 35.31 ? 229 PHE E CB 1 ATOM 6901 C CG . PHE C 1 234 ? -13.067 50.936 -69.948 1.00 34.20 ? 229 PHE E CG 1 ATOM 6902 C CD1 . PHE C 1 234 ? -13.477 51.862 -70.897 1.00 34.15 ? 229 PHE E CD1 1 ATOM 6903 C CD2 . PHE C 1 234 ? -13.876 50.712 -68.834 1.00 34.40 ? 229 PHE E CD2 1 ATOM 6904 C CE1 . PHE C 1 234 ? -14.669 52.564 -70.729 1.00 36.80 ? 229 PHE E CE1 1 ATOM 6905 C CE2 . PHE C 1 234 ? -15.067 51.408 -68.660 1.00 32.87 ? 229 PHE E CE2 1 ATOM 6906 C CZ . PHE C 1 234 ? -15.462 52.336 -69.611 1.00 34.85 ? 229 PHE E CZ 1 ATOM 6907 N N . TRP C 1 235 ? -9.126 49.173 -68.727 1.00 33.47 ? 230 TRP E N 1 ATOM 6908 C CA . TRP C 1 235 ? -7.926 48.334 -68.697 1.00 31.39 ? 230 TRP E CA 1 ATOM 6909 C C . TRP C 1 235 ? -8.191 46.943 -68.212 1.00 29.14 ? 230 TRP E C 1 ATOM 6910 O O . TRP C 1 235 ? -9.262 46.654 -67.667 1.00 33.96 ? 230 TRP E O 1 ATOM 6911 C CB . TRP C 1 235 ? -6.880 48.994 -67.786 1.00 34.09 ? 230 TRP E CB 1 ATOM 6912 C CG . TRP C 1 235 ? -7.331 49.253 -66.379 1.00 30.71 ? 230 TRP E CG 1 ATOM 6913 C CD1 . TRP C 1 235 ? -8.076 50.283 -65.946 1.00 33.10 ? 230 TRP E CD1 1 ATOM 6914 C CD2 . TRP C 1 235 ? -7.010 48.481 -65.243 1.00 30.12 ? 230 TRP E CD2 1 ATOM 6915 N NE1 . TRP C 1 235 ? -8.306 50.182 -64.585 1.00 32.11 ? 230 TRP E NE1 1 ATOM 6916 C CE2 . TRP C 1 235 ? -7.626 49.091 -64.135 1.00 29.88 ? 230 TRP E CE2 1 ATOM 6917 C CE3 . TRP C 1 235 ? -6.266 47.292 -65.048 1.00 29.18 ? 230 TRP E CE3 1 ATOM 6918 C CZ2 . TRP C 1 235 ? -7.527 48.579 -62.859 1.00 29.80 ? 230 TRP E CZ2 1 ATOM 6919 C CZ3 . TRP C 1 235 ? -6.181 46.773 -63.806 1.00 26.81 ? 230 TRP E CZ3 1 ATOM 6920 C CH2 . TRP C 1 235 ? -6.815 47.413 -62.701 1.00 29.95 ? 230 TRP E CH2 1 ATOM 6921 N N . THR C 1 236 ? -7.243 46.070 -68.440 1.00 27.88 ? 231 THR E N 1 ATOM 6922 C CA . THR C 1 236 ? -7.306 44.708 -67.905 1.00 28.32 ? 231 THR E CA 1 ATOM 6923 C C . THR C 1 236 ? -5.911 44.128 -67.784 1.00 28.77 ? 231 THR E C 1 ATOM 6924 O O . THR C 1 236 ? -4.987 44.606 -68.389 1.00 28.14 ? 231 THR E O 1 ATOM 6925 C CB . THR C 1 236 ? -8.180 43.805 -68.784 1.00 31.23 ? 231 THR E CB 1 ATOM 6926 O OG1 . THR C 1 236 ? -8.489 42.590 -68.107 1.00 33.26 ? 231 THR E OG1 1 ATOM 6927 C CG2 . THR C 1 236 ? -7.472 43.454 -70.073 1.00 32.80 ? 231 THR E CG2 1 ATOM 6928 N N . ILE C 1 237 ? -5.787 43.098 -66.963 1.00 33.05 ? 232 ILE E N 1 ATOM 6929 C CA . ILE C 1 237 ? -4.559 42.314 -66.841 1.00 35.25 ? 232 ILE E CA 1 ATOM 6930 C C . ILE C 1 237 ? -4.785 41.035 -67.622 1.00 37.08 ? 232 ILE E C 1 ATOM 6931 O O . ILE C 1 237 ? -5.615 40.200 -67.229 1.00 34.61 ? 232 ILE E O 1 ATOM 6932 C CB . ILE C 1 237 ? -4.246 41.966 -65.385 1.00 38.12 ? 232 ILE E CB 1 ATOM 6933 C CG1 . ILE C 1 237 ? -4.122 43.214 -64.520 1.00 36.48 ? 232 ILE E CG1 1 ATOM 6934 C CG2 . ILE C 1 237 ? -2.938 41.181 -65.305 1.00 42.37 ? 232 ILE E CG2 1 ATOM 6935 C CD1 . ILE C 1 237 ? -3.146 44.236 -65.064 1.00 42.38 ? 232 ILE E CD1 1 ATOM 6936 N N . LEU C 1 238 ? -4.080 40.897 -68.752 1.00 39.19 ? 233 LEU E N 1 ATOM 6937 C CA . LEU C 1 238 ? -4.241 39.721 -69.620 1.00 37.17 ? 233 LEU E CA 1 ATOM 6938 C C . LEU C 1 238 ? -3.197 38.699 -69.198 1.00 40.27 ? 233 LEU E C 1 ATOM 6939 O O . LEU C 1 238 ? -1.997 39.006 -69.250 1.00 37.52 ? 233 LEU E O 1 ATOM 6940 C CB . LEU C 1 238 ? -4.044 40.105 -71.045 1.00 34.97 ? 233 LEU E CB 1 ATOM 6941 C CG . LEU C 1 238 ? -4.266 38.967 -72.033 1.00 38.25 ? 233 LEU E CG 1 ATOM 6942 C CD1 . LEU C 1 238 ? -5.700 38.501 -72.004 1.00 36.33 ? 233 LEU E CD1 1 ATOM 6943 C CD2 . LEU C 1 238 ? -3.905 39.431 -73.474 1.00 39.01 ? 233 LEU E CD2 1 ATOM 6944 N N . LYS C 1 239 ? -3.650 37.534 -68.715 1.00 37.19 ? 234 LYS E N 1 ATOM 6945 C CA . LYS C 1 239 ? -2.740 36.541 -68.117 1.00 42.59 ? 234 LYS E CA 1 ATOM 6946 C C . LYS C 1 239 ? -1.918 35.873 -69.190 1.00 42.95 ? 234 LYS E C 1 ATOM 6947 O O . LYS C 1 239 ? -2.342 35.852 -70.340 1.00 40.90 ? 234 LYS E O 1 ATOM 6948 C CB . LYS C 1 239 ? -3.490 35.442 -67.366 1.00 45.68 ? 234 LYS E CB 1 ATOM 6949 C CG . LYS C 1 239 ? -4.347 35.922 -66.199 1.00 51.39 ? 234 LYS E CG 1 ATOM 6950 C CD . LYS C 1 239 ? -3.506 36.619 -65.182 1.00 53.08 ? 234 LYS E CD 1 ATOM 6951 C CE . LYS C 1 239 ? -4.002 36.366 -63.789 1.00 63.19 ? 234 LYS E CE 1 ATOM 6952 N NZ . LYS C 1 239 ? -3.037 37.017 -62.844 1.00 73.91 ? 234 LYS E NZ 1 ATOM 6953 N N . PRO C 1 240 ? -0.753 35.314 -68.805 1.00 45.18 ? 235 PRO E N 1 ATOM 6954 C CA . PRO C 1 240 ? 0.129 34.745 -69.781 1.00 44.30 ? 235 PRO E CA 1 ATOM 6955 C C . PRO C 1 240 ? -0.488 33.839 -70.807 1.00 47.85 ? 235 PRO E C 1 ATOM 6956 O O . PRO C 1 240 ? -0.140 34.003 -71.988 1.00 66.18 ? 235 PRO E O 1 ATOM 6957 C CB . PRO C 1 240 ? 1.194 34.065 -68.955 1.00 42.18 ? 235 PRO E CB 1 ATOM 6958 C CG . PRO C 1 240 ? 1.318 34.965 -67.781 1.00 42.16 ? 235 PRO E CG 1 ATOM 6959 C CD . PRO C 1 240 ? -0.098 35.367 -67.476 1.00 43.17 ? 235 PRO E CD 1 ATOM 6960 N N . ASN C 1 241 ? -1.370 32.904 -70.582 1.00 42.90 ? 236 ASN E N 1 ATOM 6961 C CA . ASN C 1 241 ? -1.749 32.306 -71.969 1.00 50.79 ? 236 ASN E CA 1 ATOM 6962 C C . ASN C 1 241 ? -3.109 32.655 -72.564 1.00 49.00 ? 236 ASN E C 1 ATOM 6963 O O . ASN C 1 241 ? -3.668 31.906 -73.350 1.00 43.74 ? 236 ASN E O 1 ATOM 6964 C CB . ASN C 1 241 ? -1.403 30.824 -72.132 1.00 56.48 ? 236 ASN E CB 1 ATOM 6965 C CG . ASN C 1 241 ? -0.118 30.654 -72.890 1.00 63.57 ? 236 ASN E CG 1 ATOM 6966 O OD1 . ASN C 1 241 ? -0.136 30.533 -74.097 1.00 72.59 ? 236 ASN E OD1 1 ATOM 6967 N ND2 . ASN C 1 241 ? 1.024 30.766 -72.189 1.00 68.90 ? 236 ASN E ND2 1 ATOM 6968 N N . ASP C 1 242 ? -3.622 33.816 -72.185 1.00 45.57 ? 237 ASP E N 1 ATOM 6969 C CA . ASP C 1 242 ? -4.960 34.211 -72.546 1.00 42.12 ? 237 ASP E CA 1 ATOM 6970 C C . ASP C 1 242 ? -4.881 35.120 -73.742 1.00 39.80 ? 237 ASP E C 1 ATOM 6971 O O . ASP C 1 242 ? -3.805 35.591 -74.117 1.00 45.81 ? 237 ASP E O 1 ATOM 6972 C CB . ASP C 1 242 ? -5.611 34.906 -71.336 1.00 42.86 ? 237 ASP E CB 1 ATOM 6973 C CG . ASP C 1 242 ? -7.124 34.959 -71.405 1.00 42.78 ? 237 ASP E CG 1 ATOM 6974 O OD1 . ASP C 1 242 ? -7.761 34.252 -72.259 1.00 43.72 ? 237 ASP E OD1 1 ATOM 6975 O OD2 . ASP C 1 242 ? -7.671 35.717 -70.563 1.00 42.71 ? 237 ASP E OD2 1 ATOM 6976 N N . ALA C 1 243 ? -6.019 35.346 -74.366 1.00 37.95 ? 238 ALA E N 1 ATOM 6977 C CA . ALA C 1 243 ? -6.104 36.293 -75.455 1.00 36.79 ? 238 ALA E CA 1 ATOM 6978 C C . ALA C 1 243 ? -7.204 37.252 -75.194 1.00 34.52 ? 238 ALA E C 1 ATOM 6979 O O . ALA C 1 243 ? -8.160 36.926 -74.491 1.00 39.92 ? 238 ALA E O 1 ATOM 6980 C CB . ALA C 1 243 ? -6.343 35.569 -76.755 1.00 37.61 ? 238 ALA E CB 1 ATOM 6981 N N . ILE C 1 244 ? -7.053 38.452 -75.747 1.00 34.21 ? 239 ILE E N 1 ATOM 6982 C CA . ILE C 1 244 ? -8.042 39.510 -75.633 1.00 33.44 ? 239 ILE E CA 1 ATOM 6983 C C . ILE C 1 244 ? -8.665 39.718 -77.014 1.00 37.34 ? 239 ILE E C 1 ATOM 6984 O O . ILE C 1 244 ? -7.970 39.723 -78.031 1.00 35.52 ? 239 ILE E O 1 ATOM 6985 C CB . ILE C 1 244 ? -7.408 40.805 -75.128 1.00 34.11 ? 239 ILE E CB 1 ATOM 6986 C CG1 . ILE C 1 244 ? -8.469 41.907 -74.932 1.00 33.64 ? 239 ILE E CG1 1 ATOM 6987 C CG2 . ILE C 1 244 ? -6.313 41.303 -76.076 1.00 36.85 ? 239 ILE E CG2 1 ATOM 6988 C CD1 . ILE C 1 244 ? -8.024 42.980 -73.958 1.00 33.11 ? 239 ILE E CD1 1 ATOM 6989 N N . HIS C 1 245 ? -9.980 39.859 -77.057 1.00 38.95 ? 240 HIS E N 1 ATOM 6990 C CA . HIS C 1 245 ? -10.688 39.926 -78.340 1.00 38.00 ? 240 HIS E CA 1 ATOM 6991 C C . HIS C 1 245 ? -11.453 41.219 -78.440 1.00 39.68 ? 240 HIS E C 1 ATOM 6992 O O . HIS C 1 245 ? -12.374 41.458 -77.655 1.00 42.11 ? 240 HIS E O 1 ATOM 6993 C CB . HIS C 1 245 ? -11.646 38.764 -78.497 1.00 35.88 ? 240 HIS E CB 1 ATOM 6994 C CG . HIS C 1 245 ? -11.010 37.444 -78.262 1.00 36.97 ? 240 HIS E CG 1 ATOM 6995 N ND1 . HIS C 1 245 ? -10.507 36.657 -79.283 1.00 37.86 ? 240 HIS E ND1 1 ATOM 6996 C CD2 . HIS C 1 245 ? -10.777 36.769 -77.114 1.00 39.24 ? 240 HIS E CD2 1 ATOM 6997 C CE1 . HIS C 1 245 ? -10.022 35.542 -78.774 1.00 35.97 ? 240 HIS E CE1 1 ATOM 6998 N NE2 . HIS C 1 245 ? -10.172 35.583 -77.461 1.00 39.66 ? 240 HIS E NE2 1 ATOM 6999 N N . PHE C 1 246 ? -11.085 42.035 -79.428 1.00 38.44 ? 241 PHE E N 1 ATOM 7000 C CA . PHE C 1 246 ? -11.704 43.320 -79.657 1.00 38.48 ? 241 PHE E CA 1 ATOM 7001 C C . PHE C 1 246 ? -12.588 43.265 -80.868 1.00 38.84 ? 241 PHE E C 1 ATOM 7002 O O . PHE C 1 246 ? -12.249 42.595 -81.828 1.00 42.17 ? 241 PHE E O 1 ATOM 7003 C CB . PHE C 1 246 ? -10.633 44.337 -79.937 1.00 36.81 ? 241 PHE E CB 1 ATOM 7004 C CG . PHE C 1 246 ? -9.855 44.706 -78.746 1.00 36.44 ? 241 PHE E CG 1 ATOM 7005 C CD1 . PHE C 1 246 ? -10.379 45.609 -77.822 1.00 37.85 ? 241 PHE E CD1 1 ATOM 7006 C CD2 . PHE C 1 246 ? -8.618 44.195 -78.541 1.00 35.75 ? 241 PHE E CD2 1 ATOM 7007 C CE1 . PHE C 1 246 ? -9.636 46.022 -76.738 1.00 36.15 ? 241 PHE E CE1 1 ATOM 7008 C CE2 . PHE C 1 246 ? -7.860 44.607 -77.460 1.00 37.06 ? 241 PHE E CE2 1 ATOM 7009 C CZ . PHE C 1 246 ? -8.380 45.514 -76.548 1.00 36.68 ? 241 PHE E CZ 1 ATOM 7010 N N . GLU C 1 247 ? -13.722 43.948 -80.810 1.00 39.11 ? 242 GLU E N 1 ATOM 7011 C CA . GLU C 1 247 ? -14.611 44.102 -81.970 1.00 42.16 ? 242 GLU E CA 1 ATOM 7012 C C . GLU C 1 247 ? -15.289 45.451 -81.888 1.00 42.07 ? 242 GLU E C 1 ATOM 7013 O O . GLU C 1 247 ? -15.808 45.841 -80.842 1.00 41.75 ? 242 GLU E O 1 ATOM 7014 C CB . GLU C 1 247 ? -15.674 43.006 -82.050 1.00 44.33 ? 242 GLU E CB 1 ATOM 7015 C CG . GLU C 1 247 ? -16.677 43.204 -83.195 1.00 49.19 ? 242 GLU E CG 1 ATOM 7016 C CD . GLU C 1 247 ? -17.739 42.108 -83.327 1.00 53.53 ? 242 GLU E CD 1 ATOM 7017 O OE1 . GLU C 1 247 ? -17.424 40.909 -83.193 1.00 53.45 ? 242 GLU E OE1 1 ATOM 7018 O OE2 . GLU C 1 247 ? -18.923 42.429 -83.575 1.00 58.09 ? 242 GLU E OE2 1 ATOM 7019 N N . SER C 1 248 ? -15.219 46.198 -82.971 1.00 40.48 ? 243 SER E N 1 ATOM 7020 C CA . SER C 1 248 ? -15.815 47.523 -82.987 1.00 41.62 ? 243 SER E CA 1 ATOM 7021 C C . SER C 1 248 ? -16.120 47.998 -84.395 1.00 40.90 ? 243 SER E C 1 ATOM 7022 O O . SER C 1 248 ? -15.388 47.694 -85.321 1.00 46.64 ? 243 SER E O 1 ATOM 7023 C CB . SER C 1 248 ? -14.883 48.553 -82.359 1.00 41.05 ? 243 SER E CB 1 ATOM 7024 O OG . SER C 1 248 ? -15.510 49.820 -82.352 1.00 41.27 ? 243 SER E OG 1 ATOM 7025 N N . ASN C 1 249 ? -17.167 48.783 -84.524 1.00 41.88 ? 244 ASN E N 1 ATOM 7026 C CA . ASN C 1 249 ? -17.428 49.481 -85.770 1.00 46.13 ? 244 ASN E CA 1 ATOM 7027 C C . ASN C 1 249 ? -17.375 50.977 -85.625 1.00 47.93 ? 244 ASN E C 1 ATOM 7028 O O . ASN C 1 249 ? -18.015 51.677 -86.400 1.00 51.38 ? 244 ASN E O 1 ATOM 7029 C CB . ASN C 1 249 ? -18.796 49.098 -86.313 1.00 46.18 ? 244 ASN E CB 1 ATOM 7030 C CG . ASN C 1 249 ? -19.896 49.643 -85.467 1.00 46.42 ? 244 ASN E CG 1 ATOM 7031 O OD1 . ASN C 1 249 ? -19.708 49.887 -84.277 1.00 41.90 ? 244 ASN E OD1 1 ATOM 7032 N ND2 . ASN C 1 249 ? -21.078 49.737 -86.043 1.00 50.86 ? 244 ASN E ND2 1 ATOM 7033 N N . GLY C 1 250 ? -16.650 51.467 -84.621 1.00 45.20 ? 245 GLY E N 1 ATOM 7034 C CA . GLY C 1 250 ? -16.483 52.882 -84.461 1.00 42.97 ? 245 GLY E CA 1 ATOM 7035 C C . GLY C 1 250 ? -16.115 53.312 -83.084 1.00 42.89 ? 245 GLY E C 1 ATOM 7036 O O . GLY C 1 250 ? -16.315 52.587 -82.140 1.00 48.81 ? 245 GLY E O 1 ATOM 7037 N N . ASN C 1 251 ? -15.588 54.538 -82.963 1.00 44.01 ? 246 ASN E N 1 ATOM 7038 C CA . ASN C 1 251 ? -15.322 55.170 -81.653 1.00 40.98 ? 246 ASN E CA 1 ATOM 7039 C C . ASN C 1 251 ? -14.341 54.432 -80.778 1.00 43.21 ? 246 ASN E C 1 ATOM 7040 O O . ASN C 1 251 ? -14.306 54.613 -79.567 1.00 45.35 ? 246 ASN E O 1 ATOM 7041 C CB . ASN C 1 251 ? -16.624 55.334 -80.883 1.00 38.09 ? 246 ASN E CB 1 ATOM 7042 C CG . ASN C 1 251 ? -17.683 56.028 -81.719 1.00 36.81 ? 246 ASN E CG 1 ATOM 7043 O OD1 . ASN C 1 251 ? -18.216 55.442 -82.645 1.00 37.49 ? 246 ASN E OD1 1 ATOM 7044 N ND2 . ASN C 1 251 ? -18.031 57.256 -81.359 1.00 36.48 ? 246 ASN E ND2 1 ATOM 7045 N N . PHE C 1 252 ? -13.508 53.625 -81.401 1.00 44.43 ? 247 PHE E N 1 ATOM 7046 C CA . PHE C 1 252 ? -12.579 52.742 -80.700 1.00 44.48 ? 247 PHE E CA 1 ATOM 7047 C C . PHE C 1 252 ? -11.174 53.405 -80.625 1.00 45.60 ? 247 PHE E C 1 ATOM 7048 O O . PHE C 1 252 ? -10.610 53.817 -81.645 1.00 43.25 ? 247 PHE E O 1 ATOM 7049 C CB . PHE C 1 252 ? -12.552 51.418 -81.464 1.00 39.95 ? 247 PHE E CB 1 ATOM 7050 C CG . PHE C 1 252 ? -11.639 50.378 -80.907 1.00 40.35 ? 247 PHE E CG 1 ATOM 7051 C CD1 . PHE C 1 252 ? -11.442 50.220 -79.527 1.00 39.84 ? 247 PHE E CD1 1 ATOM 7052 C CD2 . PHE C 1 252 ? -11.017 49.481 -81.770 1.00 39.13 ? 247 PHE E CD2 1 ATOM 7053 C CE1 . PHE C 1 252 ? -10.625 49.191 -79.050 1.00 39.04 ? 247 PHE E CE1 1 ATOM 7054 C CE2 . PHE C 1 252 ? -10.160 48.498 -81.288 1.00 38.83 ? 247 PHE E CE2 1 ATOM 7055 C CZ . PHE C 1 252 ? -9.985 48.333 -79.930 1.00 38.89 ? 247 PHE E CZ 1 ATOM 7056 N N . ILE C 1 253 ? -10.655 53.532 -79.409 1.00 43.02 ? 248 ILE E N 1 ATOM 7057 C CA . ILE C 1 253 ? -9.309 53.989 -79.201 1.00 43.17 ? 248 ILE E CA 1 ATOM 7058 C C . ILE C 1 253 ? -8.511 52.733 -78.850 1.00 43.44 ? 248 ILE E C 1 ATOM 7059 O O . ILE C 1 253 ? -8.599 52.224 -77.747 1.00 42.87 ? 248 ILE E O 1 ATOM 7060 C CB . ILE C 1 253 ? -9.215 55.037 -78.085 1.00 46.50 ? 248 ILE E CB 1 ATOM 7061 C CG1 . ILE C 1 253 ? -10.299 56.102 -78.232 1.00 46.49 ? 248 ILE E CG1 1 ATOM 7062 C CG2 . ILE C 1 253 ? -7.836 55.698 -78.087 1.00 44.19 ? 248 ILE E CG2 1 ATOM 7063 C CD1 . ILE C 1 253 ? -10.164 56.957 -79.468 1.00 48.68 ? 248 ILE E CD1 1 ATOM 7064 N N . ALA C 1 254 ? -7.715 52.253 -79.805 1.00 41.01 ? 249 ALA E N 1 ATOM 7065 C CA . ALA C 1 254 ? -7.161 50.919 -79.752 1.00 40.26 ? 249 ALA E CA 1 ATOM 7066 C C . ALA C 1 254 ? -5.827 50.854 -79.015 1.00 39.29 ? 249 ALA E C 1 ATOM 7067 O O . ALA C 1 254 ? -5.045 51.799 -79.041 1.00 37.74 ? 249 ALA E O 1 ATOM 7068 C CB . ALA C 1 254 ? -6.983 50.372 -81.152 1.00 40.28 ? 249 ALA E CB 1 ATOM 7069 N N . PRO C 1 255 ? -5.568 49.723 -78.363 1.00 39.67 ? 250 PRO E N 1 ATOM 7070 C CA . PRO C 1 255 ? -4.219 49.581 -77.869 1.00 44.07 ? 250 PRO E CA 1 ATOM 7071 C C . PRO C 1 255 ? -3.224 49.664 -79.011 1.00 43.36 ? 250 PRO E C 1 ATOM 7072 O O . PRO C 1 255 ? -3.533 49.258 -80.118 1.00 37.43 ? 250 PRO E O 1 ATOM 7073 C CB . PRO C 1 255 ? -4.185 48.153 -77.284 1.00 41.34 ? 250 PRO E CB 1 ATOM 7074 C CG . PRO C 1 255 ? -5.594 47.728 -77.226 1.00 43.40 ? 250 PRO E CG 1 ATOM 7075 C CD . PRO C 1 255 ? -6.322 48.473 -78.285 1.00 38.65 ? 250 PRO E CD 1 ATOM 7076 N N . GLU C 1 256 ? -2.033 50.163 -78.698 1.00 47.51 ? 251 GLU E N 1 ATOM 7077 C CA . GLU C 1 256 ? -0.877 50.041 -79.567 1.00 48.23 ? 251 GLU E CA 1 ATOM 7078 C C . GLU C 1 256 ? 0.233 49.426 -78.719 1.00 47.70 ? 251 GLU E C 1 ATOM 7079 O O . GLU C 1 256 ? 0.688 48.321 -79.001 1.00 45.49 ? 251 GLU E O 1 ATOM 7080 C CB . GLU C 1 256 ? -0.480 51.416 -80.115 1.00 54.99 ? 251 GLU E CB 1 ATOM 7081 C CG . GLU C 1 256 ? 0.629 51.428 -81.173 1.00 61.71 ? 251 GLU E CG 1 ATOM 7082 C CD . GLU C 1 256 ? 1.008 52.836 -81.630 1.00 65.83 ? 251 GLU E CD 1 ATOM 7083 O OE1 . GLU C 1 256 ? 0.258 53.822 -81.398 1.00 76.07 ? 251 GLU E OE1 1 ATOM 7084 O OE2 . GLU C 1 256 ? 2.092 52.966 -82.226 1.00 75.14 ? 251 GLU E OE2 1 ATOM 7085 N N . TYR C 1 257 ? 0.648 50.130 -77.671 1.00 44.26 ? 252 TYR E N 1 ATOM 7086 C CA . TYR C 1 257 ? 1.560 49.581 -76.698 1.00 48.86 ? 252 TYR E CA 1 ATOM 7087 C C . TYR C 1 257 ? 0.805 49.098 -75.441 1.00 49.80 ? 252 TYR E C 1 ATOM 7088 O O . TYR C 1 257 ? -0.333 49.438 -75.192 1.00 50.49 ? 252 TYR E O 1 ATOM 7089 C CB . TYR C 1 257 ? 2.545 50.634 -76.264 1.00 49.92 ? 252 TYR E CB 1 ATOM 7090 C CG . TYR C 1 257 ? 3.472 51.096 -77.330 1.00 54.31 ? 252 TYR E CG 1 ATOM 7091 C CD1 . TYR C 1 257 ? 4.759 50.571 -77.436 1.00 59.72 ? 252 TYR E CD1 1 ATOM 7092 C CD2 . TYR C 1 257 ? 3.086 52.081 -78.239 1.00 58.20 ? 252 TYR E CD2 1 ATOM 7093 C CE1 . TYR C 1 257 ? 5.629 51.013 -78.438 1.00 60.23 ? 252 TYR E CE1 1 ATOM 7094 C CE2 . TYR C 1 257 ? 3.942 52.540 -79.228 1.00 55.31 ? 252 TYR E CE2 1 ATOM 7095 C CZ . TYR C 1 257 ? 5.203 52.009 -79.332 1.00 58.91 ? 252 TYR E CZ 1 ATOM 7096 O OH . TYR C 1 257 ? 6.036 52.471 -80.313 1.00 61.35 ? 252 TYR E OH 1 ATOM 7097 N N . ALA C 1 258 ? 1.490 48.305 -74.651 1.00 53.78 ? 253 ALA E N 1 ATOM 7098 C CA . ALA C 1 258 ? 0.933 47.701 -73.449 1.00 53.76 ? 253 ALA E CA 1 ATOM 7099 C C . ALA C 1 258 ? 2.098 47.483 -72.531 1.00 51.27 ? 253 ALA E C 1 ATOM 7100 O O . ALA C 1 258 ? 3.237 47.755 -72.927 1.00 52.43 ? 253 ALA E O 1 ATOM 7101 C CB . ALA C 1 258 ? 0.228 46.383 -73.801 1.00 52.80 ? 253 ALA E CB 1 ATOM 7102 N N . TYR C 1 259 ? 1.878 46.913 -71.357 1.00 48.03 ? 254 TYR E N 1 ATOM 7103 C CA . TYR C 1 259 ? 2.997 46.769 -70.443 1.00 45.38 ? 254 TYR E CA 1 ATOM 7104 C C . TYR C 1 259 ? 3.122 45.391 -69.816 1.00 43.81 ? 254 TYR E C 1 ATOM 7105 O O . TYR C 1 259 ? 2.194 44.924 -69.171 1.00 47.08 ? 254 TYR E O 1 ATOM 7106 C CB . TYR C 1 259 ? 2.843 47.800 -69.367 1.00 46.85 ? 254 TYR E CB 1 ATOM 7107 C CG . TYR C 1 259 ? 2.747 49.243 -69.839 1.00 50.37 ? 254 TYR E CG 1 ATOM 7108 C CD1 . TYR C 1 259 ? 1.510 49.878 -70.028 1.00 54.32 ? 254 TYR E CD1 1 ATOM 7109 C CD2 . TYR C 1 259 ? 3.875 49.994 -69.999 1.00 51.90 ? 254 TYR E CD2 1 ATOM 7110 C CE1 . TYR C 1 259 ? 1.431 51.213 -70.406 1.00 56.01 ? 254 TYR E CE1 1 ATOM 7111 C CE2 . TYR C 1 259 ? 3.803 51.322 -70.369 1.00 55.14 ? 254 TYR E CE2 1 ATOM 7112 C CZ . TYR C 1 259 ? 2.592 51.927 -70.580 1.00 56.72 ? 254 TYR E CZ 1 ATOM 7113 O OH . TYR C 1 259 ? 2.574 53.255 -70.958 1.00 57.11 ? 254 TYR E OH 1 ATOM 7114 N N . LYS C 1 260 ? 4.281 44.751 -69.971 1.00 43.19 ? 255 LYS E N 1 ATOM 7115 C CA . LYS C 1 260 ? 4.599 43.548 -69.186 1.00 41.06 ? 255 LYS E CA 1 ATOM 7116 C C . LYS C 1 260 ? 4.760 43.996 -67.728 1.00 40.00 ? 255 LYS E C 1 ATOM 7117 O O . LYS C 1 260 ? 5.441 44.981 -67.448 1.00 40.10 ? 255 LYS E O 1 ATOM 7118 C CB . LYS C 1 260 ? 5.859 42.872 -69.653 1.00 43.49 ? 255 LYS E CB 1 ATOM 7119 C CG . LYS C 1 260 ? 5.800 42.490 -71.115 1.00 53.74 ? 255 LYS E CG 1 ATOM 7120 C CD . LYS C 1 260 ? 6.677 41.293 -71.475 1.00 59.80 ? 255 LYS E CD 1 ATOM 7121 C CE . LYS C 1 260 ? 8.154 41.584 -71.357 1.00 64.09 ? 255 LYS E CE 1 ATOM 7122 N NZ . LYS C 1 260 ? 8.894 40.300 -71.372 1.00 70.98 ? 255 LYS E NZ 1 ATOM 7123 N N . ILE C 1 261 ? 4.145 43.268 -66.808 1.00 35.73 ? 256 ILE E N 1 ATOM 7124 C CA . ILE C 1 261 ? 4.075 43.700 -65.467 1.00 37.39 ? 256 ILE E CA 1 ATOM 7125 C C . ILE C 1 261 ? 4.304 42.491 -64.578 1.00 41.61 ? 256 ILE E C 1 ATOM 7126 O O . ILE C 1 261 ? 3.747 41.424 -64.809 1.00 45.65 ? 256 ILE E O 1 ATOM 7127 C CB . ILE C 1 261 ? 2.771 44.441 -65.272 1.00 41.71 ? 256 ILE E CB 1 ATOM 7128 C CG1 . ILE C 1 261 ? 2.574 44.886 -63.877 1.00 47.64 ? 256 ILE E CG1 1 ATOM 7129 C CG2 . ILE C 1 261 ? 1.602 43.529 -65.586 1.00 52.30 ? 256 ILE E CG2 1 ATOM 7130 C CD1 . ILE C 1 261 ? 1.311 45.726 -63.680 1.00 53.64 ? 256 ILE E CD1 1 ATOM 7131 N N . VAL C 1 262 ? 5.193 42.623 -63.593 1.00 41.75 ? 257 VAL E N 1 ATOM 7132 C CA . VAL C 1 262 ? 5.313 41.600 -62.525 1.00 40.25 ? 257 VAL E CA 1 ATOM 7133 C C . VAL C 1 262 ? 5.142 42.273 -61.184 1.00 39.88 ? 257 VAL E C 1 ATOM 7134 O O . VAL C 1 262 ? 5.802 43.263 -60.920 1.00 42.29 ? 257 VAL E O 1 ATOM 7135 C CB . VAL C 1 262 ? 6.673 40.868 -62.561 1.00 40.86 ? 257 VAL E CB 1 ATOM 7136 C CG1 . VAL C 1 262 ? 6.823 39.938 -61.371 1.00 39.71 ? 257 VAL E CG1 1 ATOM 7137 C CG2 . VAL C 1 262 ? 6.780 40.044 -63.820 1.00 39.60 ? 257 VAL E CG2 1 ATOM 7138 N N . LYS C 1 263 ? 4.269 41.742 -60.349 1.00 43.72 ? 258 LYS E N 1 ATOM 7139 C CA . LYS C 1 263 ? 3.771 42.472 -59.193 1.00 49.13 ? 258 LYS E CA 1 ATOM 7140 C C . LYS C 1 263 ? 4.491 42.267 -57.854 1.00 53.15 ? 258 LYS E C 1 ATOM 7141 O O . LYS C 1 263 ? 5.155 43.220 -57.342 1.00 73.51 ? 258 LYS E O 1 ATOM 7142 C CB . LYS C 1 263 ? 2.271 42.256 -59.031 1.00 50.70 ? 258 LYS E CB 1 ATOM 7143 C CG . LYS C 1 263 ? 1.522 43.574 -58.834 1.00 55.05 ? 258 LYS E CG 1 ATOM 7144 C CD . LYS C 1 263 ? 1.927 44.326 -57.572 1.00 49.63 ? 258 LYS E CD 1 ATOM 7145 C CE . LYS C 1 263 ? 0.807 45.230 -57.114 1.00 47.24 ? 258 LYS E CE 1 ATOM 7146 N NZ . LYS C 1 263 ? 1.268 46.278 -56.154 1.00 46.50 ? 258 LYS E NZ 1 ATOM 7147 N N . LYS C 1 264 ? 4.345 41.118 -57.226 1.00 47.82 ? 259 LYS E N 1 ATOM 7148 C CA . LYS C 1 264 ? 5.136 40.884 -55.950 1.00 58.37 ? 259 LYS E CA 1 ATOM 7149 C C . LYS C 1 264 ? 4.848 41.572 -54.593 1.00 54.42 ? 259 LYS E C 1 ATOM 7150 O O . LYS C 1 264 ? 4.799 40.885 -53.573 1.00 67.91 ? 259 LYS E O 1 ATOM 7151 C CB . LYS C 1 264 ? 6.622 41.109 -56.215 1.00 60.25 ? 259 LYS E CB 1 ATOM 7152 C CG . LYS C 1 264 ? 7.537 40.170 -55.467 1.00 68.39 ? 259 LYS E CG 1 ATOM 7153 C CD . LYS C 1 264 ? 8.617 39.616 -56.388 1.00 74.06 ? 259 LYS E CD 1 ATOM 7154 C CE . LYS C 1 264 ? 8.031 38.639 -57.398 1.00 77.22 ? 259 LYS E CE 1 ATOM 7155 N NZ . LYS C 1 264 ? 9.052 38.240 -58.398 1.00 79.59 ? 259 LYS E NZ 1 ATOM 7156 N N . GLY C 1 265 ? 4.733 42.892 -54.586 1.00 50.83 ? 260 GLY E N 1 ATOM 7157 C CA . GLY C 1 265 ? 4.476 43.720 -53.399 1.00 50.18 ? 260 GLY E CA 1 ATOM 7158 C C . GLY C 1 265 ? 3.575 44.959 -53.604 1.00 44.99 ? 260 GLY E C 1 ATOM 7159 O O . GLY C 1 265 ? 3.339 45.403 -54.710 1.00 40.01 ? 260 GLY E O 1 ATOM 7160 N N . ASP C 1 266 ? 3.128 45.546 -52.496 1.00 50.13 ? 261 ASP E N 1 ATOM 7161 C CA . ASP C 1 266 ? 2.201 46.693 -52.498 1.00 52.67 ? 261 ASP E CA 1 ATOM 7162 C C . ASP C 1 266 ? 2.781 47.937 -51.819 1.00 43.86 ? 261 ASP E C 1 ATOM 7163 O O . ASP C 1 266 ? 3.599 47.853 -50.915 1.00 47.24 ? 261 ASP E O 1 ATOM 7164 C CB . ASP C 1 266 ? 0.927 46.326 -51.765 1.00 61.78 ? 261 ASP E CB 1 ATOM 7165 C CG . ASP C 1 266 ? 0.018 45.412 -52.573 1.00 75.59 ? 261 ASP E CG 1 ATOM 7166 O OD1 . ASP C 1 266 ? -0.618 45.885 -53.582 1.00 71.42 ? 261 ASP E OD1 1 ATOM 7167 O OD2 . ASP C 1 266 ? -0.089 44.242 -52.113 1.00 79.69 ? 261 ASP E OD2 1 ATOM 7168 N N . SER C 1 267 ? 2.313 49.093 -52.250 1.00 37.05 ? 262 SER E N 1 ATOM 7169 C CA . SER C 1 267 ? 2.789 50.346 -51.738 1.00 37.39 ? 262 SER E CA 1 ATOM 7170 C C . SER C 1 267 ? 1.627 51.343 -51.862 1.00 36.67 ? 262 SER E C 1 ATOM 7171 O O . SER C 1 267 ? 0.505 50.968 -51.627 1.00 39.22 ? 262 SER E O 1 ATOM 7172 C CB . SER C 1 267 ? 3.973 50.785 -52.580 1.00 39.51 ? 262 SER E CB 1 ATOM 7173 O OG . SER C 1 267 ? 4.662 51.776 -51.948 1.00 39.61 ? 262 SER E OG 1 ATOM 7174 N N . THR C 1 268 ? 1.900 52.607 -52.167 1.00 35.55 ? 263 THR E N 1 ATOM 7175 C CA . THR C 1 268 ? 0.848 53.571 -52.428 1.00 35.29 ? 263 THR E CA 1 ATOM 7176 C C . THR C 1 268 ? 1.430 54.733 -53.191 1.00 37.81 ? 263 THR E C 1 ATOM 7177 O O . THR C 1 268 ? 2.610 54.715 -53.536 1.00 39.45 ? 263 THR E O 1 ATOM 7178 C CB . THR C 1 268 ? 0.174 54.095 -51.155 1.00 35.91 ? 263 THR E CB 1 ATOM 7179 O OG1 . THR C 1 268 ? -1.020 54.774 -51.513 1.00 38.29 ? 263 THR E OG1 1 ATOM 7180 C CG2 . THR C 1 268 ? 1.083 55.071 -50.393 1.00 39.02 ? 263 THR E CG2 1 ATOM 7181 N N . ILE C 1 269 ? 0.606 55.724 -53.478 1.00 35.59 ? 264 ILE E N 1 ATOM 7182 C CA . ILE C 1 269 ? 1.061 56.908 -54.183 1.00 38.30 ? 264 ILE E CA 1 ATOM 7183 C C . ILE C 1 269 ? 1.407 58.007 -53.184 1.00 37.67 ? 264 ILE E C 1 ATOM 7184 O O . ILE C 1 269 ? 0.569 58.387 -52.380 1.00 39.80 ? 264 ILE E O 1 ATOM 7185 C CB . ILE C 1 269 ? -0.044 57.468 -55.090 1.00 41.98 ? 264 ILE E CB 1 ATOM 7186 C CG1 . ILE C 1 269 ? -0.591 56.368 -56.007 1.00 42.70 ? 264 ILE E CG1 1 ATOM 7187 C CG2 . ILE C 1 269 ? 0.440 58.691 -55.878 1.00 43.22 ? 264 ILE E CG2 1 ATOM 7188 C CD1 . ILE C 1 269 ? 0.440 55.750 -56.899 1.00 43.66 ? 264 ILE E CD1 1 ATOM 7189 N N . MET C 1 270 ? 2.633 58.521 -53.250 1.00 39.09 ? 265 MET E N 1 ATOM 7190 C CA . MET C 1 270 ? 3.046 59.613 -52.399 1.00 42.78 ? 265 MET E CA 1 ATOM 7191 C C . MET C 1 270 ? 2.875 60.953 -53.129 1.00 43.36 ? 265 MET E C 1 ATOM 7192 O O . MET C 1 270 ? 3.276 61.092 -54.269 1.00 48.05 ? 265 MET E O 1 ATOM 7193 C CB . MET C 1 270 ? 4.486 59.427 -51.942 1.00 44.36 ? 265 MET E CB 1 ATOM 7194 C CG . MET C 1 270 ? 5.023 60.640 -51.183 1.00 44.46 ? 265 MET E CG 1 ATOM 7195 S SD . MET C 1 270 ? 6.572 60.363 -50.313 1.00 43.50 ? 265 MET E SD 1 ATOM 7196 C CE . MET C 1 270 ? 6.052 59.125 -49.145 1.00 45.23 ? 265 MET E CE 1 ATOM 7197 N N . LYS C 1 271 ? 2.261 61.922 -52.459 1.00 43.98 ? 266 LYS E N 1 ATOM 7198 C CA . LYS C 1 271 ? 2.153 63.277 -52.972 1.00 46.34 ? 266 LYS E CA 1 ATOM 7199 C C . LYS C 1 271 ? 3.286 64.093 -52.356 1.00 46.38 ? 266 LYS E C 1 ATOM 7200 O O . LYS C 1 271 ? 3.330 64.280 -51.147 1.00 40.78 ? 266 LYS E O 1 ATOM 7201 C CB . LYS C 1 271 ? 0.793 63.904 -52.615 1.00 50.07 ? 266 LYS E CB 1 ATOM 7202 C CG . LYS C 1 271 ? -0.441 63.180 -53.181 1.00 53.06 ? 266 LYS E CG 1 ATOM 7203 C CD . LYS C 1 271 ? -0.391 63.002 -54.698 1.00 57.61 ? 266 LYS E CD 1 ATOM 7204 C CE . LYS C 1 271 ? -1.736 63.236 -55.407 1.00 60.24 ? 266 LYS E CE 1 ATOM 7205 N NZ . LYS C 1 271 ? -1.583 63.824 -56.809 1.00 54.91 ? 266 LYS E NZ 1 ATOM 7206 N N . SER C 1 272 ? 4.210 64.562 -53.189 1.00 46.15 ? 267 SER E N 1 ATOM 7207 C CA . SER C 1 272 ? 5.332 65.387 -52.727 1.00 44.50 ? 267 SER E CA 1 ATOM 7208 C C . SER C 1 272 ? 5.813 66.340 -53.792 1.00 46.27 ? 267 SER E C 1 ATOM 7209 O O . SER C 1 272 ? 5.779 66.013 -54.995 1.00 45.25 ? 267 SER E O 1 ATOM 7210 C CB . SER C 1 272 ? 6.520 64.512 -52.383 1.00 48.55 ? 267 SER E CB 1 ATOM 7211 O OG . SER C 1 272 ? 7.530 65.291 -51.759 1.00 46.61 ? 267 SER E OG 1 ATOM 7212 N N . GLU C 1 273 ? 6.312 67.493 -53.358 1.00 52.97 ? 268 GLU E N 1 ATOM 7213 C CA . GLU C 1 273 ? 6.833 68.511 -54.299 1.00 57.00 ? 268 GLU E CA 1 ATOM 7214 C C . GLU C 1 273 ? 8.353 68.443 -54.411 1.00 61.08 ? 268 GLU E C 1 ATOM 7215 O O . GLU C 1 273 ? 8.975 69.053 -55.298 1.00 73.70 ? 268 GLU E O 1 ATOM 7216 C CB . GLU C 1 273 ? 6.395 69.915 -53.880 1.00 56.51 ? 268 GLU E CB 1 ATOM 7217 C CG . GLU C 1 273 ? 4.903 70.068 -53.635 1.00 58.77 ? 268 GLU E CG 1 ATOM 7218 C CD . GLU C 1 273 ? 4.020 69.627 -54.813 1.00 63.74 ? 268 GLU E CD 1 ATOM 7219 O OE1 . GLU C 1 273 ? 4.166 70.161 -55.938 1.00 68.49 ? 268 GLU E OE1 1 ATOM 7220 O OE2 . GLU C 1 273 ? 3.150 68.738 -54.619 1.00 72.91 ? 268 GLU E OE2 1 ATOM 7221 N N . MET C 1 274 ? 8.936 67.604 -53.573 1.00 59.48 ? 269 MET E N 1 ATOM 7222 C CA . MET C 1 274 ? 10.359 67.437 -53.511 1.00 58.34 ? 269 MET E CA 1 ATOM 7223 C C . MET C 1 274 ? 11.012 66.598 -54.579 1.00 57.54 ? 269 MET E C 1 ATOM 7224 O O . MET C 1 274 ? 10.405 66.122 -55.541 1.00 57.66 ? 269 MET E O 1 ATOM 7225 C CB . MET C 1 274 ? 10.729 66.802 -52.218 1.00 55.92 ? 269 MET E CB 1 ATOM 7226 C CG . MET C 1 274 ? 10.340 67.701 -51.072 1.00 62.89 ? 269 MET E CG 1 ATOM 7227 S SD . MET C 1 274 ? 11.187 67.147 -49.611 1.00 73.14 ? 269 MET E SD 1 ATOM 7228 C CE . MET C 1 274 ? 11.073 65.387 -49.855 1.00 69.31 ? 269 MET E CE 1 ATOM 7229 N N . GLU C 1 275 ? 12.311 66.488 -54.353 1.00 57.14 ? 270 GLU E N 1 ATOM 7230 C CA . GLU C 1 275 ? 13.265 66.105 -55.341 1.00 56.36 ? 270 GLU E CA 1 ATOM 7231 C C . GLU C 1 275 ? 14.002 64.847 -54.932 1.00 53.35 ? 270 GLU E C 1 ATOM 7232 O O . GLU C 1 275 ? 14.223 64.650 -53.741 1.00 52.65 ? 270 GLU E O 1 ATOM 7233 C CB . GLU C 1 275 ? 14.258 67.267 -55.504 1.00 58.82 ? 270 GLU E CB 1 ATOM 7234 C CG . GLU C 1 275 ? 14.665 67.418 -56.946 1.00 67.08 ? 270 GLU E CG 1 ATOM 7235 C CD . GLU C 1 275 ? 13.594 68.076 -57.782 1.00 68.62 ? 270 GLU E CD 1 ATOM 7236 O OE1 . GLU C 1 275 ? 12.771 68.810 -57.179 1.00 66.21 ? 270 GLU E OE1 1 ATOM 7237 O OE2 . GLU C 1 275 ? 13.578 67.823 -59.023 1.00 70.60 ? 270 GLU E OE2 1 ATOM 7238 N N . TYR C 1 276 ? 14.406 64.018 -55.913 1.00 49.73 ? 271 TYR E N 1 ATOM 7239 C CA . TYR C 1 276 ? 15.218 62.803 -55.663 1.00 48.12 ? 271 TYR E CA 1 ATOM 7240 C C . TYR C 1 276 ? 16.567 63.240 -55.078 1.00 49.13 ? 271 TYR E C 1 ATOM 7241 O O . TYR C 1 276 ? 17.207 64.154 -55.602 1.00 45.98 ? 271 TYR E O 1 ATOM 7242 C CB . TYR C 1 276 ? 15.434 61.964 -56.948 1.00 47.15 ? 271 TYR E CB 1 ATOM 7243 C CG . TYR C 1 276 ? 16.145 60.647 -56.727 1.00 47.22 ? 271 TYR E CG 1 ATOM 7244 C CD1 . TYR C 1 276 ? 15.696 59.740 -55.783 1.00 45.85 ? 271 TYR E CD1 1 ATOM 7245 C CD2 . TYR C 1 276 ? 17.293 60.311 -57.454 1.00 48.85 ? 271 TYR E CD2 1 ATOM 7246 C CE1 . TYR C 1 276 ? 16.340 58.535 -55.573 1.00 46.08 ? 271 TYR E CE1 1 ATOM 7247 C CE2 . TYR C 1 276 ? 17.941 59.093 -57.253 1.00 48.80 ? 271 TYR E CE2 1 ATOM 7248 C CZ . TYR C 1 276 ? 17.451 58.217 -56.312 1.00 48.84 ? 271 TYR E CZ 1 ATOM 7249 O OH . TYR C 1 276 ? 18.093 57.037 -56.106 1.00 55.12 ? 271 TYR E OH 1 ATOM 7250 N N . GLY C 1 277 ? 16.996 62.555 -54.034 1.00 49.06 ? 272 GLY E N 1 ATOM 7251 C CA . GLY C 1 277 ? 18.239 62.885 -53.348 1.00 49.54 ? 272 GLY E CA 1 ATOM 7252 C C . GLY C 1 277 ? 19.338 61.833 -53.351 1.00 53.17 ? 272 GLY E C 1 ATOM 7253 O O . GLY C 1 277 ? 20.249 61.870 -52.523 1.00 53.90 ? 272 GLY E O 1 ATOM 7254 N N . HIS C 1 278 ? 19.245 60.870 -54.257 1.00 53.58 ? 273 HIS E N 1 ATOM 7255 C CA . HIS C 1 278 ? 20.331 59.909 -54.433 1.00 56.89 ? 273 HIS E CA 1 ATOM 7256 C C . HIS C 1 278 ? 20.699 59.266 -53.096 1.00 55.79 ? 273 HIS E C 1 ATOM 7257 O O . HIS C 1 278 ? 21.846 59.114 -52.768 1.00 60.04 ? 273 HIS E O 1 ATOM 7258 C CB . HIS C 1 278 ? 21.558 60.609 -55.073 1.00 58.49 ? 273 HIS E CB 1 ATOM 7259 C CG . HIS C 1 278 ? 21.235 61.353 -56.330 1.00 58.56 ? 273 HIS E CG 1 ATOM 7260 N ND1 . HIS C 1 278 ? 21.179 60.738 -57.570 1.00 56.91 ? 273 HIS E ND1 1 ATOM 7261 C CD2 . HIS C 1 278 ? 20.890 62.648 -56.534 1.00 57.36 ? 273 HIS E CD2 1 ATOM 7262 C CE1 . HIS C 1 278 ? 20.789 61.617 -58.479 1.00 56.42 ? 273 HIS E CE1 1 ATOM 7263 N NE2 . HIS C 1 278 ? 20.618 62.785 -57.879 1.00 58.53 ? 273 HIS E NE2 1 ATOM 7264 N N . CYS C 1 279 ? 19.689 58.889 -52.342 1.00 56.92 ? 274 CYS E N 1 ATOM 7265 C CA . CYS C 1 279 ? 19.824 58.414 -50.969 1.00 56.66 ? 274 CYS E CA 1 ATOM 7266 C C . CYS C 1 279 ? 18.996 57.145 -50.855 1.00 52.38 ? 274 CYS E C 1 ATOM 7267 O O . CYS C 1 279 ? 18.222 56.803 -51.753 1.00 48.31 ? 274 CYS E O 1 ATOM 7268 C CB . CYS C 1 279 ? 19.279 59.463 -49.981 1.00 62.13 ? 274 CYS E CB 1 ATOM 7269 S SG . CYS C 1 279 ? 17.705 60.246 -50.506 1.00 70.71 ? 274 CYS E SG 1 ATOM 7270 N N . ASN C 1 280 ? 19.141 56.464 -49.738 1.00 49.63 ? 275 ASN E N 1 ATOM 7271 C CA . ASN C 1 280 ? 18.365 55.280 -49.477 1.00 51.47 ? 275 ASN E CA 1 ATOM 7272 C C . ASN C 1 280 ? 17.758 55.412 -48.083 1.00 50.48 ? 275 ASN E C 1 ATOM 7273 O O . ASN C 1 280 ? 18.312 56.075 -47.197 1.00 50.23 ? 275 ASN E O 1 ATOM 7274 C CB . ASN C 1 280 ? 19.236 54.020 -49.651 1.00 50.97 ? 275 ASN E CB 1 ATOM 7275 C CG . ASN C 1 280 ? 18.460 52.720 -49.459 1.00 53.33 ? 275 ASN E CG 1 ATOM 7276 O OD1 . ASN C 1 280 ? 17.379 52.545 -50.013 1.00 51.35 ? 275 ASN E OD1 1 ATOM 7277 N ND2 . ASN C 1 280 ? 18.996 51.822 -48.651 1.00 52.26 ? 275 ASN E ND2 1 ATOM 7278 N N . THR C 1 281 ? 16.590 54.812 -47.903 1.00 48.59 ? 276 THR E N 1 ATOM 7279 C CA . THR C 1 281 ? 15.922 54.824 -46.598 1.00 47.02 ? 276 THR E CA 1 ATOM 7280 C C . THR C 1 281 ? 15.012 53.610 -46.371 1.00 48.09 ? 276 THR E C 1 ATOM 7281 O O . THR C 1 281 ? 14.676 52.892 -47.304 1.00 51.69 ? 276 THR E O 1 ATOM 7282 C CB . THR C 1 281 ? 15.151 56.129 -46.425 1.00 45.57 ? 276 THR E CB 1 ATOM 7283 O OG1 . THR C 1 281 ? 14.719 56.243 -45.085 1.00 46.62 ? 276 THR E OG1 1 ATOM 7284 C CG2 . THR C 1 281 ? 13.948 56.194 -47.328 1.00 47.04 ? 276 THR E CG2 1 ATOM 7285 N N . LYS C 1 282 ? 14.649 53.394 -45.117 1.00 52.39 ? 277 LYS E N 1 ATOM 7286 C CA . LYS C 1 282 ? 13.623 52.419 -44.714 1.00 52.46 ? 277 LYS E CA 1 ATOM 7287 C C . LYS C 1 282 ? 12.263 53.078 -44.613 1.00 48.34 ? 277 LYS E C 1 ATOM 7288 O O . LYS C 1 282 ? 11.245 52.378 -44.521 1.00 47.42 ? 277 LYS E O 1 ATOM 7289 C CB . LYS C 1 282 ? 13.798 51.923 -43.279 1.00 59.57 ? 277 LYS E CB 1 ATOM 7290 C CG . LYS C 1 282 ? 14.765 50.842 -42.918 1.00 71.85 ? 277 LYS E CG 1 ATOM 7291 C CD . LYS C 1 282 ? 14.374 50.387 -41.483 1.00 77.85 ? 277 LYS E CD 1 ATOM 7292 C CE . LYS C 1 282 ? 15.041 51.272 -40.444 1.00 90.97 ? 277 LYS E CE 1 ATOM 7293 N NZ . LYS C 1 282 ? 16.448 50.821 -40.222 1.00 102.23 ? 277 LYS E NZ 1 ATOM 7294 N N . CYS C 1 283 ? 12.272 54.401 -44.463 1.00 44.06 ? 278 CYS E N 1 ATOM 7295 C CA . CYS C 1 283 ? 11.091 55.171 -44.085 1.00 41.95 ? 278 CYS E CA 1 ATOM 7296 C C . CYS C 1 283 ? 11.064 56.495 -44.837 1.00 40.03 ? 278 CYS E C 1 ATOM 7297 O O . CYS C 1 283 ? 11.790 57.412 -44.494 1.00 42.51 ? 278 CYS E O 1 ATOM 7298 C CB . CYS C 1 283 ? 11.072 55.421 -42.561 1.00 40.43 ? 278 CYS E CB 1 ATOM 7299 S SG . CYS C 1 283 ? 9.663 56.426 -42.029 1.00 44.06 ? 278 CYS E SG 1 ATOM 7300 N N . GLN C 1 284 ? 10.164 56.628 -45.814 1.00 41.07 ? 279 GLN E N 1 ATOM 7301 C CA . GLN C 1 284 ? 10.013 57.895 -46.559 1.00 37.62 ? 279 GLN E CA 1 ATOM 7302 C C . GLN C 1 284 ? 8.780 58.670 -46.122 1.00 39.13 ? 279 GLN E C 1 ATOM 7303 O O . GLN C 1 284 ? 7.715 58.077 -45.884 1.00 38.22 ? 279 GLN E O 1 ATOM 7304 C CB . GLN C 1 284 ? 9.869 57.581 -48.020 1.00 39.21 ? 279 GLN E CB 1 ATOM 7305 C CG . GLN C 1 284 ? 9.915 58.781 -48.940 1.00 41.34 ? 279 GLN E CG 1 ATOM 7306 C CD . GLN C 1 284 ? 11.265 59.496 -48.951 1.00 42.38 ? 279 GLN E CD 1 ATOM 7307 O OE1 . GLN C 1 284 ? 12.341 58.856 -49.120 1.00 40.23 ? 279 GLN E OE1 1 ATOM 7308 N NE2 . GLN C 1 284 ? 11.239 60.783 -48.627 1.00 42.91 ? 279 GLN E NE2 1 ATOM 7309 N N . THR C 1 285 ? 8.933 59.989 -45.983 1.00 37.46 ? 280 THR E N 1 ATOM 7310 C CA . THR C 1 285 ? 7.807 60.886 -45.806 1.00 37.60 ? 280 THR E CA 1 ATOM 7311 C C . THR C 1 285 ? 7.795 61.897 -46.928 1.00 36.86 ? 280 THR E C 1 ATOM 7312 O O . THR C 1 285 ? 8.783 62.065 -47.613 1.00 36.15 ? 280 THR E O 1 ATOM 7313 C CB . THR C 1 285 ? 7.827 61.640 -44.477 1.00 38.90 ? 280 THR E CB 1 ATOM 7314 O OG1 . THR C 1 285 ? 8.523 62.879 -44.617 1.00 44.76 ? 280 THR E OG1 1 ATOM 7315 C CG2 . THR C 1 285 ? 8.469 60.812 -43.416 1.00 40.10 ? 280 THR E CG2 1 ATOM 7316 N N . PRO C 1 286 ? 6.648 62.544 -47.156 1.00 39.63 ? 281 PRO E N 1 ATOM 7317 C CA . PRO C 1 286 ? 6.604 63.435 -48.295 1.00 40.45 ? 281 PRO E CA 1 ATOM 7318 C C . PRO C 1 286 ? 7.435 64.695 -48.134 1.00 44.58 ? 281 PRO E C 1 ATOM 7319 O O . PRO C 1 286 ? 7.637 65.391 -49.145 1.00 47.25 ? 281 PRO E O 1 ATOM 7320 C CB . PRO C 1 286 ? 5.135 63.843 -48.385 1.00 39.08 ? 281 PRO E CB 1 ATOM 7321 C CG . PRO C 1 286 ? 4.396 62.872 -47.552 1.00 40.09 ? 281 PRO E CG 1 ATOM 7322 C CD . PRO C 1 286 ? 5.349 62.503 -46.459 1.00 38.60 ? 281 PRO E CD 1 ATOM 7323 N N . ILE C 1 287 ? 7.942 64.980 -46.921 1.00 43.56 ? 282 ILE E N 1 ATOM 7324 C CA . ILE C 1 287 ? 8.874 66.113 -46.740 1.00 44.88 ? 282 ILE E CA 1 ATOM 7325 C C . ILE C 1 287 ? 10.332 65.685 -46.482 1.00 48.16 ? 282 ILE E C 1 ATOM 7326 O O . ILE C 1 287 ? 11.232 66.537 -46.311 1.00 47.28 ? 282 ILE E O 1 ATOM 7327 C CB . ILE C 1 287 ? 8.403 67.061 -45.641 1.00 46.24 ? 282 ILE E CB 1 ATOM 7328 C CG1 . ILE C 1 287 ? 8.323 66.350 -44.299 1.00 44.18 ? 282 ILE E CG1 1 ATOM 7329 C CG2 . ILE C 1 287 ? 7.066 67.691 -46.016 1.00 45.80 ? 282 ILE E CG2 1 ATOM 7330 C CD1 . ILE C 1 287 ? 8.083 67.318 -43.150 1.00 44.29 ? 282 ILE E CD1 1 ATOM 7331 N N . GLY C 1 288 ? 10.580 64.370 -46.503 1.00 48.34 ? 283 GLY E N 1 ATOM 7332 C CA . GLY C 1 288 ? 11.918 63.824 -46.320 1.00 47.14 ? 283 GLY E CA 1 ATOM 7333 C C . GLY C 1 288 ? 11.944 62.454 -45.682 1.00 46.90 ? 283 GLY E C 1 ATOM 7334 O O . GLY C 1 288 ? 11.001 62.067 -45.004 1.00 46.90 ? 283 GLY E O 1 ATOM 7335 N N . ALA C 1 289 ? 13.062 61.755 -45.868 1.00 45.63 ? 284 ALA E N 1 ATOM 7336 C CA . ALA C 1 289 ? 13.297 60.432 -45.288 1.00 45.19 ? 284 ALA E CA 1 ATOM 7337 C C . ALA C 1 289 ? 13.744 60.495 -43.833 1.00 45.66 ? 284 ALA E C 1 ATOM 7338 O O . ALA C 1 289 ? 14.345 61.456 -43.384 1.00 54.12 ? 284 ALA E O 1 ATOM 7339 C CB . ALA C 1 289 ? 14.343 59.689 -46.090 1.00 42.83 ? 284 ALA E CB 1 ATOM 7340 N N . ILE C 1 290 ? 13.428 59.449 -43.107 1.00 47.09 ? 285 ILE E N 1 ATOM 7341 C CA . ILE C 1 290 ? 13.678 59.362 -41.664 1.00 50.57 ? 285 ILE E CA 1 ATOM 7342 C C . ILE C 1 290 ? 14.714 58.279 -41.514 1.00 53.81 ? 285 ILE E C 1 ATOM 7343 O O . ILE C 1 290 ? 14.595 57.207 -42.129 1.00 51.53 ? 285 ILE E O 1 ATOM 7344 C CB . ILE C 1 290 ? 12.399 58.944 -40.864 1.00 47.94 ? 285 ILE E CB 1 ATOM 7345 C CG1 . ILE C 1 290 ? 11.425 60.110 -40.726 1.00 49.33 ? 285 ILE E CG1 1 ATOM 7346 C CG2 . ILE C 1 290 ? 12.742 58.474 -39.464 1.00 53.50 ? 285 ILE E CG2 1 ATOM 7347 C CD1 . ILE C 1 290 ? 10.066 59.696 -40.199 1.00 47.26 ? 285 ILE E CD1 1 ATOM 7348 N N . ASN C 1 291 ? 15.698 58.539 -40.670 1.00 55.73 ? 286 ASN E N 1 ATOM 7349 C CA . ASN C 1 291 ? 16.788 57.599 -40.452 1.00 58.76 ? 286 ASN E CA 1 ATOM 7350 C C . ASN C 1 291 ? 16.960 57.531 -38.945 1.00 56.45 ? 286 ASN E C 1 ATOM 7351 O O . ASN C 1 291 ? 17.595 58.411 -38.344 1.00 53.32 ? 286 ASN E O 1 ATOM 7352 C CB . ASN C 1 291 ? 18.028 58.144 -41.195 1.00 63.78 ? 286 ASN E CB 1 ATOM 7353 C CG . ASN C 1 291 ? 19.268 57.328 -41.009 1.00 73.76 ? 286 ASN E CG 1 ATOM 7354 O OD1 . ASN C 1 291 ? 19.215 56.177 -40.548 1.00 75.08 ? 286 ASN E OD1 1 ATOM 7355 N ND2 . ASN C 1 291 ? 20.433 57.944 -41.398 1.00 91.91 ? 286 ASN E ND2 1 ATOM 7356 N N . SER C 1 292 ? 16.347 56.524 -38.328 1.00 49.90 ? 287 SER E N 1 ATOM 7357 C CA . SER C 1 292 ? 16.182 56.519 -36.870 1.00 44.95 ? 287 SER E CA 1 ATOM 7358 C C . SER C 1 292 ? 15.844 55.158 -36.301 1.00 47.01 ? 287 SER E C 1 ATOM 7359 O O . SER C 1 292 ? 15.266 54.304 -36.984 1.00 50.12 ? 287 SER E O 1 ATOM 7360 C CB . SER C 1 292 ? 15.070 57.452 -36.487 1.00 42.31 ? 287 SER E CB 1 ATOM 7361 O OG . SER C 1 292 ? 14.920 57.498 -35.096 1.00 41.45 ? 287 SER E OG 1 ATOM 7362 N N . SER C 1 293 ? 16.242 54.963 -35.051 1.00 49.56 ? 288 SER E N 1 ATOM 7363 C CA . SER C 1 293 ? 15.901 53.773 -34.276 1.00 54.47 ? 288 SER E CA 1 ATOM 7364 C C . SER C 1 293 ? 14.920 54.147 -33.176 1.00 54.27 ? 288 SER E C 1 ATOM 7365 O O . SER C 1 293 ? 14.493 53.280 -32.422 1.00 56.32 ? 288 SER E O 1 ATOM 7366 C CB . SER C 1 293 ? 17.147 53.188 -33.623 1.00 60.72 ? 288 SER E CB 1 ATOM 7367 O OG . SER C 1 293 ? 17.878 52.453 -34.569 1.00 74.89 ? 288 SER E OG 1 ATOM 7368 N N . MET C 1 294 ? 14.579 55.435 -33.082 1.00 48.18 ? 289 MET E N 1 ATOM 7369 C CA . MET C 1 294 ? 13.635 55.883 -32.098 1.00 48.13 ? 289 MET E CA 1 ATOM 7370 C C . MET C 1 294 ? 12.249 55.268 -32.335 1.00 46.26 ? 289 MET E C 1 ATOM 7371 O O . MET C 1 294 ? 11.860 54.987 -33.462 1.00 45.11 ? 289 MET E O 1 ATOM 7372 C CB . MET C 1 294 ? 13.554 57.412 -32.077 1.00 57.45 ? 289 MET E CB 1 ATOM 7373 C CG . MET C 1 294 ? 14.831 58.113 -31.593 1.00 60.46 ? 289 MET E CG 1 ATOM 7374 S SD . MET C 1 294 ? 15.550 57.257 -30.171 1.00 71.40 ? 289 MET E SD 1 ATOM 7375 C CE . MET C 1 294 ? 16.927 58.338 -29.757 1.00 83.36 ? 289 MET E CE 1 ATOM 7376 N N . PRO C 1 295 ? 11.523 55.001 -31.249 1.00 45.69 ? 290 PRO E N 1 ATOM 7377 C CA . PRO C 1 295 ? 10.203 54.421 -31.307 1.00 45.39 ? 290 PRO E CA 1 ATOM 7378 C C . PRO C 1 295 ? 9.083 55.354 -31.740 1.00 42.91 ? 290 PRO E C 1 ATOM 7379 O O . PRO C 1 295 ? 8.008 54.857 -32.142 1.00 49.38 ? 290 PRO E O 1 ATOM 7380 C CB . PRO C 1 295 ? 9.959 53.992 -29.868 1.00 48.32 ? 290 PRO E CB 1 ATOM 7381 C CG . PRO C 1 295 ? 10.711 54.960 -29.055 1.00 48.63 ? 290 PRO E CG 1 ATOM 7382 C CD . PRO C 1 295 ? 11.942 55.260 -29.859 1.00 48.89 ? 290 PRO E CD 1 ATOM 7383 N N . PHE C 1 296 ? 9.300 56.662 -31.653 1.00 37.58 ? 291 PHE E N 1 ATOM 7384 C CA . PHE C 1 296 ? 8.296 57.649 -32.046 1.00 38.58 ? 291 PHE E CA 1 ATOM 7385 C C . PHE C 1 296 ? 8.839 58.723 -32.977 1.00 40.44 ? 291 PHE E C 1 ATOM 7386 O O . PHE C 1 296 ? 10.033 58.983 -32.989 1.00 41.34 ? 291 PHE E O 1 ATOM 7387 C CB . PHE C 1 296 ? 7.692 58.281 -30.806 1.00 39.83 ? 291 PHE E CB 1 ATOM 7388 C CG . PHE C 1 296 ? 7.144 57.277 -29.841 1.00 37.34 ? 291 PHE E CG 1 ATOM 7389 C CD1 . PHE C 1 296 ? 5.980 56.578 -30.124 1.00 35.82 ? 291 PHE E CD1 1 ATOM 7390 C CD2 . PHE C 1 296 ? 7.789 57.025 -28.653 1.00 38.67 ? 291 PHE E CD2 1 ATOM 7391 C CE1 . PHE C 1 296 ? 5.479 55.618 -29.242 1.00 35.60 ? 291 PHE E CE1 1 ATOM 7392 C CE2 . PHE C 1 296 ? 7.281 56.084 -27.759 1.00 39.12 ? 291 PHE E CE2 1 ATOM 7393 C CZ . PHE C 1 296 ? 6.130 55.392 -28.054 1.00 38.83 ? 291 PHE E CZ 1 ATOM 7394 N N . HIS C 1 297 ? 7.962 59.348 -33.752 1.00 43.00 ? 292 HIS E N 1 ATOM 7395 C CA . HIS C 1 297 ? 8.363 60.517 -34.551 1.00 41.81 ? 292 HIS E CA 1 ATOM 7396 C C . HIS C 1 297 ? 7.186 61.479 -34.721 1.00 41.37 ? 292 HIS E C 1 ATOM 7397 O O . HIS C 1 297 ? 6.049 61.111 -34.493 1.00 44.37 ? 292 HIS E O 1 ATOM 7398 C CB . HIS C 1 297 ? 8.906 60.093 -35.897 1.00 42.32 ? 292 HIS E CB 1 ATOM 7399 C CG . HIS C 1 297 ? 7.853 59.698 -36.888 1.00 45.30 ? 292 HIS E CG 1 ATOM 7400 N ND1 . HIS C 1 297 ? 7.366 60.558 -37.842 1.00 45.03 ? 292 HIS E ND1 1 ATOM 7401 C CD2 . HIS C 1 297 ? 7.219 58.520 -37.093 1.00 46.42 ? 292 HIS E CD2 1 ATOM 7402 C CE1 . HIS C 1 297 ? 6.446 59.947 -38.562 1.00 44.91 ? 292 HIS E CE1 1 ATOM 7403 N NE2 . HIS C 1 297 ? 6.343 58.706 -38.134 1.00 47.10 ? 292 HIS E NE2 1 ATOM 7404 N N . ASN C 1 298 ? 7.467 62.715 -35.089 1.00 41.34 ? 293 ASN E N 1 ATOM 7405 C CA . ASN C 1 298 ? 6.419 63.684 -35.300 1.00 41.81 ? 293 ASN E CA 1 ATOM 7406 C C . ASN C 1 298 ? 6.524 64.386 -36.638 1.00 44.28 ? 293 ASN E C 1 ATOM 7407 O O . ASN C 1 298 ? 5.977 65.465 -36.823 1.00 45.74 ? 293 ASN E O 1 ATOM 7408 C CB . ASN C 1 298 ? 6.412 64.716 -34.189 1.00 42.56 ? 293 ASN E CB 1 ATOM 7409 C CG . ASN C 1 298 ? 7.624 65.606 -34.222 1.00 43.43 ? 293 ASN E CG 1 ATOM 7410 O OD1 . ASN C 1 298 ? 8.557 65.366 -34.975 1.00 39.39 ? 293 ASN E OD1 1 ATOM 7411 N ND2 . ASN C 1 298 ? 7.616 66.634 -33.395 1.00 43.47 ? 293 ASN E ND2 1 ATOM 7412 N N . ILE C 1 299 ? 7.207 63.762 -37.579 1.00 44.86 ? 294 ILE E N 1 ATOM 7413 C CA . ILE C 1 299 ? 7.508 64.413 -38.837 1.00 48.77 ? 294 ILE E CA 1 ATOM 7414 C C . ILE C 1 299 ? 6.283 64.610 -39.764 1.00 50.57 ? 294 ILE E C 1 ATOM 7415 O O . ILE C 1 299 ? 5.999 65.741 -40.206 1.00 51.88 ? 294 ILE E O 1 ATOM 7416 C CB . ILE C 1 299 ? 8.660 63.682 -39.539 1.00 49.69 ? 294 ILE E CB 1 ATOM 7417 C CG1 . ILE C 1 299 ? 9.989 63.946 -38.841 1.00 56.27 ? 294 ILE E CG1 1 ATOM 7418 C CG2 . ILE C 1 299 ? 8.903 64.235 -40.920 1.00 51.01 ? 294 ILE E CG2 1 ATOM 7419 C CD1 . ILE C 1 299 ? 10.542 62.877 -37.949 1.00 61.73 ? 294 ILE E CD1 1 ATOM 7420 N N . HIS C 1 300 ? 5.547 63.530 -40.043 1.00 49.18 ? 295 HIS E N 1 ATOM 7421 C CA . HIS C 1 300 ? 4.456 63.564 -41.033 1.00 43.17 ? 295 HIS E CA 1 ATOM 7422 C C . HIS C 1 300 ? 3.690 62.267 -40.976 1.00 44.41 ? 295 HIS E C 1 ATOM 7423 O O . HIS C 1 300 ? 4.295 61.215 -40.721 1.00 46.87 ? 295 HIS E O 1 ATOM 7424 C CB . HIS C 1 300 ? 5.074 63.675 -42.409 1.00 45.97 ? 295 HIS E CB 1 ATOM 7425 C CG . HIS C 1 300 ? 4.153 64.234 -43.445 1.00 47.37 ? 295 HIS E CG 1 ATOM 7426 N ND1 . HIS C 1 300 ? 3.188 63.475 -44.050 1.00 51.99 ? 295 HIS E ND1 1 ATOM 7427 C CD2 . HIS C 1 300 ? 4.082 65.455 -44.021 1.00 46.43 ? 295 HIS E CD2 1 ATOM 7428 C CE1 . HIS C 1 300 ? 2.557 64.197 -44.957 1.00 47.33 ? 295 HIS E CE1 1 ATOM 7429 N NE2 . HIS C 1 300 ? 3.071 65.407 -44.948 1.00 47.85 ? 295 HIS E NE2 1 ATOM 7430 N N . PRO C 1 301 ? 2.370 62.297 -41.207 1.00 41.81 ? 296 PRO E N 1 ATOM 7431 C CA . PRO C 1 301 ? 1.610 61.042 -41.142 1.00 42.02 ? 296 PRO E CA 1 ATOM 7432 C C . PRO C 1 301 ? 1.669 60.128 -42.389 1.00 41.55 ? 296 PRO E C 1 ATOM 7433 O O . PRO C 1 301 ? 1.462 58.922 -42.277 1.00 47.55 ? 296 PRO E O 1 ATOM 7434 C CB . PRO C 1 301 ? 0.159 61.536 -40.932 1.00 40.14 ? 296 PRO E CB 1 ATOM 7435 C CG . PRO C 1 301 ? 0.153 62.912 -41.488 1.00 39.21 ? 296 PRO E CG 1 ATOM 7436 C CD . PRO C 1 301 ? 1.487 63.462 -41.110 1.00 41.71 ? 296 PRO E CD 1 ATOM 7437 N N . LEU C 1 302 ? 1.886 60.712 -43.558 1.00 37.75 ? 297 LEU E N 1 ATOM 7438 C CA . LEU C 1 302 ? 1.753 59.982 -44.790 1.00 35.83 ? 297 LEU E CA 1 ATOM 7439 C C . LEU C 1 302 ? 3.038 59.270 -45.192 1.00 37.82 ? 297 LEU E C 1 ATOM 7440 O O . LEU C 1 302 ? 3.632 59.557 -46.253 1.00 35.50 ? 297 LEU E O 1 ATOM 7441 C CB . LEU C 1 302 ? 1.237 60.886 -45.879 1.00 37.82 ? 297 LEU E CB 1 ATOM 7442 C CG . LEU C 1 302 ? 0.048 61.759 -45.436 1.00 40.86 ? 297 LEU E CG 1 ATOM 7443 C CD1 . LEU C 1 302 ? -0.497 62.614 -46.594 1.00 41.73 ? 297 LEU E CD1 1 ATOM 7444 C CD2 . LEU C 1 302 ? -1.074 60.890 -44.874 1.00 43.39 ? 297 LEU E CD2 1 ATOM 7445 N N . THR C 1 303 ? 3.473 58.336 -44.328 1.00 37.30 ? 298 THR E N 1 ATOM 7446 C CA . THR C 1 303 ? 4.763 57.636 -44.482 1.00 37.08 ? 298 THR E CA 1 ATOM 7447 C C . THR C 1 303 ? 4.614 56.373 -45.298 1.00 36.85 ? 298 THR E C 1 ATOM 7448 O O . THR C 1 303 ? 3.592 55.712 -45.258 1.00 41.80 ? 298 THR E O 1 ATOM 7449 C CB . THR C 1 303 ? 5.388 57.271 -43.117 1.00 38.32 ? 298 THR E CB 1 ATOM 7450 O OG1 . THR C 1 303 ? 4.498 56.471 -42.343 1.00 37.27 ? 298 THR E OG1 1 ATOM 7451 C CG2 . THR C 1 303 ? 5.666 58.541 -42.318 1.00 41.16 ? 298 THR E CG2 1 ATOM 7452 N N . ILE C 1 304 ? 5.673 56.015 -45.999 1.00 36.21 ? 299 ILE E N 1 ATOM 7453 C CA . ILE C 1 304 ? 5.780 54.726 -46.633 1.00 35.08 ? 299 ILE E CA 1 ATOM 7454 C C . ILE C 1 304 ? 7.048 54.089 -46.158 1.00 37.25 ? 299 ILE E C 1 ATOM 7455 O O . ILE C 1 304 ? 8.144 54.644 -46.343 1.00 43.79 ? 299 ILE E O 1 ATOM 7456 C CB . ILE C 1 304 ? 5.818 54.857 -48.152 1.00 35.96 ? 299 ILE E CB 1 ATOM 7457 C CG1 . ILE C 1 304 ? 4.574 55.596 -48.613 1.00 35.83 ? 299 ILE E CG1 1 ATOM 7458 C CG2 . ILE C 1 304 ? 5.905 53.489 -48.814 1.00 33.65 ? 299 ILE E CG2 1 ATOM 7459 C CD1 . ILE C 1 304 ? 4.562 55.884 -50.094 1.00 38.44 ? 299 ILE E CD1 1 ATOM 7460 N N . GLY C 1 305 ? 6.914 52.890 -45.605 1.00 39.92 ? 300 GLY E N 1 ATOM 7461 C CA . GLY C 1 305 ? 8.053 52.136 -45.106 1.00 40.53 ? 300 GLY E CA 1 ATOM 7462 C C . GLY C 1 305 ? 7.805 51.658 -43.690 1.00 40.84 ? 300 GLY E C 1 ATOM 7463 O O . GLY C 1 305 ? 6.658 51.553 -43.263 1.00 38.63 ? 300 GLY E O 1 ATOM 7464 N N . GLU C 1 306 ? 8.896 51.353 -42.987 1.00 40.64 ? 301 GLU E N 1 ATOM 7465 C CA . GLU C 1 306 ? 8.816 50.940 -41.615 1.00 44.84 ? 301 GLU E CA 1 ATOM 7466 C C . GLU C 1 306 ? 9.254 52.081 -40.805 1.00 40.78 ? 301 GLU E C 1 ATOM 7467 O O . GLU C 1 306 ? 10.440 52.360 -40.765 1.00 45.59 ? 301 GLU E O 1 ATOM 7468 C CB . GLU C 1 306 ? 9.783 49.853 -41.262 1.00 48.71 ? 301 GLU E CB 1 ATOM 7469 C CG . GLU C 1 306 ? 9.618 48.575 -41.997 1.00 55.85 ? 301 GLU E CG 1 ATOM 7470 C CD . GLU C 1 306 ? 10.749 47.646 -41.604 1.00 71.23 ? 301 GLU E CD 1 ATOM 7471 O OE1 . GLU C 1 306 ? 10.823 47.299 -40.341 1.00 58.37 ? 301 GLU E OE1 1 ATOM 7472 O OE2 . GLU C 1 306 ? 11.548 47.347 -42.570 1.00 67.95 ? 301 GLU E OE2 1 ATOM 7473 N N . CYS C 1 307 ? 8.318 52.694 -40.103 1.00 39.35 ? 302 CYS E N 1 ATOM 7474 C CA . CYS C 1 307 ? 8.595 53.925 -39.449 1.00 40.15 ? 302 CYS E CA 1 ATOM 7475 C C . CYS C 1 307 ? 8.344 53.816 -37.984 1.00 37.75 ? 302 CYS E C 1 ATOM 7476 O O . CYS C 1 307 ? 7.793 52.843 -37.533 1.00 38.06 ? 302 CYS E O 1 ATOM 7477 C CB . CYS C 1 307 ? 7.739 54.978 -40.082 1.00 40.39 ? 302 CYS E CB 1 ATOM 7478 S SG . CYS C 1 307 ? 8.045 55.102 -41.849 1.00 45.17 ? 302 CYS E SG 1 ATOM 7479 N N . PRO C 1 308 ? 8.827 54.793 -37.218 1.00 43.30 ? 303 PRO E N 1 ATOM 7480 C CA . PRO C 1 308 ? 8.429 54.868 -35.802 1.00 42.07 ? 303 PRO E CA 1 ATOM 7481 C C . PRO C 1 308 ? 6.966 55.227 -35.761 1.00 39.48 ? 303 PRO E C 1 ATOM 7482 O O . PRO C 1 308 ? 6.394 55.558 -36.776 1.00 40.49 ? 303 PRO E O 1 ATOM 7483 C CB . PRO C 1 308 ? 9.286 56.005 -35.233 1.00 41.39 ? 303 PRO E CB 1 ATOM 7484 C CG . PRO C 1 308 ? 10.441 56.142 -36.190 1.00 44.50 ? 303 PRO E CG 1 ATOM 7485 C CD . PRO C 1 308 ? 9.959 55.681 -37.534 1.00 42.51 ? 303 PRO E CD 1 ATOM 7486 N N . LYS C 1 309 ? 6.380 55.185 -34.589 1.00 39.69 ? 304 LYS E N 1 ATOM 7487 C CA . LYS C 1 309 ? 4.963 55.454 -34.442 1.00 39.61 ? 304 LYS E CA 1 ATOM 7488 C C . LYS C 1 309 ? 4.746 56.940 -34.426 1.00 42.84 ? 304 LYS E C 1 ATOM 7489 O O . LYS C 1 309 ? 5.454 57.666 -33.690 1.00 46.96 ? 304 LYS E O 1 ATOM 7490 C CB . LYS C 1 309 ? 4.463 54.802 -33.141 1.00 39.84 ? 304 LYS E CB 1 ATOM 7491 C CG . LYS C 1 309 ? 4.553 53.281 -33.145 1.00 39.55 ? 304 LYS E CG 1 ATOM 7492 C CD . LYS C 1 309 ? 3.885 52.737 -34.404 1.00 43.45 ? 304 LYS E CD 1 ATOM 7493 C CE . LYS C 1 309 ? 3.778 51.226 -34.472 1.00 47.36 ? 304 LYS E CE 1 ATOM 7494 N NZ . LYS C 1 309 ? 5.109 50.599 -34.694 1.00 56.50 ? 304 LYS E NZ 1 ATOM 7495 N N . TYR C 1 310 ? 3.819 57.421 -35.261 1.00 39.63 ? 305 TYR E N 1 ATOM 7496 C CA . TYR C 1 310 ? 3.595 58.861 -35.411 1.00 40.00 ? 305 TYR E CA 1 ATOM 7497 C C . TYR C 1 310 ? 2.808 59.393 -34.223 1.00 41.73 ? 305 TYR E C 1 ATOM 7498 O O . TYR C 1 310 ? 1.790 58.809 -33.855 1.00 36.80 ? 305 TYR E O 1 ATOM 7499 C CB . TYR C 1 310 ? 2.855 59.163 -36.715 1.00 41.07 ? 305 TYR E CB 1 ATOM 7500 C CG . TYR C 1 310 ? 2.605 60.625 -37.011 1.00 44.00 ? 305 TYR E CG 1 ATOM 7501 C CD1 . TYR C 1 310 ? 3.648 61.539 -37.141 1.00 49.85 ? 305 TYR E CD1 1 ATOM 7502 C CD2 . TYR C 1 310 ? 1.316 61.092 -37.172 1.00 48.26 ? 305 TYR E CD2 1 ATOM 7503 C CE1 . TYR C 1 310 ? 3.374 62.883 -37.419 1.00 51.36 ? 305 TYR E CE1 1 ATOM 7504 C CE2 . TYR C 1 310 ? 1.033 62.414 -37.435 1.00 48.04 ? 305 TYR E CE2 1 ATOM 7505 C CZ . TYR C 1 310 ? 2.055 63.302 -37.559 1.00 47.33 ? 305 TYR E CZ 1 ATOM 7506 O OH . TYR C 1 310 ? 1.689 64.588 -37.775 1.00 50.08 ? 305 TYR E OH 1 ATOM 7507 N N . VAL C 1 311 ? 3.287 60.495 -33.630 1.00 43.30 ? 306 VAL E N 1 ATOM 7508 C CA . VAL C 1 311 ? 2.601 61.123 -32.501 1.00 43.69 ? 306 VAL E CA 1 ATOM 7509 C C . VAL C 1 311 ? 2.550 62.636 -32.577 1.00 44.92 ? 306 VAL E C 1 ATOM 7510 O O . VAL C 1 311 ? 3.304 63.276 -33.310 1.00 48.72 ? 306 VAL E O 1 ATOM 7511 C CB . VAL C 1 311 ? 3.246 60.731 -31.159 1.00 46.07 ? 306 VAL E CB 1 ATOM 7512 C CG1 . VAL C 1 311 ? 3.266 59.225 -30.972 1.00 45.77 ? 306 VAL E CG1 1 ATOM 7513 C CG2 . VAL C 1 311 ? 4.657 61.274 -31.035 1.00 48.32 ? 306 VAL E CG2 1 ATOM 7514 N N . LYS C 1 312 ? 1.668 63.208 -31.783 1.00 48.28 ? 307 LYS E N 1 ATOM 7515 C CA . LYS C 1 312 ? 1.554 64.654 -31.658 1.00 56.85 ? 307 LYS E CA 1 ATOM 7516 C C . LYS C 1 312 ? 2.338 65.117 -30.404 1.00 57.86 ? 307 LYS E C 1 ATOM 7517 O O . LYS C 1 312 ? 1.766 65.219 -29.326 1.00 68.70 ? 307 LYS E O 1 ATOM 7518 C CB . LYS C 1 312 ? 0.057 64.998 -31.582 1.00 60.57 ? 307 LYS E CB 1 ATOM 7519 C CG . LYS C 1 312 ? -0.240 66.477 -31.501 1.00 71.31 ? 307 LYS E CG 1 ATOM 7520 C CD . LYS C 1 312 ? -1.622 66.880 -32.006 1.00 79.33 ? 307 LYS E CD 1 ATOM 7521 C CE . LYS C 1 312 ? -1.547 68.267 -32.642 1.00 86.59 ? 307 LYS E CE 1 ATOM 7522 N NZ . LYS C 1 312 ? -2.817 69.026 -32.550 1.00 92.70 ? 307 LYS E NZ 1 ATOM 7523 N N . SER C 1 313 ? 3.650 65.298 -30.521 1.00 54.90 ? 308 SER E N 1 ATOM 7524 C CA . SER C 1 313 ? 4.506 65.772 -29.403 1.00 60.29 ? 308 SER E CA 1 ATOM 7525 C C . SER C 1 313 ? 5.639 66.557 -29.942 1.00 56.84 ? 308 SER E C 1 ATOM 7526 O O . SER C 1 313 ? 6.057 66.334 -31.070 1.00 58.76 ? 308 SER E O 1 ATOM 7527 C CB . SER C 1 313 ? 5.188 64.668 -28.583 1.00 60.38 ? 308 SER E CB 1 ATOM 7528 O OG . SER C 1 313 ? 4.322 63.645 -28.223 1.00 69.84 ? 308 SER E OG 1 ATOM 7529 N N . ASN C 1 314 ? 6.205 67.408 -29.095 1.00 62.27 ? 309 ASN E N 1 ATOM 7530 C CA . ASN C 1 314 ? 7.437 68.145 -29.437 1.00 65.59 ? 309 ASN E CA 1 ATOM 7531 C C . ASN C 1 314 ? 8.676 67.472 -28.924 1.00 58.89 ? 309 ASN E C 1 ATOM 7532 O O . ASN C 1 314 ? 9.769 67.751 -29.389 1.00 67.79 ? 309 ASN E O 1 ATOM 7533 C CB . ASN C 1 314 ? 7.388 69.549 -28.845 1.00 74.35 ? 309 ASN E CB 1 ATOM 7534 C CG . ASN C 1 314 ? 6.113 70.257 -29.183 1.00 85.88 ? 309 ASN E CG 1 ATOM 7535 O OD1 . ASN C 1 314 ? 5.414 70.753 -28.297 1.00 93.24 ? 309 ASN E OD1 1 ATOM 7536 N ND2 . ASN C 1 314 ? 5.756 70.250 -30.478 1.00 92.79 ? 309 ASN E ND2 1 ATOM 7537 N N . LYS C 1 315 ? 8.489 66.543 -27.995 1.00 56.57 ? 310 LYS E N 1 ATOM 7538 C CA . LYS C 1 315 ? 9.482 66.271 -26.992 1.00 60.61 ? 310 LYS E CA 1 ATOM 7539 C C . LYS C 1 315 ? 9.060 65.028 -26.224 1.00 52.57 ? 310 LYS E C 1 ATOM 7540 O O . LYS C 1 315 ? 8.019 65.042 -25.591 1.00 51.64 ? 310 LYS E O 1 ATOM 7541 C CB . LYS C 1 315 ? 9.462 67.451 -26.007 1.00 67.90 ? 310 LYS E CB 1 ATOM 7542 C CG . LYS C 1 315 ? 10.784 67.910 -25.440 1.00 78.54 ? 310 LYS E CG 1 ATOM 7543 C CD . LYS C 1 315 ? 10.581 68.964 -24.349 1.00 84.31 ? 310 LYS E CD 1 ATOM 7544 C CE . LYS C 1 315 ? 9.933 68.300 -23.132 1.00 92.54 ? 310 LYS E CE 1 ATOM 7545 N NZ . LYS C 1 315 ? 9.978 69.095 -21.884 1.00 95.53 ? 310 LYS E NZ 1 ATOM 7546 N N . LEU C 1 316 ? 9.875 63.986 -26.230 1.00 48.90 ? 311 LEU E N 1 ATOM 7547 C CA . LEU C 1 316 ? 9.672 62.874 -25.294 1.00 51.74 ? 311 LEU E CA 1 ATOM 7548 C C . LEU C 1 316 ? 10.986 62.569 -24.579 1.00 52.54 ? 311 LEU E C 1 ATOM 7549 O O . LEU C 1 316 ? 11.797 61.768 -25.037 1.00 52.64 ? 311 LEU E O 1 ATOM 7550 C CB . LEU C 1 316 ? 9.147 61.623 -26.017 1.00 51.12 ? 311 LEU E CB 1 ATOM 7551 C CG . LEU C 1 316 ? 7.735 61.676 -26.599 1.00 50.55 ? 311 LEU E CG 1 ATOM 7552 C CD1 . LEU C 1 316 ? 7.514 60.402 -27.390 1.00 50.45 ? 311 LEU E CD1 1 ATOM 7553 C CD2 . LEU C 1 316 ? 6.662 61.810 -25.546 1.00 50.77 ? 311 LEU E CD2 1 ATOM 7554 N N . VAL C 1 317 ? 11.207 63.228 -23.453 1.00 55.54 ? 312 VAL E N 1 ATOM 7555 C CA . VAL C 1 317 ? 12.526 63.201 -22.824 1.00 53.32 ? 312 VAL E CA 1 ATOM 7556 C C . VAL C 1 317 ? 12.551 62.331 -21.590 1.00 53.01 ? 312 VAL E C 1 ATOM 7557 O O . VAL C 1 317 ? 11.892 62.636 -20.589 1.00 49.46 ? 312 VAL E O 1 ATOM 7558 C CB . VAL C 1 317 ? 12.997 64.599 -22.450 1.00 55.78 ? 312 VAL E CB 1 ATOM 7559 C CG1 . VAL C 1 317 ? 14.442 64.561 -21.945 1.00 55.83 ? 312 VAL E CG1 1 ATOM 7560 C CG2 . VAL C 1 317 ? 12.894 65.517 -23.656 1.00 56.50 ? 312 VAL E CG2 1 ATOM 7561 N N . LEU C 1 318 ? 13.354 61.275 -21.654 1.00 51.10 ? 313 LEU E N 1 ATOM 7562 C CA . LEU C 1 318 ? 13.607 60.434 -20.503 1.00 49.71 ? 313 LEU E CA 1 ATOM 7563 C C . LEU C 1 318 ? 14.783 60.943 -19.704 1.00 54.99 ? 313 LEU E C 1 ATOM 7564 O O . LEU C 1 318 ? 15.842 61.239 -20.244 1.00 62.18 ? 313 LEU E O 1 ATOM 7565 C CB . LEU C 1 318 ? 13.925 59.016 -20.929 1.00 47.77 ? 313 LEU E CB 1 ATOM 7566 C CG . LEU C 1 318 ? 12.769 58.177 -21.505 1.00 47.36 ? 313 LEU E CG 1 ATOM 7567 C CD1 . LEU C 1 318 ? 13.301 56.884 -22.108 1.00 48.52 ? 313 LEU E CD1 1 ATOM 7568 C CD2 . LEU C 1 318 ? 11.708 57.873 -20.479 1.00 45.57 ? 313 LEU E CD2 1 ATOM 7569 N N . ALA C 1 319 ? 14.608 61.028 -18.394 1.00 60.86 ? 314 ALA E N 1 ATOM 7570 C CA . ALA C 1 319 ? 15.758 61.219 -17.489 1.00 63.61 ? 314 ALA E CA 1 ATOM 7571 C C . ALA C 1 319 ? 16.668 59.986 -17.518 1.00 61.95 ? 314 ALA E C 1 ATOM 7572 O O . ALA C 1 319 ? 16.213 58.842 -17.477 1.00 57.77 ? 314 ALA E O 1 ATOM 7573 C CB . ALA C 1 319 ? 15.302 61.486 -16.059 1.00 61.39 ? 314 ALA E CB 1 ATOM 7574 N N . THR C 1 320 ? 17.956 60.253 -17.604 1.00 62.13 ? 315 THR E N 1 ATOM 7575 C CA . THR C 1 320 ? 18.975 59.227 -17.427 1.00 65.84 ? 315 THR E CA 1 ATOM 7576 C C . THR C 1 320 ? 19.821 59.491 -16.176 1.00 68.39 ? 315 THR E C 1 ATOM 7577 O O . THR C 1 320 ? 20.226 58.557 -15.497 1.00 68.57 ? 315 THR E O 1 ATOM 7578 C CB . THR C 1 320 ? 19.867 59.102 -18.677 1.00 63.30 ? 315 THR E CB 1 ATOM 7579 O OG1 . THR C 1 320 ? 20.157 60.404 -19.206 1.00 54.70 ? 315 THR E OG1 1 ATOM 7580 C CG2 . THR C 1 320 ? 19.143 58.285 -19.731 1.00 64.92 ? 315 THR E CG2 1 ATOM 7581 N N . GLY C 1 321 ? 20.054 60.764 -15.866 1.00 66.25 ? 316 GLY E N 1 ATOM 7582 C CA . GLY C 1 321 ? 20.836 61.129 -14.705 1.00 66.52 ? 316 GLY E CA 1 ATOM 7583 C C . GLY C 1 321 ? 20.024 61.462 -13.471 1.00 69.63 ? 316 GLY E C 1 ATOM 7584 O O . GLY C 1 321 ? 18.890 61.012 -13.310 1.00 74.80 ? 316 GLY E O 1 ATOM 7585 N N . LEU C 1 322 ? 20.595 62.313 -12.622 1.00 67.09 ? 317 LEU E N 1 ATOM 7586 C CA . LEU C 1 322 ? 20.023 62.660 -11.320 1.00 62.70 ? 317 LEU E CA 1 ATOM 7587 C C . LEU C 1 322 ? 19.404 64.044 -11.349 1.00 58.12 ? 317 LEU E C 1 ATOM 7588 O O . LEU C 1 322 ? 19.694 64.813 -12.257 1.00 51.92 ? 317 LEU E O 1 ATOM 7589 C CB . LEU C 1 322 ? 21.158 62.646 -10.293 1.00 72.70 ? 317 LEU E CB 1 ATOM 7590 C CG . LEU C 1 322 ? 21.976 61.347 -10.332 1.00 75.70 ? 317 LEU E CG 1 ATOM 7591 C CD1 . LEU C 1 322 ? 23.270 61.442 -11.147 1.00 69.60 ? 317 LEU E CD1 1 ATOM 7592 C CD2 . LEU C 1 322 ? 22.278 60.926 -8.908 1.00 78.51 ? 317 LEU E CD2 1 ATOM 7593 N N . ARG C 1 323 ? 18.616 64.389 -10.334 1.00 55.23 ? 318 ARG E N 1 ATOM 7594 C CA . ARG C 1 323 ? 18.259 65.810 -10.129 1.00 64.08 ? 318 ARG E CA 1 ATOM 7595 C C . ARG C 1 323 ? 19.501 66.667 -9.972 1.00 63.05 ? 318 ARG E C 1 ATOM 7596 O O . ARG C 1 323 ? 20.419 66.271 -9.289 1.00 61.99 ? 318 ARG E O 1 ATOM 7597 C CB . ARG C 1 323 ? 17.420 66.090 -8.877 1.00 66.17 ? 318 ARG E CB 1 ATOM 7598 C CG . ARG C 1 323 ? 16.390 65.067 -8.539 1.00 67.77 ? 318 ARG E CG 1 ATOM 7599 C CD . ARG C 1 323 ? 15.534 65.558 -7.406 1.00 70.96 ? 318 ARG E CD 1 ATOM 7600 N NE . ARG C 1 323 ? 14.337 64.728 -7.326 1.00 72.22 ? 318 ARG E NE 1 ATOM 7601 C CZ . ARG C 1 323 ? 13.113 65.126 -7.663 1.00 74.93 ? 318 ARG E CZ 1 ATOM 7602 N NH1 . ARG C 1 323 ? 12.886 66.372 -8.076 1.00 69.52 ? 318 ARG E NH1 1 ATOM 7603 N NH2 . ARG C 1 323 ? 12.099 64.268 -7.567 1.00 79.18 ? 318 ARG E NH2 1 ATOM 7604 N N . ASN C 1 324 ? 19.451 67.880 -10.505 1.00 70.42 ? 319 ASN E N 1 ATOM 7605 C CA . ASN C 1 324 ? 20.599 68.779 -10.573 1.00 72.02 ? 319 ASN E CA 1 ATOM 7606 C C . ASN C 1 324 ? 20.288 70.085 -9.872 1.00 72.75 ? 319 ASN E C 1 ATOM 7607 O O . ASN C 1 324 ? 20.694 70.275 -8.736 1.00 86.02 ? 319 ASN E O 1 ATOM 7608 C CB . ASN C 1 324 ? 20.926 69.041 -12.039 1.00 68.43 ? 319 ASN E CB 1 ATOM 7609 C CG . ASN C 1 324 ? 22.391 69.374 -12.285 1.00 66.34 ? 319 ASN E CG 1 ATOM 7610 O OD1 . ASN C 1 324 ? 23.273 69.058 -11.475 1.00 69.05 ? 319 ASN E OD1 1 ATOM 7611 N ND2 . ASN C 1 324 ? 22.657 70.019 -13.429 1.00 60.67 ? 319 ASN E ND2 1 ATOM 7612 N N . GLY D 2 12 ? 22.055 36.759 -0.333 1.00 62.17 ? 12 GLY B N 1 ATOM 7613 C CA . GLY D 2 12 ? 21.398 35.589 -0.988 1.00 62.56 ? 12 GLY B CA 1 ATOM 7614 C C . GLY D 2 12 ? 20.121 35.044 -0.313 1.00 67.07 ? 12 GLY B C 1 ATOM 7615 O O . GLY D 2 12 ? 19.800 35.410 0.821 1.00 69.94 ? 12 GLY B O 1 ATOM 7616 N N . GLY D 2 13 ? 19.409 34.143 -1.007 1.00 61.77 ? 13 GLY B N 1 ATOM 7617 C CA . GLY D 2 13 ? 18.165 33.503 -0.511 1.00 59.28 ? 13 GLY B CA 1 ATOM 7618 C C . GLY D 2 13 ? 18.458 32.107 0.014 1.00 64.01 ? 13 GLY B C 1 ATOM 7619 O O . GLY D 2 13 ? 19.593 31.642 -0.108 1.00 59.54 ? 13 GLY B O 1 ATOM 7620 N N . TRP D 2 14 ? 17.456 31.447 0.614 1.00 73.49 ? 14 TRP B N 1 ATOM 7621 C CA . TRP D 2 14 ? 17.673 30.193 1.405 1.00 76.28 ? 14 TRP B CA 1 ATOM 7622 C C . TRP D 2 14 ? 16.991 28.931 0.879 1.00 78.42 ? 14 TRP B C 1 ATOM 7623 O O . TRP D 2 14 ? 15.783 28.730 1.082 1.00 79.00 ? 14 TRP B O 1 ATOM 7624 C CB . TRP D 2 14 ? 17.186 30.340 2.841 1.00 76.93 ? 14 TRP B CB 1 ATOM 7625 C CG . TRP D 2 14 ? 17.878 31.362 3.698 1.00 84.69 ? 14 TRP B CG 1 ATOM 7626 C CD1 . TRP D 2 14 ? 19.161 31.821 3.594 1.00 83.39 ? 14 TRP B CD1 1 ATOM 7627 C CD2 . TRP D 2 14 ? 17.316 31.993 4.842 1.00 85.39 ? 14 TRP B CD2 1 ATOM 7628 N NE1 . TRP D 2 14 ? 19.412 32.734 4.594 1.00 82.29 ? 14 TRP B NE1 1 ATOM 7629 C CE2 . TRP D 2 14 ? 18.291 32.852 5.373 1.00 86.31 ? 14 TRP B CE2 1 ATOM 7630 C CE3 . TRP D 2 14 ? 16.069 31.921 5.461 1.00 82.73 ? 14 TRP B CE3 1 ATOM 7631 C CZ2 . TRP D 2 14 ? 18.050 33.640 6.494 1.00 90.05 ? 14 TRP B CZ2 1 ATOM 7632 C CZ3 . TRP D 2 14 ? 15.825 32.697 6.555 1.00 81.31 ? 14 TRP B CZ3 1 ATOM 7633 C CH2 . TRP D 2 14 ? 16.808 33.549 7.069 1.00 89.32 ? 14 TRP B CH2 1 ATOM 7634 N N . GLN D 2 15 ? 17.772 28.051 0.259 1.00 78.14 ? 15 GLN B N 1 ATOM 7635 C CA . GLN D 2 15 ? 17.272 26.734 -0.174 1.00 81.89 ? 15 GLN B CA 1 ATOM 7636 C C . GLN D 2 15 ? 16.493 25.981 0.929 1.00 80.05 ? 15 GLN B C 1 ATOM 7637 O O . GLN D 2 15 ? 15.492 25.298 0.672 1.00 82.32 ? 15 GLN B O 1 ATOM 7638 C CB . GLN D 2 15 ? 18.426 25.855 -0.690 1.00 83.20 ? 15 GLN B CB 1 ATOM 7639 C CG . GLN D 2 15 ? 19.243 26.432 -1.852 1.00 89.91 ? 15 GLN B CG 1 ATOM 7640 C CD . GLN D 2 15 ? 18.532 26.434 -3.211 1.00 93.94 ? 15 GLN B CD 1 ATOM 7641 O OE1 . GLN D 2 15 ? 17.515 25.760 -3.413 1.00 87.94 ? 15 GLN B OE1 1 ATOM 7642 N NE2 . GLN D 2 15 ? 19.084 27.192 -4.157 1.00 93.50 ? 15 GLN B NE2 1 ATOM 7643 N N . GLY D 2 16 ? 16.956 26.140 2.161 1.00 87.32 ? 16 GLY B N 1 ATOM 7644 C CA . GLY D 2 16 ? 16.404 25.433 3.321 1.00 85.06 ? 16 GLY B CA 1 ATOM 7645 C C . GLY D 2 16 ? 14.983 25.780 3.732 1.00 82.01 ? 16 GLY B C 1 ATOM 7646 O O . GLY D 2 16 ? 14.261 24.932 4.243 1.00 79.43 ? 16 GLY B O 1 ATOM 7647 N N . MET D 2 17 ? 14.586 27.037 3.558 1.00 81.93 ? 17 MET B N 1 ATOM 7648 C CA . MET D 2 17 ? 13.214 27.441 3.849 1.00 82.27 ? 17 MET B CA 1 ATOM 7649 C C . MET D 2 17 ? 12.243 26.920 2.799 1.00 87.08 ? 17 MET B C 1 ATOM 7650 O O . MET D 2 17 ? 12.217 27.405 1.669 1.00 88.51 ? 17 MET B O 1 ATOM 7651 C CB . MET D 2 17 ? 13.072 28.948 3.962 1.00 80.20 ? 17 MET B CB 1 ATOM 7652 C CG . MET D 2 17 ? 11.788 29.319 4.670 1.00 81.48 ? 17 MET B CG 1 ATOM 7653 S SD . MET D 2 17 ? 11.422 31.062 4.679 1.00 84.03 ? 17 MET B SD 1 ATOM 7654 C CE . MET D 2 17 ? 12.979 31.832 4.865 1.00 84.01 ? 17 MET B CE 1 ATOM 7655 N N . VAL D 2 18 ? 11.424 25.956 3.214 1.00 92.63 ? 18 VAL B N 1 ATOM 7656 C CA . VAL D 2 18 ? 10.503 25.263 2.321 1.00 92.67 ? 18 VAL B CA 1 ATOM 7657 C C . VAL D 2 18 ? 9.034 25.632 2.523 1.00 84.25 ? 18 VAL B C 1 ATOM 7658 O O . VAL D 2 18 ? 8.259 25.459 1.615 1.00 86.97 ? 18 VAL B O 1 ATOM 7659 C CB . VAL D 2 18 ? 10.641 23.708 2.389 1.00 95.17 ? 18 VAL B CB 1 ATOM 7660 C CG1 . VAL D 2 18 ? 11.966 23.275 1.794 1.00 92.08 ? 18 VAL B CG1 1 ATOM 7661 C CG2 . VAL D 2 18 ? 10.450 23.165 3.801 1.00 96.42 ? 18 VAL B CG2 1 ATOM 7662 N N . ASP D 2 19 ? 8.643 26.136 3.680 1.00 84.42 ? 19 ASP B N 1 ATOM 7663 C CA . ASP D 2 19 ? 7.204 26.320 3.966 1.00 91.16 ? 19 ASP B CA 1 ATOM 7664 C C . ASP D 2 19 ? 6.669 27.761 3.751 1.00 83.77 ? 19 ASP B C 1 ATOM 7665 O O . ASP D 2 19 ? 5.550 28.078 4.184 1.00 77.12 ? 19 ASP B O 1 ATOM 7666 C CB . ASP D 2 19 ? 6.852 25.811 5.384 1.00 104.69 ? 19 ASP B CB 1 ATOM 7667 C CG . ASP D 2 19 ? 7.779 26.367 6.472 1.00 113.61 ? 19 ASP B CG 1 ATOM 7668 O OD1 . ASP D 2 19 ? 8.962 26.699 6.166 1.00 123.98 ? 19 ASP B OD1 1 ATOM 7669 O OD2 . ASP D 2 19 ? 7.320 26.446 7.635 1.00 110.23 ? 19 ASP B OD2 1 ATOM 7670 N N . GLY D 2 20 ? 7.431 28.620 3.063 1.00 70.50 ? 20 GLY B N 1 ATOM 7671 C CA . GLY D 2 20 ? 6.981 30.020 2.830 1.00 72.20 ? 20 GLY B CA 1 ATOM 7672 C C . GLY D 2 20 ? 7.916 30.899 2.015 1.00 72.11 ? 20 GLY B C 1 ATOM 7673 O O . GLY D 2 20 ? 8.890 30.404 1.461 1.00 78.52 ? 20 GLY B O 1 ATOM 7674 N N . TRP D 2 21 ? 7.614 32.203 1.935 1.00 66.69 ? 21 TRP B N 1 ATOM 7675 C CA . TRP D 2 21 ? 8.378 33.128 1.068 1.00 64.71 ? 21 TRP B CA 1 ATOM 7676 C C . TRP D 2 21 ? 9.402 33.942 1.846 1.00 64.99 ? 21 TRP B C 1 ATOM 7677 O O . TRP D 2 21 ? 10.530 34.153 1.396 1.00 66.42 ? 21 TRP B O 1 ATOM 7678 C CB . TRP D 2 21 ? 7.450 34.074 0.271 1.00 66.59 ? 21 TRP B CB 1 ATOM 7679 C CG . TRP D 2 21 ? 6.922 33.512 -1.045 1.00 71.74 ? 21 TRP B CG 1 ATOM 7680 C CD1 . TRP D 2 21 ? 7.239 32.310 -1.621 1.00 77.21 ? 21 TRP B CD1 1 ATOM 7681 C CD2 . TRP D 2 21 ? 6.006 34.142 -1.936 1.00 70.22 ? 21 TRP B CD2 1 ATOM 7682 N NE1 . TRP D 2 21 ? 6.564 32.154 -2.803 1.00 77.13 ? 21 TRP B NE1 1 ATOM 7683 C CE2 . TRP D 2 21 ? 5.803 33.265 -3.022 1.00 72.59 ? 21 TRP B CE2 1 ATOM 7684 C CE3 . TRP D 2 21 ? 5.328 35.351 -1.915 1.00 75.36 ? 21 TRP B CE3 1 ATOM 7685 C CZ2 . TRP D 2 21 ? 4.964 33.563 -4.074 1.00 73.26 ? 21 TRP B CZ2 1 ATOM 7686 C CZ3 . TRP D 2 21 ? 4.483 35.649 -2.967 1.00 81.85 ? 21 TRP B CZ3 1 ATOM 7687 C CH2 . TRP D 2 21 ? 4.318 34.760 -4.040 1.00 76.76 ? 21 TRP B CH2 1 ATOM 7688 N N . TYR D 2 22 ? 8.987 34.414 3.002 1.00 64.79 ? 22 TYR B N 1 ATOM 7689 C CA . TYR D 2 22 ? 9.857 35.125 3.896 1.00 65.32 ? 22 TYR B CA 1 ATOM 7690 C C . TYR D 2 22 ? 9.859 34.471 5.278 1.00 66.42 ? 22 TYR B C 1 ATOM 7691 O O . TYR D 2 22 ? 8.828 34.021 5.769 1.00 65.81 ? 22 TYR B O 1 ATOM 7692 C CB . TYR D 2 22 ? 9.363 36.543 4.045 1.00 67.26 ? 22 TYR B CB 1 ATOM 7693 C CG . TYR D 2 22 ? 8.778 37.192 2.810 1.00 63.82 ? 22 TYR B CG 1 ATOM 7694 C CD1 . TYR D 2 22 ? 9.545 37.408 1.658 1.00 63.24 ? 22 TYR B CD1 1 ATOM 7695 C CD2 . TYR D 2 22 ? 7.481 37.676 2.833 1.00 61.88 ? 22 TYR B CD2 1 ATOM 7696 C CE1 . TYR D 2 22 ? 9.000 38.058 0.557 1.00 61.70 ? 22 TYR B CE1 1 ATOM 7697 C CE2 . TYR D 2 22 ? 6.932 38.322 1.746 1.00 60.86 ? 22 TYR B CE2 1 ATOM 7698 C CZ . TYR D 2 22 ? 7.684 38.505 0.621 1.00 58.53 ? 22 TYR B CZ 1 ATOM 7699 O OH . TYR D 2 22 ? 7.088 39.131 -0.418 1.00 55.60 ? 22 TYR B OH 1 ATOM 7700 N N . GLY D 2 23 ? 11.013 34.436 5.926 1.00 71.44 ? 23 GLY B N 1 ATOM 7701 C CA . GLY D 2 23 ? 11.080 33.876 7.274 1.00 73.64 ? 23 GLY B CA 1 ATOM 7702 C C . GLY D 2 23 ? 12.380 34.027 8.032 1.00 70.27 ? 23 GLY B C 1 ATOM 7703 O O . GLY D 2 23 ? 13.162 34.958 7.796 1.00 62.04 ? 23 GLY B O 1 ATOM 7704 N N . TYR D 2 24 ? 12.614 33.052 8.909 1.00 67.73 ? 24 TYR B N 1 ATOM 7705 C CA . TYR D 2 24 ? 13.687 33.097 9.876 1.00 66.00 ? 24 TYR B CA 1 ATOM 7706 C C . TYR D 2 24 ? 14.570 31.876 9.836 1.00 63.94 ? 24 TYR B C 1 ATOM 7707 O O . TYR D 2 24 ? 14.078 30.760 9.707 1.00 66.57 ? 24 TYR B O 1 ATOM 7708 C CB . TYR D 2 24 ? 13.071 33.178 11.273 1.00 69.31 ? 24 TYR B CB 1 ATOM 7709 C CG . TYR D 2 24 ? 11.953 34.183 11.383 1.00 64.87 ? 24 TYR B CG 1 ATOM 7710 C CD1 . TYR D 2 24 ? 12.225 35.530 11.514 1.00 65.18 ? 24 TYR B CD1 1 ATOM 7711 C CD2 . TYR D 2 24 ? 10.613 33.787 11.337 1.00 65.91 ? 24 TYR B CD2 1 ATOM 7712 C CE1 . TYR D 2 24 ? 11.197 36.465 11.617 1.00 63.02 ? 24 TYR B CE1 1 ATOM 7713 C CE2 . TYR D 2 24 ? 9.576 34.721 11.454 1.00 59.37 ? 24 TYR B CE2 1 ATOM 7714 C CZ . TYR D 2 24 ? 9.881 36.060 11.586 1.00 55.38 ? 24 TYR B CZ 1 ATOM 7715 O OH . TYR D 2 24 ? 8.903 37.005 11.705 1.00 58.36 ? 24 TYR B OH 1 ATOM 7716 N N . HIS D 2 25 ? 15.874 32.094 9.999 1.00 68.04 ? 25 HIS B N 1 ATOM 7717 C CA . HIS D 2 25 ? 16.813 31.019 10.389 1.00 77.51 ? 25 HIS B CA 1 ATOM 7718 C C . HIS D 2 25 ? 17.317 31.332 11.800 1.00 71.49 ? 25 HIS B C 1 ATOM 7719 O O . HIS D 2 25 ? 17.848 32.414 12.055 1.00 67.92 ? 25 HIS B O 1 ATOM 7720 C CB . HIS D 2 25 ? 18.002 30.932 9.432 1.00 84.26 ? 25 HIS B CB 1 ATOM 7721 C CG . HIS D 2 25 ? 18.913 29.766 9.684 1.00 89.06 ? 25 HIS B CG 1 ATOM 7722 N ND1 . HIS D 2 25 ? 20.288 29.878 9.682 1.00 92.29 ? 25 HIS B ND1 1 ATOM 7723 C CD2 . HIS D 2 25 ? 18.647 28.463 9.931 1.00 93.15 ? 25 HIS B CD2 1 ATOM 7724 C CE1 . HIS D 2 25 ? 20.829 28.696 9.917 1.00 91.34 ? 25 HIS B CE1 1 ATOM 7725 N NE2 . HIS D 2 25 ? 19.855 27.819 10.074 1.00 94.53 ? 25 HIS B NE2 1 ATOM 7726 N N . HIS D 2 26 ? 17.145 30.383 12.704 1.00 70.49 ? 26 HIS B N 1 ATOM 7727 C CA . HIS D 2 26 ? 17.549 30.575 14.089 1.00 73.10 ? 26 HIS B CA 1 ATOM 7728 C C . HIS D 2 26 ? 18.707 29.652 14.416 1.00 78.52 ? 26 HIS B C 1 ATOM 7729 O O . HIS D 2 26 ? 18.669 28.454 14.124 1.00 72.39 ? 26 HIS B O 1 ATOM 7730 C CB . HIS D 2 26 ? 16.386 30.344 15.045 1.00 66.57 ? 26 HIS B CB 1 ATOM 7731 C CG . HIS D 2 26 ? 16.024 28.905 15.228 1.00 73.08 ? 26 HIS B CG 1 ATOM 7732 N ND1 . HIS D 2 26 ? 14.985 28.310 14.549 1.00 87.24 ? 26 HIS B ND1 1 ATOM 7733 C CD2 . HIS D 2 26 ? 16.555 27.943 16.015 1.00 80.33 ? 26 HIS B CD2 1 ATOM 7734 C CE1 . HIS D 2 26 ? 14.880 27.046 14.923 1.00 89.71 ? 26 HIS B CE1 1 ATOM 7735 N NE2 . HIS D 2 26 ? 15.831 26.794 15.802 1.00 85.82 ? 26 HIS B NE2 1 ATOM 7736 N N . SER D 2 27 ? 19.725 30.227 15.044 1.00 84.52 ? 27 SER B N 1 ATOM 7737 C CA . SER D 2 27 ? 20.961 29.518 15.352 1.00 87.44 ? 27 SER B CA 1 ATOM 7738 C C . SER D 2 27 ? 21.239 29.622 16.857 1.00 85.33 ? 27 SER B C 1 ATOM 7739 O O . SER D 2 27 ? 21.772 30.633 17.330 1.00 82.96 ? 27 SER B O 1 ATOM 7740 C CB . SER D 2 27 ? 22.106 30.123 14.539 1.00 88.27 ? 27 SER B CB 1 ATOM 7741 O OG . SER D 2 27 ? 23.034 29.130 14.157 1.00 89.50 ? 27 SER B OG 1 ATOM 7742 N N . ASN D 2 28 ? 20.847 28.584 17.601 1.00 86.05 ? 28 ASN B N 1 ATOM 7743 C CA . ASN D 2 28 ? 21.082 28.515 19.057 1.00 82.56 ? 28 ASN B CA 1 ATOM 7744 C C . ASN D 2 28 ? 21.640 27.147 19.522 1.00 93.09 ? 28 ASN B C 1 ATOM 7745 O O . ASN D 2 28 ? 22.113 26.351 18.707 1.00 90.83 ? 28 ASN B O 1 ATOM 7746 C CB . ASN D 2 28 ? 19.820 28.923 19.836 1.00 74.64 ? 28 ASN B CB 1 ATOM 7747 C CG . ASN D 2 28 ? 18.748 27.844 19.862 1.00 75.01 ? 28 ASN B CG 1 ATOM 7748 O OD1 . ASN D 2 28 ? 18.885 26.781 19.266 1.00 70.06 ? 28 ASN B OD1 1 ATOM 7749 N ND2 . ASN D 2 28 ? 17.681 28.114 20.598 1.00 82.23 ? 28 ASN B ND2 1 ATOM 7750 N N . GLU D 2 29 ? 21.600 26.886 20.828 1.00 101.71 ? 29 GLU B N 1 ATOM 7751 C CA . GLU D 2 29 ? 22.222 25.683 21.394 1.00 109.25 ? 29 GLU B CA 1 ATOM 7752 C C . GLU D 2 29 ? 21.571 24.382 20.957 1.00 104.01 ? 29 GLU B C 1 ATOM 7753 O O . GLU D 2 29 ? 22.271 23.411 20.673 1.00 103.51 ? 29 GLU B O 1 ATOM 7754 C CB . GLU D 2 29 ? 22.206 25.727 22.922 1.00 127.08 ? 29 GLU B CB 1 ATOM 7755 C CG . GLU D 2 29 ? 23.545 25.376 23.528 1.00 133.84 ? 29 GLU B CG 1 ATOM 7756 C CD . GLU D 2 29 ? 24.495 26.557 23.492 1.00 137.38 ? 29 GLU B CD 1 ATOM 7757 O OE1 . GLU D 2 29 ? 24.105 27.638 24.007 1.00 140.90 ? 29 GLU B OE1 1 ATOM 7758 O OE2 . GLU D 2 29 ? 25.615 26.402 22.951 1.00 119.62 ? 29 GLU B OE2 1 ATOM 7759 N N . GLN D 2 30 ? 20.241 24.380 20.877 1.00 99.06 ? 30 GLN B N 1 ATOM 7760 C CA . GLN D 2 30 ? 19.469 23.153 20.639 1.00 96.57 ? 30 GLN B CA 1 ATOM 7761 C C . GLN D 2 30 ? 19.549 22.696 19.187 1.00 98.08 ? 30 GLN B C 1 ATOM 7762 O O . GLN D 2 30 ? 18.928 21.705 18.813 1.00 99.96 ? 30 GLN B O 1 ATOM 7763 C CB . GLN D 2 30 ? 17.990 23.329 21.012 1.00 95.55 ? 30 GLN B CB 1 ATOM 7764 C CG . GLN D 2 30 ? 17.717 23.528 22.488 1.00 94.09 ? 30 GLN B CG 1 ATOM 7765 C CD . GLN D 2 30 ? 17.667 24.985 22.856 1.00 93.15 ? 30 GLN B CD 1 ATOM 7766 O OE1 . GLN D 2 30 ? 16.588 25.547 22.976 1.00 93.02 ? 30 GLN B OE1 1 ATOM 7767 N NE2 . GLN D 2 30 ? 18.832 25.606 23.030 1.00 94.17 ? 30 GLN B NE2 1 ATOM 7768 N N . GLY D 2 31 ? 20.307 23.422 18.371 1.00 104.14 ? 31 GLY B N 1 ATOM 7769 C CA . GLY D 2 31 ? 20.389 23.165 16.936 1.00 104.93 ? 31 GLY B CA 1 ATOM 7770 C C . GLY D 2 31 ? 19.698 24.297 16.203 1.00 98.37 ? 31 GLY B C 1 ATOM 7771 O O . GLY D 2 31 ? 18.961 25.085 16.813 1.00 87.99 ? 31 GLY B O 1 ATOM 7772 N N . SER D 2 32 ? 19.958 24.380 14.904 1.00 89.77 ? 32 SER B N 1 ATOM 7773 C CA . SER D 2 32 ? 19.422 25.439 14.072 1.00 87.99 ? 32 SER B CA 1 ATOM 7774 C C . SER D 2 32 ? 18.278 24.937 13.194 1.00 89.61 ? 32 SER B C 1 ATOM 7775 O O . SER D 2 32 ? 17.933 23.754 13.218 1.00 90.45 ? 32 SER B O 1 ATOM 7776 C CB . SER D 2 32 ? 20.540 26.033 13.220 1.00 86.19 ? 32 SER B CB 1 ATOM 7777 O OG . SER D 2 32 ? 21.144 25.018 12.446 1.00 84.03 ? 32 SER B OG 1 ATOM 7778 N N . GLY D 2 33 ? 17.688 25.848 12.421 1.00 90.51 ? 33 GLY B N 1 ATOM 7779 C CA . GLY D 2 33 ? 16.532 25.524 11.581 1.00 88.13 ? 33 GLY B CA 1 ATOM 7780 C C . GLY D 2 33 ? 15.773 26.725 11.038 1.00 79.40 ? 33 GLY B C 1 ATOM 7781 O O . GLY D 2 33 ? 15.901 27.842 11.539 1.00 72.83 ? 33 GLY B O 1 ATOM 7782 N N . TYR D 2 34 ? 14.991 26.479 9.987 1.00 70.31 ? 34 TYR B N 1 ATOM 7783 C CA . TYR D 2 34 ? 14.283 27.535 9.279 1.00 62.47 ? 34 TYR B CA 1 ATOM 7784 C C . TYR D 2 34 ? 12.819 27.519 9.611 1.00 61.10 ? 34 TYR B C 1 ATOM 7785 O O . TYR D 2 34 ? 12.211 26.448 9.738 1.00 59.96 ? 34 TYR B O 1 ATOM 7786 C CB . TYR D 2 34 ? 14.419 27.349 7.759 1.00 63.02 ? 34 TYR B CB 1 ATOM 7787 C CG . TYR D 2 34 ? 15.823 27.401 7.219 1.00 57.63 ? 34 TYR B CG 1 ATOM 7788 C CD1 . TYR D 2 34 ? 16.575 26.221 7.047 1.00 61.07 ? 34 TYR B CD1 1 ATOM 7789 C CD2 . TYR D 2 34 ? 16.395 28.616 6.838 1.00 59.05 ? 34 TYR B CD2 1 ATOM 7790 C CE1 . TYR D 2 34 ? 17.879 26.263 6.556 1.00 62.20 ? 34 TYR B CE1 1 ATOM 7791 C CE2 . TYR D 2 34 ? 17.701 28.669 6.345 1.00 65.18 ? 34 TYR B CE2 1 ATOM 7792 C CZ . TYR D 2 34 ? 18.437 27.496 6.216 1.00 64.08 ? 34 TYR B CZ 1 ATOM 7793 O OH . TYR D 2 34 ? 19.715 27.561 5.726 1.00 66.98 ? 34 TYR B OH 1 ATOM 7794 N N . ALA D 2 35 ? 12.228 28.700 9.709 1.00 62.79 ? 35 ALA B N 1 ATOM 7795 C CA . ALA D 2 35 ? 10.757 28.805 9.818 1.00 64.68 ? 35 ALA B CA 1 ATOM 7796 C C . ALA D 2 35 ? 10.194 29.993 9.033 1.00 67.14 ? 35 ALA B C 1 ATOM 7797 O O . ALA D 2 35 ? 10.704 31.106 9.096 1.00 70.33 ? 35 ALA B O 1 ATOM 7798 C CB . ALA D 2 35 ? 10.334 28.896 11.276 1.00 57.40 ? 35 ALA B CB 1 ATOM 7799 N N . ALA D 2 36 ? 9.090 29.770 8.351 1.00 69.19 ? 36 ALA B N 1 ATOM 7800 C CA . ALA D 2 36 ? 8.508 30.812 7.541 1.00 74.82 ? 36 ALA B CA 1 ATOM 7801 C C . ALA D 2 36 ? 7.635 31.752 8.375 1.00 73.61 ? 36 ALA B C 1 ATOM 7802 O O . ALA D 2 36 ? 6.943 31.314 9.278 1.00 70.75 ? 36 ALA B O 1 ATOM 7803 C CB . ALA D 2 36 ? 7.716 30.173 6.415 1.00 77.18 ? 36 ALA B CB 1 ATOM 7804 N N . ASP D 2 37 ? 7.672 33.043 8.053 1.00 76.37 ? 37 ASP B N 1 ATOM 7805 C CA . ASP D 2 37 ? 6.692 33.998 8.557 1.00 77.44 ? 37 ASP B CA 1 ATOM 7806 C C . ASP D 2 37 ? 5.399 33.851 7.738 1.00 83.36 ? 37 ASP B C 1 ATOM 7807 O O . ASP D 2 37 ? 5.337 34.237 6.577 1.00 76.71 ? 37 ASP B O 1 ATOM 7808 C CB . ASP D 2 37 ? 7.196 35.437 8.471 1.00 75.97 ? 37 ASP B CB 1 ATOM 7809 C CG . ASP D 2 37 ? 6.325 36.389 9.241 1.00 75.99 ? 37 ASP B CG 1 ATOM 7810 O OD1 . ASP D 2 37 ? 6.268 36.236 10.483 1.00 80.75 ? 37 ASP B OD1 1 ATOM 7811 O OD2 . ASP D 2 37 ? 5.676 37.258 8.614 1.00 79.54 ? 37 ASP B OD2 1 ATOM 7812 N N . LYS D 2 38 ? 4.383 33.268 8.368 1.00 87.14 ? 38 LYS B N 1 ATOM 7813 C CA . LYS D 2 38 ? 3.077 33.038 7.765 1.00 86.64 ? 38 LYS B CA 1 ATOM 7814 C C . LYS D 2 38 ? 2.415 34.307 7.240 1.00 87.85 ? 38 LYS B C 1 ATOM 7815 O O . LYS D 2 38 ? 2.073 34.388 6.073 1.00 83.61 ? 38 LYS B O 1 ATOM 7816 C CB . LYS D 2 38 ? 2.137 32.449 8.818 1.00 91.89 ? 38 LYS B CB 1 ATOM 7817 C CG . LYS D 2 38 ? 1.403 31.203 8.395 1.00 102.32 ? 38 LYS B CG 1 ATOM 7818 C CD . LYS D 2 38 ? 2.389 30.042 8.356 1.00 107.33 ? 38 LYS B CD 1 ATOM 7819 C CE . LYS D 2 38 ? 1.800 28.785 8.965 1.00 116.39 ? 38 LYS B CE 1 ATOM 7820 N NZ . LYS D 2 38 ? 2.736 27.644 8.819 1.00 117.85 ? 38 LYS B NZ 1 ATOM 7821 N N . GLU D 2 39 ? 2.220 35.284 8.113 1.00 87.06 ? 39 GLU B N 1 ATOM 7822 C CA . GLU D 2 39 ? 1.389 36.430 7.785 1.00 87.71 ? 39 GLU B CA 1 ATOM 7823 C C . GLU D 2 39 ? 1.904 37.150 6.552 1.00 79.16 ? 39 GLU B C 1 ATOM 7824 O O . GLU D 2 39 ? 1.150 37.349 5.608 1.00 88.40 ? 39 GLU B O 1 ATOM 7825 C CB . GLU D 2 39 ? 1.282 37.421 8.956 1.00 100.00 ? 39 GLU B CB 1 ATOM 7826 C CG . GLU D 2 39 ? 0.413 38.644 8.644 1.00 112.03 ? 39 GLU B CG 1 ATOM 7827 C CD . GLU D 2 39 ? 0.332 39.657 9.779 1.00 122.85 ? 39 GLU B CD 1 ATOM 7828 O OE1 . GLU D 2 39 ? 0.156 39.236 10.950 1.00 127.54 ? 39 GLU B OE1 1 ATOM 7829 O OE2 . GLU D 2 39 ? 0.423 40.878 9.488 1.00 115.98 ? 39 GLU B OE2 1 ATOM 7830 N N . SER D 2 40 ? 3.173 37.553 6.560 1.00 72.55 ? 40 SER B N 1 ATOM 7831 C CA . SER D 2 40 ? 3.704 38.389 5.472 1.00 66.11 ? 40 SER B CA 1 ATOM 7832 C C . SER D 2 40 ? 3.895 37.608 4.157 1.00 65.91 ? 40 SER B C 1 ATOM 7833 O O . SER D 2 40 ? 3.786 38.198 3.091 1.00 67.30 ? 40 SER B O 1 ATOM 7834 C CB . SER D 2 40 ? 5.001 39.079 5.879 1.00 59.83 ? 40 SER B CB 1 ATOM 7835 O OG . SER D 2 40 ? 6.076 38.163 5.892 1.00 57.53 ? 40 SER B OG 1 ATOM 7836 N N . THR D 2 41 ? 4.163 36.300 4.251 1.00 59.86 ? 41 THR B N 1 ATOM 7837 C CA . THR D 2 41 ? 4.111 35.394 3.104 1.00 64.28 ? 41 THR B CA 1 ATOM 7838 C C . THR D 2 41 ? 2.725 35.360 2.439 1.00 63.71 ? 41 THR B C 1 ATOM 7839 O O . THR D 2 41 ? 2.611 35.453 1.229 1.00 66.34 ? 41 THR B O 1 ATOM 7840 C CB . THR D 2 41 ? 4.502 33.956 3.507 1.00 69.32 ? 41 THR B CB 1 ATOM 7841 O OG1 . THR D 2 41 ? 5.924 33.880 3.663 1.00 67.90 ? 41 THR B OG1 1 ATOM 7842 C CG2 . THR D 2 41 ? 4.081 32.926 2.443 1.00 69.02 ? 41 THR B CG2 1 ATOM 7843 N N . GLN D 2 42 ? 1.680 35.229 3.242 1.00 68.18 ? 42 GLN B N 1 ATOM 7844 C CA . GLN D 2 42 ? 0.296 35.252 2.752 1.00 65.28 ? 42 GLN B CA 1 ATOM 7845 C C . GLN D 2 42 ? -0.058 36.595 2.123 1.00 67.61 ? 42 GLN B C 1 ATOM 7846 O O . GLN D 2 42 ? -0.753 36.639 1.119 1.00 68.20 ? 42 GLN B O 1 ATOM 7847 C CB . GLN D 2 42 ? -0.692 34.966 3.882 1.00 70.60 ? 42 GLN B CB 1 ATOM 7848 C CG . GLN D 2 42 ? -2.040 34.446 3.416 1.00 74.91 ? 42 GLN B CG 1 ATOM 7849 C CD . GLN D 2 42 ? -1.910 33.169 2.587 1.00 77.65 ? 42 GLN B CD 1 ATOM 7850 O OE1 . GLN D 2 42 ? -1.476 32.122 3.085 1.00 77.47 ? 42 GLN B OE1 1 ATOM 7851 N NE2 . GLN D 2 42 ? -2.278 33.257 1.307 1.00 76.32 ? 42 GLN B NE2 1 ATOM 7852 N N . LYS D 2 43 ? 0.428 37.689 2.701 1.00 66.14 ? 43 LYS B N 1 ATOM 7853 C CA . LYS D 2 43 ? 0.163 39.021 2.161 1.00 72.72 ? 43 LYS B CA 1 ATOM 7854 C C . LYS D 2 43 ? 0.733 39.201 0.745 1.00 68.75 ? 43 LYS B C 1 ATOM 7855 O O . LYS D 2 43 ? 0.092 39.786 -0.130 1.00 67.38 ? 43 LYS B O 1 ATOM 7856 C CB . LYS D 2 43 ? 0.748 40.082 3.068 1.00 83.16 ? 43 LYS B CB 1 ATOM 7857 C CG . LYS D 2 43 ? 0.088 41.448 2.890 1.00 96.75 ? 43 LYS B CG 1 ATOM 7858 C CD . LYS D 2 43 ? -1.307 41.478 3.510 1.00 107.76 ? 43 LYS B CD 1 ATOM 7859 C CE . LYS D 2 43 ? -1.836 42.886 3.734 1.00 115.49 ? 43 LYS B CE 1 ATOM 7860 N NZ . LYS D 2 43 ? -2.961 42.897 4.722 1.00 117.01 ? 43 LYS B NZ 1 ATOM 7861 N N . ALA D 2 44 ? 1.932 38.675 0.550 1.00 62.31 ? 44 ALA B N 1 ATOM 7862 C CA . ALA D 2 44 ? 2.582 38.659 -0.747 1.00 61.85 ? 44 ALA B CA 1 ATOM 7863 C C . ALA D 2 44 ? 1.927 37.715 -1.760 1.00 57.13 ? 44 ALA B C 1 ATOM 7864 O O . ALA D 2 44 ? 1.778 38.075 -2.900 1.00 55.90 ? 44 ALA B O 1 ATOM 7865 C CB . ALA D 2 44 ? 4.039 38.293 -0.586 1.00 57.87 ? 44 ALA B CB 1 ATOM 7866 N N . ILE D 2 45 ? 1.539 36.518 -1.340 1.00 56.63 ? 45 ILE B N 1 ATOM 7867 C CA . ILE D 2 45 ? 0.791 35.625 -2.207 1.00 57.26 ? 45 ILE B CA 1 ATOM 7868 C C . ILE D 2 45 ? -0.538 36.277 -2.642 1.00 59.90 ? 45 ILE B C 1 ATOM 7869 O O . ILE D 2 45 ? -0.902 36.222 -3.811 1.00 69.49 ? 45 ILE B O 1 ATOM 7870 C CB . ILE D 2 45 ? 0.543 34.262 -1.547 1.00 59.39 ? 45 ILE B CB 1 ATOM 7871 C CG1 . ILE D 2 45 ? 1.793 33.404 -1.664 1.00 66.04 ? 45 ILE B CG1 1 ATOM 7872 C CG2 . ILE D 2 45 ? -0.628 33.520 -2.187 1.00 55.75 ? 45 ILE B CG2 1 ATOM 7873 C CD1 . ILE D 2 45 ? 1.771 32.130 -0.825 1.00 66.74 ? 45 ILE B CD1 1 ATOM 7874 N N . ASP D 2 46 ? -1.267 36.883 -1.717 1.00 60.49 ? 46 ASP B N 1 ATOM 7875 C CA . ASP D 2 46 ? -2.525 37.556 -2.078 1.00 60.59 ? 46 ASP B CA 1 ATOM 7876 C C . ASP D 2 46 ? -2.283 38.673 -3.093 1.00 57.52 ? 46 ASP B C 1 ATOM 7877 O O . ASP D 2 46 ? -3.018 38.794 -4.079 1.00 53.45 ? 46 ASP B O 1 ATOM 7878 C CB . ASP D 2 46 ? -3.243 38.126 -0.863 1.00 59.45 ? 46 ASP B CB 1 ATOM 7879 C CG . ASP D 2 46 ? -3.750 37.040 0.094 1.00 68.22 ? 46 ASP B CG 1 ATOM 7880 O OD1 . ASP D 2 46 ? -3.596 35.825 -0.218 1.00 65.71 ? 46 ASP B OD1 1 ATOM 7881 O OD2 . ASP D 2 46 ? -4.311 37.408 1.163 1.00 69.11 ? 46 ASP B OD2 1 ATOM 7882 N N . GLY D 2 47 ? -1.223 39.435 -2.874 1.00 51.55 ? 47 GLY B N 1 ATOM 7883 C CA . GLY D 2 47 ? -0.975 40.620 -3.665 1.00 52.99 ? 47 GLY B CA 1 ATOM 7884 C C . GLY D 2 47 ? -0.524 40.277 -5.071 1.00 52.37 ? 47 GLY B C 1 ATOM 7885 O O . GLY D 2 47 ? -0.982 40.839 -6.057 1.00 51.99 ? 47 GLY B O 1 ATOM 7886 N N . VAL D 2 48 ? 0.366 39.320 -5.148 1.00 48.71 ? 48 VAL B N 1 ATOM 7887 C CA . VAL D 2 48 ? 0.898 38.873 -6.427 1.00 51.03 ? 48 VAL B CA 1 ATOM 7888 C C . VAL D 2 48 ? -0.185 38.153 -7.230 1.00 51.21 ? 48 VAL B C 1 ATOM 7889 O O . VAL D 2 48 ? -0.259 38.290 -8.438 1.00 48.44 ? 48 VAL B O 1 ATOM 7890 C CB . VAL D 2 48 ? 2.180 38.020 -6.186 1.00 51.74 ? 48 VAL B CB 1 ATOM 7891 C CG1 . VAL D 2 48 ? 2.492 37.134 -7.354 1.00 55.28 ? 48 VAL B CG1 1 ATOM 7892 C CG2 . VAL D 2 48 ? 3.368 38.950 -5.905 1.00 53.08 ? 48 VAL B CG2 1 ATOM 7893 N N . THR D 2 49 ? -1.031 37.407 -6.534 1.00 54.88 ? 49 THR B N 1 ATOM 7894 C CA . THR D 2 49 ? -2.152 36.733 -7.153 1.00 55.88 ? 49 THR B CA 1 ATOM 7895 C C . THR D 2 49 ? -3.140 37.759 -7.694 1.00 56.19 ? 49 THR B C 1 ATOM 7896 O O . THR D 2 49 ? -3.667 37.608 -8.797 1.00 64.07 ? 49 THR B O 1 ATOM 7897 C CB . THR D 2 49 ? -2.823 35.746 -6.170 1.00 57.12 ? 49 THR B CB 1 ATOM 7898 O OG1 . THR D 2 49 ? -1.936 34.634 -5.955 1.00 57.87 ? 49 THR B OG1 1 ATOM 7899 C CG2 . THR D 2 49 ? -4.146 35.217 -6.711 1.00 55.63 ? 49 THR B CG2 1 ATOM 7900 N N . ASN D 2 50 ? -3.394 38.806 -6.924 1.00 51.69 ? 50 ASN B N 1 ATOM 7901 C CA . ASN D 2 50 ? -4.253 39.867 -7.400 1.00 50.32 ? 50 ASN B CA 1 ATOM 7902 C C . ASN D 2 50 ? -3.731 40.553 -8.631 1.00 47.81 ? 50 ASN B C 1 ATOM 7903 O O . ASN D 2 50 ? -4.502 41.005 -9.470 1.00 48.12 ? 50 ASN B O 1 ATOM 7904 C CB . ASN D 2 50 ? -4.442 40.931 -6.359 1.00 52.37 ? 50 ASN B CB 1 ATOM 7905 C CG . ASN D 2 50 ? -5.852 41.004 -5.900 1.00 61.75 ? 50 ASN B CG 1 ATOM 7906 O OD1 . ASN D 2 50 ? -6.618 41.874 -6.346 1.00 67.35 ? 50 ASN B OD1 1 ATOM 7907 N ND2 . ASN D 2 50 ? -6.244 40.051 -5.050 1.00 63.18 ? 50 ASN B ND2 1 ATOM 7908 N N . LYS D 2 51 ? -2.423 40.693 -8.689 1.00 46.36 ? 51 LYS B N 1 ATOM 7909 C CA . LYS D 2 51 ? -1.789 41.425 -9.764 1.00 46.11 ? 51 LYS B CA 1 ATOM 7910 C C . LYS D 2 51 ? -2.012 40.695 -11.073 1.00 44.13 ? 51 LYS B C 1 ATOM 7911 O O . LYS D 2 51 ? -2.437 41.278 -12.042 1.00 40.22 ? 51 LYS B O 1 ATOM 7912 C CB . LYS D 2 51 ? -0.304 41.572 -9.505 1.00 44.57 ? 51 LYS B CB 1 ATOM 7913 C CG . LYS D 2 51 ? 0.478 42.056 -10.721 1.00 44.30 ? 51 LYS B CG 1 ATOM 7914 C CD . LYS D 2 51 ? 1.963 42.206 -10.437 1.00 44.20 ? 51 LYS B CD 1 ATOM 7915 C CE . LYS D 2 51 ? 2.271 43.269 -9.396 1.00 44.98 ? 51 LYS B CE 1 ATOM 7916 N NZ . LYS D 2 51 ? 3.651 43.813 -9.597 1.00 43.21 ? 51 LYS B NZ 1 ATOM 7917 N N . VAL D 2 52 ? -1.718 39.413 -11.051 1.00 42.40 ? 52 VAL B N 1 ATOM 7918 C CA . VAL D 2 52 ? -1.864 38.598 -12.190 1.00 45.45 ? 52 VAL B CA 1 ATOM 7919 C C . VAL D 2 52 ? -3.340 38.618 -12.666 1.00 44.07 ? 52 VAL B C 1 ATOM 7920 O O . VAL D 2 52 ? -3.619 38.788 -13.872 1.00 41.38 ? 52 VAL B O 1 ATOM 7921 C CB . VAL D 2 52 ? -1.391 37.161 -11.893 1.00 45.13 ? 52 VAL B CB 1 ATOM 7922 C CG1 . VAL D 2 52 ? -1.759 36.212 -13.029 1.00 46.52 ? 52 VAL B CG1 1 ATOM 7923 C CG2 . VAL D 2 52 ? 0.108 37.149 -11.700 1.00 46.28 ? 52 VAL B CG2 1 ATOM 7924 N N . ASN D 2 53 ? -4.254 38.389 -11.741 1.00 41.56 ? 53 ASN B N 1 ATOM 7925 C CA . ASN D 2 53 ? -5.673 38.326 -12.085 1.00 41.31 ? 53 ASN B CA 1 ATOM 7926 C C . ASN D 2 53 ? -6.194 39.644 -12.593 1.00 39.93 ? 53 ASN B C 1 ATOM 7927 O O . ASN D 2 53 ? -7.020 39.690 -13.463 1.00 44.97 ? 53 ASN B O 1 ATOM 7928 C CB . ASN D 2 53 ? -6.506 37.873 -10.887 1.00 43.85 ? 53 ASN B CB 1 ATOM 7929 C CG . ASN D 2 53 ? -6.306 36.404 -10.541 1.00 42.75 ? 53 ASN B CG 1 ATOM 7930 O OD1 . ASN D 2 53 ? -5.871 35.591 -11.357 1.00 41.01 ? 53 ASN B OD1 1 ATOM 7931 N ND2 . ASN D 2 53 ? -6.652 36.060 -9.325 1.00 49.12 ? 53 ASN B ND2 1 ATOM 7932 N N . SER D 2 54 ? -5.640 40.735 -12.106 1.00 42.83 ? 54 SER B N 1 ATOM 7933 C CA . SER D 2 54 ? -5.997 42.061 -12.597 1.00 44.17 ? 54 SER B CA 1 ATOM 7934 C C . SER D 2 54 ? -5.536 42.259 -14.057 1.00 43.81 ? 54 SER B C 1 ATOM 7935 O O . SER D 2 54 ? -6.267 42.767 -14.886 1.00 47.26 ? 54 SER B O 1 ATOM 7936 C CB . SER D 2 54 ? -5.353 43.126 -11.717 1.00 44.80 ? 54 SER B CB 1 ATOM 7937 O OG . SER D 2 54 ? -5.954 43.123 -10.449 1.00 51.37 ? 54 SER B OG 1 ATOM 7938 N N . ILE D 2 55 ? -4.317 41.858 -14.345 1.00 41.29 ? 55 ILE B N 1 ATOM 7939 C CA . ILE D 2 55 ? -3.766 41.973 -15.692 1.00 43.06 ? 55 ILE B CA 1 ATOM 7940 C C . ILE D 2 55 ? -4.528 41.097 -16.682 1.00 45.40 ? 55 ILE B C 1 ATOM 7941 O O . ILE D 2 55 ? -4.683 41.463 -17.837 1.00 45.60 ? 55 ILE B O 1 ATOM 7942 C CB . ILE D 2 55 ? -2.288 41.609 -15.678 1.00 44.07 ? 55 ILE B CB 1 ATOM 7943 C CG1 . ILE D 2 55 ? -1.502 42.751 -15.034 1.00 43.88 ? 55 ILE B CG1 1 ATOM 7944 C CG2 . ILE D 2 55 ? -1.778 41.351 -17.078 1.00 45.66 ? 55 ILE B CG2 1 ATOM 7945 C CD1 . ILE D 2 55 ? -0.088 42.414 -14.669 1.00 43.91 ? 55 ILE B CD1 1 ATOM 7946 N N . ILE D 2 56 ? -5.056 39.979 -16.194 1.00 44.56 ? 56 ILE B N 1 ATOM 7947 C CA . ILE D 2 56 ? -5.911 39.089 -16.970 1.00 45.03 ? 56 ILE B CA 1 ATOM 7948 C C . ILE D 2 56 ? -7.382 39.581 -17.064 1.00 46.32 ? 56 ILE B C 1 ATOM 7949 O O . ILE D 2 56 ? -7.953 39.621 -18.137 1.00 49.13 ? 56 ILE B O 1 ATOM 7950 C CB . ILE D 2 56 ? -5.900 37.655 -16.340 1.00 41.81 ? 56 ILE B CB 1 ATOM 7951 C CG1 . ILE D 2 56 ? -4.521 37.030 -16.513 1.00 40.49 ? 56 ILE B CG1 1 ATOM 7952 C CG2 . ILE D 2 56 ? -6.968 36.721 -16.947 1.00 42.30 ? 56 ILE B CG2 1 ATOM 7953 C CD1 . ILE D 2 56 ? -4.344 35.695 -15.803 1.00 37.61 ? 56 ILE B CD1 1 ATOM 7954 N N . ASP D 2 57 ? -7.986 39.890 -15.922 1.00 45.34 ? 57 ASP B N 1 ATOM 7955 C CA . ASP D 2 57 ? -9.442 40.091 -15.808 1.00 45.49 ? 57 ASP B CA 1 ATOM 7956 C C . ASP D 2 57 ? -9.881 41.447 -16.408 1.00 45.36 ? 57 ASP B C 1 ATOM 7957 O O . ASP D 2 57 ? -11.024 41.596 -16.739 1.00 45.96 ? 57 ASP B O 1 ATOM 7958 C CB . ASP D 2 57 ? -9.919 40.032 -14.332 1.00 47.96 ? 57 ASP B CB 1 ATOM 7959 C CG . ASP D 2 57 ? -9.775 38.627 -13.686 1.00 54.06 ? 57 ASP B CG 1 ATOM 7960 O OD1 . ASP D 2 57 ? -9.551 37.635 -14.413 1.00 57.58 ? 57 ASP B OD1 1 ATOM 7961 O OD2 . ASP D 2 57 ? -9.853 38.525 -12.429 1.00 52.45 ? 57 ASP B OD2 1 ATOM 7962 N N . LYS D 2 58 ? -8.979 42.433 -16.494 1.00 44.38 ? 58 LYS B N 1 ATOM 7963 C CA . LYS D 2 58 ? -9.291 43.774 -17.040 1.00 43.31 ? 58 LYS B CA 1 ATOM 7964 C C . LYS D 2 58 ? -9.367 43.818 -18.553 1.00 43.01 ? 58 LYS B C 1 ATOM 7965 O O . LYS D 2 58 ? -9.823 44.802 -19.117 1.00 44.20 ? 58 LYS B O 1 ATOM 7966 C CB . LYS D 2 58 ? -8.239 44.785 -16.579 1.00 48.67 ? 58 LYS B CB 1 ATOM 7967 C CG . LYS D 2 58 ? -8.717 45.790 -15.552 1.00 54.08 ? 58 LYS B CG 1 ATOM 7968 C CD . LYS D 2 58 ? -9.416 45.172 -14.359 1.00 54.98 ? 58 LYS B CD 1 ATOM 7969 C CE . LYS D 2 58 ? -10.659 45.950 -13.995 1.00 60.93 ? 58 LYS B CE 1 ATOM 7970 N NZ . LYS D 2 58 ? -10.403 47.014 -12.998 1.00 60.27 ? 58 LYS B NZ 1 ATOM 7971 N N . MET D 2 59 ? -8.873 42.776 -19.220 1.00 43.88 ? 59 MET B N 1 ATOM 7972 C CA . MET D 2 59 ? -9.002 42.653 -20.656 1.00 44.87 ? 59 MET B CA 1 ATOM 7973 C C . MET D 2 59 ? -10.469 42.471 -21.061 1.00 43.95 ? 59 MET B C 1 ATOM 7974 O O . MET D 2 59 ? -11.129 41.536 -20.651 1.00 46.68 ? 59 MET B O 1 ATOM 7975 C CB . MET D 2 59 ? -8.202 41.463 -21.174 1.00 47.20 ? 59 MET B CB 1 ATOM 7976 C CG . MET D 2 59 ? -8.153 41.363 -22.695 1.00 44.49 ? 59 MET B CG 1 ATOM 7977 S SD . MET D 2 59 ? -7.580 42.864 -23.515 1.00 44.41 ? 59 MET B SD 1 ATOM 7978 C CE . MET D 2 59 ? -5.819 42.753 -23.237 1.00 45.80 ? 59 MET B CE 1 ATOM 7979 N N . ASN D 2 60 ? -10.972 43.412 -21.831 1.00 42.07 ? 60 ASN B N 1 ATOM 7980 C CA . ASN D 2 60 ? -12.261 43.284 -22.426 1.00 45.98 ? 60 ASN B CA 1 ATOM 7981 C C . ASN D 2 60 ? -12.136 42.481 -23.738 1.00 50.07 ? 60 ASN B C 1 ATOM 7982 O O . ASN D 2 60 ? -11.352 42.813 -24.635 1.00 48.11 ? 60 ASN B O 1 ATOM 7983 C CB . ASN D 2 60 ? -12.812 44.650 -22.700 1.00 47.72 ? 60 ASN B CB 1 ATOM 7984 C CG . ASN D 2 60 ? -14.218 44.606 -23.203 1.00 51.36 ? 60 ASN B CG 1 ATOM 7985 O OD1 . ASN D 2 60 ? -15.104 44.058 -22.542 1.00 53.20 ? 60 ASN B OD1 1 ATOM 7986 N ND2 . ASN D 2 60 ? -14.452 45.207 -24.359 1.00 53.66 ? 60 ASN B ND2 1 ATOM 7987 N N . THR D 2 61 ? -12.921 41.420 -23.825 1.00 51.78 ? 61 THR B N 1 ATOM 7988 C CA . THR D 2 61 ? -12.881 40.486 -24.918 1.00 55.94 ? 61 THR B CA 1 ATOM 7989 C C . THR D 2 61 ? -14.186 40.662 -25.665 1.00 55.27 ? 61 THR B C 1 ATOM 7990 O O . THR D 2 61 ? -15.230 40.718 -25.041 1.00 63.28 ? 61 THR B O 1 ATOM 7991 C CB . THR D 2 61 ? -12.704 39.065 -24.342 1.00 58.79 ? 61 THR B CB 1 ATOM 7992 O OG1 . THR D 2 61 ? -11.503 38.501 -24.858 1.00 63.12 ? 61 THR B OG1 1 ATOM 7993 C CG2 . THR D 2 61 ? -13.921 38.145 -24.590 1.00 65.55 ? 61 THR B CG2 1 ATOM 7994 N N . GLN D 2 62 ? -14.158 40.809 -26.990 1.00 49.36 ? 62 GLN B N 1 ATOM 7995 C CA . GLN D 2 62 ? -15.423 40.769 -27.707 1.00 45.23 ? 62 GLN B CA 1 ATOM 7996 C C . GLN D 2 62 ? -15.431 39.950 -28.981 1.00 41.93 ? 62 GLN B C 1 ATOM 7997 O O . GLN D 2 62 ? -14.406 39.696 -29.579 1.00 40.32 ? 62 GLN B O 1 ATOM 7998 C CB . GLN D 2 62 ? -16.030 42.153 -27.971 1.00 46.40 ? 62 GLN B CB 1 ATOM 7999 C CG . GLN D 2 62 ? -15.104 43.323 -28.105 1.00 48.30 ? 62 GLN B CG 1 ATOM 8000 C CD . GLN D 2 62 ? -15.885 44.624 -28.196 1.00 45.58 ? 62 GLN B CD 1 ATOM 8001 O OE1 . GLN D 2 62 ? -17.063 44.651 -28.568 1.00 43.97 ? 62 GLN B OE1 1 ATOM 8002 N NE2 . GLN D 2 62 ? -15.209 45.718 -27.916 1.00 47.59 ? 62 GLN B NE2 1 ATOM 8003 N N . PHE D 2 63 ? -16.634 39.553 -29.378 1.00 36.13 ? 63 PHE B N 1 ATOM 8004 C CA . PHE D 2 63 ? -16.781 38.771 -30.556 1.00 35.36 ? 63 PHE B CA 1 ATOM 8005 C C . PHE D 2 63 ? -16.300 39.567 -31.761 1.00 32.78 ? 63 PHE B C 1 ATOM 8006 O O . PHE D 2 63 ? -16.797 40.655 -32.002 1.00 32.29 ? 63 PHE B O 1 ATOM 8007 C CB . PHE D 2 63 ? -18.253 38.340 -30.779 1.00 34.63 ? 63 PHE B CB 1 ATOM 8008 C CG . PHE D 2 63 ? -18.418 37.550 -32.025 1.00 35.52 ? 63 PHE B CG 1 ATOM 8009 C CD1 . PHE D 2 63 ? -18.196 36.185 -32.007 1.00 37.75 ? 63 PHE B CD1 1 ATOM 8010 C CD2 . PHE D 2 63 ? -18.639 38.157 -33.220 1.00 35.35 ? 63 PHE B CD2 1 ATOM 8011 C CE1 . PHE D 2 63 ? -18.279 35.424 -33.160 1.00 38.13 ? 63 PHE B CE1 1 ATOM 8012 C CE2 . PHE D 2 63 ? -18.728 37.411 -34.399 1.00 39.72 ? 63 PHE B CE2 1 ATOM 8013 C CZ . PHE D 2 63 ? -18.525 36.039 -34.360 1.00 40.45 ? 63 PHE B CZ 1 ATOM 8014 N N . GLU D 2 64 ? -15.393 38.993 -32.559 1.00 31.81 ? 64 GLU B N 1 ATOM 8015 C CA . GLU D 2 64 ? -15.130 39.532 -33.918 1.00 30.97 ? 64 GLU B CA 1 ATOM 8016 C C . GLU D 2 64 ? -14.885 38.414 -34.913 1.00 32.24 ? 64 GLU B C 1 ATOM 8017 O O . GLU D 2 64 ? -14.393 37.331 -34.541 1.00 34.15 ? 64 GLU B O 1 ATOM 8018 C CB . GLU D 2 64 ? -13.914 40.468 -33.939 1.00 31.64 ? 64 GLU B CB 1 ATOM 8019 C CG . GLU D 2 64 ? -13.911 41.592 -32.906 1.00 33.00 ? 64 GLU B CG 1 ATOM 8020 C CD . GLU D 2 64 ? -14.967 42.658 -33.144 1.00 33.92 ? 64 GLU B CD 1 ATOM 8021 O OE1 . GLU D 2 64 ? -15.555 42.740 -34.273 1.00 30.67 ? 64 GLU B OE1 1 ATOM 8022 O OE2 . GLU D 2 64 ? -15.199 43.405 -32.146 1.00 34.72 ? 64 GLU B OE2 1 ATOM 8023 N N . ALA D 2 65 ? -15.198 38.701 -36.177 1.00 28.89 ? 65 ALA B N 1 ATOM 8024 C CA . ALA D 2 65 ? -14.967 37.785 -37.249 1.00 29.27 ? 65 ALA B CA 1 ATOM 8025 C C . ALA D 2 65 ? -13.961 38.403 -38.205 1.00 30.09 ? 65 ALA B C 1 ATOM 8026 O O . ALA D 2 65 ? -14.261 39.407 -38.889 1.00 33.65 ? 65 ALA B O 1 ATOM 8027 C CB . ALA D 2 65 ? -16.269 37.451 -37.969 1.00 28.81 ? 65 ALA B CB 1 ATOM 8028 N N . VAL D 2 66 ? -12.759 37.832 -38.219 1.00 29.17 ? 66 VAL B N 1 ATOM 8029 C CA . VAL D 2 66 ? -11.653 38.386 -39.001 1.00 28.88 ? 66 VAL B CA 1 ATOM 8030 C C . VAL D 2 66 ? -11.413 37.472 -40.179 1.00 30.23 ? 66 VAL B C 1 ATOM 8031 O O . VAL D 2 66 ? -11.069 36.316 -39.997 1.00 31.75 ? 66 VAL B O 1 ATOM 8032 C CB . VAL D 2 66 ? -10.371 38.466 -38.233 1.00 28.28 ? 66 VAL B CB 1 ATOM 8033 C CG1 . VAL D 2 66 ? -9.295 39.087 -39.095 1.00 27.47 ? 66 VAL B CG1 1 ATOM 8034 C CG2 . VAL D 2 66 ? -10.532 39.200 -36.899 1.00 28.51 ? 66 VAL B CG2 1 ATOM 8035 N N . GLY D 2 67 ? -11.645 37.998 -41.375 1.00 31.74 ? 67 GLY B N 1 ATOM 8036 C CA . GLY D 2 67 ? -11.385 37.299 -42.625 1.00 33.01 ? 67 GLY B CA 1 ATOM 8037 C C . GLY D 2 67 ? -10.757 38.213 -43.682 1.00 31.72 ? 67 GLY B C 1 ATOM 8038 O O . GLY D 2 67 ? -10.094 39.192 -43.372 1.00 33.11 ? 67 GLY B O 1 ATOM 8039 N N . ARG D 2 68 ? -10.954 37.850 -44.929 1.00 31.78 ? 68 ARG B N 1 ATOM 8040 C CA . ARG D 2 68 ? -10.372 38.554 -46.051 1.00 31.07 ? 68 ARG B CA 1 ATOM 8041 C C . ARG D 2 68 ? -11.427 38.581 -47.095 1.00 32.39 ? 68 ARG B C 1 ATOM 8042 O O . ARG D 2 68 ? -11.435 37.759 -47.967 1.00 37.74 ? 68 ARG B O 1 ATOM 8043 C CB . ARG D 2 68 ? -9.121 37.803 -46.534 1.00 33.11 ? 68 ARG B CB 1 ATOM 8044 C CG . ARG D 2 68 ? -7.938 37.876 -45.535 1.00 34.30 ? 68 ARG B CG 1 ATOM 8045 C CD . ARG D 2 68 ? -7.442 39.319 -45.381 1.00 34.98 ? 68 ARG B CD 1 ATOM 8046 N NE . ARG D 2 68 ? -6.258 39.515 -44.567 1.00 35.38 ? 68 ARG B NE 1 ATOM 8047 C CZ . ARG D 2 68 ? -6.253 39.958 -43.323 1.00 34.60 ? 68 ARG B CZ 1 ATOM 8048 N NH1 . ARG D 2 68 ? -7.382 40.227 -42.699 1.00 34.45 ? 68 ARG B NH1 1 ATOM 8049 N NH2 . ARG D 2 68 ? -5.105 40.121 -42.687 1.00 35.22 ? 68 ARG B NH2 1 ATOM 8050 N N . GLU D 2 69 ? -12.359 39.527 -46.986 1.00 36.30 ? 69 GLU B N 1 ATOM 8051 C CA . GLU D 2 69 ? -13.616 39.499 -47.758 1.00 34.08 ? 69 GLU B CA 1 ATOM 8052 C C . GLU D 2 69 ? -13.578 40.411 -48.962 1.00 33.57 ? 69 GLU B C 1 ATOM 8053 O O . GLU D 2 69 ? -14.568 40.480 -49.735 1.00 31.37 ? 69 GLU B O 1 ATOM 8054 C CB . GLU D 2 69 ? -14.764 39.968 -46.858 1.00 37.51 ? 69 GLU B CB 1 ATOM 8055 C CG . GLU D 2 69 ? -15.306 38.956 -45.847 1.00 43.72 ? 69 GLU B CG 1 ATOM 8056 C CD . GLU D 2 69 ? -16.676 38.271 -46.243 1.00 57.79 ? 69 GLU B CD 1 ATOM 8057 O OE1 . GLU D 2 69 ? -17.104 38.106 -47.510 1.00 52.38 ? 69 GLU B OE1 1 ATOM 8058 O OE2 . GLU D 2 69 ? -17.317 37.868 -45.205 1.00 48.78 ? 69 GLU B OE2 1 ATOM 8059 N N . PHE D 2 70 ? -12.471 41.142 -49.147 1.00 30.73 ? 70 PHE B N 1 ATOM 8060 C CA . PHE D 2 70 ? -12.368 42.079 -50.309 1.00 31.94 ? 70 PHE B CA 1 ATOM 8061 C C . PHE D 2 70 ? -11.749 41.483 -51.582 1.00 31.99 ? 70 PHE B C 1 ATOM 8062 O O . PHE D 2 70 ? -10.834 40.672 -51.528 1.00 32.54 ? 70 PHE B O 1 ATOM 8063 C CB . PHE D 2 70 ? -11.658 43.357 -49.877 1.00 31.31 ? 70 PHE B CB 1 ATOM 8064 C CG . PHE D 2 70 ? -12.394 44.066 -48.800 1.00 30.61 ? 70 PHE B CG 1 ATOM 8065 C CD1 . PHE D 2 70 ? -11.997 43.965 -47.498 1.00 31.81 ? 70 PHE B CD1 1 ATOM 8066 C CD2 . PHE D 2 70 ? -13.585 44.715 -49.074 1.00 30.31 ? 70 PHE B CD2 1 ATOM 8067 C CE1 . PHE D 2 70 ? -12.752 44.541 -46.499 1.00 30.97 ? 70 PHE B CE1 1 ATOM 8068 C CE2 . PHE D 2 70 ? -14.318 45.323 -48.064 1.00 28.97 ? 70 PHE B CE2 1 ATOM 8069 C CZ . PHE D 2 70 ? -13.923 45.206 -46.782 1.00 28.00 ? 70 PHE B CZ 1 ATOM 8070 N N . ASN D 2 71 ? -12.285 41.846 -52.734 1.00 32.27 ? 71 ASN B N 1 ATOM 8071 C CA . ASN D 2 71 ? -11.810 41.242 -53.972 1.00 31.52 ? 71 ASN B CA 1 ATOM 8072 C C . ASN D 2 71 ? -10.630 41.991 -54.602 1.00 31.25 ? 71 ASN B C 1 ATOM 8073 O O . ASN D 2 71 ? -10.097 42.949 -54.037 1.00 27.06 ? 71 ASN B O 1 ATOM 8074 C CB . ASN D 2 71 ? -12.968 41.075 -54.967 1.00 32.57 ? 71 ASN B CB 1 ATOM 8075 C CG . ASN D 2 71 ? -13.457 42.398 -55.548 1.00 33.19 ? 71 ASN B CG 1 ATOM 8076 O OD1 . ASN D 2 71 ? -12.708 43.382 -55.746 1.00 32.20 ? 71 ASN B OD1 1 ATOM 8077 N ND2 . ASN D 2 71 ? -14.705 42.423 -55.820 1.00 31.73 ? 71 ASN B ND2 1 ATOM 8078 N N . ASN D 2 72 ? -10.238 41.561 -55.800 1.00 33.65 ? 72 ASN B N 1 ATOM 8079 C CA . ASN D 2 72 ? -9.016 42.078 -56.410 1.00 38.22 ? 72 ASN B CA 1 ATOM 8080 C C . ASN D 2 72 ? -9.114 43.559 -56.897 1.00 35.13 ? 72 ASN B C 1 ATOM 8081 O O . ASN D 2 72 ? -8.112 44.170 -57.246 1.00 34.68 ? 72 ASN B O 1 ATOM 8082 C CB . ASN D 2 72 ? -8.564 41.136 -57.519 1.00 44.24 ? 72 ASN B CB 1 ATOM 8083 C CG . ASN D 2 72 ? -7.110 41.401 -57.953 1.00 51.43 ? 72 ASN B CG 1 ATOM 8084 O OD1 . ASN D 2 72 ? -6.205 41.532 -57.129 1.00 58.20 ? 72 ASN B OD1 1 ATOM 8085 N ND2 . ASN D 2 72 ? -6.902 41.528 -59.254 1.00 52.99 ? 72 ASN B ND2 1 ATOM 8086 N N . LEU D 2 73 ? -10.315 44.102 -56.967 1.00 31.75 ? 73 LEU B N 1 ATOM 8087 C CA . LEU D 2 73 ? -10.509 45.543 -57.238 1.00 31.80 ? 73 LEU B CA 1 ATOM 8088 C C . LEU D 2 73 ? -10.980 46.330 -56.047 1.00 31.45 ? 73 LEU B C 1 ATOM 8089 O O . LEU D 2 73 ? -11.734 47.299 -56.193 1.00 32.65 ? 73 LEU B O 1 ATOM 8090 C CB . LEU D 2 73 ? -11.487 45.721 -58.411 1.00 31.85 ? 73 LEU B CB 1 ATOM 8091 C CG . LEU D 2 73 ? -10.830 45.370 -59.766 1.00 34.30 ? 73 LEU B CG 1 ATOM 8092 C CD1 . LEU D 2 73 ? -11.806 45.403 -60.941 1.00 34.43 ? 73 LEU B CD1 1 ATOM 8093 C CD2 . LEU D 2 73 ? -9.646 46.295 -60.071 1.00 36.97 ? 73 LEU B CD2 1 ATOM 8094 N N . GLU D 2 74 ? -10.621 45.827 -54.863 1.00 30.61 ? 74 GLU B N 1 ATOM 8095 C CA . GLU D 2 74 ? -10.932 46.455 -53.596 1.00 29.55 ? 74 GLU B CA 1 ATOM 8096 C C . GLU D 2 74 ? -9.687 46.370 -52.748 1.00 29.34 ? 74 GLU B C 1 ATOM 8097 O O . GLU D 2 74 ? -9.753 46.218 -51.509 1.00 29.56 ? 74 GLU B O 1 ATOM 8098 C CB . GLU D 2 74 ? -12.107 45.765 -52.892 1.00 30.53 ? 74 GLU B CB 1 ATOM 8099 C CG . GLU D 2 74 ? -13.451 45.880 -53.629 1.00 33.55 ? 74 GLU B CG 1 ATOM 8100 C CD . GLU D 2 74 ? -14.587 44.971 -53.040 1.00 35.82 ? 74 GLU B CD 1 ATOM 8101 O OE1 . GLU D 2 74 ? -14.312 43.843 -52.565 1.00 39.56 ? 74 GLU B OE1 1 ATOM 8102 O OE2 . GLU D 2 74 ? -15.755 45.397 -53.038 1.00 29.66 ? 74 GLU B OE2 1 ATOM 8103 N N . ARG D 2 75 ? -8.529 46.512 -53.402 1.00 30.84 ? 75 ARG B N 1 ATOM 8104 C CA . ARG D 2 75 ? -7.235 46.458 -52.718 1.00 32.45 ? 75 ARG B CA 1 ATOM 8105 C C . ARG D 2 75 ? -7.032 47.690 -51.853 1.00 30.91 ? 75 ARG B C 1 ATOM 8106 O O . ARG D 2 75 ? -6.337 47.607 -50.846 1.00 32.35 ? 75 ARG B O 1 ATOM 8107 C CB . ARG D 2 75 ? -6.101 46.367 -53.706 1.00 36.58 ? 75 ARG B CB 1 ATOM 8108 C CG . ARG D 2 75 ? -6.033 45.060 -54.474 1.00 44.38 ? 75 ARG B CG 1 ATOM 8109 C CD . ARG D 2 75 ? -5.872 43.921 -53.499 1.00 57.66 ? 75 ARG B CD 1 ATOM 8110 N NE . ARG D 2 75 ? -5.578 42.635 -54.138 1.00 74.05 ? 75 ARG B NE 1 ATOM 8111 C CZ . ARG D 2 75 ? -6.065 41.457 -53.725 1.00 85.94 ? 75 ARG B CZ 1 ATOM 8112 N NH1 . ARG D 2 75 ? -6.905 41.373 -52.683 1.00 93.55 ? 75 ARG B NH1 1 ATOM 8113 N NH2 . ARG D 2 75 ? -5.747 40.346 -54.376 1.00 88.35 ? 75 ARG B NH2 1 ATOM 8114 N N . ARG D 2 76 ? -7.662 48.825 -52.183 1.00 28.81 ? 76 ARG B N 1 ATOM 8115 C CA . ARG D 2 76 ? -7.479 49.979 -51.303 1.00 30.69 ? 76 ARG B CA 1 ATOM 8116 C C . ARG D 2 76 ? -8.082 49.715 -49.935 1.00 29.78 ? 76 ARG B C 1 ATOM 8117 O O . ARG D 2 76 ? -7.487 50.015 -48.914 1.00 27.59 ? 76 ARG B O 1 ATOM 8118 C CB . ARG D 2 76 ? -8.035 51.258 -51.953 1.00 33.12 ? 76 ARG B CB 1 ATOM 8119 C CG . ARG D 2 76 ? -7.221 51.679 -53.158 1.00 35.10 ? 76 ARG B CG 1 ATOM 8120 C CD . ARG D 2 76 ? -7.912 52.713 -53.973 1.00 33.21 ? 76 ARG B CD 1 ATOM 8121 N NE . ARG D 2 76 ? -9.189 52.263 -54.382 1.00 33.20 ? 76 ARG B NE 1 ATOM 8122 C CZ . ARG D 2 76 ? -10.257 53.045 -54.495 1.00 32.13 ? 76 ARG B CZ 1 ATOM 8123 N NH1 . ARG D 2 76 ? -10.201 54.329 -54.184 1.00 32.64 ? 76 ARG B NH1 1 ATOM 8124 N NH2 . ARG D 2 76 ? -11.394 52.521 -54.893 1.00 30.55 ? 76 ARG B NH2 1 ATOM 8125 N N . ILE D 2 77 ? -9.286 49.173 -49.929 1.00 32.87 ? 77 ILE B N 1 ATOM 8126 C CA . ILE D 2 77 ? -10.003 48.872 -48.681 1.00 34.38 ? 77 ILE B CA 1 ATOM 8127 C C . ILE D 2 77 ? -9.264 47.781 -47.939 1.00 32.03 ? 77 ILE B C 1 ATOM 8128 O O . ILE D 2 77 ? -9.070 47.877 -46.737 1.00 29.96 ? 77 ILE B O 1 ATOM 8129 C CB . ILE D 2 77 ? -11.459 48.461 -48.940 1.00 38.59 ? 77 ILE B CB 1 ATOM 8130 C CG1 . ILE D 2 77 ? -12.243 49.616 -49.522 1.00 44.06 ? 77 ILE B CG1 1 ATOM 8131 C CG2 . ILE D 2 77 ? -12.133 48.121 -47.637 1.00 38.82 ? 77 ILE B CG2 1 ATOM 8132 C CD1 . ILE D 2 77 ? -13.511 49.186 -50.232 1.00 47.58 ? 77 ILE B CD1 1 ATOM 8133 N N . GLU D 2 78 ? -8.813 46.767 -48.664 1.00 32.21 ? 78 GLU B N 1 ATOM 8134 C CA . GLU D 2 78 ? -8.027 45.722 -48.031 1.00 35.42 ? 78 GLU B CA 1 ATOM 8135 C C . GLU D 2 78 ? -6.834 46.353 -47.361 1.00 34.58 ? 78 GLU B C 1 ATOM 8136 O O . GLU D 2 78 ? -6.489 45.993 -46.236 1.00 33.55 ? 78 GLU B O 1 ATOM 8137 C CB . GLU D 2 78 ? -7.614 44.648 -49.054 1.00 42.18 ? 78 GLU B CB 1 ATOM 8138 C CG . GLU D 2 78 ? -6.750 43.480 -48.525 1.00 49.20 ? 78 GLU B CG 1 ATOM 8139 C CD . GLU D 2 78 ? -6.368 42.466 -49.660 1.00 66.48 ? 78 GLU B CD 1 ATOM 8140 O OE1 . GLU D 2 78 ? -5.641 42.854 -50.634 1.00 66.37 ? 78 GLU B OE1 1 ATOM 8141 O OE2 . GLU D 2 78 ? -6.841 41.273 -49.617 1.00 70.64 ? 78 GLU B OE2 1 ATOM 8142 N N . ASN D 2 79 ? -6.163 47.297 -48.034 1.00 34.78 ? 79 ASN B N 1 ATOM 8143 C CA . ASN D 2 79 ? -4.987 47.949 -47.400 1.00 34.29 ? 79 ASN B CA 1 ATOM 8144 C C . ASN D 2 79 ? -5.384 48.684 -46.121 1.00 31.31 ? 79 ASN B C 1 ATOM 8145 O O . ASN D 2 79 ? -4.649 48.729 -45.131 1.00 27.20 ? 79 ASN B O 1 ATOM 8146 C CB . ASN D 2 79 ? -4.281 48.895 -48.388 1.00 37.52 ? 79 ASN B CB 1 ATOM 8147 C CG . ASN D 2 79 ? -3.035 49.531 -47.812 1.00 39.96 ? 79 ASN B CG 1 ATOM 8148 O OD1 . ASN D 2 79 ? -2.961 50.742 -47.704 1.00 51.82 ? 79 ASN B OD1 1 ATOM 8149 N ND2 . ASN D 2 79 ? -2.095 48.736 -47.394 1.00 36.20 ? 79 ASN B ND2 1 ATOM 8150 N N . LEU D 2 80 ? -6.582 49.248 -46.126 1.00 32.22 ? 80 LEU B N 1 ATOM 8151 C CA . LEU D 2 80 ? -7.089 49.978 -44.949 1.00 32.50 ? 80 LEU B CA 1 ATOM 8152 C C . LEU D 2 80 ? -7.242 49.007 -43.799 1.00 30.90 ? 80 LEU B C 1 ATOM 8153 O O . LEU D 2 80 ? -6.779 49.253 -42.699 1.00 29.15 ? 80 LEU B O 1 ATOM 8154 C CB . LEU D 2 80 ? -8.390 50.681 -45.308 1.00 36.79 ? 80 LEU B CB 1 ATOM 8155 C CG . LEU D 2 80 ? -9.226 51.395 -44.264 1.00 41.89 ? 80 LEU B CG 1 ATOM 8156 C CD1 . LEU D 2 80 ? -8.344 52.277 -43.434 1.00 49.17 ? 80 LEU B CD1 1 ATOM 8157 C CD2 . LEU D 2 80 ? -10.297 52.268 -44.922 1.00 40.47 ? 80 LEU B CD2 1 ATOM 8158 N N . ASN D 2 81 ? -7.779 47.821 -44.082 1.00 32.96 ? 81 ASN B N 1 ATOM 8159 C CA . ASN D 2 81 ? -7.866 46.793 -43.068 1.00 31.22 ? 81 ASN B CA 1 ATOM 8160 C C . ASN D 2 81 ? -6.517 46.318 -42.594 1.00 31.73 ? 81 ASN B C 1 ATOM 8161 O O . ASN D 2 81 ? -6.303 46.079 -41.405 1.00 32.16 ? 81 ASN B O 1 ATOM 8162 C CB . ASN D 2 81 ? -8.626 45.585 -43.606 1.00 34.15 ? 81 ASN B CB 1 ATOM 8163 C CG . ASN D 2 81 ? -8.693 44.456 -42.590 1.00 33.81 ? 81 ASN B CG 1 ATOM 8164 O OD1 . ASN D 2 81 ? -9.422 44.535 -41.606 1.00 32.92 ? 81 ASN B OD1 1 ATOM 8165 N ND2 . ASN D 2 81 ? -7.919 43.435 -42.807 1.00 35.16 ? 81 ASN B ND2 1 ATOM 8166 N N . LYS D 2 82 ? -5.581 46.165 -43.512 1.00 31.51 ? 82 LYS B N 1 ATOM 8167 C CA . LYS D 2 82 ? -4.239 45.794 -43.092 1.00 33.74 ? 82 LYS B CA 1 ATOM 8168 C C . LYS D 2 82 ? -3.636 46.787 -42.125 1.00 34.11 ? 82 LYS B C 1 ATOM 8169 O O . LYS D 2 82 ? -2.984 46.414 -41.140 1.00 32.46 ? 82 LYS B O 1 ATOM 8170 C CB . LYS D 2 82 ? -3.324 45.674 -44.281 1.00 34.52 ? 82 LYS B CB 1 ATOM 8171 C CG . LYS D 2 82 ? -1.882 45.319 -43.936 1.00 35.59 ? 82 LYS B CG 1 ATOM 8172 C CD . LYS D 2 82 ? -1.081 45.340 -45.240 1.00 35.31 ? 82 LYS B CD 1 ATOM 8173 C CE . LYS D 2 82 ? 0.411 45.218 -45.059 1.00 38.32 ? 82 LYS B CE 1 ATOM 8174 N NZ . LYS D 2 82 ? 0.992 44.665 -43.804 1.00 39.76 ? 82 LYS B NZ 1 ATOM 8175 N N . LYS D 2 83 ? -3.819 48.067 -42.419 1.00 35.79 ? 83 LYS B N 1 ATOM 8176 C CA . LYS D 2 83 ? -3.174 49.071 -41.584 1.00 35.29 ? 83 LYS B CA 1 ATOM 8177 C C . LYS D 2 83 ? -3.825 49.036 -40.180 1.00 34.11 ? 83 LYS B C 1 ATOM 8178 O O . LYS D 2 83 ? -3.147 49.204 -39.153 1.00 33.99 ? 83 LYS B O 1 ATOM 8179 C CB . LYS D 2 83 ? -3.263 50.456 -42.193 1.00 35.14 ? 83 LYS B CB 1 ATOM 8180 C CG . LYS D 2 83 ? -2.427 50.704 -43.410 1.00 37.39 ? 83 LYS B CG 1 ATOM 8181 C CD . LYS D 2 83 ? -2.492 52.158 -43.826 1.00 39.82 ? 83 LYS B CD 1 ATOM 8182 C CE . LYS D 2 83 ? -3.766 52.409 -44.589 1.00 43.00 ? 83 LYS B CE 1 ATOM 8183 N NZ . LYS D 2 83 ? -4.007 53.855 -44.856 1.00 48.64 ? 83 LYS B NZ 1 ATOM 8184 N N . MET D 2 84 ? -5.122 48.791 -40.137 1.00 33.80 ? 84 MET B N 1 ATOM 8185 C CA . MET D 2 84 ? -5.844 48.695 -38.844 1.00 33.50 ? 84 MET B CA 1 ATOM 8186 C C . MET D 2 84 ? -5.391 47.485 -38.044 1.00 31.98 ? 84 MET B C 1 ATOM 8187 O O . MET D 2 84 ? -4.989 47.621 -36.904 1.00 29.74 ? 84 MET B O 1 ATOM 8188 C CB . MET D 2 84 ? -7.324 48.630 -39.099 1.00 38.41 ? 84 MET B CB 1 ATOM 8189 C CG . MET D 2 84 ? -8.175 48.725 -37.832 1.00 43.45 ? 84 MET B CG 1 ATOM 8190 S SD . MET D 2 84 ? -9.782 47.917 -38.118 1.00 50.41 ? 84 MET B SD 1 ATOM 8191 C CE . MET D 2 84 ? -9.202 46.225 -37.837 1.00 50.97 ? 84 MET B CE 1 ATOM 8192 N N . GLU D 2 85 ? -5.392 46.311 -38.670 1.00 31.75 ? 85 GLU B N 1 ATOM 8193 C CA . GLU D 2 85 ? -4.920 45.094 -37.997 1.00 34.50 ? 85 GLU B CA 1 ATOM 8194 C C . GLU D 2 85 ? -3.513 45.201 -37.466 1.00 33.65 ? 85 GLU B C 1 ATOM 8195 O O . GLU D 2 85 ? -3.241 44.881 -36.308 1.00 34.80 ? 85 GLU B O 1 ATOM 8196 C CB . GLU D 2 85 ? -4.904 43.910 -38.957 1.00 38.68 ? 85 GLU B CB 1 ATOM 8197 C CG . GLU D 2 85 ? -6.195 43.132 -39.058 1.00 39.56 ? 85 GLU B CG 1 ATOM 8198 C CD . GLU D 2 85 ? -6.058 41.840 -39.844 1.00 41.09 ? 85 GLU B CD 1 ATOM 8199 O OE1 . GLU D 2 85 ? -4.930 41.295 -40.014 1.00 50.79 ? 85 GLU B OE1 1 ATOM 8200 O OE2 . GLU D 2 85 ? -7.092 41.371 -40.321 1.00 41.14 ? 85 GLU B OE2 1 ATOM 8201 N N . ASP D 2 86 ? -2.598 45.595 -38.336 1.00 32.44 ? 86 ASP B N 1 ATOM 8202 C CA . ASP D 2 86 ? -1.166 45.769 -37.937 1.00 33.62 ? 86 ASP B CA 1 ATOM 8203 C C . ASP D 2 86 ? -1.049 46.798 -36.828 1.00 29.83 ? 86 ASP B C 1 ATOM 8204 O O . ASP D 2 86 ? -0.270 46.637 -35.897 1.00 29.31 ? 86 ASP B O 1 ATOM 8205 C CB . ASP D 2 86 ? -0.300 46.186 -39.149 1.00 34.83 ? 86 ASP B CB 1 ATOM 8206 C CG . ASP D 2 86 ? -0.271 45.099 -40.251 1.00 39.43 ? 86 ASP B CG 1 ATOM 8207 O OD1 . ASP D 2 86 ? -0.752 43.956 -40.026 1.00 42.16 ? 86 ASP B OD1 1 ATOM 8208 O OD2 . ASP D 2 86 ? 0.187 45.392 -41.367 1.00 43.10 ? 86 ASP B OD2 1 ATOM 8209 N N . GLY D 2 87 ? -1.847 47.855 -36.955 1.00 30.62 ? 87 GLY B N 1 ATOM 8210 C CA . GLY D 2 87 ? -1.913 48.911 -35.980 1.00 32.24 ? 87 GLY B CA 1 ATOM 8211 C C . GLY D 2 87 ? -2.173 48.377 -34.611 1.00 32.20 ? 87 GLY B C 1 ATOM 8212 O O . GLY D 2 87 ? -1.411 48.662 -33.682 1.00 32.97 ? 87 GLY B O 1 ATOM 8213 N N . PHE D 2 88 ? -3.210 47.560 -34.500 1.00 29.99 ? 88 PHE B N 1 ATOM 8214 C CA . PHE D 2 88 ? -3.595 47.052 -33.196 1.00 31.72 ? 88 PHE B CA 1 ATOM 8215 C C . PHE D 2 88 ? -2.600 46.042 -32.724 1.00 30.60 ? 88 PHE B C 1 ATOM 8216 O O . PHE D 2 88 ? -2.278 45.986 -31.544 1.00 34.34 ? 88 PHE B O 1 ATOM 8217 C CB . PHE D 2 88 ? -5.026 46.455 -33.193 1.00 32.32 ? 88 PHE B CB 1 ATOM 8218 C CG . PHE D 2 88 ? -6.125 47.482 -33.204 1.00 29.36 ? 88 PHE B CG 1 ATOM 8219 C CD1 . PHE D 2 88 ? -6.220 48.384 -32.191 1.00 32.24 ? 88 PHE B CD1 1 ATOM 8220 C CD2 . PHE D 2 88 ? -7.011 47.556 -34.221 1.00 27.50 ? 88 PHE B CD2 1 ATOM 8221 C CE1 . PHE D 2 88 ? -7.204 49.353 -32.181 1.00 30.68 ? 88 PHE B CE1 1 ATOM 8222 C CE2 . PHE D 2 88 ? -7.997 48.523 -34.237 1.00 28.16 ? 88 PHE B CE2 1 ATOM 8223 C CZ . PHE D 2 88 ? -8.097 49.412 -33.202 1.00 29.94 ? 88 PHE B CZ 1 ATOM 8224 N N . LEU D 2 89 ? -2.088 45.241 -33.617 1.00 32.35 ? 89 LEU B N 1 ATOM 8225 C CA . LEU D 2 89 ? -0.997 44.351 -33.208 1.00 34.89 ? 89 LEU B CA 1 ATOM 8226 C C . LEU D 2 89 ? 0.203 45.123 -32.613 1.00 34.06 ? 89 LEU B C 1 ATOM 8227 O O . LEU D 2 89 ? 0.806 44.698 -31.629 1.00 30.53 ? 89 LEU B O 1 ATOM 8228 C CB . LEU D 2 89 ? -0.566 43.463 -34.366 1.00 38.57 ? 89 LEU B CB 1 ATOM 8229 C CG . LEU D 2 89 ? 0.580 42.498 -34.025 1.00 41.20 ? 89 LEU B CG 1 ATOM 8230 C CD1 . LEU D 2 89 ? 0.235 41.090 -34.462 1.00 43.14 ? 89 LEU B CD1 1 ATOM 8231 C CD2 . LEU D 2 89 ? 1.860 42.920 -34.692 1.00 45.06 ? 89 LEU B CD2 1 ATOM 8232 N N . ASP D 2 90 ? 0.557 46.252 -33.224 1.00 35.80 ? 90 ASP B N 1 ATOM 8233 C CA . ASP D 2 90 ? 1.713 47.036 -32.741 1.00 36.71 ? 90 ASP B CA 1 ATOM 8234 C C . ASP D 2 90 ? 1.411 47.627 -31.366 1.00 36.28 ? 90 ASP B C 1 ATOM 8235 O O . ASP D 2 90 ? 2.211 47.516 -30.440 1.00 37.36 ? 90 ASP B O 1 ATOM 8236 C CB . ASP D 2 90 ? 2.079 48.134 -33.743 1.00 39.69 ? 90 ASP B CB 1 ATOM 8237 C CG . ASP D 2 90 ? 2.699 47.591 -35.069 1.00 44.05 ? 90 ASP B CG 1 ATOM 8238 O OD1 . ASP D 2 90 ? 3.093 46.425 -35.098 1.00 45.36 ? 90 ASP B OD1 1 ATOM 8239 O OD2 . ASP D 2 90 ? 2.763 48.338 -36.082 1.00 42.57 ? 90 ASP B OD2 1 ATOM 8240 N N . VAL D 2 91 ? 0.205 48.188 -31.225 1.00 35.83 ? 91 VAL B N 1 ATOM 8241 C CA . VAL D 2 91 ? -0.265 48.659 -29.943 1.00 34.53 ? 91 VAL B CA 1 ATOM 8242 C C . VAL D 2 91 ? -0.239 47.550 -28.864 1.00 35.61 ? 91 VAL B C 1 ATOM 8243 O O . VAL D 2 91 ? 0.342 47.751 -27.797 1.00 37.62 ? 91 VAL B O 1 ATOM 8244 C CB . VAL D 2 91 ? -1.664 49.290 -30.043 1.00 32.97 ? 91 VAL B CB 1 ATOM 8245 C CG1 . VAL D 2 91 ? -2.244 49.595 -28.672 1.00 31.98 ? 91 VAL B CG1 1 ATOM 8246 C CG2 . VAL D 2 91 ? -1.617 50.552 -30.857 1.00 31.70 ? 91 VAL B CG2 1 ATOM 8247 N N . TRP D 2 92 ? -0.868 46.401 -29.116 1.00 34.09 ? 92 TRP B N 1 ATOM 8248 C CA . TRP D 2 92 ? -0.960 45.390 -28.066 1.00 35.47 ? 92 TRP B CA 1 ATOM 8249 C C . TRP D 2 92 ? 0.374 44.728 -27.760 1.00 36.39 ? 92 TRP B C 1 ATOM 8250 O O . TRP D 2 92 ? 0.672 44.420 -26.608 1.00 39.77 ? 92 TRP B O 1 ATOM 8251 C CB . TRP D 2 92 ? -1.988 44.329 -28.408 1.00 33.97 ? 92 TRP B CB 1 ATOM 8252 C CG . TRP D 2 92 ? -3.379 44.781 -28.343 1.00 34.21 ? 92 TRP B CG 1 ATOM 8253 C CD1 . TRP D 2 92 ? -4.270 44.822 -29.377 1.00 34.77 ? 92 TRP B CD1 1 ATOM 8254 C CD2 . TRP D 2 92 ? -4.101 45.183 -27.176 1.00 33.83 ? 92 TRP B CD2 1 ATOM 8255 N NE1 . TRP D 2 92 ? -5.484 45.232 -28.927 1.00 35.45 ? 92 TRP B NE1 1 ATOM 8256 C CE2 . TRP D 2 92 ? -5.404 45.476 -27.579 1.00 35.56 ? 92 TRP B CE2 1 ATOM 8257 C CE3 . TRP D 2 92 ? -3.767 45.334 -25.832 1.00 36.27 ? 92 TRP B CE3 1 ATOM 8258 C CZ2 . TRP D 2 92 ? -6.404 45.890 -26.668 1.00 37.78 ? 92 TRP B CZ2 1 ATOM 8259 C CZ3 . TRP D 2 92 ? -4.747 45.763 -24.931 1.00 38.96 ? 92 TRP B CZ3 1 ATOM 8260 C CH2 . TRP D 2 92 ? -6.047 46.017 -25.351 1.00 38.67 ? 92 TRP B CH2 1 ATOM 8261 N N . THR D 2 93 ? 1.207 44.546 -28.772 1.00 37.63 ? 93 THR B N 1 ATOM 8262 C CA . THR D 2 93 ? 2.544 43.993 -28.535 1.00 38.92 ? 93 THR B CA 1 ATOM 8263 C C . THR D 2 93 ? 3.383 44.869 -27.606 1.00 38.48 ? 93 THR B C 1 ATOM 8264 O O . THR D 2 93 ? 3.882 44.390 -26.583 1.00 35.55 ? 93 THR B O 1 ATOM 8265 C CB . THR D 2 93 ? 3.325 43.764 -29.826 1.00 40.51 ? 93 THR B CB 1 ATOM 8266 O OG1 . THR D 2 93 ? 2.591 42.855 -30.640 1.00 36.27 ? 93 THR B OG1 1 ATOM 8267 C CG2 . THR D 2 93 ? 4.676 43.151 -29.522 1.00 42.48 ? 93 THR B CG2 1 ATOM 8268 N N . TYR D 2 94 ? 3.484 46.155 -27.935 1.00 37.90 ? 94 TYR B N 1 ATOM 8269 C CA . TYR D 2 94 ? 4.254 47.110 -27.112 1.00 42.27 ? 94 TYR B CA 1 ATOM 8270 C C . TYR D 2 94 ? 3.701 47.215 -25.679 1.00 42.62 ? 94 TYR B C 1 ATOM 8271 O O . TYR D 2 94 ? 4.444 47.171 -24.722 1.00 36.13 ? 94 TYR B O 1 ATOM 8272 C CB . TYR D 2 94 ? 4.273 48.506 -27.763 1.00 45.55 ? 94 TYR B CB 1 ATOM 8273 C CG . TYR D 2 94 ? 5.329 49.464 -27.230 1.00 45.31 ? 94 TYR B CG 1 ATOM 8274 C CD1 . TYR D 2 94 ? 6.659 49.235 -27.434 1.00 43.92 ? 94 TYR B CD1 1 ATOM 8275 C CD2 . TYR D 2 94 ? 4.962 50.614 -26.507 1.00 48.52 ? 94 TYR B CD2 1 ATOM 8276 C CE1 . TYR D 2 94 ? 7.607 50.105 -26.924 1.00 47.73 ? 94 TYR B CE1 1 ATOM 8277 C CE2 . TYR D 2 94 ? 5.904 51.507 -26.030 1.00 45.15 ? 94 TYR B CE2 1 ATOM 8278 C CZ . TYR D 2 94 ? 7.227 51.243 -26.232 1.00 46.35 ? 94 TYR B CZ 1 ATOM 8279 O OH . TYR D 2 94 ? 8.180 52.109 -25.779 1.00 45.26 ? 94 TYR B OH 1 ATOM 8280 N N . ASN D 2 95 ? 2.394 47.367 -25.566 1.00 45.16 ? 95 ASN B N 1 ATOM 8281 C CA . ASN D 2 95 ? 1.781 47.510 -24.269 1.00 51.50 ? 95 ASN B CA 1 ATOM 8282 C C . ASN D 2 95 ? 1.953 46.262 -23.422 1.00 48.71 ? 95 ASN B C 1 ATOM 8283 O O . ASN D 2 95 ? 2.286 46.375 -22.239 1.00 45.83 ? 95 ASN B O 1 ATOM 8284 C CB . ASN D 2 95 ? 0.300 47.893 -24.379 1.00 51.72 ? 95 ASN B CB 1 ATOM 8285 C CG . ASN D 2 95 ? 0.110 49.315 -24.895 1.00 60.54 ? 95 ASN B CG 1 ATOM 8286 O OD1 . ASN D 2 95 ? 1.064 50.098 -25.040 1.00 60.92 ? 95 ASN B OD1 1 ATOM 8287 N ND2 . ASN D 2 95 ? -1.134 49.654 -25.196 1.00 72.46 ? 95 ASN B ND2 1 ATOM 8288 N N . ALA D 2 96 ? 1.791 45.097 -24.031 1.00 38.85 ? 96 ALA B N 1 ATOM 8289 C CA . ALA D 2 96 ? 1.959 43.876 -23.296 1.00 40.28 ? 96 ALA B CA 1 ATOM 8290 C C . ALA D 2 96 ? 3.406 43.704 -22.850 1.00 40.06 ? 96 ALA B C 1 ATOM 8291 O O . ALA D 2 96 ? 3.635 43.392 -21.693 1.00 41.69 ? 96 ALA B O 1 ATOM 8292 C CB . ALA D 2 96 ? 1.531 42.670 -24.124 1.00 40.89 ? 96 ALA B CB 1 ATOM 8293 N N . GLU D 2 97 ? 4.362 43.931 -23.753 1.00 38.55 ? 97 GLU B N 1 ATOM 8294 C CA . GLU D 2 97 ? 5.770 43.719 -23.453 1.00 42.22 ? 97 GLU B CA 1 ATOM 8295 C C . GLU D 2 97 ? 6.249 44.659 -22.360 1.00 43.36 ? 97 GLU B C 1 ATOM 8296 O O . GLU D 2 97 ? 6.904 44.242 -21.408 1.00 45.70 ? 97 GLU B O 1 ATOM 8297 C CB . GLU D 2 97 ? 6.625 43.899 -24.692 1.00 45.16 ? 97 GLU B CB 1 ATOM 8298 C CG . GLU D 2 97 ? 6.401 42.858 -25.789 1.00 49.38 ? 97 GLU B CG 1 ATOM 8299 C CD . GLU D 2 97 ? 7.222 41.578 -25.640 1.00 51.83 ? 97 GLU B CD 1 ATOM 8300 O OE1 . GLU D 2 97 ? 8.120 41.503 -24.773 1.00 54.34 ? 97 GLU B OE1 1 ATOM 8301 O OE2 . GLU D 2 97 ? 6.959 40.618 -26.408 1.00 55.25 ? 97 GLU B OE2 1 ATOM 8302 N N . LEU D 2 98 ? 5.859 45.919 -22.461 1.00 43.37 ? 98 LEU B N 1 ATOM 8303 C CA . LEU D 2 98 ? 6.257 46.892 -21.470 1.00 45.59 ? 98 LEU B CA 1 ATOM 8304 C C . LEU D 2 98 ? 5.580 46.722 -20.121 1.00 47.58 ? 98 LEU B C 1 ATOM 8305 O O . LEU D 2 98 ? 6.185 46.956 -19.069 1.00 48.93 ? 98 LEU B O 1 ATOM 8306 C CB . LEU D 2 98 ? 6.015 48.300 -21.964 1.00 46.06 ? 98 LEU B CB 1 ATOM 8307 C CG . LEU D 2 98 ? 7.051 48.837 -22.921 1.00 52.42 ? 98 LEU B CG 1 ATOM 8308 C CD1 . LEU D 2 98 ? 7.003 50.340 -22.818 1.00 56.86 ? 98 LEU B CD1 1 ATOM 8309 C CD2 . LEU D 2 98 ? 8.456 48.379 -22.606 1.00 59.07 ? 98 LEU B CD2 1 ATOM 8310 N N . LEU D 2 99 ? 4.312 46.371 -20.157 1.00 44.25 ? 99 LEU B N 1 ATOM 8311 C CA . LEU D 2 99 ? 3.586 46.059 -18.967 1.00 43.25 ? 99 LEU B CA 1 ATOM 8312 C C . LEU D 2 99 ? 4.285 44.923 -18.165 1.00 43.78 ? 99 LEU B C 1 ATOM 8313 O O . LEU D 2 99 ? 4.408 44.977 -16.963 1.00 42.68 ? 99 LEU B O 1 ATOM 8314 C CB . LEU D 2 99 ? 2.186 45.653 -19.357 1.00 43.24 ? 99 LEU B CB 1 ATOM 8315 C CG . LEU D 2 99 ? 1.359 44.972 -18.290 1.00 48.76 ? 99 LEU B CG 1 ATOM 8316 C CD1 . LEU D 2 99 ? 0.993 46.049 -17.287 1.00 50.21 ? 99 LEU B CD1 1 ATOM 8317 C CD2 . LEU D 2 99 ? 0.103 44.288 -18.839 1.00 51.40 ? 99 LEU B CD2 1 ATOM 8318 N N . VAL D 2 100 ? 4.681 43.877 -18.849 1.00 45.40 ? 100 VAL B N 1 ATOM 8319 C CA . VAL D 2 100 ? 5.314 42.752 -18.201 1.00 45.52 ? 100 VAL B CA 1 ATOM 8320 C C . VAL D 2 100 ? 6.661 43.206 -17.611 1.00 46.17 ? 100 VAL B C 1 ATOM 8321 O O . VAL D 2 100 ? 6.993 42.868 -16.499 1.00 43.88 ? 100 VAL B O 1 ATOM 8322 C CB . VAL D 2 100 ? 5.489 41.603 -19.222 1.00 45.94 ? 100 VAL B CB 1 ATOM 8323 C CG1 . VAL D 2 100 ? 6.531 40.592 -18.782 1.00 48.54 ? 100 VAL B CG1 1 ATOM 8324 C CG2 . VAL D 2 100 ? 4.164 40.909 -19.445 1.00 46.13 ? 100 VAL B CG2 1 ATOM 8325 N N . LEU D 2 101 ? 7.447 43.928 -18.390 1.00 43.47 ? 101 LEU B N 1 ATOM 8326 C CA . LEU D 2 101 ? 8.716 44.493 -17.907 1.00 45.44 ? 101 LEU B CA 1 ATOM 8327 C C . LEU D 2 101 ? 8.545 45.351 -16.639 1.00 46.17 ? 101 LEU B C 1 ATOM 8328 O O . LEU D 2 101 ? 9.315 45.233 -15.704 1.00 51.48 ? 101 LEU B O 1 ATOM 8329 C CB . LEU D 2 101 ? 9.342 45.346 -19.015 1.00 43.58 ? 101 LEU B CB 1 ATOM 8330 C CG . LEU D 2 101 ? 10.520 44.863 -19.840 1.00 41.98 ? 101 LEU B CG 1 ATOM 8331 C CD1 . LEU D 2 101 ? 10.513 43.379 -20.120 1.00 45.05 ? 101 LEU B CD1 1 ATOM 8332 C CD2 . LEU D 2 101 ? 10.597 45.681 -21.106 1.00 39.46 ? 101 LEU B CD2 1 ATOM 8333 N N . MET D 2 102 ? 7.524 46.200 -16.614 1.00 45.57 ? 102 MET B N 1 ATOM 8334 C CA . MET D 2 102 ? 7.347 47.157 -15.543 1.00 47.09 ? 102 MET B CA 1 ATOM 8335 C C . MET D 2 102 ? 6.823 46.492 -14.297 1.00 48.36 ? 102 MET B C 1 ATOM 8336 O O . MET D 2 102 ? 7.253 46.802 -13.167 1.00 51.60 ? 102 MET B O 1 ATOM 8337 C CB . MET D 2 102 ? 6.355 48.250 -15.918 1.00 51.89 ? 102 MET B CB 1 ATOM 8338 C CG . MET D 2 102 ? 6.847 49.263 -16.933 1.00 58.08 ? 102 MET B CG 1 ATOM 8339 S SD . MET D 2 102 ? 5.465 50.291 -17.469 1.00 70.64 ? 102 MET B SD 1 ATOM 8340 C CE . MET D 2 102 ? 6.277 51.463 -18.513 1.00 75.46 ? 102 MET B CE 1 ATOM 8341 N N . GLU D 2 103 ? 5.866 45.603 -14.481 1.00 47.43 ? 103 GLU B N 1 ATOM 8342 C CA . GLU D 2 103 ? 5.296 44.927 -13.356 1.00 49.85 ? 103 GLU B CA 1 ATOM 8343 C C . GLU D 2 103 ? 6.269 43.913 -12.761 1.00 51.20 ? 103 GLU B C 1 ATOM 8344 O O . GLU D 2 103 ? 6.276 43.697 -11.547 1.00 54.47 ? 103 GLU B O 1 ATOM 8345 C CB . GLU D 2 103 ? 3.923 44.370 -13.686 1.00 51.26 ? 103 GLU B CB 1 ATOM 8346 C CG . GLU D 2 103 ? 2.893 45.501 -13.741 1.00 57.83 ? 103 GLU B CG 1 ATOM 8347 C CD . GLU D 2 103 ? 2.692 46.245 -12.405 1.00 63.02 ? 103 GLU B CD 1 ATOM 8348 O OE1 . GLU D 2 103 ? 2.724 45.581 -11.352 1.00 59.66 ? 103 GLU B OE1 1 ATOM 8349 O OE2 . GLU D 2 103 ? 2.464 47.487 -12.399 1.00 65.74 ? 103 GLU B OE2 1 ATOM 8350 N N . ASN D 2 104 ? 7.113 43.311 -13.584 1.00 46.19 ? 104 ASN B N 1 ATOM 8351 C CA . ASN D 2 104 ? 8.164 42.501 -13.035 1.00 44.88 ? 104 ASN B CA 1 ATOM 8352 C C . ASN D 2 104 ? 9.091 43.313 -12.108 1.00 46.91 ? 104 ASN B C 1 ATOM 8353 O O . ASN D 2 104 ? 9.462 42.832 -11.041 1.00 40.92 ? 104 ASN B O 1 ATOM 8354 C CB . ASN D 2 104 ? 8.946 41.785 -14.148 1.00 42.61 ? 104 ASN B CB 1 ATOM 8355 C CG . ASN D 2 104 ? 8.180 40.623 -14.701 1.00 43.76 ? 104 ASN B CG 1 ATOM 8356 O OD1 . ASN D 2 104 ? 7.131 40.271 -14.152 1.00 45.44 ? 104 ASN B OD1 1 ATOM 8357 N ND2 . ASN D 2 104 ? 8.657 40.030 -15.804 1.00 42.50 ? 104 ASN B ND2 1 ATOM 8358 N N . GLU D 2 105 ? 9.501 44.508 -12.539 1.00 48.37 ? 105 GLU B N 1 ATOM 8359 C CA . GLU D 2 105 ? 10.344 45.355 -11.715 1.00 49.34 ? 105 GLU B CA 1 ATOM 8360 C C . GLU D 2 105 ? 9.658 45.524 -10.367 1.00 51.62 ? 105 GLU B C 1 ATOM 8361 O O . GLU D 2 105 ? 10.299 45.399 -9.332 1.00 52.36 ? 105 GLU B O 1 ATOM 8362 C CB . GLU D 2 105 ? 10.540 46.715 -12.348 1.00 55.84 ? 105 GLU B CB 1 ATOM 8363 C CG . GLU D 2 105 ? 11.605 47.563 -11.701 1.00 61.73 ? 105 GLU B CG 1 ATOM 8364 C CD . GLU D 2 105 ? 11.481 49.048 -12.029 1.00 74.29 ? 105 GLU B CD 1 ATOM 8365 O OE1 . GLU D 2 105 ? 12.057 49.492 -13.048 1.00 81.49 ? 105 GLU B OE1 1 ATOM 8366 O OE2 . GLU D 2 105 ? 10.853 49.789 -11.243 1.00 76.31 ? 105 GLU B OE2 1 ATOM 8367 N N . ARG D 2 106 ? 8.359 45.792 -10.389 1.00 46.38 ? 106 ARG B N 1 ATOM 8368 C CA . ARG D 2 106 ? 7.630 46.142 -9.165 1.00 50.43 ? 106 ARG B CA 1 ATOM 8369 C C . ARG D 2 106 ? 7.399 44.970 -8.229 1.00 52.88 ? 106 ARG B C 1 ATOM 8370 O O . ARG D 2 106 ? 7.432 45.113 -7.005 1.00 49.66 ? 106 ARG B O 1 ATOM 8371 C CB . ARG D 2 106 ? 6.292 46.762 -9.485 1.00 52.42 ? 106 ARG B CB 1 ATOM 8372 C CG . ARG D 2 106 ? 6.426 48.040 -10.278 1.00 62.10 ? 106 ARG B CG 1 ATOM 8373 C CD . ARG D 2 106 ? 5.320 49.019 -9.972 1.00 76.65 ? 106 ARG B CD 1 ATOM 8374 N NE . ARG D 2 106 ? 5.558 49.751 -8.721 1.00 93.01 ? 106 ARG B NE 1 ATOM 8375 C CZ . ARG D 2 106 ? 4.630 50.478 -8.099 1.00 102.50 ? 106 ARG B CZ 1 ATOM 8376 N NH1 . ARG D 2 106 ? 3.409 50.549 -8.621 1.00 119.64 ? 106 ARG B NH1 1 ATOM 8377 N NH2 . ARG D 2 106 ? 4.900 51.126 -6.963 1.00 96.03 ? 106 ARG B NH2 1 ATOM 8378 N N . THR D 2 107 ? 7.176 43.808 -8.813 1.00 52.81 ? 107 THR B N 1 ATOM 8379 C CA . THR D 2 107 ? 7.003 42.605 -8.041 1.00 49.29 ? 107 THR B CA 1 ATOM 8380 C C . THR D 2 107 ? 8.284 42.318 -7.267 1.00 49.71 ? 107 THR B C 1 ATOM 8381 O O . THR D 2 107 ? 8.245 42.067 -6.077 1.00 57.38 ? 107 THR B O 1 ATOM 8382 C CB . THR D 2 107 ? 6.606 41.454 -8.966 1.00 48.56 ? 107 THR B CB 1 ATOM 8383 O OG1 . THR D 2 107 ? 5.270 41.699 -9.438 1.00 48.05 ? 107 THR B OG1 1 ATOM 8384 C CG2 . THR D 2 107 ? 6.668 40.111 -8.247 1.00 45.98 ? 107 THR B CG2 1 ATOM 8385 N N . LEU D 2 108 ? 9.419 42.423 -7.923 1.00 52.50 ? 108 LEU B N 1 ATOM 8386 C CA . LEU D 2 108 ? 10.717 42.208 -7.253 1.00 56.90 ? 108 LEU B CA 1 ATOM 8387 C C . LEU D 2 108 ? 11.010 43.258 -6.173 1.00 58.03 ? 108 LEU B C 1 ATOM 8388 O O . LEU D 2 108 ? 11.489 42.910 -5.097 1.00 54.49 ? 108 LEU B O 1 ATOM 8389 C CB . LEU D 2 108 ? 11.872 42.149 -8.271 1.00 55.83 ? 108 LEU B CB 1 ATOM 8390 C CG . LEU D 2 108 ? 11.807 41.004 -9.296 1.00 64.30 ? 108 LEU B CG 1 ATOM 8391 C CD1 . LEU D 2 108 ? 13.149 40.874 -10.005 1.00 65.16 ? 108 LEU B CD1 1 ATOM 8392 C CD2 . LEU D 2 108 ? 11.375 39.663 -8.695 1.00 62.97 ? 108 LEU B CD2 1 ATOM 8393 N N . ASP D 2 109 ? 10.695 44.524 -6.445 1.00 55.38 ? 109 ASP B N 1 ATOM 8394 C CA . ASP D 2 109 ? 10.827 45.574 -5.441 1.00 55.22 ? 109 ASP B CA 1 ATOM 8395 C C . ASP D 2 109 ? 9.849 45.331 -4.259 1.00 56.60 ? 109 ASP B C 1 ATOM 8396 O O . ASP D 2 109 ? 10.154 45.641 -3.121 1.00 51.40 ? 109 ASP B O 1 ATOM 8397 C CB . ASP D 2 109 ? 10.603 46.965 -6.052 1.00 55.19 ? 109 ASP B CB 1 ATOM 8398 C CG . ASP D 2 109 ? 11.756 47.409 -6.977 1.00 60.74 ? 109 ASP B CG 1 ATOM 8399 O OD1 . ASP D 2 109 ? 12.919 46.964 -6.788 1.00 59.57 ? 109 ASP B OD1 1 ATOM 8400 O OD2 . ASP D 2 109 ? 11.499 48.245 -7.876 1.00 65.85 ? 109 ASP B OD2 1 ATOM 8401 N N . PHE D 2 110 ? 8.695 44.733 -4.549 1.00 54.23 ? 110 PHE B N 1 ATOM 8402 C CA . PHE D 2 110 ? 7.704 44.428 -3.536 1.00 52.20 ? 110 PHE B CA 1 ATOM 8403 C C . PHE D 2 110 ? 8.252 43.375 -2.563 1.00 56.94 ? 110 PHE B C 1 ATOM 8404 O O . PHE D 2 110 ? 8.015 43.440 -1.358 1.00 57.26 ? 110 PHE B O 1 ATOM 8405 C CB . PHE D 2 110 ? 6.413 43.955 -4.236 1.00 48.36 ? 110 PHE B CB 1 ATOM 8406 C CG . PHE D 2 110 ? 5.308 43.472 -3.326 1.00 43.46 ? 110 PHE B CG 1 ATOM 8407 C CD1 . PHE D 2 110 ? 4.723 44.305 -2.378 1.00 45.37 ? 110 PHE B CD1 1 ATOM 8408 C CD2 . PHE D 2 110 ? 4.829 42.154 -3.443 1.00 44.58 ? 110 PHE B CD2 1 ATOM 8409 C CE1 . PHE D 2 110 ? 3.684 43.836 -1.539 1.00 45.02 ? 110 PHE B CE1 1 ATOM 8410 C CE2 . PHE D 2 110 ? 3.792 41.679 -2.615 1.00 47.22 ? 110 PHE B CE2 1 ATOM 8411 C CZ . PHE D 2 110 ? 3.210 42.524 -1.667 1.00 44.92 ? 110 PHE B CZ 1 ATOM 8412 N N . HIS D 2 111 ? 8.946 42.385 -3.090 1.00 57.65 ? 111 HIS B N 1 ATOM 8413 C CA . HIS D 2 111 ? 9.495 41.343 -2.249 1.00 59.72 ? 111 HIS B CA 1 ATOM 8414 C C . HIS D 2 111 ? 10.548 41.924 -1.317 1.00 60.83 ? 111 HIS B C 1 ATOM 8415 O O . HIS D 2 111 ? 10.465 41.757 -0.106 1.00 61.73 ? 111 HIS B O 1 ATOM 8416 C CB . HIS D 2 111 ? 10.040 40.195 -3.091 1.00 52.07 ? 111 HIS B CB 1 ATOM 8417 C CG . HIS D 2 111 ? 8.967 39.294 -3.580 1.00 55.75 ? 111 HIS B CG 1 ATOM 8418 N ND1 . HIS D 2 111 ? 8.892 38.836 -4.879 1.00 60.12 ? 111 HIS B ND1 1 ATOM 8419 C CD2 . HIS D 2 111 ? 7.870 38.821 -2.952 1.00 55.53 ? 111 HIS B CD2 1 ATOM 8420 C CE1 . HIS D 2 111 ? 7.807 38.091 -5.016 1.00 58.84 ? 111 HIS B CE1 1 ATOM 8421 N NE2 . HIS D 2 111 ? 7.180 38.055 -3.856 1.00 60.22 ? 111 HIS B NE2 1 ATOM 8422 N N . ASP D 2 112 ? 11.513 42.603 -1.910 1.00 62.23 ? 112 ASP B N 1 ATOM 8423 C CA . ASP D 2 112 ? 12.488 43.422 -1.200 1.00 69.46 ? 112 ASP B CA 1 ATOM 8424 C C . ASP D 2 112 ? 11.886 44.158 -0.009 1.00 67.27 ? 112 ASP B C 1 ATOM 8425 O O . ASP D 2 112 ? 12.375 44.041 1.113 1.00 65.35 ? 112 ASP B O 1 ATOM 8426 C CB . ASP D 2 112 ? 13.019 44.485 -2.161 1.00 74.97 ? 112 ASP B CB 1 ATOM 8427 C CG . ASP D 2 112 ? 14.488 44.573 -2.156 1.00 75.99 ? 112 ASP B CG 1 ATOM 8428 O OD1 . ASP D 2 112 ? 15.058 43.521 -2.456 1.00 88.65 ? 112 ASP B OD1 1 ATOM 8429 O OD2 . ASP D 2 112 ? 15.062 45.666 -1.889 1.00 79.69 ? 112 ASP B OD2 1 ATOM 8430 N N . SER D 2 113 ? 10.849 44.947 -0.291 1.00 61.68 ? 113 SER B N 1 ATOM 8431 C CA . SER D 2 113 ? 10.246 45.835 0.689 1.00 58.97 ? 113 SER B CA 1 ATOM 8432 C C . SER D 2 113 ? 9.622 45.005 1.808 1.00 60.31 ? 113 SER B C 1 ATOM 8433 O O . SER D 2 113 ? 9.684 45.397 2.977 1.00 60.41 ? 113 SER B O 1 ATOM 8434 C CB . SER D 2 113 ? 9.221 46.764 0.012 1.00 59.35 ? 113 SER B CB 1 ATOM 8435 O OG . SER D 2 113 ? 8.261 47.327 0.900 1.00 64.18 ? 113 SER B OG 1 ATOM 8436 N N . ASN D 2 114 ? 9.040 43.860 1.458 1.00 54.90 ? 114 ASN B N 1 ATOM 8437 C CA . ASN D 2 114 ? 8.431 42.973 2.456 1.00 60.68 ? 114 ASN B CA 1 ATOM 8438 C C . ASN D 2 114 ? 9.455 42.366 3.440 1.00 60.05 ? 114 ASN B C 1 ATOM 8439 O O . ASN D 2 114 ? 9.199 42.263 4.632 1.00 65.58 ? 114 ASN B O 1 ATOM 8440 C CB . ASN D 2 114 ? 7.653 41.841 1.783 1.00 58.26 ? 114 ASN B CB 1 ATOM 8441 C CG . ASN D 2 114 ? 6.354 42.311 1.138 1.00 65.39 ? 114 ASN B CG 1 ATOM 8442 O OD1 . ASN D 2 114 ? 5.838 43.403 1.407 1.00 49.90 ? 114 ASN B OD1 1 ATOM 8443 N ND2 . ASN D 2 114 ? 5.838 41.487 0.248 1.00 69.34 ? 114 ASN B ND2 1 ATOM 8444 N N . VAL D 2 115 ? 10.594 41.958 2.902 1.00 65.75 ? 115 VAL B N 1 ATOM 8445 C CA . VAL D 2 115 ? 11.674 41.358 3.658 1.00 69.30 ? 115 VAL B CA 1 ATOM 8446 C C . VAL D 2 115 ? 12.274 42.411 4.595 1.00 69.10 ? 115 VAL B C 1 ATOM 8447 O O . VAL D 2 115 ? 12.509 42.127 5.751 1.00 61.08 ? 115 VAL B O 1 ATOM 8448 C CB . VAL D 2 115 ? 12.769 40.781 2.715 1.00 75.61 ? 115 VAL B CB 1 ATOM 8449 C CG1 . VAL D 2 115 ? 14.068 40.486 3.456 1.00 72.83 ? 115 VAL B CG1 1 ATOM 8450 C CG2 . VAL D 2 115 ? 12.272 39.504 2.056 1.00 80.82 ? 115 VAL B CG2 1 ATOM 8451 N N . LYS D 2 116 ? 12.514 43.612 4.083 1.00 63.40 ? 116 LYS B N 1 ATOM 8452 C CA . LYS D 2 116 ? 13.050 44.697 4.884 1.00 67.77 ? 116 LYS B CA 1 ATOM 8453 C C . LYS D 2 116 ? 12.079 45.193 5.974 1.00 73.53 ? 116 LYS B C 1 ATOM 8454 O O . LYS D 2 116 ? 12.495 45.788 6.973 1.00 74.56 ? 116 LYS B O 1 ATOM 8455 C CB . LYS D 2 116 ? 13.451 45.836 3.965 1.00 68.13 ? 116 LYS B CB 1 ATOM 8456 C CG . LYS D 2 116 ? 14.071 47.013 4.662 1.00 80.26 ? 116 LYS B CG 1 ATOM 8457 C CD . LYS D 2 116 ? 14.882 47.893 3.706 1.00 90.94 ? 116 LYS B CD 1 ATOM 8458 C CE . LYS D 2 116 ? 16.215 48.332 4.324 1.00 94.79 ? 116 LYS B CE 1 ATOM 8459 N NZ . LYS D 2 116 ? 16.020 49.207 5.509 1.00 91.74 ? 116 LYS B NZ 1 ATOM 8460 N N . ASN D 2 117 ? 10.792 44.938 5.797 1.00 68.04 ? 117 ASN B N 1 ATOM 8461 C CA . ASN D 2 117 ? 9.857 45.226 6.850 1.00 65.17 ? 117 ASN B CA 1 ATOM 8462 C C . ASN D 2 117 ? 9.844 44.134 7.917 1.00 63.40 ? 117 ASN B C 1 ATOM 8463 O O . ASN D 2 117 ? 9.580 44.433 9.094 1.00 60.88 ? 117 ASN B O 1 ATOM 8464 C CB . ASN D 2 117 ? 8.443 45.390 6.291 1.00 69.16 ? 117 ASN B CB 1 ATOM 8465 C CG . ASN D 2 117 ? 8.267 46.659 5.452 1.00 68.36 ? 117 ASN B CG 1 ATOM 8466 O OD1 . ASN D 2 117 ? 9.051 47.609 5.520 1.00 72.56 ? 117 ASN B OD1 1 ATOM 8467 N ND2 . ASN D 2 117 ? 7.212 46.667 4.650 1.00 61.48 ? 117 ASN B ND2 1 ATOM 8468 N N . LEU D 2 118 ? 10.065 42.874 7.522 1.00 58.74 ? 118 LEU B N 1 ATOM 8469 C CA . LEU D 2 118 ? 10.239 41.811 8.518 1.00 64.38 ? 118 LEU B CA 1 ATOM 8470 C C . LEU D 2 118 ? 11.413 42.131 9.452 1.00 59.65 ? 118 LEU B C 1 ATOM 8471 O O . LEU D 2 118 ? 11.260 42.196 10.670 1.00 57.38 ? 118 LEU B O 1 ATOM 8472 C CB . LEU D 2 118 ? 10.525 40.457 7.896 1.00 68.35 ? 118 LEU B CB 1 ATOM 8473 C CG . LEU D 2 118 ? 9.411 39.438 7.874 1.00 76.30 ? 118 LEU B CG 1 ATOM 8474 C CD1 . LEU D 2 118 ? 10.039 38.058 7.735 1.00 76.53 ? 118 LEU B CD1 1 ATOM 8475 C CD2 . LEU D 2 118 ? 8.518 39.474 9.103 1.00 80.64 ? 118 LEU B CD2 1 ATOM 8476 N N . TYR D 2 119 ? 12.569 42.314 8.825 1.00 58.50 ? 119 TYR B N 1 ATOM 8477 C CA . TYR D 2 119 ? 13.784 42.683 9.475 1.00 62.13 ? 119 TYR B CA 1 ATOM 8478 C C . TYR D 2 119 ? 13.566 43.821 10.473 1.00 63.17 ? 119 TYR B C 1 ATOM 8479 O O . TYR D 2 119 ? 14.093 43.774 11.563 1.00 71.40 ? 119 TYR B O 1 ATOM 8480 C CB . TYR D 2 119 ? 14.808 43.119 8.427 1.00 58.19 ? 119 TYR B CB 1 ATOM 8481 C CG . TYR D 2 119 ? 16.144 43.404 9.001 1.00 54.61 ? 119 TYR B CG 1 ATOM 8482 C CD1 . TYR D 2 119 ? 17.039 42.379 9.207 1.00 56.78 ? 119 TYR B CD1 1 ATOM 8483 C CD2 . TYR D 2 119 ? 16.515 44.700 9.376 1.00 57.48 ? 119 TYR B CD2 1 ATOM 8484 C CE1 . TYR D 2 119 ? 18.293 42.629 9.745 1.00 60.59 ? 119 TYR B CE1 1 ATOM 8485 C CE2 . TYR D 2 119 ? 17.765 44.956 9.918 1.00 61.66 ? 119 TYR B CE2 1 ATOM 8486 C CZ . TYR D 2 119 ? 18.639 43.913 10.108 1.00 60.10 ? 119 TYR B CZ 1 ATOM 8487 O OH . TYR D 2 119 ? 19.866 44.135 10.647 1.00 72.37 ? 119 TYR B OH 1 ATOM 8488 N N . ASP D 2 120 ? 12.795 44.824 10.102 1.00 62.28 ? 120 ASP B N 1 ATOM 8489 C CA . ASP D 2 120 ? 12.563 45.984 10.981 1.00 64.82 ? 120 ASP B CA 1 ATOM 8490 C C . ASP D 2 120 ? 11.678 45.673 12.181 1.00 66.56 ? 120 ASP B C 1 ATOM 8491 O O . ASP D 2 120 ? 11.963 46.110 13.277 1.00 66.48 ? 120 ASP B O 1 ATOM 8492 C CB . ASP D 2 120 ? 12.063 47.175 10.188 1.00 66.51 ? 120 ASP B CB 1 ATOM 8493 C CG . ASP D 2 120 ? 13.211 47.846 9.365 1.00 77.93 ? 120 ASP B CG 1 ATOM 8494 O OD1 . ASP D 2 120 ? 14.399 47.583 9.641 1.00 82.81 ? 120 ASP B OD1 1 ATOM 8495 O OD2 . ASP D 2 120 ? 12.951 48.590 8.398 1.00 82.84 ? 120 ASP B OD2 1 ATOM 8496 N N . LYS D 2 121 ? 10.669 44.843 12.002 1.00 62.96 ? 121 LYS B N 1 ATOM 8497 C CA . LYS D 2 121 ? 9.796 44.469 13.119 1.00 69.91 ? 121 LYS B CA 1 ATOM 8498 C C . LYS D 2 121 ? 10.498 43.541 14.156 1.00 76.44 ? 121 LYS B C 1 ATOM 8499 O O . LYS D 2 121 ? 10.167 43.542 15.354 1.00 77.88 ? 121 LYS B O 1 ATOM 8500 C CB . LYS D 2 121 ? 8.448 43.978 12.579 1.00 75.42 ? 121 LYS B CB 1 ATOM 8501 C CG . LYS D 2 121 ? 7.939 42.591 12.958 1.00 83.49 ? 121 LYS B CG 1 ATOM 8502 C CD . LYS D 2 121 ? 6.452 42.420 12.574 1.00 88.56 ? 121 LYS B CD 1 ATOM 8503 C CE . LYS D 2 121 ? 6.055 43.036 11.220 1.00 95.63 ? 121 LYS B CE 1 ATOM 8504 N NZ . LYS D 2 121 ? 5.798 42.049 10.132 1.00 101.00 ? 121 LYS B NZ 1 ATOM 8505 N N . VAL D 2 122 ? 11.508 42.804 13.705 1.00 76.50 ? 122 VAL B N 1 ATOM 8506 C CA . VAL D 2 122 ? 12.423 42.111 14.631 1.00 71.54 ? 122 VAL B CA 1 ATOM 8507 C C . VAL D 2 122 ? 13.389 43.094 15.303 1.00 68.92 ? 122 VAL B C 1 ATOM 8508 O O . VAL D 2 122 ? 13.406 43.190 16.541 1.00 70.31 ? 122 VAL B O 1 ATOM 8509 C CB . VAL D 2 122 ? 13.189 40.991 13.939 1.00 64.50 ? 122 VAL B CB 1 ATOM 8510 C CG1 . VAL D 2 122 ? 14.395 40.553 14.763 1.00 63.24 ? 122 VAL B CG1 1 ATOM 8511 C CG2 . VAL D 2 122 ? 12.256 39.821 13.705 1.00 64.18 ? 122 VAL B CG2 1 ATOM 8512 N N . ARG D 2 123 ? 14.158 43.829 14.504 1.00 59.55 ? 123 ARG B N 1 ATOM 8513 C CA . ARG D 2 123 ? 14.990 44.940 15.021 1.00 63.58 ? 123 ARG B CA 1 ATOM 8514 C C . ARG D 2 123 ? 14.286 45.732 16.148 1.00 67.42 ? 123 ARG B C 1 ATOM 8515 O O . ARG D 2 123 ? 14.901 46.045 17.156 1.00 71.36 ? 123 ARG B O 1 ATOM 8516 C CB . ARG D 2 123 ? 15.416 45.857 13.872 1.00 59.82 ? 123 ARG B CB 1 ATOM 8517 C CG . ARG D 2 123 ? 16.177 47.129 14.209 1.00 65.02 ? 123 ARG B CG 1 ATOM 8518 C CD . ARG D 2 123 ? 16.173 48.100 13.014 1.00 75.85 ? 123 ARG B CD 1 ATOM 8519 N NE . ARG D 2 123 ? 15.808 49.488 13.333 1.00 93.24 ? 123 ARG B NE 1 ATOM 8520 C CZ . ARG D 2 123 ? 14.563 49.967 13.417 1.00 106.79 ? 123 ARG B CZ 1 ATOM 8521 N NH1 . ARG D 2 123 ? 13.521 49.177 13.197 1.00 117.38 ? 123 ARG B NH1 1 ATOM 8522 N NH2 . ARG D 2 123 ? 14.356 51.246 13.737 1.00 110.63 ? 123 ARG B NH2 1 ATOM 8523 N N . LEU D 2 124 ? 12.993 46.014 15.998 1.00 73.76 ? 124 LEU B N 1 ATOM 8524 C CA . LEU D 2 124 ? 12.220 46.741 17.029 1.00 73.97 ? 124 LEU B CA 1 ATOM 8525 C C . LEU D 2 124 ? 11.937 45.999 18.350 1.00 70.73 ? 124 LEU B C 1 ATOM 8526 O O . LEU D 2 124 ? 11.869 46.627 19.391 1.00 66.95 ? 124 LEU B O 1 ATOM 8527 C CB . LEU D 2 124 ? 10.883 47.206 16.459 1.00 82.30 ? 124 LEU B CB 1 ATOM 8528 C CG . LEU D 2 124 ? 10.891 48.426 15.522 1.00 92.18 ? 124 LEU B CG 1 ATOM 8529 C CD1 . LEU D 2 124 ? 9.451 48.937 15.375 1.00 90.83 ? 124 LEU B CD1 1 ATOM 8530 C CD2 . LEU D 2 124 ? 11.845 49.533 15.999 1.00 89.50 ? 124 LEU B CD2 1 ATOM 8531 N N . GLN D 2 125 ? 11.726 44.689 18.293 1.00 64.87 ? 125 GLN B N 1 ATOM 8532 C CA . GLN D 2 125 ? 11.527 43.865 19.483 1.00 66.04 ? 125 GLN B CA 1 ATOM 8533 C C . GLN D 2 125 ? 12.812 43.693 20.293 1.00 64.84 ? 125 GLN B C 1 ATOM 8534 O O . GLN D 2 125 ? 12.750 43.650 21.533 1.00 69.33 ? 125 GLN B O 1 ATOM 8535 C CB . GLN D 2 125 ? 11.053 42.459 19.107 1.00 68.68 ? 125 GLN B CB 1 ATOM 8536 C CG . GLN D 2 125 ? 9.628 42.344 18.615 1.00 68.96 ? 125 GLN B CG 1 ATOM 8537 C CD . GLN D 2 125 ? 9.173 40.888 18.585 1.00 72.82 ? 125 GLN B CD 1 ATOM 8538 O OE1 . GLN D 2 125 ? 9.449 40.166 17.618 1.00 68.68 ? 125 GLN B OE1 1 ATOM 8539 N NE2 . GLN D 2 125 ? 8.490 40.457 19.643 1.00 64.70 ? 125 GLN B NE2 1 ATOM 8540 N N . LEU D 2 126 ? 13.937 43.524 19.580 1.00 57.66 ? 126 LEU B N 1 ATOM 8541 C CA . LEU D 2 126 ? 15.255 43.288 20.158 1.00 57.54 ? 126 LEU B CA 1 ATOM 8542 C C . LEU D 2 126 ? 16.007 44.480 20.696 1.00 61.32 ? 126 LEU B C 1 ATOM 8543 O O . LEU D 2 126 ? 16.656 44.349 21.714 1.00 63.81 ? 126 LEU B O 1 ATOM 8544 C CB . LEU D 2 126 ? 16.160 42.584 19.135 1.00 56.30 ? 126 LEU B CB 1 ATOM 8545 C CG . LEU D 2 126 ? 15.637 41.247 18.605 1.00 55.40 ? 126 LEU B CG 1 ATOM 8546 C CD1 . LEU D 2 126 ? 16.751 40.429 17.977 1.00 58.07 ? 126 LEU B CD1 1 ATOM 8547 C CD2 . LEU D 2 126 ? 14.951 40.427 19.679 1.00 56.33 ? 126 LEU B CD2 1 ATOM 8548 N N . ARG D 2 127 ? 15.972 45.607 19.994 1.00 70.99 ? 127 ARG B N 1 ATOM 8549 C CA . ARG D 2 127 ? 16.773 46.821 20.326 1.00 74.23 ? 127 ARG B CA 1 ATOM 8550 C C . ARG D 2 127 ? 18.211 46.456 20.684 1.00 69.97 ? 127 ARG B C 1 ATOM 8551 O O . ARG D 2 127 ? 18.873 45.808 19.887 1.00 68.99 ? 127 ARG B O 1 ATOM 8552 C CB . ARG D 2 127 ? 16.131 47.694 21.409 1.00 87.75 ? 127 ARG B CB 1 ATOM 8553 C CG . ARG D 2 127 ? 15.031 48.650 20.966 1.00 94.07 ? 127 ARG B CG 1 ATOM 8554 C CD . ARG D 2 127 ? 14.500 49.302 22.213 1.00 106.66 ? 127 ARG B CD 1 ATOM 8555 N NE . ARG D 2 127 ? 13.515 48.429 22.853 1.00 116.66 ? 127 ARG B NE 1 ATOM 8556 C CZ . ARG D 2 127 ? 13.231 48.419 24.156 1.00 119.66 ? 127 ARG B CZ 1 ATOM 8557 N NH1 . ARG D 2 127 ? 13.854 49.250 24.993 1.00 120.30 ? 127 ARG B NH1 1 ATOM 8558 N NH2 . ARG D 2 127 ? 12.318 47.569 24.623 1.00 112.49 ? 127 ARG B NH2 1 ATOM 8559 N N . ASP D 2 128 ? 18.684 46.822 21.885 1.00 66.81 ? 128 ASP B N 1 ATOM 8560 C CA . ASP D 2 128 ? 20.086 46.626 22.258 1.00 63.71 ? 128 ASP B CA 1 ATOM 8561 C C . ASP D 2 128 ? 20.390 45.265 22.890 1.00 63.03 ? 128 ASP B C 1 ATOM 8562 O O . ASP D 2 128 ? 21.566 44.951 23.121 1.00 61.25 ? 128 ASP B O 1 ATOM 8563 C CB . ASP D 2 128 ? 20.594 47.759 23.167 1.00 67.89 ? 128 ASP B CB 1 ATOM 8564 C CG . ASP D 2 128 ? 19.744 47.958 24.412 1.00 71.34 ? 128 ASP B CG 1 ATOM 8565 O OD1 . ASP D 2 128 ? 18.850 47.131 24.709 1.00 72.07 ? 128 ASP B OD1 1 ATOM 8566 O OD2 . ASP D 2 128 ? 19.980 48.964 25.101 1.00 78.38 ? 128 ASP B OD2 1 ATOM 8567 N N . ASN D 2 129 ? 19.356 44.452 23.157 1.00 59.33 ? 129 ASN B N 1 ATOM 8568 C CA . ASN D 2 129 ? 19.561 43.042 23.574 1.00 60.98 ? 129 ASN B CA 1 ATOM 8569 C C . ASN D 2 129 ? 20.249 42.205 22.484 1.00 60.54 ? 129 ASN B C 1 ATOM 8570 O O . ASN D 2 129 ? 20.597 41.063 22.714 1.00 56.28 ? 129 ASN B O 1 ATOM 8571 C CB . ASN D 2 129 ? 18.252 42.329 23.982 1.00 60.26 ? 129 ASN B CB 1 ATOM 8572 C CG . ASN D 2 129 ? 17.707 42.795 25.340 1.00 59.75 ? 129 ASN B CG 1 ATOM 8573 O OD1 . ASN D 2 129 ? 18.211 43.736 25.921 1.00 61.07 ? 129 ASN B OD1 1 ATOM 8574 N ND2 . ASN D 2 129 ? 16.649 42.149 25.810 1.00 56.05 ? 129 ASN B ND2 1 ATOM 8575 N N . ALA D 2 130 ? 20.392 42.762 21.288 1.00 62.26 ? 130 ALA B N 1 ATOM 8576 C CA . ALA D 2 130 ? 21.151 42.114 20.229 1.00 64.19 ? 130 ALA B CA 1 ATOM 8577 C C . ALA D 2 130 ? 21.874 43.121 19.332 1.00 61.71 ? 130 ALA B C 1 ATOM 8578 O O . ALA D 2 130 ? 21.597 44.329 19.339 1.00 60.80 ? 130 ALA B O 1 ATOM 8579 C CB . ALA D 2 130 ? 20.250 41.179 19.414 1.00 65.31 ? 130 ALA B CB 1 ATOM 8580 N N . LYS D 2 131 ? 22.792 42.571 18.555 1.00 58.89 ? 131 LYS B N 1 ATOM 8581 C CA . LYS D 2 131 ? 23.698 43.307 17.689 1.00 65.53 ? 131 LYS B CA 1 ATOM 8582 C C . LYS D 2 131 ? 23.337 43.060 16.216 1.00 65.00 ? 131 LYS B C 1 ATOM 8583 O O . LYS D 2 131 ? 23.384 41.911 15.729 1.00 64.13 ? 131 LYS B O 1 ATOM 8584 C CB . LYS D 2 131 ? 25.085 42.761 17.958 1.00 67.23 ? 131 LYS B CB 1 ATOM 8585 C CG . LYS D 2 131 ? 26.259 43.342 17.197 1.00 73.88 ? 131 LYS B CG 1 ATOM 8586 C CD . LYS D 2 131 ? 27.462 42.413 17.409 1.00 79.08 ? 131 LYS B CD 1 ATOM 8587 C CE . LYS D 2 131 ? 28.812 43.113 17.388 1.00 88.32 ? 131 LYS B CE 1 ATOM 8588 N NZ . LYS D 2 131 ? 29.486 43.018 16.064 1.00 87.34 ? 131 LYS B NZ 1 ATOM 8589 N N . GLU D 2 132 ? 23.000 44.134 15.506 1.00 70.12 ? 132 GLU B N 1 ATOM 8590 C CA . GLU D 2 132 ? 22.784 44.061 14.050 1.00 75.29 ? 132 GLU B CA 1 ATOM 8591 C C . GLU D 2 132 ? 24.076 43.714 13.309 1.00 73.98 ? 132 GLU B C 1 ATOM 8592 O O . GLU D 2 132 ? 24.937 44.559 13.145 1.00 68.90 ? 132 GLU B O 1 ATOM 8593 C CB . GLU D 2 132 ? 22.242 45.381 13.497 1.00 74.69 ? 132 GLU B CB 1 ATOM 8594 C CG . GLU D 2 132 ? 20.791 45.664 13.832 1.00 75.21 ? 132 GLU B CG 1 ATOM 8595 C CD . GLU D 2 132 ? 20.210 46.767 12.963 1.00 82.36 ? 132 GLU B CD 1 ATOM 8596 O OE1 . GLU D 2 132 ? 19.846 46.466 11.811 1.00 78.69 ? 132 GLU B OE1 1 ATOM 8597 O OE2 . GLU D 2 132 ? 20.111 47.922 13.439 1.00 84.56 ? 132 GLU B OE2 1 ATOM 8598 N N . LEU D 2 133 ? 24.192 42.460 12.873 1.00 72.48 ? 133 LEU B N 1 ATOM 8599 C CA . LEU D 2 133 ? 25.372 42.013 12.148 1.00 74.99 ? 133 LEU B CA 1 ATOM 8600 C C . LEU D 2 133 ? 25.496 42.678 10.772 1.00 81.08 ? 133 LEU B C 1 ATOM 8601 O O . LEU D 2 133 ? 26.594 42.739 10.219 1.00 73.82 ? 133 LEU B O 1 ATOM 8602 C CB . LEU D 2 133 ? 25.395 40.482 12.011 1.00 77.52 ? 133 LEU B CB 1 ATOM 8603 C CG . LEU D 2 133 ? 25.897 39.672 13.218 1.00 82.81 ? 133 LEU B CG 1 ATOM 8604 C CD1 . LEU D 2 133 ? 25.587 38.200 13.023 1.00 82.93 ? 133 LEU B CD1 1 ATOM 8605 C CD2 . LEU D 2 133 ? 27.397 39.878 13.444 1.00 91.39 ? 133 LEU B CD2 1 ATOM 8606 N N . GLY D 2 134 ? 24.373 43.154 10.223 1.00 85.94 ? 134 GLY B N 1 ATOM 8607 C CA . GLY D 2 134 ? 24.369 43.856 8.930 1.00 82.51 ? 134 GLY B CA 1 ATOM 8608 C C . GLY D 2 134 ? 24.338 42.950 7.700 1.00 77.16 ? 134 GLY B C 1 ATOM 8609 O O . GLY D 2 134 ? 24.708 43.364 6.600 1.00 64.65 ? 134 GLY B O 1 ATOM 8610 N N . ASN D 2 135 ? 23.909 41.709 7.898 1.00 73.35 ? 135 ASN B N 1 ATOM 8611 C CA . ASN D 2 135 ? 23.754 40.748 6.805 1.00 69.52 ? 135 ASN B CA 1 ATOM 8612 C C . ASN D 2 135 ? 22.372 40.094 6.864 1.00 68.47 ? 135 ASN B C 1 ATOM 8613 O O . ASN D 2 135 ? 22.154 38.984 6.367 1.00 64.13 ? 135 ASN B O 1 ATOM 8614 C CB . ASN D 2 135 ? 24.842 39.681 6.888 1.00 70.65 ? 135 ASN B CB 1 ATOM 8615 C CG . ASN D 2 135 ? 24.745 38.823 8.159 1.00 77.08 ? 135 ASN B CG 1 ATOM 8616 O OD1 . ASN D 2 135 ? 24.024 39.151 9.111 1.00 72.37 ? 135 ASN B OD1 1 ATOM 8617 N ND2 . ASN D 2 135 ? 25.522 37.735 8.193 1.00 70.17 ? 135 ASN B ND2 1 ATOM 8618 N N . GLY D 2 136 ? 21.446 40.787 7.521 1.00 65.83 ? 136 GLY B N 1 ATOM 8619 C CA . GLY D 2 136 ? 20.139 40.233 7.817 1.00 60.66 ? 136 GLY B CA 1 ATOM 8620 C C . GLY D 2 136 ? 20.057 39.487 9.140 1.00 60.63 ? 136 GLY B C 1 ATOM 8621 O O . GLY D 2 136 ? 18.970 39.124 9.564 1.00 62.41 ? 136 GLY B O 1 ATOM 8622 N N . CYS D 2 137 ? 21.191 39.269 9.807 1.00 66.54 ? 137 CYS B N 1 ATOM 8623 C CA . CYS D 2 137 ? 21.194 38.540 11.082 1.00 65.26 ? 137 CYS B CA 1 ATOM 8624 C C . CYS D 2 137 ? 21.365 39.402 12.330 1.00 63.20 ? 137 CYS B C 1 ATOM 8625 O O . CYS D 2 137 ? 21.930 40.499 12.294 1.00 59.99 ? 137 CYS B O 1 ATOM 8626 C CB . CYS D 2 137 ? 22.255 37.479 11.070 1.00 67.23 ? 137 CYS B CB 1 ATOM 8627 S SG . CYS D 2 137 ? 21.975 36.292 9.749 1.00 68.44 ? 137 CYS B SG 1 ATOM 8628 N N . PHE D 2 138 ? 20.786 38.901 13.419 1.00 63.65 ? 138 PHE B N 1 ATOM 8629 C CA . PHE D 2 138 ? 20.882 39.515 14.738 1.00 62.29 ? 138 PHE B CA 1 ATOM 8630 C C . PHE D 2 138 ? 21.670 38.605 15.647 1.00 63.14 ? 138 PHE B C 1 ATOM 8631 O O . PHE D 2 138 ? 21.322 37.427 15.773 1.00 59.36 ? 138 PHE B O 1 ATOM 8632 C CB . PHE D 2 138 ? 19.485 39.695 15.351 1.00 65.51 ? 138 PHE B CB 1 ATOM 8633 C CG . PHE D 2 138 ? 18.696 40.743 14.695 1.00 60.62 ? 138 PHE B CG 1 ATOM 8634 C CD1 . PHE D 2 138 ? 18.860 42.062 15.064 1.00 58.55 ? 138 PHE B CD1 1 ATOM 8635 C CD2 . PHE D 2 138 ? 17.853 40.421 13.663 1.00 60.42 ? 138 PHE B CD2 1 ATOM 8636 C CE1 . PHE D 2 138 ? 18.168 43.053 14.415 1.00 63.33 ? 138 PHE B CE1 1 ATOM 8637 C CE2 . PHE D 2 138 ? 17.151 41.408 13.008 1.00 62.56 ? 138 PHE B CE2 1 ATOM 8638 C CZ . PHE D 2 138 ? 17.307 42.730 13.381 1.00 61.65 ? 138 PHE B CZ 1 ATOM 8639 N N . GLU D 2 139 ? 22.726 39.137 16.265 1.00 66.89 ? 139 GLU B N 1 ATOM 8640 C CA . GLU D 2 139 ? 23.519 38.364 17.224 1.00 68.66 ? 139 GLU B CA 1 ATOM 8641 C C . GLU D 2 139 ? 23.129 38.738 18.643 1.00 66.19 ? 139 GLU B C 1 ATOM 8642 O O . GLU D 2 139 ? 23.367 39.865 19.114 1.00 59.10 ? 139 GLU B O 1 ATOM 8643 C CB . GLU D 2 139 ? 25.006 38.574 17.015 1.00 81.20 ? 139 GLU B CB 1 ATOM 8644 C CG . GLU D 2 139 ? 25.850 37.491 17.684 1.00 92.31 ? 139 GLU B CG 1 ATOM 8645 C CD . GLU D 2 139 ? 27.346 37.745 17.600 1.00 91.11 ? 139 GLU B CD 1 ATOM 8646 O OE1 . GLU D 2 139 ? 27.760 38.913 17.665 1.00 86.11 ? 139 GLU B OE1 1 ATOM 8647 O OE2 . GLU D 2 139 ? 28.107 36.762 17.478 1.00 96.94 ? 139 GLU B OE2 1 ATOM 8648 N N . PHE D 2 140 ? 22.491 37.795 19.313 1.00 63.85 ? 140 PHE B N 1 ATOM 8649 C CA . PHE D 2 140 ? 22.010 38.041 20.658 1.00 68.93 ? 140 PHE B CA 1 ATOM 8650 C C . PHE D 2 140 ? 23.167 38.268 21.668 1.00 69.08 ? 140 PHE B C 1 ATOM 8651 O O . PHE D 2 140 ? 24.223 37.632 21.606 1.00 66.91 ? 140 PHE B O 1 ATOM 8652 C CB . PHE D 2 140 ? 21.157 36.871 21.126 1.00 67.33 ? 140 PHE B CB 1 ATOM 8653 C CG . PHE D 2 140 ? 19.778 36.824 20.535 1.00 66.93 ? 140 PHE B CG 1 ATOM 8654 C CD1 . PHE D 2 140 ? 19.512 36.038 19.416 1.00 71.19 ? 140 PHE B CD1 1 ATOM 8655 C CD2 . PHE D 2 140 ? 18.740 37.487 21.139 1.00 62.12 ? 140 PHE B CD2 1 ATOM 8656 C CE1 . PHE D 2 140 ? 18.240 35.946 18.898 1.00 68.69 ? 140 PHE B CE1 1 ATOM 8657 C CE2 . PHE D 2 140 ? 17.474 37.393 20.634 1.00 68.15 ? 140 PHE B CE2 1 ATOM 8658 C CZ . PHE D 2 140 ? 17.221 36.635 19.506 1.00 67.79 ? 140 PHE B CZ 1 ATOM 8659 N N . TYR D 2 141 ? 22.933 39.186 22.599 1.00 68.05 ? 141 TYR B N 1 ATOM 8660 C CA . TYR D 2 141 ? 23.826 39.417 23.718 1.00 68.83 ? 141 TYR B CA 1 ATOM 8661 C C . TYR D 2 141 ? 23.413 38.574 24.918 1.00 68.11 ? 141 TYR B C 1 ATOM 8662 O O . TYR D 2 141 ? 23.837 38.818 26.044 1.00 78.60 ? 141 TYR B O 1 ATOM 8663 C CB . TYR D 2 141 ? 23.792 40.877 24.125 1.00 67.78 ? 141 TYR B CB 1 ATOM 8664 C CG . TYR D 2 141 ? 24.462 41.825 23.166 1.00 67.11 ? 141 TYR B CG 1 ATOM 8665 C CD1 . TYR D 2 141 ? 25.677 41.512 22.564 1.00 65.26 ? 141 TYR B CD1 1 ATOM 8666 C CD2 . TYR D 2 141 ? 23.889 43.068 22.892 1.00 67.80 ? 141 TYR B CD2 1 ATOM 8667 C CE1 . TYR D 2 141 ? 26.294 42.405 21.702 1.00 69.05 ? 141 TYR B CE1 1 ATOM 8668 C CE2 . TYR D 2 141 ? 24.491 43.966 22.018 1.00 62.67 ? 141 TYR B CE2 1 ATOM 8669 C CZ . TYR D 2 141 ? 25.698 43.637 21.431 1.00 65.22 ? 141 TYR B CZ 1 ATOM 8670 O OH . TYR D 2 141 ? 26.334 44.500 20.572 1.00 54.57 ? 141 TYR B OH 1 ATOM 8671 N N . HIS D 2 142 ? 22.615 37.556 24.655 1.00 63.83 ? 142 HIS B N 1 ATOM 8672 C CA . HIS D 2 142 ? 22.139 36.667 25.676 1.00 61.88 ? 142 HIS B CA 1 ATOM 8673 C C . HIS D 2 142 ? 21.738 35.341 25.045 1.00 68.98 ? 142 HIS B C 1 ATOM 8674 O O . HIS D 2 142 ? 21.868 35.131 23.833 1.00 70.18 ? 142 HIS B O 1 ATOM 8675 C CB . HIS D 2 142 ? 20.981 37.293 26.443 1.00 60.58 ? 142 HIS B CB 1 ATOM 8676 C CG . HIS D 2 142 ? 19.671 37.238 25.729 1.00 57.96 ? 142 HIS B CG 1 ATOM 8677 N ND1 . HIS D 2 142 ? 19.136 38.340 25.094 1.00 57.73 ? 142 HIS B ND1 1 ATOM 8678 C CD2 . HIS D 2 142 ? 18.780 36.236 25.571 1.00 54.04 ? 142 HIS B CD2 1 ATOM 8679 C CE1 . HIS D 2 142 ? 17.978 38.012 24.554 1.00 59.52 ? 142 HIS B CE1 1 ATOM 8680 N NE2 . HIS D 2 142 ? 17.733 36.744 24.839 1.00 58.19 ? 142 HIS B NE2 1 ATOM 8681 N N . LYS D 2 143 ? 21.290 34.431 25.892 1.00 73.28 ? 143 LYS B N 1 ATOM 8682 C CA . LYS D 2 143 ? 21.065 33.065 25.478 1.00 77.43 ? 143 LYS B CA 1 ATOM 8683 C C . LYS D 2 143 ? 19.570 32.897 25.184 1.00 78.34 ? 143 LYS B C 1 ATOM 8684 O O . LYS D 2 143 ? 18.697 33.133 26.049 1.00 75.93 ? 143 LYS B O 1 ATOM 8685 C CB . LYS D 2 143 ? 21.557 32.103 26.569 1.00 87.37 ? 143 LYS B CB 1 ATOM 8686 C CG . LYS D 2 143 ? 22.400 30.886 26.125 1.00 93.31 ? 143 LYS B CG 1 ATOM 8687 C CD . LYS D 2 143 ? 21.687 29.528 26.260 1.00 104.21 ? 143 LYS B CD 1 ATOM 8688 C CE . LYS D 2 143 ? 20.853 29.392 27.540 1.00 102.11 ? 143 LYS B CE 1 ATOM 8689 N NZ . LYS D 2 143 ? 19.416 29.046 27.295 1.00 91.59 ? 143 LYS B NZ 1 ATOM 8690 N N . CYS D 2 144 ? 19.289 32.501 23.942 1.00 80.93 ? 144 CYS B N 1 ATOM 8691 C CA . CYS D 2 144 ? 17.926 32.476 23.401 1.00 81.53 ? 144 CYS B CA 1 ATOM 8692 C C . CYS D 2 144 ? 17.576 31.054 22.968 1.00 85.16 ? 144 CYS B C 1 ATOM 8693 O O . CYS D 2 144 ? 17.934 30.596 21.874 1.00 82.82 ? 144 CYS B O 1 ATOM 8694 C CB . CYS D 2 144 ? 17.822 33.486 22.246 1.00 81.73 ? 144 CYS B CB 1 ATOM 8695 S SG . CYS D 2 144 ? 16.181 33.938 21.630 1.00 77.27 ? 144 CYS B SG 1 ATOM 8696 N N . ASP D 2 145 ? 16.882 30.352 23.855 1.00 86.26 ? 145 ASP B N 1 ATOM 8697 C CA . ASP D 2 145 ? 16.539 28.959 23.613 1.00 91.70 ? 145 ASP B CA 1 ATOM 8698 C C . ASP D 2 145 ? 15.429 28.888 22.544 1.00 90.20 ? 145 ASP B C 1 ATOM 8699 O O . ASP D 2 145 ? 15.035 29.912 21.992 1.00 78.60 ? 145 ASP B O 1 ATOM 8700 C CB . ASP D 2 145 ? 16.181 28.233 24.934 1.00 95.09 ? 145 ASP B CB 1 ATOM 8701 C CG . ASP D 2 145 ? 14.894 28.733 25.580 1.00 103.31 ? 145 ASP B CG 1 ATOM 8702 O OD1 . ASP D 2 145 ? 14.263 27.943 26.324 1.00 106.65 ? 145 ASP B OD1 1 ATOM 8703 O OD2 . ASP D 2 145 ? 14.512 29.903 25.360 1.00 114.76 ? 145 ASP B OD2 1 ATOM 8704 N N . ASN D 2 146 ? 14.963 27.677 22.248 1.00 89.29 ? 146 ASN B N 1 ATOM 8705 C CA . ASN D 2 146 ? 13.948 27.452 21.205 1.00 82.13 ? 146 ASN B CA 1 ATOM 8706 C C . ASN D 2 146 ? 12.602 28.111 21.514 1.00 77.93 ? 146 ASN B C 1 ATOM 8707 O O . ASN D 2 146 ? 11.837 28.389 20.602 1.00 86.93 ? 146 ASN B O 1 ATOM 8708 C CB . ASN D 2 146 ? 13.742 25.937 20.919 1.00 76.88 ? 146 ASN B CB 1 ATOM 8709 C CG . ASN D 2 146 ? 14.829 25.306 20.017 1.00 78.97 ? 146 ASN B CG 1 ATOM 8710 O OD1 . ASN D 2 146 ? 14.835 24.086 19.852 1.00 81.54 ? 146 ASN B OD1 1 ATOM 8711 N ND2 . ASN D 2 146 ? 15.738 26.105 19.446 1.00 75.89 ? 146 ASN B ND2 1 ATOM 8712 N N . LYS D 2 147 ? 12.313 28.356 22.784 1.00 80.54 ? 147 LYS B N 1 ATOM 8713 C CA . LYS D 2 147 ? 11.079 29.066 23.175 1.00 87.20 ? 147 LYS B CA 1 ATOM 8714 C C . LYS D 2 147 ? 11.283 30.581 23.088 1.00 78.52 ? 147 LYS B C 1 ATOM 8715 O O . LYS D 2 147 ? 10.340 31.330 22.843 1.00 78.39 ? 147 LYS B O 1 ATOM 8716 C CB . LYS D 2 147 ? 10.612 28.680 24.595 1.00 96.42 ? 147 LYS B CB 1 ATOM 8717 C CG . LYS D 2 147 ? 10.718 27.191 24.921 1.00 107.09 ? 147 LYS B CG 1 ATOM 8718 C CD . LYS D 2 147 ? 10.438 26.880 26.385 1.00 111.81 ? 147 LYS B CD 1 ATOM 8719 C CE . LYS D 2 147 ? 11.440 25.860 26.913 1.00 113.56 ? 147 LYS B CE 1 ATOM 8720 N NZ . LYS D 2 147 ? 10.904 25.077 28.060 1.00 117.35 ? 147 LYS B NZ 1 ATOM 8721 N N . CYS D 2 148 ? 12.512 31.026 23.304 1.00 73.55 ? 148 CYS B N 1 ATOM 8722 C CA . CYS D 2 148 ? 12.853 32.431 23.146 1.00 73.98 ? 148 CYS B CA 1 ATOM 8723 C C . CYS D 2 148 ? 12.751 32.748 21.648 1.00 68.22 ? 148 CYS B C 1 ATOM 8724 O O . CYS D 2 148 ? 12.102 33.715 21.249 1.00 66.08 ? 148 CYS B O 1 ATOM 8725 C CB . CYS D 2 148 ? 14.269 32.730 23.698 1.00 75.88 ? 148 CYS B CB 1 ATOM 8726 S SG . CYS D 2 148 ? 14.971 34.354 23.276 1.00 82.68 ? 148 CYS B SG 1 ATOM 8727 N N . MET D 2 149 ? 13.446 31.955 20.839 1.00 64.27 ? 149 MET B N 1 ATOM 8728 C CA . MET D 2 149 ? 13.352 32.022 19.369 1.00 68.90 ? 149 MET B CA 1 ATOM 8729 C C . MET D 2 149 ? 11.899 32.052 18.855 1.00 71.16 ? 149 MET B C 1 ATOM 8730 O O . MET D 2 149 ? 11.494 32.987 18.159 1.00 61.68 ? 149 MET B O 1 ATOM 8731 C CB . MET D 2 149 ? 14.094 30.830 18.739 1.00 69.25 ? 149 MET B CB 1 ATOM 8732 C CG . MET D 2 149 ? 15.597 31.006 18.476 1.00 64.77 ? 149 MET B CG 1 ATOM 8733 S SD . MET D 2 149 ? 16.256 32.688 18.393 1.00 67.05 ? 149 MET B SD 1 ATOM 8734 C CE . MET D 2 149 ? 17.982 32.374 17.999 1.00 75.79 ? 149 MET B CE 1 ATOM 8735 N N . GLU D 2 150 ? 11.114 31.046 19.224 1.00 74.42 ? 150 GLU B N 1 ATOM 8736 C CA . GLU D 2 150 ? 9.685 31.048 18.898 1.00 80.45 ? 150 GLU B CA 1 ATOM 8737 C C . GLU D 2 150 ? 9.015 32.372 19.284 1.00 77.87 ? 150 GLU B C 1 ATOM 8738 O O . GLU D 2 150 ? 8.155 32.850 18.567 1.00 80.00 ? 150 GLU B O 1 ATOM 8739 C CB . GLU D 2 150 ? 8.964 29.864 19.573 1.00 88.60 ? 150 GLU B CB 1 ATOM 8740 C CG . GLU D 2 150 ? 7.437 29.832 19.443 1.00 89.31 ? 150 GLU B CG 1 ATOM 8741 C CD . GLU D 2 150 ? 6.994 29.454 18.020 1.00 89.94 ? 150 GLU B CD 1 ATOM 8742 O OE1 . GLU D 2 150 ? 6.246 28.462 17.845 1.00 86.82 ? 150 GLU B OE1 1 ATOM 8743 O OE2 . GLU D 2 150 ? 7.437 30.118 17.057 1.00 93.30 ? 150 GLU B OE2 1 ATOM 8744 N N . SER D 2 151 ? 9.419 32.967 20.405 1.00 72.54 ? 151 SER B N 1 ATOM 8745 C CA . SER D 2 151 ? 8.801 34.209 20.877 1.00 66.67 ? 151 SER B CA 1 ATOM 8746 C C . SER D 2 151 ? 9.096 35.393 19.958 1.00 62.79 ? 151 SER B C 1 ATOM 8747 O O . SER D 2 151 ? 8.189 36.167 19.683 1.00 61.34 ? 151 SER B O 1 ATOM 8748 C CB . SER D 2 151 ? 9.167 34.529 22.343 1.00 64.11 ? 151 SER B CB 1 ATOM 8749 O OG . SER D 2 151 ? 10.502 35.005 22.494 1.00 61.79 ? 151 SER B OG 1 ATOM 8750 N N . VAL D 2 152 ? 10.328 35.539 19.458 1.00 64.88 ? 152 VAL B N 1 ATOM 8751 C CA . VAL D 2 152 ? 10.599 36.639 18.494 1.00 74.82 ? 152 VAL B CA 1 ATOM 8752 C C . VAL D 2 152 ? 9.797 36.445 17.210 1.00 71.49 ? 152 VAL B C 1 ATOM 8753 O O . VAL D 2 152 ? 9.329 37.408 16.626 1.00 60.51 ? 152 VAL B O 1 ATOM 8754 C CB . VAL D 2 152 ? 12.078 36.840 18.078 1.00 77.33 ? 152 VAL B CB 1 ATOM 8755 C CG1 . VAL D 2 152 ? 12.796 37.785 19.016 1.00 81.52 ? 152 VAL B CG1 1 ATOM 8756 C CG2 . VAL D 2 152 ? 12.805 35.534 17.981 1.00 83.93 ? 152 VAL B CG2 1 ATOM 8757 N N . ARG D 2 153 ? 9.628 35.185 16.817 1.00 77.00 ? 153 ARG B N 1 ATOM 8758 C CA . ARG D 2 153 ? 8.859 34.830 15.615 1.00 80.41 ? 153 ARG B CA 1 ATOM 8759 C C . ARG D 2 153 ? 7.373 35.224 15.669 1.00 80.72 ? 153 ARG B C 1 ATOM 8760 O O . ARG D 2 153 ? 6.866 35.771 14.695 1.00 72.61 ? 153 ARG B O 1 ATOM 8761 C CB . ARG D 2 153 ? 8.966 33.341 15.320 1.00 76.01 ? 153 ARG B CB 1 ATOM 8762 C CG . ARG D 2 153 ? 10.309 32.961 14.745 1.00 76.00 ? 153 ARG B CG 1 ATOM 8763 C CD . ARG D 2 153 ? 10.261 31.575 14.143 1.00 73.84 ? 153 ARG B CD 1 ATOM 8764 N NE . ARG D 2 153 ? 11.343 30.771 14.696 1.00 78.34 ? 153 ARG B NE 1 ATOM 8765 C CZ . ARG D 2 153 ? 11.209 29.798 15.605 1.00 78.48 ? 153 ARG B CZ 1 ATOM 8766 N NH1 . ARG D 2 153 ? 10.016 29.444 16.067 1.00 83.07 ? 153 ARG B NH1 1 ATOM 8767 N NH2 . ARG D 2 153 ? 12.286 29.165 16.048 1.00 76.98 ? 153 ARG B NH2 1 ATOM 8768 N N . ASN D 2 154 ? 6.694 34.984 16.793 1.00 81.70 ? 154 ASN B N 1 ATOM 8769 C CA . ASN D 2 154 ? 5.283 35.380 16.902 1.00 88.82 ? 154 ASN B CA 1 ATOM 8770 C C . ASN D 2 154 ? 5.084 36.740 17.587 1.00 83.91 ? 154 ASN B C 1 ATOM 8771 O O . ASN D 2 154 ? 3.981 37.069 18.039 1.00 91.17 ? 154 ASN B O 1 ATOM 8772 C CB . ASN D 2 154 ? 4.392 34.276 17.516 1.00 94.19 ? 154 ASN B CB 1 ATOM 8773 C CG . ASN D 2 154 ? 4.840 33.836 18.893 1.00 95.69 ? 154 ASN B CG 1 ATOM 8774 O OD1 . ASN D 2 154 ? 5.616 34.519 19.554 1.00 110.12 ? 154 ASN B OD1 1 ATOM 8775 N ND2 . ASN D 2 154 ? 4.327 32.693 19.341 1.00 95.86 ? 154 ASN B ND2 1 ATOM 8776 N N . GLY D 2 155 ? 6.139 37.551 17.617 1.00 78.00 ? 155 GLY B N 1 ATOM 8777 C CA . GLY D 2 155 ? 6.031 38.944 18.053 1.00 79.76 ? 155 GLY B CA 1 ATOM 8778 C C . GLY D 2 155 ? 5.833 39.185 19.545 1.00 79.92 ? 155 GLY B C 1 ATOM 8779 O O . GLY D 2 155 ? 5.499 40.295 19.932 1.00 81.63 ? 155 GLY B O 1 ATOM 8780 N N . THR D 2 156 ? 6.074 38.166 20.383 1.00 82.90 ? 156 THR B N 1 ATOM 8781 C CA . THR D 2 156 ? 5.884 38.257 21.868 1.00 83.87 ? 156 THR B CA 1 ATOM 8782 C C . THR D 2 156 ? 7.165 38.316 22.720 1.00 74.26 ? 156 THR B C 1 ATOM 8783 O O . THR D 2 156 ? 7.089 38.372 23.946 1.00 73.41 ? 156 THR B O 1 ATOM 8784 C CB . THR D 2 156 ? 5.029 37.072 22.417 1.00 89.84 ? 156 THR B CB 1 ATOM 8785 O OG1 . THR D 2 156 ? 5.641 35.812 22.088 1.00 80.87 ? 156 THR B OG1 1 ATOM 8786 C CG2 . THR D 2 156 ? 3.589 37.132 21.869 1.00 96.67 ? 156 THR B CG2 1 ATOM 8787 N N . TYR D 2 157 ? 8.327 38.238 22.075 1.00 76.33 ? 157 TYR B N 1 ATOM 8788 C CA . TYR D 2 157 ? 9.613 38.346 22.742 1.00 70.84 ? 157 TYR B CA 1 ATOM 8789 C C . TYR D 2 157 ? 9.556 39.385 23.833 1.00 80.64 ? 157 TYR B C 1 ATOM 8790 O O . TYR D 2 157 ? 9.170 40.524 23.575 1.00 77.15 ? 157 TYR B O 1 ATOM 8791 C CB . TYR D 2 157 ? 10.706 38.703 21.735 1.00 68.74 ? 157 TYR B CB 1 ATOM 8792 C CG . TYR D 2 157 ? 12.044 39.122 22.340 1.00 65.86 ? 157 TYR B CG 1 ATOM 8793 C CD1 . TYR D 2 157 ? 13.035 38.175 22.603 1.00 70.38 ? 157 TYR B CD1 1 ATOM 8794 C CD2 . TYR D 2 157 ? 12.323 40.467 22.616 1.00 61.95 ? 157 TYR B CD2 1 ATOM 8795 C CE1 . TYR D 2 157 ? 14.256 38.545 23.140 1.00 68.28 ? 157 TYR B CE1 1 ATOM 8796 C CE2 . TYR D 2 157 ? 13.538 40.853 23.140 1.00 60.19 ? 157 TYR B CE2 1 ATOM 8797 C CZ . TYR D 2 157 ? 14.502 39.890 23.415 1.00 70.92 ? 157 TYR B CZ 1 ATOM 8798 O OH . TYR D 2 157 ? 15.722 40.236 23.973 1.00 65.01 ? 157 TYR B OH 1 ATOM 8799 N N . ASP D 2 158 ? 9.970 38.976 25.038 1.00 86.09 ? 158 ASP B N 1 ATOM 8800 C CA . ASP D 2 158 ? 9.868 39.784 26.243 1.00 84.99 ? 158 ASP B CA 1 ATOM 8801 C C . ASP D 2 158 ? 11.266 40.359 26.600 1.00 79.19 ? 158 ASP B C 1 ATOM 8802 O O . ASP D 2 158 ? 12.120 39.673 27.197 1.00 70.93 ? 158 ASP B O 1 ATOM 8803 C CB . ASP D 2 158 ? 9.096 38.935 27.322 1.00 85.03 ? 158 ASP B CB 1 ATOM 8804 C CG . ASP D 2 158 ? 9.746 38.896 28.734 1.00 79.31 ? 158 ASP B CG 1 ATOM 8805 O OD1 . ASP D 2 158 ? 10.001 37.784 29.223 1.00 76.28 ? 158 ASP B OD1 1 ATOM 8806 O OD2 . ASP D 2 158 ? 9.931 39.935 29.387 1.00 71.30 ? 158 ASP B OD2 1 ATOM 8807 N N . TYR D 2 159 ? 11.463 41.623 26.163 1.00 72.83 ? 159 TYR B N 1 ATOM 8808 C CA . TYR D 2 159 ? 12.712 42.399 26.344 1.00 66.97 ? 159 TYR B CA 1 ATOM 8809 C C . TYR D 2 159 ? 13.111 42.477 27.812 1.00 69.11 ? 159 TYR B C 1 ATOM 8810 O O . TYR D 2 159 ? 14.302 42.371 28.117 1.00 64.76 ? 159 TYR B O 1 ATOM 8811 C CB . TYR D 2 159 ? 12.607 43.828 25.752 1.00 59.99 ? 159 TYR B CB 1 ATOM 8812 C CG . TYR D 2 159 ? 13.825 44.740 25.958 1.00 59.53 ? 159 TYR B CG 1 ATOM 8813 C CD1 . TYR D 2 159 ? 14.833 44.850 24.991 1.00 60.48 ? 159 TYR B CD1 1 ATOM 8814 C CD2 . TYR D 2 159 ? 13.958 45.518 27.111 1.00 60.29 ? 159 TYR B CD2 1 ATOM 8815 C CE1 . TYR D 2 159 ? 15.935 45.690 25.159 1.00 60.62 ? 159 TYR B CE1 1 ATOM 8816 C CE2 . TYR D 2 159 ? 15.059 46.372 27.291 1.00 61.11 ? 159 TYR B CE2 1 ATOM 8817 C CZ . TYR D 2 159 ? 16.051 46.457 26.310 1.00 63.65 ? 159 TYR B CZ 1 ATOM 8818 O OH . TYR D 2 159 ? 17.169 47.287 26.421 1.00 60.53 ? 159 TYR B OH 1 ATOM 8819 N N . PRO D 2 160 ? 12.125 42.708 28.707 1.00 72.37 ? 160 PRO B N 1 ATOM 8820 C CA . PRO D 2 160 ? 12.468 42.801 30.131 1.00 78.26 ? 160 PRO B CA 1 ATOM 8821 C C . PRO D 2 160 ? 13.299 41.636 30.666 1.00 72.62 ? 160 PRO B C 1 ATOM 8822 O O . PRO D 2 160 ? 14.392 41.852 31.197 1.00 74.61 ? 160 PRO B O 1 ATOM 8823 C CB . PRO D 2 160 ? 11.091 42.868 30.821 1.00 80.47 ? 160 PRO B CB 1 ATOM 8824 C CG . PRO D 2 160 ? 10.094 43.159 29.747 1.00 79.28 ? 160 PRO B CG 1 ATOM 8825 C CD . PRO D 2 160 ? 10.803 43.311 28.443 1.00 71.69 ? 160 PRO B CD 1 ATOM 8826 N N . GLN D 2 161 ? 12.798 40.415 30.506 1.00 73.98 ? 161 GLN B N 1 ATOM 8827 C CA . GLN D 2 161 ? 13.522 39.214 30.944 1.00 74.20 ? 161 GLN B CA 1 ATOM 8828 C C . GLN D 2 161 ? 15.053 39.244 30.762 1.00 69.86 ? 161 GLN B C 1 ATOM 8829 O O . GLN D 2 161 ? 15.782 38.722 31.601 1.00 67.52 ? 161 GLN B O 1 ATOM 8830 C CB . GLN D 2 161 ? 12.981 37.982 30.208 1.00 78.68 ? 161 GLN B CB 1 ATOM 8831 C CG . GLN D 2 161 ? 12.379 36.925 31.117 1.00 86.10 ? 161 GLN B CG 1 ATOM 8832 C CD . GLN D 2 161 ? 13.284 35.719 31.263 1.00 88.57 ? 161 GLN B CD 1 ATOM 8833 O OE1 . GLN D 2 161 ? 13.483 34.973 30.304 1.00 100.19 ? 161 GLN B OE1 1 ATOM 8834 N NE2 . GLN D 2 161 ? 13.844 35.528 32.454 1.00 80.03 ? 161 GLN B NE2 1 ATOM 8835 N N . TYR D 2 162 ? 15.519 39.827 29.649 1.00 66.41 ? 162 TYR B N 1 ATOM 8836 C CA . TYR D 2 162 ? 16.898 39.656 29.204 1.00 61.18 ? 162 TYR B CA 1 ATOM 8837 C C . TYR D 2 162 ? 17.773 40.907 29.262 1.00 57.77 ? 162 TYR B C 1 ATOM 8838 O O . TYR D 2 162 ? 18.989 40.794 29.030 1.00 49.72 ? 162 TYR B O 1 ATOM 8839 C CB . TYR D 2 162 ? 16.953 39.061 27.781 1.00 61.85 ? 162 TYR B CB 1 ATOM 8840 C CG . TYR D 2 162 ? 16.191 37.754 27.626 1.00 67.44 ? 162 TYR B CG 1 ATOM 8841 C CD1 . TYR D 2 162 ? 14.868 37.749 27.174 1.00 61.22 ? 162 TYR B CD1 1 ATOM 8842 C CD2 . TYR D 2 162 ? 16.797 36.512 27.923 1.00 68.81 ? 162 TYR B CD2 1 ATOM 8843 C CE1 . TYR D 2 162 ? 14.173 36.562 27.029 1.00 61.87 ? 162 TYR B CE1 1 ATOM 8844 C CE2 . TYR D 2 162 ? 16.107 35.314 27.763 1.00 69.11 ? 162 TYR B CE2 1 ATOM 8845 C CZ . TYR D 2 162 ? 14.788 35.346 27.324 1.00 67.50 ? 162 TYR B CZ 1 ATOM 8846 O OH . TYR D 2 162 ? 14.069 34.171 27.173 1.00 69.01 ? 162 TYR B OH 1 ATOM 8847 N N . SER D 2 163 ? 17.198 42.068 29.605 1.00 61.53 ? 163 SER B N 1 ATOM 8848 C CA . SER D 2 163 ? 17.931 43.365 29.519 1.00 69.41 ? 163 SER B CA 1 ATOM 8849 C C . SER D 2 163 ? 19.316 43.303 30.176 1.00 70.09 ? 163 SER B C 1 ATOM 8850 O O . SER D 2 163 ? 20.339 43.665 29.549 1.00 72.07 ? 163 SER B O 1 ATOM 8851 C CB . SER D 2 163 ? 17.153 44.504 30.211 1.00 73.11 ? 163 SER B CB 1 ATOM 8852 O OG . SER D 2 163 ? 15.749 44.311 30.180 1.00 74.38 ? 163 SER B OG 1 ATOM 8853 N N . GLU D 2 164 ? 19.308 42.784 31.414 1.00 69.81 ? 164 GLU B N 1 ATOM 8854 C CA . GLU D 2 164 ? 20.460 42.760 32.337 1.00 75.81 ? 164 GLU B CA 1 ATOM 8855 C C . GLU D 2 164 ? 21.601 41.915 31.843 1.00 65.37 ? 164 GLU B C 1 ATOM 8856 O O . GLU D 2 164 ? 22.750 42.348 31.770 1.00 61.81 ? 164 GLU B O 1 ATOM 8857 C CB . GLU D 2 164 ? 20.037 42.202 33.718 1.00 82.83 ? 164 GLU B CB 1 ATOM 8858 C CG . GLU D 2 164 ? 19.627 43.233 34.737 1.00 89.46 ? 164 GLU B CG 1 ATOM 8859 C CD . GLU D 2 164 ? 20.758 43.599 35.663 1.00 108.62 ? 164 GLU B CD 1 ATOM 8860 O OE1 . GLU D 2 164 ? 21.314 42.698 36.329 1.00 122.93 ? 164 GLU B OE1 1 ATOM 8861 O OE2 . GLU D 2 164 ? 21.084 44.801 35.726 1.00 119.50 ? 164 GLU B OE2 1 ATOM 8862 N N . GLU D 2 165 ? 21.269 40.677 31.537 1.00 65.45 ? 165 GLU B N 1 ATOM 8863 C CA . GLU D 2 165 ? 22.242 39.736 30.983 1.00 70.05 ? 165 GLU B CA 1 ATOM 8864 C C . GLU D 2 165 ? 22.916 40.289 29.731 1.00 66.28 ? 165 GLU B C 1 ATOM 8865 O O . GLU D 2 165 ? 24.083 39.977 29.442 1.00 71.38 ? 165 GLU B O 1 ATOM 8866 C CB . GLU D 2 165 ? 21.545 38.399 30.681 1.00 79.63 ? 165 GLU B CB 1 ATOM 8867 C CG . GLU D 2 165 ? 22.427 37.333 30.034 1.00 84.33 ? 165 GLU B CG 1 ATOM 8868 C CD . GLU D 2 165 ? 21.664 36.049 29.721 1.00 91.61 ? 165 GLU B CD 1 ATOM 8869 O OE1 . GLU D 2 165 ? 20.450 35.964 30.035 1.00 81.04 ? 165 GLU B OE1 1 ATOM 8870 O OE2 . GLU D 2 165 ? 22.286 35.133 29.134 1.00 101.23 ? 165 GLU B OE2 1 ATOM 8871 N N . ALA D 2 166 ? 22.145 41.058 28.964 1.00 68.69 ? 166 ALA B N 1 ATOM 8872 C CA . ALA D 2 166 ? 22.635 41.675 27.724 1.00 71.71 ? 166 ALA B CA 1 ATOM 8873 C C . ALA D 2 166 ? 23.418 42.921 28.022 1.00 63.64 ? 166 ALA B C 1 ATOM 8874 O O . ALA D 2 166 ? 24.512 43.111 27.516 1.00 63.22 ? 166 ALA B O 1 ATOM 8875 C CB . ALA D 2 166 ? 21.477 41.984 26.782 1.00 77.89 ? 166 ALA B CB 1 ATOM 8876 N N . ARG D 2 167 ? 22.865 43.763 28.873 1.00 64.28 ? 167 ARG B N 1 ATOM 8877 C CA . ARG D 2 167 ? 23.633 44.901 29.359 1.00 73.54 ? 167 ARG B CA 1 ATOM 8878 C C . ARG D 2 167 ? 25.066 44.464 29.755 1.00 74.22 ? 167 ARG B C 1 ATOM 8879 O O . ARG D 2 167 ? 26.043 45.090 29.342 1.00 78.38 ? 167 ARG B O 1 ATOM 8880 C CB . ARG D 2 167 ? 22.942 45.583 30.541 1.00 77.43 ? 167 ARG B CB 1 ATOM 8881 C CG . ARG D 2 167 ? 22.998 47.105 30.469 1.00 87.76 ? 167 ARG B CG 1 ATOM 8882 C CD . ARG D 2 167 ? 22.819 47.799 31.815 1.00 96.45 ? 167 ARG B CD 1 ATOM 8883 N NE . ARG D 2 167 ? 23.645 47.171 32.862 1.00 102.82 ? 167 ARG B NE 1 ATOM 8884 C CZ . ARG D 2 167 ? 23.196 46.625 33.992 1.00 107.12 ? 167 ARG B CZ 1 ATOM 8885 N NH1 . ARG D 2 167 ? 21.892 46.647 34.295 1.00 106.59 ? 167 ARG B NH1 1 ATOM 8886 N NH2 . ARG D 2 167 ? 24.064 46.069 34.842 1.00 101.66 ? 167 ARG B NH2 1 ATOM 8887 N N . LEU D 2 168 ? 25.185 43.354 30.493 1.00 75.21 ? 168 LEU B N 1 ATOM 8888 C CA . LEU D 2 168 ? 26.480 42.933 31.095 1.00 76.00 ? 168 LEU B CA 1 ATOM 8889 C C . LEU D 2 168 ? 27.419 42.447 30.019 1.00 77.21 ? 168 LEU B C 1 ATOM 8890 O O . LEU D 2 168 ? 28.616 42.740 30.050 1.00 76.19 ? 168 LEU B O 1 ATOM 8891 C CB . LEU D 2 168 ? 26.345 41.778 32.117 1.00 80.26 ? 168 LEU B CB 1 ATOM 8892 C CG . LEU D 2 168 ? 26.161 41.967 33.645 1.00 84.07 ? 168 LEU B CG 1 ATOM 8893 C CD1 . LEU D 2 168 ? 26.691 43.312 34.132 1.00 80.70 ? 168 LEU B CD1 1 ATOM 8894 C CD2 . LEU D 2 168 ? 24.726 41.767 34.139 1.00 87.96 ? 168 LEU B CD2 1 ATOM 8895 N N . LYS D 2 169 ? 26.863 41.659 29.098 1.00 77.98 ? 169 LYS B N 1 ATOM 8896 C CA . LYS D 2 169 ? 27.634 41.101 27.980 1.00 79.22 ? 169 LYS B CA 1 ATOM 8897 C C . LYS D 2 169 ? 28.003 42.149 26.891 1.00 80.16 ? 169 LYS B C 1 ATOM 8898 O O . LYS D 2 169 ? 28.918 41.938 26.091 1.00 85.18 ? 169 LYS B O 1 ATOM 8899 C CB . LYS D 2 169 ? 26.882 39.896 27.393 1.00 80.32 ? 169 LYS B CB 1 ATOM 8900 C CG . LYS D 2 169 ? 27.436 39.307 26.099 1.00 85.61 ? 169 LYS B CG 1 ATOM 8901 C CD . LYS D 2 169 ? 28.862 38.758 26.225 1.00 97.40 ? 169 LYS B CD 1 ATOM 8902 C CE . LYS D 2 169 ? 29.109 37.534 25.345 1.00 103.53 ? 169 LYS B CE 1 ATOM 8903 N NZ . LYS D 2 169 ? 28.520 36.309 25.954 1.00 110.01 ? 169 LYS B NZ 1 ATOM 8904 N N . ARG D 2 170 ? 27.301 43.279 26.888 1.00 78.95 ? 170 ARG B N 1 ATOM 8905 C CA . ARG D 2 170 ? 27.559 44.356 25.953 1.00 76.22 ? 170 ARG B CA 1 ATOM 8906 C C . ARG D 2 170 ? 28.693 45.216 26.488 1.00 80.61 ? 170 ARG B C 1 ATOM 8907 O O . ARG D 2 170 ? 29.648 45.498 25.773 1.00 85.38 ? 170 ARG B O 1 ATOM 8908 C CB . ARG D 2 170 ? 26.296 45.213 25.751 1.00 77.54 ? 170 ARG B CB 1 ATOM 8909 C CG . ARG D 2 170 ? 26.313 46.082 24.499 1.00 75.43 ? 170 ARG B CG 1 ATOM 8910 C CD . ARG D 2 170 ? 25.267 47.197 24.567 1.00 75.91 ? 170 ARG B CD 1 ATOM 8911 N NE . ARG D 2 170 ? 23.971 46.670 24.972 1.00 71.27 ? 170 ARG B NE 1 ATOM 8912 C CZ . ARG D 2 170 ? 23.273 47.063 26.039 1.00 72.65 ? 170 ARG B CZ 1 ATOM 8913 N NH1 . ARG D 2 170 ? 23.711 48.029 26.839 1.00 71.78 ? 170 ARG B NH1 1 ATOM 8914 N NH2 . ARG D 2 170 ? 22.100 46.494 26.303 1.00 73.84 ? 170 ARG B NH2 1 ATOM 8915 N N . GLU D 2 171 ? 28.565 45.654 27.740 1.00 85.98 ? 171 GLU B N 1 ATOM 8916 C CA . GLU D 2 171 ? 29.619 46.451 28.412 1.00 97.93 ? 171 GLU B CA 1 ATOM 8917 C C . GLU D 2 171 ? 30.942 45.686 28.550 1.00 98.19 ? 171 GLU B C 1 ATOM 8918 O O . GLU D 2 171 ? 32.024 46.256 28.761 1.00 92.07 ? 171 GLU B O 1 ATOM 8919 C CB . GLU D 2 171 ? 29.186 46.869 29.817 1.00 105.91 ? 171 GLU B CB 1 ATOM 8920 C CG . GLU D 2 171 ? 27.957 47.764 29.908 1.00 112.23 ? 171 GLU B CG 1 ATOM 8921 C CD . GLU D 2 171 ? 27.470 47.956 31.344 1.00 115.84 ? 171 GLU B CD 1 ATOM 8922 O OE1 . GLU D 2 171 ? 27.164 49.109 31.707 1.00 113.93 ? 171 GLU B OE1 1 ATOM 8923 O OE2 . GLU D 2 171 ? 27.391 46.958 32.110 1.00 107.79 ? 171 GLU B OE2 1 ATOM 8924 N N . GLU D 2 172 ? 30.835 44.374 28.454 1.00 100.78 ? 172 GLU B N 1 ATOM 8925 C CA . GLU D 2 172 ? 31.989 43.507 28.498 1.00 104.45 ? 172 GLU B CA 1 ATOM 8926 C C . GLU D 2 172 ? 32.837 43.658 27.233 1.00 110.42 ? 172 GLU B C 1 ATOM 8927 O O . GLU D 2 172 ? 33.891 43.043 27.140 1.00 104.88 ? 172 GLU B O 1 ATOM 8928 C CB . GLU D 2 172 ? 31.486 42.080 28.635 1.00 102.20 ? 172 GLU B CB 1 ATOM 8929 C CG . GLU D 2 172 ? 32.515 41.010 28.915 1.00 97.75 ? 172 GLU B CG 1 ATOM 8930 C CD . GLU D 2 172 ? 31.984 39.671 28.457 1.00 100.15 ? 172 GLU B CD 1 ATOM 8931 O OE1 . GLU D 2 172 ? 31.263 39.020 29.252 1.00 91.32 ? 172 GLU B OE1 1 ATOM 8932 O OE2 . GLU D 2 172 ? 32.250 39.302 27.282 1.00 95.19 ? 172 GLU B OE2 1 ATOM 8933 N N . ILE D 2 173 ? 32.365 44.458 26.263 1.00 118.64 ? 173 ILE B N 1 ATOM 8934 C CA . ILE D 2 173 ? 33.110 44.757 25.038 1.00 113.85 ? 173 ILE B CA 1 ATOM 8935 C C . ILE D 2 173 ? 32.819 46.196 24.527 1.00 107.48 ? 173 ILE B C 1 ATOM 8936 O O . ILE D 2 173 ? 33.208 47.220 25.123 1.00 84.14 ? 173 ILE B O 1 ATOM 8937 C CB . ILE D 2 173 ? 32.717 43.744 23.929 1.00 107.69 ? 173 ILE B CB 1 ATOM 8938 C CG1 . ILE D 2 173 ? 31.872 42.597 24.516 1.00 105.04 ? 173 ILE B CG1 1 ATOM 8939 C CG2 . ILE D 2 173 ? 33.963 43.209 23.221 1.00 108.32 ? 173 ILE B CG2 1 ATOM 8940 C CD1 . ILE D 2 173 ? 31.046 41.841 23.500 1.00 103.91 ? 173 ILE B CD1 1 ATOM 8941 N N . GLY E 2 12 ? -2.506 52.353 12.544 1.00 71.58 ? 12 GLY D N 1 ATOM 8942 C CA . GLY E 2 12 ? -3.716 53.195 12.235 1.00 72.96 ? 12 GLY D CA 1 ATOM 8943 C C . GLY E 2 12 ? -3.465 54.685 11.928 1.00 78.40 ? 12 GLY D C 1 ATOM 8944 O O . GLY E 2 12 ? -2.355 55.198 12.118 1.00 79.08 ? 12 GLY D O 1 ATOM 8945 N N . GLY E 2 13 ? -4.511 55.385 11.471 1.00 80.03 ? 13 GLY D N 1 ATOM 8946 C CA . GLY E 2 13 ? -4.490 56.860 11.210 1.00 77.35 ? 13 GLY D CA 1 ATOM 8947 C C . GLY E 2 13 ? -5.274 57.678 12.246 1.00 74.22 ? 13 GLY D C 1 ATOM 8948 O O . GLY E 2 13 ? -5.885 57.083 13.131 1.00 69.28 ? 13 GLY D O 1 ATOM 8949 N N . TRP E 2 14 ? -5.274 59.020 12.135 1.00 72.64 ? 14 TRP D N 1 ATOM 8950 C CA . TRP E 2 14 ? -5.872 59.937 13.179 1.00 73.37 ? 14 TRP D CA 1 ATOM 8951 C C . TRP E 2 14 ? -7.026 60.883 12.745 1.00 73.36 ? 14 TRP D C 1 ATOM 8952 O O . TRP E 2 14 ? -6.773 61.924 12.123 1.00 67.08 ? 14 TRP D O 1 ATOM 8953 C CB . TRP E 2 14 ? -4.787 60.870 13.782 1.00 70.91 ? 14 TRP D CB 1 ATOM 8954 C CG . TRP E 2 14 ? -3.621 60.222 14.477 1.00 65.22 ? 14 TRP D CG 1 ATOM 8955 C CD1 . TRP E 2 14 ? -3.592 59.025 15.127 1.00 64.74 ? 14 TRP D CD1 1 ATOM 8956 C CD2 . TRP E 2 14 ? -2.311 60.776 14.595 1.00 61.86 ? 14 TRP D CD2 1 ATOM 8957 N NE1 . TRP E 2 14 ? -2.324 58.792 15.638 1.00 69.30 ? 14 TRP D NE1 1 ATOM 8958 C CE2 . TRP E 2 14 ? -1.518 59.850 15.304 1.00 64.18 ? 14 TRP D CE2 1 ATOM 8959 C CE3 . TRP E 2 14 ? -1.728 61.958 14.146 1.00 60.40 ? 14 TRP D CE3 1 ATOM 8960 C CZ2 . TRP E 2 14 ? -0.170 60.079 15.579 1.00 63.52 ? 14 TRP D CZ2 1 ATOM 8961 C CZ3 . TRP E 2 14 ? -0.393 62.198 14.424 1.00 60.52 ? 14 TRP D CZ3 1 ATOM 8962 C CH2 . TRP E 2 14 ? 0.376 61.262 15.137 1.00 59.83 ? 14 TRP D CH2 1 ATOM 8963 N N . GLN E 2 15 ? -8.260 60.597 13.166 1.00 78.76 ? 15 GLN D N 1 ATOM 8964 C CA . GLN E 2 15 ? -9.398 61.560 12.988 1.00 81.93 ? 15 GLN D CA 1 ATOM 8965 C C . GLN E 2 15 ? -9.090 63.000 13.449 1.00 78.21 ? 15 GLN D C 1 ATOM 8966 O O . GLN E 2 15 ? -9.515 63.982 12.835 1.00 70.83 ? 15 GLN D O 1 ATOM 8967 C CB . GLN E 2 15 ? -10.636 61.070 13.740 1.00 84.65 ? 15 GLN D CB 1 ATOM 8968 C CG . GLN E 2 15 ? -11.210 59.766 13.219 1.00 87.96 ? 15 GLN D CG 1 ATOM 8969 C CD . GLN E 2 15 ? -11.935 59.919 11.890 1.00 92.83 ? 15 GLN D CD 1 ATOM 8970 O OE1 . GLN E 2 15 ? -12.422 60.999 11.533 1.00 95.31 ? 15 GLN D OE1 1 ATOM 8971 N NE2 . GLN E 2 15 ? -12.028 58.819 11.152 1.00 98.03 ? 15 GLN D NE2 1 ATOM 8972 N N . GLY E 2 16 ? -8.335 63.100 14.536 1.00 80.74 ? 16 GLY D N 1 ATOM 8973 C CA . GLY E 2 16 ? -8.035 64.378 15.186 1.00 82.88 ? 16 GLY D CA 1 ATOM 8974 C C . GLY E 2 16 ? -7.192 65.353 14.394 1.00 77.28 ? 16 GLY D C 1 ATOM 8975 O O . GLY E 2 16 ? -7.327 66.558 14.544 1.00 80.70 ? 16 GLY D O 1 ATOM 8976 N N . MET E 2 17 ? -6.300 64.838 13.569 1.00 73.27 ? 17 MET D N 1 ATOM 8977 C CA . MET E 2 17 ? -5.570 65.707 12.689 1.00 74.98 ? 17 MET D CA 1 ATOM 8978 C C . MET E 2 17 ? -6.406 66.179 11.503 1.00 79.73 ? 17 MET D C 1 ATOM 8979 O O . MET E 2 17 ? -6.702 65.402 10.594 1.00 83.56 ? 17 MET D O 1 ATOM 8980 C CB . MET E 2 17 ? -4.321 65.028 12.179 1.00 77.85 ? 17 MET D CB 1 ATOM 8981 C CG . MET E 2 17 ? -3.380 66.064 11.613 1.00 81.86 ? 17 MET D CG 1 ATOM 8982 S SD . MET E 2 17 ? -1.971 65.350 10.799 1.00 101.60 ? 17 MET D SD 1 ATOM 8983 C CE . MET E 2 17 ? -1.495 64.126 12.016 1.00 97.20 ? 17 MET D CE 1 ATOM 8984 N N . VAL E 2 18 ? -6.752 67.464 11.515 1.00 78.30 ? 18 VAL D N 1 ATOM 8985 C CA . VAL E 2 18 ? -7.655 68.063 10.522 1.00 77.56 ? 18 VAL D CA 1 ATOM 8986 C C . VAL E 2 18 ? -6.981 69.062 9.614 1.00 77.81 ? 18 VAL D C 1 ATOM 8987 O O . VAL E 2 18 ? -7.495 69.354 8.555 1.00 75.67 ? 18 VAL D O 1 ATOM 8988 C CB . VAL E 2 18 ? -8.882 68.769 11.167 1.00 80.45 ? 18 VAL D CB 1 ATOM 8989 C CG1 . VAL E 2 18 ? -9.803 67.729 11.788 1.00 81.26 ? 18 VAL D CG1 1 ATOM 8990 C CG2 . VAL E 2 18 ? -8.472 69.841 12.194 1.00 76.75 ? 18 VAL D CG2 1 ATOM 8991 N N . ASP E 2 19 ? -5.846 69.604 10.016 1.00 81.79 ? 19 ASP D N 1 ATOM 8992 C CA . ASP E 2 19 ? -5.266 70.700 9.237 1.00 90.10 ? 19 ASP D CA 1 ATOM 8993 C C . ASP E 2 19 ? -4.234 70.224 8.199 1.00 85.22 ? 19 ASP D C 1 ATOM 8994 O O . ASP E 2 19 ? -3.506 71.044 7.638 1.00 84.03 ? 19 ASP D O 1 ATOM 8995 C CB . ASP E 2 19 ? -4.708 71.815 10.152 1.00 98.18 ? 19 ASP D CB 1 ATOM 8996 C CG . ASP E 2 19 ? -3.818 71.288 11.290 1.00 110.39 ? 19 ASP D CG 1 ATOM 8997 O OD1 . ASP E 2 19 ? -3.992 70.131 11.726 1.00 112.73 ? 19 ASP D OD1 1 ATOM 8998 O OD2 . ASP E 2 19 ? -2.949 72.055 11.771 1.00 122.18 ? 19 ASP D OD2 1 ATOM 8999 N N . GLY E 2 20 ? -4.172 68.914 7.941 1.00 77.78 ? 20 GLY D N 1 ATOM 9000 C CA . GLY E 2 20 ? -3.183 68.375 6.996 1.00 72.67 ? 20 GLY D CA 1 ATOM 9001 C C . GLY E 2 20 ? -3.180 66.868 6.760 1.00 67.08 ? 20 GLY D C 1 ATOM 9002 O O . GLY E 2 20 ? -4.038 66.157 7.251 1.00 73.36 ? 20 GLY D O 1 ATOM 9003 N N . TRP E 2 21 ? -2.192 66.380 6.014 1.00 69.96 ? 21 TRP D N 1 ATOM 9004 C CA . TRP E 2 21 ? -2.131 64.951 5.616 1.00 68.72 ? 21 TRP D CA 1 ATOM 9005 C C . TRP E 2 21 ? -1.221 64.114 6.498 1.00 63.14 ? 21 TRP D C 1 ATOM 9006 O O . TRP E 2 21 ? -1.549 62.966 6.848 1.00 54.23 ? 21 TRP D O 1 ATOM 9007 C CB . TRP E 2 21 ? -1.724 64.787 4.139 1.00 73.03 ? 21 TRP D CB 1 ATOM 9008 C CG . TRP E 2 21 ? -2.883 64.847 3.149 1.00 80.22 ? 21 TRP D CG 1 ATOM 9009 C CD1 . TRP E 2 21 ? -4.214 64.938 3.439 1.00 87.19 ? 21 TRP D CD1 1 ATOM 9010 C CD2 . TRP E 2 21 ? -2.793 64.808 1.735 1.00 86.50 ? 21 TRP D CD2 1 ATOM 9011 N NE1 . TRP E 2 21 ? -4.948 64.984 2.294 1.00 90.55 ? 21 TRP D NE1 1 ATOM 9012 C CE2 . TRP E 2 21 ? -4.104 64.898 1.227 1.00 91.62 ? 21 TRP D CE2 1 ATOM 9013 C CE3 . TRP E 2 21 ? -1.731 64.707 0.841 1.00 95.95 ? 21 TRP D CE3 1 ATOM 9014 C CZ2 . TRP E 2 21 ? -4.386 64.890 -0.136 1.00 91.19 ? 21 TRP D CZ2 1 ATOM 9015 C CZ3 . TRP E 2 21 ? -2.006 64.702 -0.519 1.00 98.54 ? 21 TRP D CZ3 1 ATOM 9016 C CH2 . TRP E 2 21 ? -3.330 64.789 -0.992 1.00 95.75 ? 21 TRP D CH2 1 ATOM 9017 N N . TYR E 2 22 ? -0.076 64.697 6.834 1.00 61.56 ? 22 TYR D N 1 ATOM 9018 C CA . TYR E 2 22 ? 0.855 64.076 7.718 1.00 62.36 ? 22 TYR D CA 1 ATOM 9019 C C . TYR E 2 22 ? 1.199 65.009 8.869 1.00 65.78 ? 22 TYR D C 1 ATOM 9020 O O . TYR E 2 22 ? 1.381 66.218 8.660 1.00 69.27 ? 22 TYR D O 1 ATOM 9021 C CB . TYR E 2 22 ? 2.143 63.772 6.968 1.00 64.74 ? 22 TYR D CB 1 ATOM 9022 C CG . TYR E 2 22 ? 1.993 63.340 5.547 1.00 64.81 ? 22 TYR D CG 1 ATOM 9023 C CD1 . TYR E 2 22 ? 1.307 62.169 5.217 1.00 68.60 ? 22 TYR D CD1 1 ATOM 9024 C CD2 . TYR E 2 22 ? 2.584 64.074 4.525 1.00 66.89 ? 22 TYR D CD2 1 ATOM 9025 C CE1 . TYR E 2 22 ? 1.203 61.755 3.905 1.00 71.42 ? 22 TYR D CE1 1 ATOM 9026 C CE2 . TYR E 2 22 ? 2.491 63.670 3.216 1.00 67.57 ? 22 TYR D CE2 1 ATOM 9027 C CZ . TYR E 2 22 ? 1.800 62.523 2.915 1.00 69.83 ? 22 TYR D CZ 1 ATOM 9028 O OH . TYR E 2 22 ? 1.757 62.159 1.616 1.00 67.58 ? 22 TYR D OH 1 ATOM 9029 N N . GLY E 2 23 ? 1.370 64.445 10.063 1.00 61.02 ? 23 GLY D N 1 ATOM 9030 C CA . GLY E 2 23 ? 1.812 65.248 11.190 1.00 66.51 ? 23 GLY D CA 1 ATOM 9031 C C . GLY E 2 23 ? 2.131 64.532 12.499 1.00 65.04 ? 23 GLY D C 1 ATOM 9032 O O . GLY E 2 23 ? 2.555 63.373 12.518 1.00 63.54 ? 23 GLY D O 1 ATOM 9033 N N . TYR E 2 24 ? 1.941 65.265 13.588 1.00 66.02 ? 24 TYR D N 1 ATOM 9034 C CA . TYR E 2 24 ? 2.428 64.883 14.905 1.00 64.76 ? 24 TYR D CA 1 ATOM 9035 C C . TYR E 2 24 ? 1.360 64.967 15.966 1.00 67.87 ? 24 TYR D C 1 ATOM 9036 O O . TYR E 2 24 ? 0.538 65.877 15.925 1.00 68.35 ? 24 TYR D O 1 ATOM 9037 C CB . TYR E 2 24 ? 3.532 65.837 15.310 1.00 68.64 ? 24 TYR D CB 1 ATOM 9038 C CG . TYR E 2 24 ? 4.597 66.083 14.274 1.00 67.74 ? 24 TYR D CG 1 ATOM 9039 C CD1 . TYR E 2 24 ? 5.659 65.195 14.119 1.00 63.49 ? 24 TYR D CD1 1 ATOM 9040 C CD2 . TYR E 2 24 ? 4.556 67.223 13.465 1.00 65.29 ? 24 TYR D CD2 1 ATOM 9041 C CE1 . TYR E 2 24 ? 6.643 65.428 13.183 1.00 65.01 ? 24 TYR D CE1 1 ATOM 9042 C CE2 . TYR E 2 24 ? 5.546 67.468 12.535 1.00 65.12 ? 24 TYR D CE2 1 ATOM 9043 C CZ . TYR E 2 24 ? 6.582 66.563 12.394 1.00 65.12 ? 24 TYR D CZ 1 ATOM 9044 O OH . TYR E 2 24 ? 7.562 66.766 11.448 1.00 67.23 ? 24 TYR D OH 1 ATOM 9045 N N . HIS E 2 25 ? 1.367 64.007 16.896 1.00 70.92 ? 25 HIS D N 1 ATOM 9046 C CA . HIS E 2 25 ? 0.632 64.113 18.164 1.00 77.94 ? 25 HIS D CA 1 ATOM 9047 C C . HIS E 2 25 ? 1.630 64.185 19.318 1.00 82.09 ? 25 HIS D C 1 ATOM 9048 O O . HIS E 2 25 ? 2.430 63.270 19.515 1.00 77.12 ? 25 HIS D O 1 ATOM 9049 C CB . HIS E 2 25 ? -0.311 62.927 18.393 1.00 84.83 ? 25 HIS D CB 1 ATOM 9050 C CG . HIS E 2 25 ? -1.163 63.068 19.625 1.00 89.29 ? 25 HIS D CG 1 ATOM 9051 N ND1 . HIS E 2 25 ? -1.315 62.061 20.557 1.00 88.71 ? 25 HIS D ND1 1 ATOM 9052 C CD2 . HIS E 2 25 ? -1.891 64.111 20.079 1.00 83.88 ? 25 HIS D CD2 1 ATOM 9053 C CE1 . HIS E 2 25 ? -2.108 62.474 21.524 1.00 83.14 ? 25 HIS D CE1 1 ATOM 9054 N NE2 . HIS E 2 25 ? -2.471 63.715 21.257 1.00 86.12 ? 25 HIS D NE2 1 ATOM 9055 N N . HIS E 2 26 ? 1.591 65.279 20.065 1.00 86.54 ? 26 HIS D N 1 ATOM 9056 C CA . HIS E 2 26 ? 2.576 65.500 21.116 1.00 89.76 ? 26 HIS D CA 1 ATOM 9057 C C . HIS E 2 26 ? 1.890 65.454 22.461 1.00 90.76 ? 26 HIS D C 1 ATOM 9058 O O . HIS E 2 26 ? 0.830 66.047 22.644 1.00 87.12 ? 26 HIS D O 1 ATOM 9059 C CB . HIS E 2 26 ? 3.315 66.813 20.909 1.00 93.58 ? 26 HIS D CB 1 ATOM 9060 C CG . HIS E 2 26 ? 2.492 68.018 21.194 1.00 105.41 ? 26 HIS D CG 1 ATOM 9061 N ND1 . HIS E 2 26 ? 1.877 68.755 20.205 1.00 113.45 ? 26 HIS D ND1 1 ATOM 9062 C CD2 . HIS E 2 26 ? 2.186 68.623 22.366 1.00 110.47 ? 26 HIS D CD2 1 ATOM 9063 C CE1 . HIS E 2 26 ? 1.224 69.762 20.755 1.00 116.82 ? 26 HIS D CE1 1 ATOM 9064 N NE2 . HIS E 2 26 ? 1.399 69.705 22.064 1.00 118.43 ? 26 HIS D NE2 1 ATOM 9065 N N . SER E 2 27 ? 2.498 64.715 23.386 1.00 94.66 ? 27 SER D N 1 ATOM 9066 C CA . SER E 2 27 ? 1.920 64.444 24.698 1.00 93.80 ? 27 SER D CA 1 ATOM 9067 C C . SER E 2 27 ? 2.895 64.851 25.793 1.00 92.04 ? 27 SER D C 1 ATOM 9068 O O . SER E 2 27 ? 3.825 64.092 26.122 1.00 86.88 ? 27 SER D O 1 ATOM 9069 C CB . SER E 2 27 ? 1.566 62.956 24.816 1.00 95.61 ? 27 SER D CB 1 ATOM 9070 O OG . SER E 2 27 ? 0.393 62.779 25.587 1.00 102.13 ? 27 SER D OG 1 ATOM 9071 N N . ASN E 2 28 ? 2.707 66.067 26.319 1.00 89.47 ? 28 ASN D N 1 ATOM 9072 C CA . ASN E 2 28 ? 3.563 66.591 27.404 1.00 84.39 ? 28 ASN D CA 1 ATOM 9073 C C . ASN E 2 28 ? 2.751 67.236 28.534 1.00 92.51 ? 28 ASN D C 1 ATOM 9074 O O . ASN E 2 28 ? 1.537 67.028 28.620 1.00 92.73 ? 28 ASN D O 1 ATOM 9075 C CB . ASN E 2 28 ? 4.643 67.537 26.846 1.00 76.89 ? 28 ASN D CB 1 ATOM 9076 C CG . ASN E 2 28 ? 4.104 68.899 26.436 1.00 79.20 ? 28 ASN D CG 1 ATOM 9077 O OD1 . ASN E 2 28 ? 2.900 69.175 26.503 1.00 79.70 ? 28 ASN D OD1 1 ATOM 9078 N ND2 . ASN E 2 28 ? 5.012 69.775 26.037 1.00 78.15 ? 28 ASN D ND2 1 ATOM 9079 N N . GLU E 2 29 ? 3.420 68.003 29.397 1.00 98.94 ? 29 GLU D N 1 ATOM 9080 C CA . GLU E 2 29 ? 2.778 68.558 30.595 1.00 109.55 ? 29 GLU D CA 1 ATOM 9081 C C . GLU E 2 29 ? 1.678 69.560 30.291 1.00 103.38 ? 29 GLU D C 1 ATOM 9082 O O . GLU E 2 29 ? 0.635 69.521 30.931 1.00 100.19 ? 29 GLU D O 1 ATOM 9083 C CB . GLU E 2 29 ? 3.793 69.242 31.514 1.00 119.70 ? 29 GLU D CB 1 ATOM 9084 C CG . GLU E 2 29 ? 3.662 68.860 32.978 1.00 129.27 ? 29 GLU D CG 1 ATOM 9085 C CD . GLU E 2 29 ? 4.563 67.691 33.354 1.00 134.97 ? 29 GLU D CD 1 ATOM 9086 O OE1 . GLU E 2 29 ? 5.794 67.801 33.161 1.00 136.36 ? 29 GLU D OE1 1 ATOM 9087 O OE2 . GLU E 2 29 ? 4.049 66.663 33.847 1.00 141.80 ? 29 GLU D OE2 1 ATOM 9088 N N . GLN E 2 30 ? 1.905 70.420 29.291 1.00 108.91 ? 30 GLN D N 1 ATOM 9089 C CA . GLN E 2 30 ? 1.014 71.562 28.968 1.00 107.14 ? 30 GLN D CA 1 ATOM 9090 C C . GLN E 2 30 ? -0.271 71.138 28.261 1.00 105.52 ? 30 GLN D C 1 ATOM 9091 O O . GLN E 2 30 ? -1.103 71.980 27.915 1.00 102.27 ? 30 GLN D O 1 ATOM 9092 C CB . GLN E 2 30 ? 1.706 72.617 28.096 1.00 107.65 ? 30 GLN D CB 1 ATOM 9093 C CG . GLN E 2 30 ? 2.860 73.345 28.754 1.00 109.61 ? 30 GLN D CG 1 ATOM 9094 C CD . GLN E 2 30 ? 4.178 72.687 28.472 1.00 118.23 ? 30 GLN D CD 1 ATOM 9095 O OE1 . GLN E 2 30 ? 4.903 73.119 27.587 1.00 127.06 ? 30 GLN D OE1 1 ATOM 9096 N NE2 . GLN E 2 30 ? 4.485 71.614 29.204 1.00 122.85 ? 30 GLN D NE2 1 ATOM 9097 N N . GLY E 2 31 ? -0.431 69.830 28.075 1.00 109.65 ? 31 GLY D N 1 ATOM 9098 C CA . GLY E 2 31 ? -1.566 69.274 27.365 1.00 107.48 ? 31 GLY D CA 1 ATOM 9099 C C . GLY E 2 31 ? -1.053 68.702 26.072 1.00 103.11 ? 31 GLY D C 1 ATOM 9100 O O . GLY E 2 31 ? 0.063 69.026 25.631 1.00 93.27 ? 31 GLY D O 1 ATOM 9101 N N . SER E 2 32 ? -1.887 67.867 25.462 1.00 104.11 ? 32 SER D N 1 ATOM 9102 C CA . SER E 2 32 ? -1.567 67.240 24.192 1.00 104.51 ? 32 SER D CA 1 ATOM 9103 C C . SER E 2 32 ? -2.323 67.901 23.032 1.00 106.32 ? 32 SER D C 1 ATOM 9104 O O . SER E 2 32 ? -3.117 68.821 23.226 1.00 102.34 ? 32 SER D O 1 ATOM 9105 C CB . SER E 2 32 ? -1.885 65.749 24.266 1.00 100.76 ? 32 SER D CB 1 ATOM 9106 O OG . SER E 2 32 ? -3.231 65.561 24.609 1.00 96.60 ? 32 SER D OG 1 ATOM 9107 N N . GLY E 2 33 ? -2.057 67.423 21.821 1.00 107.57 ? 33 GLY D N 1 ATOM 9108 C CA . GLY E 2 33 ? -2.656 67.996 20.623 1.00 101.22 ? 33 GLY D CA 1 ATOM 9109 C C . GLY E 2 33 ? -1.958 67.579 19.343 1.00 95.32 ? 33 GLY D C 1 ATOM 9110 O O . GLY E 2 33 ? -0.812 67.107 19.351 1.00 100.01 ? 33 GLY D O 1 ATOM 9111 N N . TYR E 2 34 ? -2.666 67.766 18.238 1.00 85.22 ? 34 TYR D N 1 ATOM 9112 C CA . TYR E 2 34 ? -2.185 67.369 16.940 1.00 79.72 ? 34 TYR D CA 1 ATOM 9113 C C . TYR E 2 34 ? -1.642 68.572 16.199 1.00 78.25 ? 34 TYR D C 1 ATOM 9114 O O . TYR E 2 34 ? -2.147 69.659 16.346 1.00 77.34 ? 34 TYR D O 1 ATOM 9115 C CB . TYR E 2 34 ? -3.317 66.762 16.124 1.00 73.98 ? 34 TYR D CB 1 ATOM 9116 C CG . TYR E 2 34 ? -3.932 65.507 16.711 1.00 75.73 ? 34 TYR D CG 1 ATOM 9117 C CD1 . TYR E 2 34 ? -5.078 65.566 17.499 1.00 77.77 ? 34 TYR D CD1 1 ATOM 9118 C CD2 . TYR E 2 34 ? -3.379 64.248 16.452 1.00 72.68 ? 34 TYR D CD2 1 ATOM 9119 C CE1 . TYR E 2 34 ? -5.651 64.406 18.015 1.00 81.05 ? 34 TYR D CE1 1 ATOM 9120 C CE2 . TYR E 2 34 ? -3.945 63.086 16.964 1.00 77.34 ? 34 TYR D CE2 1 ATOM 9121 C CZ . TYR E 2 34 ? -5.080 63.171 17.732 1.00 77.27 ? 34 TYR D CZ 1 ATOM 9122 O OH . TYR E 2 34 ? -5.605 62.018 18.238 1.00 82.13 ? 34 TYR D OH 1 ATOM 9123 N N . ALA E 2 35 ? -0.592 68.378 15.415 1.00 81.71 ? 35 ALA D N 1 ATOM 9124 C CA . ALA E 2 35 ? -0.125 69.422 14.508 1.00 81.41 ? 35 ALA D CA 1 ATOM 9125 C C . ALA E 2 35 ? 0.303 68.814 13.185 1.00 82.79 ? 35 ALA D C 1 ATOM 9126 O O . ALA E 2 35 ? 1.061 67.844 13.137 1.00 82.52 ? 35 ALA D O 1 ATOM 9127 C CB . ALA E 2 35 ? 1.024 70.212 15.110 1.00 80.78 ? 35 ALA D CB 1 ATOM 9128 N N . ALA E 2 36 ? -0.166 69.415 12.107 1.00 85.35 ? 36 ALA D N 1 ATOM 9129 C CA . ALA E 2 36 ? 0.141 68.920 10.782 1.00 86.32 ? 36 ALA D CA 1 ATOM 9130 C C . ALA E 2 36 ? 1.485 69.453 10.314 1.00 84.19 ? 36 ALA D C 1 ATOM 9131 O O . ALA E 2 36 ? 1.808 70.608 10.547 1.00 85.77 ? 36 ALA D O 1 ATOM 9132 C CB . ALA E 2 36 ? -0.946 69.313 9.806 1.00 87.21 ? 36 ALA D CB 1 ATOM 9133 N N . ASP E 2 37 ? 2.273 68.590 9.677 1.00 79.68 ? 37 ASP D N 1 ATOM 9134 C CA . ASP E 2 37 ? 3.488 69.033 9.028 1.00 82.16 ? 37 ASP D CA 1 ATOM 9135 C C . ASP E 2 37 ? 3.084 69.705 7.732 1.00 82.11 ? 37 ASP D C 1 ATOM 9136 O O . ASP E 2 37 ? 2.618 69.060 6.814 1.00 91.21 ? 37 ASP D O 1 ATOM 9137 C CB . ASP E 2 37 ? 4.432 67.871 8.749 1.00 85.55 ? 37 ASP D CB 1 ATOM 9138 C CG . ASP E 2 37 ? 5.786 68.342 8.325 1.00 84.78 ? 37 ASP D CG 1 ATOM 9139 O OD1 . ASP E 2 37 ? 6.478 68.956 9.154 1.00 97.93 ? 37 ASP D OD1 1 ATOM 9140 O OD2 . ASP E 2 37 ? 6.160 68.138 7.166 1.00 81.87 ? 37 ASP D OD2 1 ATOM 9141 N N . LYS E 2 38 ? 3.217 71.015 7.691 1.00 87.76 ? 38 LYS D N 1 ATOM 9142 C CA . LYS E 2 38 ? 2.771 71.822 6.559 1.00 89.70 ? 38 LYS D CA 1 ATOM 9143 C C . LYS E 2 38 ? 3.527 71.472 5.297 1.00 81.67 ? 38 LYS D C 1 ATOM 9144 O O . LYS E 2 38 ? 2.934 71.184 4.279 1.00 75.13 ? 38 LYS D O 1 ATOM 9145 C CB . LYS E 2 38 ? 2.984 73.308 6.881 1.00 103.92 ? 38 LYS D CB 1 ATOM 9146 C CG . LYS E 2 38 ? 2.671 74.274 5.754 1.00 115.57 ? 38 LYS D CG 1 ATOM 9147 C CD . LYS E 2 38 ? 1.200 74.600 5.656 1.00 125.17 ? 38 LYS D CD 1 ATOM 9148 C CE . LYS E 2 38 ? 1.010 75.883 4.830 1.00 128.68 ? 38 LYS D CE 1 ATOM 9149 N NZ . LYS E 2 38 ? -0.028 76.798 5.380 1.00 129.82 ? 38 LYS D NZ 1 ATOM 9150 N N . GLU E 2 39 ? 4.852 71.511 5.365 1.00 87.86 ? 39 GLU D N 1 ATOM 9151 C CA . GLU E 2 39 ? 5.666 71.411 4.163 1.00 88.67 ? 39 GLU D CA 1 ATOM 9152 C C . GLU E 2 39 ? 5.391 70.106 3.408 1.00 84.62 ? 39 GLU D C 1 ATOM 9153 O O . GLU E 2 39 ? 5.101 70.135 2.225 1.00 94.23 ? 39 GLU D O 1 ATOM 9154 C CB . GLU E 2 39 ? 7.160 71.526 4.485 1.00 93.74 ? 39 GLU D CB 1 ATOM 9155 C CG . GLU E 2 39 ? 8.052 71.437 3.241 1.00 101.56 ? 39 GLU D CG 1 ATOM 9156 C CD . GLU E 2 39 ? 9.543 71.555 3.537 1.00 104.78 ? 39 GLU D CD 1 ATOM 9157 O OE1 . GLU E 2 39 ? 9.930 72.407 4.354 1.00 103.76 ? 39 GLU D OE1 1 ATOM 9158 O OE2 . GLU E 2 39 ? 10.337 70.802 2.933 1.00 106.48 ? 39 GLU D OE2 1 ATOM 9159 N N . SER E 2 40 ? 5.487 68.971 4.092 1.00 71.65 ? 40 SER D N 1 ATOM 9160 C CA . SER E 2 40 ? 5.385 67.683 3.426 1.00 71.30 ? 40 SER D CA 1 ATOM 9161 C C . SER E 2 40 ? 3.951 67.345 3.004 1.00 73.56 ? 40 SER D C 1 ATOM 9162 O O . SER E 2 40 ? 3.754 66.628 2.035 1.00 73.49 ? 40 SER D O 1 ATOM 9163 C CB . SER E 2 40 ? 5.956 66.556 4.290 1.00 71.58 ? 40 SER D CB 1 ATOM 9164 O OG . SER E 2 40 ? 5.076 66.216 5.338 1.00 61.39 ? 40 SER D OG 1 ATOM 9165 N N . THR E 2 41 ? 2.972 67.851 3.745 1.00 68.17 ? 41 THR D N 1 ATOM 9166 C CA . THR E 2 41 ? 1.580 67.837 3.309 1.00 68.27 ? 41 THR D CA 1 ATOM 9167 C C . THR E 2 41 ? 1.391 68.570 1.957 1.00 70.62 ? 41 THR D C 1 ATOM 9168 O O . THR E 2 41 ? 0.709 68.068 1.060 1.00 60.18 ? 41 THR D O 1 ATOM 9169 C CB . THR E 2 41 ? 0.646 68.458 4.376 1.00 65.16 ? 41 THR D CB 1 ATOM 9170 O OG1 . THR E 2 41 ? 0.463 67.522 5.446 1.00 58.61 ? 41 THR D OG1 1 ATOM 9171 C CG2 . THR E 2 41 ? -0.727 68.812 3.782 1.00 65.31 ? 41 THR D CG2 1 ATOM 9172 N N . GLN E 2 42 ? 1.971 69.758 1.839 1.00 70.58 ? 42 GLN D N 1 ATOM 9173 C CA . GLN E 2 42 ? 1.890 70.533 0.610 1.00 69.84 ? 42 GLN D CA 1 ATOM 9174 C C . GLN E 2 42 ? 2.564 69.816 -0.537 1.00 67.80 ? 42 GLN D C 1 ATOM 9175 O O . GLN E 2 42 ? 2.108 69.889 -1.671 1.00 67.49 ? 42 GLN D O 1 ATOM 9176 C CB . GLN E 2 42 ? 2.529 71.917 0.788 1.00 69.98 ? 42 GLN D CB 1 ATOM 9177 C CG . GLN E 2 42 ? 2.087 72.954 -0.238 1.00 69.59 ? 42 GLN D CG 1 ATOM 9178 C CD . GLN E 2 42 ? 0.582 73.222 -0.203 1.00 73.02 ? 42 GLN D CD 1 ATOM 9179 O OE1 . GLN E 2 42 ? 0.053 73.801 0.756 1.00 75.55 ? 42 GLN D OE1 1 ATOM 9180 N NE2 . GLN E 2 42 ? -0.117 72.799 -1.247 1.00 77.43 ? 42 GLN D NE2 1 ATOM 9181 N N . LYS E 2 43 ? 3.672 69.155 -0.247 1.00 72.23 ? 43 LYS D N 1 ATOM 9182 C CA . LYS E 2 43 ? 4.417 68.413 -1.269 1.00 76.13 ? 43 LYS D CA 1 ATOM 9183 C C . LYS E 2 43 ? 3.469 67.381 -1.876 1.00 69.08 ? 43 LYS D C 1 ATOM 9184 O O . LYS E 2 43 ? 3.257 67.311 -3.094 1.00 71.10 ? 43 LYS D O 1 ATOM 9185 C CB . LYS E 2 43 ? 5.682 67.775 -0.637 1.00 85.47 ? 43 LYS D CB 1 ATOM 9186 C CG . LYS E 2 43 ? 6.752 67.169 -1.564 1.00 101.46 ? 43 LYS D CG 1 ATOM 9187 C CD . LYS E 2 43 ? 8.130 67.775 -1.261 1.00 115.87 ? 43 LYS D CD 1 ATOM 9188 C CE . LYS E 2 43 ? 9.283 66.975 -1.849 1.00 113.23 ? 43 LYS D CE 1 ATOM 9189 N NZ . LYS E 2 43 ? 10.578 67.326 -1.205 1.00 112.12 ? 43 LYS D NZ 1 ATOM 9190 N N . ALA E 2 44 ? 2.843 66.619 -1.006 1.00 61.57 ? 44 ALA D N 1 ATOM 9191 C CA . ALA E 2 44 ? 1.977 65.550 -1.441 1.00 62.79 ? 44 ALA D CA 1 ATOM 9192 C C . ALA E 2 44 ? 0.759 66.063 -2.197 1.00 60.69 ? 44 ALA D C 1 ATOM 9193 O O . ALA E 2 44 ? 0.358 65.477 -3.157 1.00 60.91 ? 44 ALA D O 1 ATOM 9194 C CB . ALA E 2 44 ? 1.544 64.735 -0.246 1.00 62.82 ? 44 ALA D CB 1 ATOM 9195 N N . ILE E 2 45 ? 0.166 67.150 -1.740 1.00 65.79 ? 45 ILE D N 1 ATOM 9196 C CA . ILE E 2 45 ? -0.952 67.764 -2.449 1.00 63.23 ? 45 ILE D CA 1 ATOM 9197 C C . ILE E 2 45 ? -0.526 68.230 -3.853 1.00 62.56 ? 45 ILE D C 1 ATOM 9198 O O . ILE E 2 45 ? -1.224 67.980 -4.815 1.00 61.04 ? 45 ILE D O 1 ATOM 9199 C CB . ILE E 2 45 ? -1.576 68.930 -1.643 1.00 66.08 ? 45 ILE D CB 1 ATOM 9200 C CG1 . ILE E 2 45 ? -2.531 68.376 -0.588 1.00 69.88 ? 45 ILE D CG1 1 ATOM 9201 C CG2 . ILE E 2 45 ? -2.348 69.890 -2.545 1.00 70.06 ? 45 ILE D CG2 1 ATOM 9202 C CD1 . ILE E 2 45 ? -3.006 69.394 0.423 1.00 76.87 ? 45 ILE D CD1 1 ATOM 9203 N N . ASP E 2 46 ? 0.600 68.916 -3.967 1.00 61.00 ? 46 ASP D N 1 ATOM 9204 C CA . ASP E 2 46 ? 1.071 69.350 -5.266 1.00 63.22 ? 46 ASP D CA 1 ATOM 9205 C C . ASP E 2 46 ? 1.280 68.138 -6.173 1.00 65.56 ? 46 ASP D C 1 ATOM 9206 O O . ASP E 2 46 ? 0.926 68.176 -7.355 1.00 62.83 ? 46 ASP D O 1 ATOM 9207 C CB . ASP E 2 46 ? 2.386 70.137 -5.169 1.00 66.38 ? 46 ASP D CB 1 ATOM 9208 C CG . ASP E 2 46 ? 2.213 71.496 -4.497 1.00 71.25 ? 46 ASP D CG 1 ATOM 9209 O OD1 . ASP E 2 46 ? 1.073 71.827 -4.114 1.00 70.27 ? 46 ASP D OD1 1 ATOM 9210 O OD2 . ASP E 2 46 ? 3.226 72.218 -4.334 1.00 72.18 ? 46 ASP D OD2 1 ATOM 9211 N N . GLY E 2 47 ? 1.859 67.073 -5.617 1.00 58.46 ? 47 GLY D N 1 ATOM 9212 C CA . GLY E 2 47 ? 2.279 65.938 -6.413 1.00 59.65 ? 47 GLY D CA 1 ATOM 9213 C C . GLY E 2 47 ? 1.081 65.168 -6.925 1.00 56.27 ? 47 GLY D C 1 ATOM 9214 O O . GLY E 2 47 ? 1.011 64.807 -8.097 1.00 52.85 ? 47 GLY D O 1 ATOM 9215 N N . VAL E 2 48 ? 0.160 64.901 -6.014 1.00 53.98 ? 48 VAL D N 1 ATOM 9216 C CA . VAL E 2 48 ? -1.014 64.129 -6.304 1.00 54.54 ? 48 VAL D CA 1 ATOM 9217 C C . VAL E 2 48 ? -1.888 64.933 -7.252 1.00 60.04 ? 48 VAL D C 1 ATOM 9218 O O . VAL E 2 48 ? -2.508 64.370 -8.165 1.00 63.50 ? 48 VAL D O 1 ATOM 9219 C CB . VAL E 2 48 ? -1.729 63.720 -5.011 1.00 53.04 ? 48 VAL D CB 1 ATOM 9220 C CG1 . VAL E 2 48 ? -3.194 63.411 -5.233 1.00 58.50 ? 48 VAL D CG1 1 ATOM 9221 C CG2 . VAL E 2 48 ? -1.048 62.512 -4.407 1.00 50.99 ? 48 VAL D CG2 1 ATOM 9222 N N . THR E 2 49 ? -1.898 66.247 -7.078 1.00 58.70 ? 49 THR D N 1 ATOM 9223 C CA . THR E 2 49 ? -2.630 67.114 -7.987 1.00 58.77 ? 49 THR D CA 1 ATOM 9224 C C . THR E 2 49 ? -2.016 67.071 -9.409 1.00 57.75 ? 49 THR D C 1 ATOM 9225 O O . THR E 2 49 ? -2.740 67.069 -10.406 1.00 50.89 ? 49 THR D O 1 ATOM 9226 C CB . THR E 2 49 ? -2.717 68.549 -7.426 1.00 55.79 ? 49 THR D CB 1 ATOM 9227 O OG1 . THR E 2 49 ? -3.582 68.532 -6.285 1.00 60.98 ? 49 THR D OG1 1 ATOM 9228 C CG2 . THR E 2 49 ? -3.267 69.557 -8.446 1.00 54.66 ? 49 THR D CG2 1 ATOM 9229 N N . ASN E 2 50 ? -0.696 67.105 -9.485 1.00 58.15 ? 50 ASN D N 1 ATOM 9230 C CA . ASN E 2 50 ? -0.025 67.032 -10.755 1.00 59.39 ? 50 ASN D CA 1 ATOM 9231 C C . ASN E 2 50 ? -0.278 65.729 -11.455 1.00 58.48 ? 50 ASN D C 1 ATOM 9232 O O . ASN E 2 50 ? -0.333 65.692 -12.666 1.00 60.45 ? 50 ASN D O 1 ATOM 9233 C CB . ASN E 2 50 ? 1.465 67.169 -10.600 1.00 65.81 ? 50 ASN D CB 1 ATOM 9234 C CG . ASN E 2 50 ? 1.975 68.390 -11.285 1.00 74.87 ? 50 ASN D CG 1 ATOM 9235 O OD1 . ASN E 2 50 ? 2.466 68.315 -12.417 1.00 68.86 ? 50 ASN D OD1 1 ATOM 9236 N ND2 . ASN E 2 50 ? 1.807 69.542 -10.634 1.00 77.23 ? 50 ASN D ND2 1 ATOM 9237 N N . LYS E 2 51 ? -0.401 64.664 -10.678 1.00 49.44 ? 51 LYS D N 1 ATOM 9238 C CA . LYS E 2 51 ? -0.597 63.374 -11.219 1.00 50.08 ? 51 LYS D CA 1 ATOM 9239 C C . LYS E 2 51 ? -1.927 63.330 -11.960 1.00 47.62 ? 51 LYS D C 1 ATOM 9240 O O . LYS E 2 51 ? -2.005 62.841 -13.072 1.00 43.04 ? 51 LYS D O 1 ATOM 9241 C CB . LYS E 2 51 ? -0.565 62.291 -10.127 1.00 52.40 ? 51 LYS D CB 1 ATOM 9242 C CG . LYS E 2 51 ? -1.061 60.911 -10.589 1.00 49.86 ? 51 LYS D CG 1 ATOM 9243 C CD . LYS E 2 51 ? -1.021 59.877 -9.481 1.00 50.91 ? 51 LYS D CD 1 ATOM 9244 C CE . LYS E 2 51 ? 0.383 59.564 -8.988 1.00 55.06 ? 51 LYS D CE 1 ATOM 9245 N NZ . LYS E 2 51 ? 0.459 58.173 -8.401 1.00 56.81 ? 51 LYS D NZ 1 ATOM 9246 N N . VAL E 2 52 ? -2.972 63.757 -11.279 1.00 49.31 ? 52 VAL D N 1 ATOM 9247 C CA . VAL E 2 52 ? -4.321 63.709 -11.798 1.00 47.73 ? 52 VAL D CA 1 ATOM 9248 C C . VAL E 2 52 ? -4.400 64.557 -13.048 1.00 51.74 ? 52 VAL D C 1 ATOM 9249 O O . VAL E 2 52 ? -4.892 64.117 -14.096 1.00 57.06 ? 52 VAL D O 1 ATOM 9250 C CB . VAL E 2 52 ? -5.318 64.219 -10.746 1.00 51.65 ? 52 VAL D CB 1 ATOM 9251 C CG1 . VAL E 2 52 ? -6.681 64.447 -11.369 1.00 56.19 ? 52 VAL D CG1 1 ATOM 9252 C CG2 . VAL E 2 52 ? -5.445 63.215 -9.611 1.00 51.88 ? 52 VAL D CG2 1 ATOM 9253 N N . ASN E 2 53 ? -3.871 65.764 -12.960 1.00 50.98 ? 53 ASN D N 1 ATOM 9254 C CA . ASN E 2 53 ? -3.864 66.655 -14.097 1.00 52.98 ? 53 ASN D CA 1 ATOM 9255 C C . ASN E 2 53 ? -3.068 66.091 -15.286 1.00 51.23 ? 53 ASN D C 1 ATOM 9256 O O . ASN E 2 53 ? -3.412 66.330 -16.425 1.00 56.30 ? 53 ASN D O 1 ATOM 9257 C CB . ASN E 2 53 ? -3.341 68.047 -13.705 1.00 52.41 ? 53 ASN D CB 1 ATOM 9258 C CG . ASN E 2 53 ? -4.329 68.827 -12.842 1.00 55.46 ? 53 ASN D CG 1 ATOM 9259 O OD1 . ASN E 2 53 ? -5.519 68.549 -12.817 1.00 46.11 ? 53 ASN D OD1 1 ATOM 9260 N ND2 . ASN E 2 53 ? -3.819 69.811 -12.122 1.00 62.59 ? 53 ASN D ND2 1 ATOM 9261 N N . SER E 2 54 ? -1.996 65.377 -15.014 1.00 46.05 ? 54 SER D N 1 ATOM 9262 C CA . SER E 2 54 ? -1.182 64.790 -16.062 1.00 46.53 ? 54 SER D CA 1 ATOM 9263 C C . SER E 2 54 ? -1.969 63.692 -16.793 1.00 47.05 ? 54 SER D C 1 ATOM 9264 O O . SER E 2 54 ? -1.969 63.622 -17.999 1.00 41.12 ? 54 SER D O 1 ATOM 9265 C CB . SER E 2 54 ? 0.067 64.192 -15.469 1.00 46.71 ? 54 SER D CB 1 ATOM 9266 O OG . SER E 2 54 ? 0.993 65.180 -15.128 1.00 48.28 ? 54 SER D OG 1 ATOM 9267 N N . ILE E 2 55 ? -2.667 62.871 -16.024 1.00 48.45 ? 55 ILE D N 1 ATOM 9268 C CA . ILE E 2 55 ? -3.493 61.839 -16.559 1.00 48.35 ? 55 ILE D CA 1 ATOM 9269 C C . ILE E 2 55 ? -4.596 62.423 -17.426 1.00 49.14 ? 55 ILE D C 1 ATOM 9270 O O . ILE E 2 55 ? -5.027 61.795 -18.398 1.00 56.78 ? 55 ILE D O 1 ATOM 9271 C CB . ILE E 2 55 ? -4.020 60.955 -15.431 1.00 46.08 ? 55 ILE D CB 1 ATOM 9272 C CG1 . ILE E 2 55 ? -2.879 60.085 -14.943 1.00 46.71 ? 55 ILE D CG1 1 ATOM 9273 C CG2 . ILE E 2 55 ? -5.158 60.068 -15.914 1.00 49.88 ? 55 ILE D CG2 1 ATOM 9274 C CD1 . ILE E 2 55 ? -3.155 59.360 -13.648 1.00 46.79 ? 55 ILE D CD1 1 ATOM 9275 N N . ILE E 2 56 ? -5.060 63.611 -17.066 1.00 51.67 ? 56 ILE D N 1 ATOM 9276 C CA . ILE E 2 56 ? -6.143 64.308 -17.791 1.00 46.58 ? 56 ILE D CA 1 ATOM 9277 C C . ILE E 2 56 ? -5.594 65.103 -18.985 1.00 49.56 ? 56 ILE D C 1 ATOM 9278 O O . ILE E 2 56 ? -6.110 65.019 -20.083 1.00 48.72 ? 56 ILE D O 1 ATOM 9279 C CB . ILE E 2 56 ? -6.896 65.258 -16.827 1.00 44.63 ? 56 ILE D CB 1 ATOM 9280 C CG1 . ILE E 2 56 ? -7.692 64.465 -15.780 1.00 45.31 ? 56 ILE D CG1 1 ATOM 9281 C CG2 . ILE E 2 56 ? -7.841 66.238 -17.553 1.00 42.07 ? 56 ILE D CG2 1 ATOM 9282 C CD1 . ILE E 2 56 ? -8.337 65.320 -14.682 1.00 43.60 ? 56 ILE D CD1 1 ATOM 9283 N N . ASP E 2 57 ? -4.545 65.870 -18.741 1.00 52.99 ? 57 ASP D N 1 ATOM 9284 C CA . ASP E 2 57 ? -4.073 66.875 -19.691 1.00 57.30 ? 57 ASP D CA 1 ATOM 9285 C C . ASP E 2 57 ? -3.297 66.272 -20.856 1.00 52.76 ? 57 ASP D C 1 ATOM 9286 O O . ASP E 2 57 ? -3.181 66.898 -21.888 1.00 53.41 ? 57 ASP D O 1 ATOM 9287 C CB . ASP E 2 57 ? -3.169 67.924 -18.996 1.00 67.01 ? 57 ASP D CB 1 ATOM 9288 C CG . ASP E 2 57 ? -3.912 68.791 -17.934 1.00 75.27 ? 57 ASP D CG 1 ATOM 9289 O OD1 . ASP E 2 57 ? -5.166 68.813 -17.904 1.00 75.16 ? 57 ASP D OD1 1 ATOM 9290 O OD2 . ASP E 2 57 ? -3.214 69.482 -17.143 1.00 84.80 ? 57 ASP D OD2 1 ATOM 9291 N N . LYS E 2 58 ? -2.743 65.083 -20.683 1.00 50.52 ? 58 LYS D N 1 ATOM 9292 C CA . LYS E 2 58 ? -1.949 64.427 -21.722 1.00 49.20 ? 58 LYS D CA 1 ATOM 9293 C C . LYS E 2 58 ? -2.804 63.800 -22.833 1.00 52.15 ? 58 LYS D C 1 ATOM 9294 O O . LYS E 2 58 ? -2.292 63.511 -23.905 1.00 46.90 ? 58 LYS D O 1 ATOM 9295 C CB . LYS E 2 58 ? -1.065 63.361 -21.104 1.00 49.83 ? 58 LYS D CB 1 ATOM 9296 C CG . LYS E 2 58 ? 0.419 63.673 -21.111 1.00 54.61 ? 58 LYS D CG 1 ATOM 9297 C CD . LYS E 2 58 ? 0.767 65.034 -20.572 1.00 54.20 ? 58 LYS D CD 1 ATOM 9298 C CE . LYS E 2 58 ? 1.814 65.733 -21.426 1.00 54.51 ? 58 LYS D CE 1 ATOM 9299 N NZ . LYS E 2 58 ? 3.196 65.471 -20.970 1.00 52.46 ? 58 LYS D NZ 1 ATOM 9300 N N . MET E 2 59 ? -4.102 63.617 -22.570 1.00 55.52 ? 59 MET D N 1 ATOM 9301 C CA . MET E 2 59 ? -5.052 63.171 -23.562 1.00 55.28 ? 59 MET D CA 1 ATOM 9302 C C . MET E 2 59 ? -5.216 64.169 -24.703 1.00 57.91 ? 59 MET D C 1 ATOM 9303 O O . MET E 2 59 ? -5.626 65.304 -24.513 1.00 66.14 ? 59 MET D O 1 ATOM 9304 C CB . MET E 2 59 ? -6.435 62.919 -22.937 1.00 55.83 ? 59 MET D CB 1 ATOM 9305 C CG . MET E 2 59 ? -7.442 62.246 -23.885 1.00 53.87 ? 59 MET D CG 1 ATOM 9306 S SD . MET E 2 59 ? -6.812 60.698 -24.610 1.00 48.22 ? 59 MET D SD 1 ATOM 9307 C CE . MET E 2 59 ? -7.047 59.567 -23.259 1.00 46.97 ? 59 MET D CE 1 ATOM 9308 N N . ASN E 2 60 ? -4.881 63.718 -25.903 1.00 60.24 ? 60 ASN D N 1 ATOM 9309 C CA . ASN E 2 60 ? -5.143 64.450 -27.110 1.00 57.71 ? 60 ASN D CA 1 ATOM 9310 C C . ASN E 2 60 ? -6.559 64.118 -27.582 1.00 59.47 ? 60 ASN D C 1 ATOM 9311 O O . ASN E 2 60 ? -6.933 62.976 -27.772 1.00 62.48 ? 60 ASN D O 1 ATOM 9312 C CB . ASN E 2 60 ? -4.127 64.091 -28.176 1.00 58.32 ? 60 ASN D CB 1 ATOM 9313 C CG . ASN E 2 60 ? -4.243 64.961 -29.404 1.00 60.35 ? 60 ASN D CG 1 ATOM 9314 O OD1 . ASN E 2 60 ? -4.109 66.179 -29.318 1.00 68.10 ? 60 ASN D OD1 1 ATOM 9315 N ND2 . ASN E 2 60 ? -4.479 64.338 -30.556 1.00 57.08 ? 60 ASN D ND2 1 ATOM 9316 N N . THR E 2 61 ? -7.324 65.169 -27.788 1.00 61.73 ? 61 THR D N 1 ATOM 9317 C CA . THR E 2 61 ? -8.696 65.105 -28.165 1.00 58.24 ? 61 THR D CA 1 ATOM 9318 C C . THR E 2 61 ? -8.779 65.676 -29.580 1.00 55.18 ? 61 THR D C 1 ATOM 9319 O O . THR E 2 61 ? -8.200 66.713 -29.874 1.00 56.70 ? 61 THR D O 1 ATOM 9320 C CB . THR E 2 61 ? -9.523 65.931 -27.149 1.00 63.73 ? 61 THR D CB 1 ATOM 9321 O OG1 . THR E 2 61 ? -10.475 65.081 -26.508 1.00 71.38 ? 61 THR D OG1 1 ATOM 9322 C CG2 . THR E 2 61 ? -10.206 67.195 -27.774 1.00 64.70 ? 61 THR D CG2 1 ATOM 9323 N N . GLN E 2 62 ? -9.489 65.003 -30.477 1.00 57.56 ? 62 GLN D N 1 ATOM 9324 C CA . GLN E 2 62 ? -9.781 65.620 -31.783 1.00 56.04 ? 62 GLN D CA 1 ATOM 9325 C C . GLN E 2 62 ? -11.183 65.424 -32.300 1.00 53.04 ? 62 GLN D C 1 ATOM 9326 O O . GLN E 2 62 ? -11.893 64.495 -31.919 1.00 49.75 ? 62 GLN D O 1 ATOM 9327 C CB . GLN E 2 62 ? -8.755 65.269 -32.878 1.00 53.98 ? 62 GLN D CB 1 ATOM 9328 C CG . GLN E 2 62 ? -8.052 63.952 -32.790 1.00 52.43 ? 62 GLN D CG 1 ATOM 9329 C CD . GLN E 2 62 ? -6.930 63.838 -33.831 1.00 53.22 ? 62 GLN D CD 1 ATOM 9330 O OE1 . GLN E 2 62 ? -6.873 64.595 -34.810 1.00 54.32 ? 62 GLN D OE1 1 ATOM 9331 N NE2 . GLN E 2 62 ? -6.048 62.892 -33.618 1.00 47.88 ? 62 GLN D NE2 1 ATOM 9332 N N . PHE E 2 63 ? -11.570 66.331 -33.190 1.00 52.19 ? 63 PHE D N 1 ATOM 9333 C CA . PHE E 2 63 ? -12.877 66.254 -33.813 1.00 48.10 ? 63 PHE D CA 1 ATOM 9334 C C . PHE E 2 63 ? -13.017 64.938 -34.583 1.00 46.99 ? 63 PHE D C 1 ATOM 9335 O O . PHE E 2 63 ? -12.193 64.627 -35.452 1.00 41.35 ? 63 PHE D O 1 ATOM 9336 C CB . PHE E 2 63 ? -13.098 67.399 -34.787 1.00 46.83 ? 63 PHE D CB 1 ATOM 9337 C CG . PHE E 2 63 ? -14.428 67.350 -35.432 1.00 47.84 ? 63 PHE D CG 1 ATOM 9338 C CD1 . PHE E 2 63 ? -15.520 67.930 -34.811 1.00 52.53 ? 63 PHE D CD1 1 ATOM 9339 C CD2 . PHE E 2 63 ? -14.617 66.663 -36.595 1.00 49.15 ? 63 PHE D CD2 1 ATOM 9340 C CE1 . PHE E 2 63 ? -16.782 67.872 -35.377 1.00 51.61 ? 63 PHE D CE1 1 ATOM 9341 C CE2 . PHE E 2 63 ? -15.874 66.587 -37.170 1.00 53.86 ? 63 PHE D CE2 1 ATOM 9342 C CZ . PHE E 2 63 ? -16.963 67.193 -36.554 1.00 52.71 ? 63 PHE D CZ 1 ATOM 9343 N N . GLU E 2 64 ? -14.061 64.183 -34.278 1.00 45.09 ? 64 GLU D N 1 ATOM 9344 C CA . GLU E 2 64 ? -14.478 63.101 -35.164 1.00 46.04 ? 64 GLU D CA 1 ATOM 9345 C C . GLU E 2 64 ? -15.996 63.050 -35.227 1.00 46.57 ? 64 GLU D C 1 ATOM 9346 O O . GLU E 2 64 ? -16.693 63.383 -34.260 1.00 45.09 ? 64 GLU D O 1 ATOM 9347 C CB . GLU E 2 64 ? -13.943 61.740 -34.698 1.00 44.24 ? 64 GLU D CB 1 ATOM 9348 C CG . GLU E 2 64 ? -12.433 61.662 -34.435 1.00 42.79 ? 64 GLU D CG 1 ATOM 9349 C CD . GLU E 2 64 ? -11.567 61.807 -35.685 1.00 41.19 ? 64 GLU D CD 1 ATOM 9350 O OE1 . GLU E 2 64 ? -12.058 61.677 -36.842 1.00 40.22 ? 64 GLU D OE1 1 ATOM 9351 O OE2 . GLU E 2 64 ? -10.378 62.051 -35.489 1.00 37.39 ? 64 GLU D OE2 1 ATOM 9352 N N . ALA E 2 65 ? -16.489 62.569 -36.355 1.00 45.46 ? 65 ALA D N 1 ATOM 9353 C CA . ALA E 2 65 ? -17.897 62.378 -36.532 1.00 42.48 ? 65 ALA D CA 1 ATOM 9354 C C . ALA E 2 65 ? -18.152 60.884 -36.705 1.00 38.99 ? 65 ALA D C 1 ATOM 9355 O O . ALA E 2 65 ? -17.796 60.294 -37.726 1.00 40.75 ? 65 ALA D O 1 ATOM 9356 C CB . ALA E 2 65 ? -18.366 63.159 -37.737 1.00 43.39 ? 65 ALA D CB 1 ATOM 9357 N N . VAL E 2 66 ? -18.805 60.282 -35.718 1.00 35.21 ? 66 VAL D N 1 ATOM 9358 C CA . VAL E 2 66 ? -19.060 58.850 -35.720 1.00 33.56 ? 66 VAL D CA 1 ATOM 9359 C C . VAL E 2 66 ? -20.552 58.587 -35.987 1.00 34.04 ? 66 VAL D C 1 ATOM 9360 O O . VAL E 2 66 ? -21.387 58.953 -35.181 1.00 37.46 ? 66 VAL D O 1 ATOM 9361 C CB . VAL E 2 66 ? -18.703 58.208 -34.372 1.00 33.21 ? 66 VAL D CB 1 ATOM 9362 C CG1 . VAL E 2 66 ? -18.881 56.715 -34.490 1.00 34.11 ? 66 VAL D CG1 1 ATOM 9363 C CG2 . VAL E 2 66 ? -17.293 58.543 -33.903 1.00 31.56 ? 66 VAL D CG2 1 ATOM 9364 N N . GLY E 2 67 ? -20.857 57.943 -37.096 1.00 33.81 ? 67 GLY D N 1 ATOM 9365 C CA . GLY E 2 67 ? -22.206 57.517 -37.428 1.00 37.52 ? 67 GLY D CA 1 ATOM 9366 C C . GLY E 2 67 ? -22.252 56.120 -38.058 1.00 36.92 ? 67 GLY D C 1 ATOM 9367 O O . GLY E 2 67 ? -21.422 55.276 -37.803 1.00 38.90 ? 67 GLY D O 1 ATOM 9368 N N . ARG E 2 68 ? -23.230 55.908 -38.909 1.00 38.06 ? 68 ARG D N 1 ATOM 9369 C CA . ARG E 2 68 ? -23.452 54.633 -39.556 1.00 37.99 ? 68 ARG D CA 1 ATOM 9370 C C . ARG E 2 68 ? -23.876 54.900 -40.959 1.00 36.25 ? 68 ARG D C 1 ATOM 9371 O O . ARG E 2 68 ? -25.046 54.848 -41.258 1.00 33.46 ? 68 ARG D O 1 ATOM 9372 C CB . ARG E 2 68 ? -24.541 53.835 -38.793 1.00 37.62 ? 68 ARG D CB 1 ATOM 9373 C CG . ARG E 2 68 ? -24.059 53.372 -37.402 1.00 41.92 ? 68 ARG D CG 1 ATOM 9374 C CD . ARG E 2 68 ? -22.910 52.362 -37.520 1.00 40.34 ? 68 ARG D CD 1 ATOM 9375 N NE . ARG E 2 68 ? -22.486 51.809 -36.245 1.00 39.53 ? 68 ARG D NE 1 ATOM 9376 C CZ . ARG E 2 68 ? -21.370 52.124 -35.597 1.00 40.01 ? 68 ARG D CZ 1 ATOM 9377 N NH1 . ARG E 2 68 ? -20.553 53.063 -36.044 1.00 39.22 ? 68 ARG D NH1 1 ATOM 9378 N NH2 . ARG E 2 68 ? -21.072 51.500 -34.468 1.00 39.98 ? 68 ARG D NH2 1 ATOM 9379 N N . GLU E 2 69 ? -22.906 55.143 -41.829 1.00 39.73 ? 69 GLU D N 1 ATOM 9380 C CA . GLU E 2 69 ? -23.168 55.689 -43.148 1.00 41.12 ? 69 GLU D CA 1 ATOM 9381 C C . GLU E 2 69 ? -23.212 54.606 -44.231 1.00 39.23 ? 69 GLU D C 1 ATOM 9382 O O . GLU E 2 69 ? -23.450 54.928 -45.407 1.00 39.00 ? 69 GLU D O 1 ATOM 9383 C CB . GLU E 2 69 ? -22.068 56.702 -43.498 1.00 50.83 ? 69 GLU D CB 1 ATOM 9384 C CG . GLU E 2 69 ? -22.141 58.059 -42.780 1.00 61.84 ? 69 GLU D CG 1 ATOM 9385 C CD . GLU E 2 69 ? -22.681 59.239 -43.654 1.00 78.29 ? 69 GLU D CD 1 ATOM 9386 O OE1 . GLU E 2 69 ? -23.479 59.111 -44.686 1.00 78.32 ? 69 GLU D OE1 1 ATOM 9387 O OE2 . GLU E 2 69 ? -22.280 60.360 -43.268 1.00 73.59 ? 69 GLU D OE2 1 ATOM 9388 N N . PHE E 2 70 ? -22.977 53.345 -43.880 1.00 34.41 ? 70 PHE D N 1 ATOM 9389 C CA . PHE E 2 70 ? -22.948 52.272 -44.923 1.00 36.26 ? 70 PHE D CA 1 ATOM 9390 C C . PHE E 2 70 ? -24.257 51.521 -45.119 1.00 35.66 ? 70 PHE D C 1 ATOM 9391 O O . PHE E 2 70 ? -24.953 51.193 -44.156 1.00 34.63 ? 70 PHE D O 1 ATOM 9392 C CB . PHE E 2 70 ? -21.779 51.335 -44.672 1.00 34.44 ? 70 PHE D CB 1 ATOM 9393 C CG . PHE E 2 70 ? -20.459 52.061 -44.689 1.00 33.32 ? 70 PHE D CG 1 ATOM 9394 C CD1 . PHE E 2 70 ? -19.801 52.386 -43.512 1.00 33.48 ? 70 PHE D CD1 1 ATOM 9395 C CD2 . PHE E 2 70 ? -19.922 52.487 -45.892 1.00 32.97 ? 70 PHE D CD2 1 ATOM 9396 C CE1 . PHE E 2 70 ? -18.636 53.120 -43.542 1.00 32.74 ? 70 PHE D CE1 1 ATOM 9397 C CE2 . PHE E 2 70 ? -18.724 53.193 -45.943 1.00 31.95 ? 70 PHE D CE2 1 ATOM 9398 C CZ . PHE E 2 70 ? -18.087 53.524 -44.762 1.00 31.41 ? 70 PHE D CZ 1 ATOM 9399 N N . ASN E 2 71 ? -24.597 51.241 -46.377 1.00 33.03 ? 71 ASN D N 1 ATOM 9400 C CA . ASN E 2 71 ? -25.880 50.593 -46.682 1.00 32.63 ? 71 ASN D CA 1 ATOM 9401 C C . ASN E 2 71 ? -25.867 49.036 -46.615 1.00 32.83 ? 71 ASN D C 1 ATOM 9402 O O . ASN E 2 71 ? -24.868 48.437 -46.236 1.00 34.99 ? 71 ASN D O 1 ATOM 9403 C CB . ASN E 2 71 ? -26.428 51.091 -48.017 1.00 33.05 ? 71 ASN D CB 1 ATOM 9404 C CG . ASN E 2 71 ? -25.658 50.556 -49.209 1.00 37.21 ? 71 ASN D CG 1 ATOM 9405 O OD1 . ASN E 2 71 ? -25.127 49.429 -49.229 1.00 42.21 ? 71 ASN D OD1 1 ATOM 9406 N ND2 . ASN E 2 71 ? -25.545 51.391 -50.205 1.00 38.67 ? 71 ASN D ND2 1 ATOM 9407 N N . ASN E 2 72 ? -26.978 48.418 -47.017 1.00 34.28 ? 72 ASN D N 1 ATOM 9408 C CA . ASN E 2 72 ? -27.191 46.996 -46.859 1.00 39.08 ? 72 ASN D CA 1 ATOM 9409 C C . ASN E 2 72 ? -26.347 46.137 -47.794 1.00 36.28 ? 72 ASN D C 1 ATOM 9410 O O . ASN E 2 72 ? -26.190 44.937 -47.553 1.00 32.86 ? 72 ASN D O 1 ATOM 9411 C CB . ASN E 2 72 ? -28.676 46.651 -47.033 1.00 44.97 ? 72 ASN D CB 1 ATOM 9412 C CG . ASN E 2 72 ? -29.002 45.195 -46.622 1.00 53.84 ? 72 ASN D CG 1 ATOM 9413 O OD1 . ASN E 2 72 ? -28.730 44.754 -45.491 1.00 54.80 ? 72 ASN D OD1 1 ATOM 9414 N ND2 . ASN E 2 72 ? -29.602 44.444 -47.546 1.00 61.56 ? 72 ASN D ND2 1 ATOM 9415 N N . LEU E 2 73 ? -25.760 46.753 -48.820 1.00 33.89 ? 73 LEU D N 1 ATOM 9416 C CA . LEU E 2 73 ? -24.770 46.104 -49.624 1.00 34.02 ? 73 LEU D CA 1 ATOM 9417 C C . LEU E 2 73 ? -23.330 46.644 -49.411 1.00 34.67 ? 73 LEU D C 1 ATOM 9418 O O . LEU E 2 73 ? -22.461 46.537 -50.329 1.00 32.26 ? 73 LEU D O 1 ATOM 9419 C CB . LEU E 2 73 ? -25.165 46.171 -51.098 1.00 36.05 ? 73 LEU D CB 1 ATOM 9420 C CG . LEU E 2 73 ? -26.332 45.219 -51.416 1.00 40.13 ? 73 LEU D CG 1 ATOM 9421 C CD1 . LEU E 2 73 ? -26.872 45.383 -52.827 1.00 40.22 ? 73 LEU D CD1 1 ATOM 9422 C CD2 . LEU E 2 73 ? -25.935 43.756 -51.191 1.00 42.96 ? 73 LEU D CD2 1 ATOM 9423 N N . GLU E 2 74 ? -23.074 47.154 -48.211 1.00 31.55 ? 74 GLU D N 1 ATOM 9424 C CA . GLU E 2 74 ? -21.736 47.577 -47.803 1.00 32.04 ? 74 GLU D CA 1 ATOM 9425 C C . GLU E 2 74 ? -21.433 47.057 -46.400 1.00 31.90 ? 74 GLU D C 1 ATOM 9426 O O . GLU E 2 74 ? -20.793 47.742 -45.582 1.00 30.27 ? 74 GLU D O 1 ATOM 9427 C CB . GLU E 2 74 ? -21.637 49.097 -47.850 1.00 32.60 ? 74 GLU D CB 1 ATOM 9428 C CG . GLU E 2 74 ? -21.766 49.701 -49.249 1.00 30.58 ? 74 GLU D CG 1 ATOM 9429 C CD . GLU E 2 74 ? -21.891 51.238 -49.229 1.00 32.60 ? 74 GLU D CD 1 ATOM 9430 O OE1 . GLU E 2 74 ? -22.545 51.823 -48.328 1.00 36.79 ? 74 GLU D OE1 1 ATOM 9431 O OE2 . GLU E 2 74 ? -21.355 51.892 -50.132 1.00 32.88 ? 74 GLU D OE2 1 ATOM 9432 N N . ARG E 2 75 ? -21.906 45.838 -46.118 1.00 32.83 ? 75 ARG D N 1 ATOM 9433 C CA . ARG E 2 75 ? -21.734 45.263 -44.807 1.00 34.48 ? 75 ARG D CA 1 ATOM 9434 C C . ARG E 2 75 ? -20.268 44.882 -44.551 1.00 33.99 ? 75 ARG D C 1 ATOM 9435 O O . ARG E 2 75 ? -19.828 44.861 -43.400 1.00 34.73 ? 75 ARG D O 1 ATOM 9436 C CB . ARG E 2 75 ? -22.622 44.028 -44.645 1.00 39.66 ? 75 ARG D CB 1 ATOM 9437 C CG . ARG E 2 75 ? -24.126 44.273 -44.633 1.00 46.37 ? 75 ARG D CG 1 ATOM 9438 C CD . ARG E 2 75 ? -24.516 45.175 -43.514 1.00 58.96 ? 75 ARG D CD 1 ATOM 9439 N NE . ARG E 2 75 ? -25.971 45.230 -43.291 1.00 85.82 ? 75 ARG D NE 1 ATOM 9440 C CZ . ARG E 2 75 ? -26.663 46.334 -42.955 1.00 93.35 ? 75 ARG D CZ 1 ATOM 9441 N NH1 . ARG E 2 75 ? -26.037 47.509 -42.820 1.00 98.05 ? 75 ARG D NH1 1 ATOM 9442 N NH2 . ARG E 2 75 ? -27.985 46.266 -42.778 1.00 85.88 ? 75 ARG D NH2 1 ATOM 9443 N N . ARG E 2 76 ? -19.502 44.525 -45.583 1.00 31.46 ? 76 ARG D N 1 ATOM 9444 C CA . ARG E 2 76 ? -18.061 44.231 -45.311 1.00 30.12 ? 76 ARG D CA 1 ATOM 9445 C C . ARG E 2 76 ? -17.333 45.440 -44.769 1.00 29.26 ? 76 ARG D C 1 ATOM 9446 O O . ARG E 2 76 ? -16.594 45.352 -43.804 1.00 30.01 ? 76 ARG D O 1 ATOM 9447 C CB . ARG E 2 76 ? -17.368 43.696 -46.572 1.00 29.37 ? 76 ARG D CB 1 ATOM 9448 C CG . ARG E 2 76 ? -17.928 42.340 -46.962 1.00 27.93 ? 76 ARG D CG 1 ATOM 9449 C CD . ARG E 2 76 ? -17.525 41.981 -48.357 1.00 28.49 ? 76 ARG D CD 1 ATOM 9450 N NE . ARG E 2 76 ? -17.848 43.032 -49.298 1.00 27.28 ? 76 ARG D NE 1 ATOM 9451 C CZ . ARG E 2 76 ? -17.104 43.366 -50.335 1.00 26.06 ? 76 ARG D CZ 1 ATOM 9452 N NH1 . ARG E 2 76 ? -15.999 42.688 -50.618 1.00 27.58 ? 76 ARG D NH1 1 ATOM 9453 N NH2 . ARG E 2 76 ? -17.498 44.335 -51.132 1.00 25.52 ? 76 ARG D NH2 1 ATOM 9454 N N . ILE E 2 77 ? -17.580 46.606 -45.363 1.00 31.65 ? 77 ILE D N 1 ATOM 9455 C CA . ILE E 2 77 ? -16.971 47.881 -44.891 1.00 32.67 ? 77 ILE D CA 1 ATOM 9456 C C . ILE E 2 77 ? -17.497 48.265 -43.507 1.00 31.43 ? 77 ILE D C 1 ATOM 9457 O O . ILE E 2 77 ? -16.719 48.623 -42.617 1.00 31.20 ? 77 ILE D O 1 ATOM 9458 C CB . ILE E 2 77 ? -17.233 49.059 -45.859 1.00 34.96 ? 77 ILE D CB 1 ATOM 9459 C CG1 . ILE E 2 77 ? -16.562 48.816 -47.183 1.00 38.72 ? 77 ILE D CG1 1 ATOM 9460 C CG2 . ILE E 2 77 ? -16.640 50.320 -45.316 1.00 39.65 ? 77 ILE D CG2 1 ATOM 9461 C CD1 . ILE E 2 77 ? -17.134 49.632 -48.318 1.00 41.69 ? 77 ILE D CD1 1 ATOM 9462 N N . GLU E 2 78 ? -18.806 48.131 -43.303 1.00 32.45 ? 78 GLU D N 1 ATOM 9463 C CA . GLU E 2 78 ? -19.391 48.304 -41.967 1.00 34.87 ? 78 GLU D CA 1 ATOM 9464 C C . GLU E 2 78 ? -18.695 47.382 -40.954 1.00 34.36 ? 78 GLU D C 1 ATOM 9465 O O . GLU E 2 78 ? -18.330 47.833 -39.866 1.00 31.31 ? 78 GLU D O 1 ATOM 9466 C CB . GLU E 2 78 ? -20.896 48.058 -41.980 1.00 39.31 ? 78 GLU D CB 1 ATOM 9467 C CG . GLU E 2 78 ? -21.624 48.243 -40.642 1.00 50.64 ? 78 GLU D CG 1 ATOM 9468 C CD . GLU E 2 78 ? -23.175 47.961 -40.773 1.00 72.63 ? 78 GLU D CD 1 ATOM 9469 O OE1 . GLU E 2 78 ? -23.584 46.780 -41.067 1.00 57.66 ? 78 GLU D OE1 1 ATOM 9470 O OE2 . GLU E 2 78 ? -23.997 48.937 -40.589 1.00 74.16 ? 78 GLU D OE2 1 ATOM 9471 N N . ASN E 2 79 ? -18.421 46.124 -41.332 1.00 31.96 ? 79 ASN D N 1 ATOM 9472 C CA . ASN E 2 79 ? -17.705 45.238 -40.404 1.00 32.67 ? 79 ASN D CA 1 ATOM 9473 C C . ASN E 2 79 ? -16.295 45.758 -40.104 1.00 34.95 ? 79 ASN D C 1 ATOM 9474 O O . ASN E 2 79 ? -15.787 45.652 -38.977 1.00 31.65 ? 79 ASN D O 1 ATOM 9475 C CB . ASN E 2 79 ? -17.652 43.819 -40.923 1.00 31.21 ? 79 ASN D CB 1 ATOM 9476 C CG . ASN E 2 79 ? -16.970 42.897 -39.987 1.00 31.43 ? 79 ASN D CG 1 ATOM 9477 O OD1 . ASN E 2 79 ? -16.010 42.245 -40.340 1.00 36.49 ? 79 ASN D OD1 1 ATOM 9478 N ND2 . ASN E 2 79 ? -17.478 42.795 -38.795 1.00 33.10 ? 79 ASN D ND2 1 ATOM 9479 N N . LEU E 2 80 ? -15.670 46.342 -41.112 1.00 34.37 ? 80 LEU D N 1 ATOM 9480 C CA . LEU E 2 80 ? -14.322 46.894 -40.919 1.00 33.75 ? 80 LEU D CA 1 ATOM 9481 C C . LEU E 2 80 ? -14.423 48.012 -39.886 1.00 33.40 ? 80 LEU D C 1 ATOM 9482 O O . LEU E 2 80 ? -13.612 48.087 -38.961 1.00 31.35 ? 80 LEU D O 1 ATOM 9483 C CB . LEU E 2 80 ? -13.762 47.377 -42.265 1.00 38.13 ? 80 LEU D CB 1 ATOM 9484 C CG . LEU E 2 80 ? -12.460 48.153 -42.403 1.00 43.89 ? 80 LEU D CG 1 ATOM 9485 C CD1 . LEU E 2 80 ? -11.401 47.458 -41.606 1.00 51.16 ? 80 LEU D CD1 1 ATOM 9486 C CD2 . LEU E 2 80 ? -12.020 48.199 -43.858 1.00 45.52 ? 80 LEU D CD2 1 ATOM 9487 N N . ASN E 2 81 ? -15.430 48.866 -39.999 1.00 30.17 ? 81 ASN D N 1 ATOM 9488 C CA . ASN E 2 81 ? -15.579 49.925 -38.993 1.00 31.23 ? 81 ASN D CA 1 ATOM 9489 C C . ASN E 2 81 ? -15.840 49.352 -37.618 1.00 30.31 ? 81 ASN D C 1 ATOM 9490 O O . ASN E 2 81 ? -15.401 49.879 -36.616 1.00 36.02 ? 81 ASN D O 1 ATOM 9491 C CB . ASN E 2 81 ? -16.709 50.859 -39.395 1.00 33.30 ? 81 ASN D CB 1 ATOM 9492 C CG . ASN E 2 81 ? -16.974 51.925 -38.370 1.00 34.62 ? 81 ASN D CG 1 ATOM 9493 O OD1 . ASN E 2 81 ? -16.208 52.871 -38.229 1.00 41.54 ? 81 ASN D OD1 1 ATOM 9494 N ND2 . ASN E 2 81 ? -18.061 51.783 -37.653 1.00 37.09 ? 81 ASN D ND2 1 ATOM 9495 N N . LYS E 2 82 ? -16.629 48.307 -37.550 1.00 32.00 ? 82 LYS D N 1 ATOM 9496 C CA . LYS E 2 82 ? -16.939 47.725 -36.268 1.00 32.48 ? 82 LYS D CA 1 ATOM 9497 C C . LYS E 2 82 ? -15.694 47.235 -35.623 1.00 32.05 ? 82 LYS D C 1 ATOM 9498 O O . LYS E 2 82 ? -15.497 47.377 -34.407 1.00 36.72 ? 82 LYS D O 1 ATOM 9499 C CB . LYS E 2 82 ? -17.917 46.563 -36.419 1.00 33.21 ? 82 LYS D CB 1 ATOM 9500 C CG . LYS E 2 82 ? -18.244 45.820 -35.130 1.00 35.07 ? 82 LYS D CG 1 ATOM 9501 C CD . LYS E 2 82 ? -19.115 44.613 -35.470 1.00 35.06 ? 82 LYS D CD 1 ATOM 9502 C CE . LYS E 2 82 ? -19.332 43.620 -34.332 1.00 35.52 ? 82 LYS D CE 1 ATOM 9503 N NZ . LYS E 2 82 ? -19.089 44.016 -32.910 1.00 36.81 ? 82 LYS D NZ 1 ATOM 9504 N N . LYS E 2 83 ? -14.849 46.592 -36.401 1.00 30.32 ? 83 LYS D N 1 ATOM 9505 C CA . LYS E 2 83 ? -13.654 45.992 -35.771 1.00 29.88 ? 83 LYS D CA 1 ATOM 9506 C C . LYS E 2 83 ? -12.751 47.112 -35.255 1.00 30.86 ? 83 LYS D C 1 ATOM 9507 O O . LYS E 2 83 ? -12.083 46.966 -34.226 1.00 28.01 ? 83 LYS D O 1 ATOM 9508 C CB . LYS E 2 83 ? -12.906 45.103 -36.745 1.00 28.71 ? 83 LYS D CB 1 ATOM 9509 C CG . LYS E 2 83 ? -13.582 43.787 -37.120 1.00 28.85 ? 83 LYS D CG 1 ATOM 9510 C CD . LYS E 2 83 ? -12.679 42.937 -37.996 1.00 31.87 ? 83 LYS D CD 1 ATOM 9511 C CE . LYS E 2 83 ? -12.705 43.437 -39.424 1.00 33.05 ? 83 LYS D CE 1 ATOM 9512 N NZ . LYS E 2 83 ? -11.705 42.807 -40.312 1.00 32.38 ? 83 LYS D NZ 1 ATOM 9513 N N . MET E 2 84 ? -12.715 48.225 -36.010 1.00 31.04 ? 84 MET D N 1 ATOM 9514 C CA . MET E 2 84 ? -11.925 49.372 -35.639 1.00 32.27 ? 84 MET D CA 1 ATOM 9515 C C . MET E 2 84 ? -12.432 49.973 -34.355 1.00 33.39 ? 84 MET D C 1 ATOM 9516 O O . MET E 2 84 ? -11.668 50.130 -33.391 1.00 29.81 ? 84 MET D O 1 ATOM 9517 C CB . MET E 2 84 ? -11.886 50.402 -36.739 1.00 34.81 ? 84 MET D CB 1 ATOM 9518 C CG . MET E 2 84 ? -10.908 51.537 -36.460 1.00 40.03 ? 84 MET D CG 1 ATOM 9519 S SD . MET E 2 84 ? -11.379 53.057 -37.270 1.00 48.16 ? 84 MET D SD 1 ATOM 9520 C CE . MET E 2 84 ? -12.692 53.571 -36.168 1.00 44.16 ? 84 MET D CE 1 ATOM 9521 N N . GLU E 2 85 ? -13.725 50.280 -34.326 1.00 37.64 ? 85 GLU D N 1 ATOM 9522 C CA . GLU E 2 85 ? -14.354 50.854 -33.117 1.00 39.61 ? 85 GLU D CA 1 ATOM 9523 C C . GLU E 2 85 ? -14.120 49.987 -31.893 1.00 36.39 ? 85 GLU D C 1 ATOM 9524 O O . GLU E 2 85 ? -13.679 50.479 -30.863 1.00 33.47 ? 85 GLU D O 1 ATOM 9525 C CB . GLU E 2 85 ? -15.865 50.995 -33.277 1.00 44.98 ? 85 GLU D CB 1 ATOM 9526 C CG . GLU E 2 85 ? -16.327 52.293 -33.913 1.00 49.00 ? 85 GLU D CG 1 ATOM 9527 C CD . GLU E 2 85 ? -17.838 52.498 -33.865 1.00 46.06 ? 85 GLU D CD 1 ATOM 9528 O OE1 . GLU E 2 85 ? -18.549 51.879 -33.028 1.00 47.60 ? 85 GLU D OE1 1 ATOM 9529 O OE2 . GLU E 2 85 ? -18.302 53.318 -34.658 1.00 44.35 ? 85 GLU D OE2 1 ATOM 9530 N N . ASP E 2 86 ? -14.491 48.716 -32.008 1.00 33.77 ? 86 ASP D N 1 ATOM 9531 C CA . ASP E 2 86 ? -14.348 47.764 -30.910 1.00 33.40 ? 86 ASP D CA 1 ATOM 9532 C C . ASP E 2 86 ? -12.856 47.648 -30.465 1.00 34.56 ? 86 ASP D C 1 ATOM 9533 O O . ASP E 2 86 ? -12.555 47.555 -29.263 1.00 33.63 ? 86 ASP D O 1 ATOM 9534 C CB . ASP E 2 86 ? -14.899 46.392 -31.322 1.00 35.40 ? 86 ASP D CB 1 ATOM 9535 C CG . ASP E 2 86 ? -16.404 46.402 -31.638 1.00 38.07 ? 86 ASP D CG 1 ATOM 9536 O OD1 . ASP E 2 86 ? -17.106 47.421 -31.351 1.00 44.07 ? 86 ASP D OD1 1 ATOM 9537 O OD2 . ASP E 2 86 ? -16.888 45.372 -32.168 1.00 35.52 ? 86 ASP D OD2 1 ATOM 9538 N N . GLY E 2 87 ? -11.955 47.684 -31.449 1.00 29.44 ? 87 GLY D N 1 ATOM 9539 C CA . GLY E 2 87 ? -10.540 47.642 -31.223 1.00 30.76 ? 87 GLY D CA 1 ATOM 9540 C C . GLY E 2 87 ? -10.069 48.750 -30.339 1.00 31.30 ? 87 GLY D C 1 ATOM 9541 O O . GLY E 2 87 ? -9.401 48.509 -29.353 1.00 33.42 ? 87 GLY D O 1 ATOM 9542 N N . PHE E 2 88 ? -10.460 49.972 -30.661 1.00 32.64 ? 88 PHE D N 1 ATOM 9543 C CA . PHE E 2 88 ? -10.037 51.141 -29.858 1.00 33.86 ? 88 PHE D CA 1 ATOM 9544 C C . PHE E 2 88 ? -10.713 51.128 -28.505 1.00 37.06 ? 88 PHE D C 1 ATOM 9545 O O . PHE E 2 88 ? -10.097 51.498 -27.491 1.00 36.09 ? 88 PHE D O 1 ATOM 9546 C CB . PHE E 2 88 ? -10.307 52.466 -30.541 1.00 33.84 ? 88 PHE D CB 1 ATOM 9547 C CG . PHE E 2 88 ? -9.346 52.770 -31.627 1.00 35.29 ? 88 PHE D CG 1 ATOM 9548 C CD1 . PHE E 2 88 ? -8.008 52.888 -31.364 1.00 37.16 ? 88 PHE D CD1 1 ATOM 9549 C CD2 . PHE E 2 88 ? -9.769 52.938 -32.903 1.00 39.30 ? 88 PHE D CD2 1 ATOM 9550 C CE1 . PHE E 2 88 ? -7.096 53.129 -32.367 1.00 39.67 ? 88 PHE D CE1 1 ATOM 9551 C CE2 . PHE E 2 88 ? -8.857 53.184 -33.917 1.00 38.57 ? 88 PHE D CE2 1 ATOM 9552 C CZ . PHE E 2 88 ? -7.528 53.308 -33.648 1.00 39.12 ? 88 PHE D CZ 1 ATOM 9553 N N . LEU E 2 89 ? -11.961 50.667 -28.461 1.00 36.19 ? 89 LEU D N 1 ATOM 9554 C CA . LEU E 2 89 ? -12.627 50.541 -27.182 1.00 36.07 ? 89 LEU D CA 1 ATOM 9555 C C . LEU E 2 89 ? -11.862 49.569 -26.282 1.00 34.92 ? 89 LEU D C 1 ATOM 9556 O O . LEU E 2 89 ? -11.701 49.824 -25.086 1.00 35.92 ? 89 LEU D O 1 ATOM 9557 C CB . LEU E 2 89 ? -14.095 50.170 -27.348 1.00 37.28 ? 89 LEU D CB 1 ATOM 9558 C CG . LEU E 2 89 ? -14.856 50.054 -26.021 1.00 42.91 ? 89 LEU D CG 1 ATOM 9559 C CD1 . LEU E 2 89 ? -16.098 50.887 -25.996 1.00 44.93 ? 89 LEU D CD1 1 ATOM 9560 C CD2 . LEU E 2 89 ? -15.200 48.611 -25.740 1.00 47.86 ? 89 LEU D CD2 1 ATOM 9561 N N . ASP E 2 90 ? -11.366 48.485 -26.860 1.00 35.51 ? 90 ASP D N 1 ATOM 9562 C CA . ASP E 2 90 ? -10.639 47.502 -26.068 1.00 37.35 ? 90 ASP D CA 1 ATOM 9563 C C . ASP E 2 90 ? -9.338 48.113 -25.571 1.00 36.25 ? 90 ASP D C 1 ATOM 9564 O O . ASP E 2 90 ? -8.976 47.965 -24.404 1.00 38.52 ? 90 ASP D O 1 ATOM 9565 C CB . ASP E 2 90 ? -10.408 46.199 -26.845 1.00 38.86 ? 90 ASP D CB 1 ATOM 9566 C CG . ASP E 2 90 ? -11.692 45.402 -27.091 1.00 42.71 ? 90 ASP D CG 1 ATOM 9567 O OD1 . ASP E 2 90 ? -12.733 45.720 -26.434 1.00 47.22 ? 90 ASP D OD1 1 ATOM 9568 O OD2 . ASP E 2 90 ? -11.668 44.457 -27.957 1.00 50.68 ? 90 ASP D OD2 1 ATOM 9569 N N . VAL E 2 91 ? -8.629 48.783 -26.467 1.00 36.02 ? 91 VAL D N 1 ATOM 9570 C CA . VAL E 2 91 ? -7.353 49.452 -26.115 1.00 39.45 ? 91 VAL D CA 1 ATOM 9571 C C . VAL E 2 91 ? -7.557 50.491 -25.004 1.00 39.50 ? 91 VAL D C 1 ATOM 9572 O O . VAL E 2 91 ? -6.884 50.432 -23.996 1.00 42.98 ? 91 VAL D O 1 ATOM 9573 C CB . VAL E 2 91 ? -6.702 50.120 -27.337 1.00 37.11 ? 91 VAL D CB 1 ATOM 9574 C CG1 . VAL E 2 91 ? -5.575 51.021 -26.925 1.00 38.34 ? 91 VAL D CG1 1 ATOM 9575 C CG2 . VAL E 2 91 ? -6.189 49.078 -28.287 1.00 39.41 ? 91 VAL D CG2 1 ATOM 9576 N N . TRP E 2 92 ? -8.525 51.394 -25.160 1.00 37.47 ? 92 TRP D N 1 ATOM 9577 C CA . TRP E 2 92 ? -8.683 52.430 -24.162 1.00 36.75 ? 92 TRP D CA 1 ATOM 9578 C C . TRP E 2 92 ? -9.188 51.843 -22.837 1.00 38.90 ? 92 TRP D C 1 ATOM 9579 O O . TRP E 2 92 ? -8.817 52.319 -21.765 1.00 38.40 ? 92 TRP D O 1 ATOM 9580 C CB . TRP E 2 92 ? -9.601 53.574 -24.658 1.00 34.48 ? 92 TRP D CB 1 ATOM 9581 C CG . TRP E 2 92 ? -9.006 54.420 -25.702 1.00 33.35 ? 92 TRP D CG 1 ATOM 9582 C CD1 . TRP E 2 92 ? -9.456 54.576 -26.967 1.00 33.94 ? 92 TRP D CD1 1 ATOM 9583 C CD2 . TRP E 2 92 ? -7.858 55.260 -25.585 1.00 34.63 ? 92 TRP D CD2 1 ATOM 9584 N NE1 . TRP E 2 92 ? -8.653 55.450 -27.666 1.00 35.89 ? 92 TRP D NE1 1 ATOM 9585 C CE2 . TRP E 2 92 ? -7.650 55.869 -26.840 1.00 35.42 ? 92 TRP D CE2 1 ATOM 9586 C CE3 . TRP E 2 92 ? -7.014 55.590 -24.538 1.00 37.09 ? 92 TRP D CE3 1 ATOM 9587 C CZ2 . TRP E 2 92 ? -6.644 56.765 -27.070 1.00 34.65 ? 92 TRP D CZ2 1 ATOM 9588 C CZ3 . TRP E 2 92 ? -5.991 56.485 -24.779 1.00 36.88 ? 92 TRP D CZ3 1 ATOM 9589 C CH2 . TRP E 2 92 ? -5.836 57.078 -26.022 1.00 37.27 ? 92 TRP D CH2 1 ATOM 9590 N N . THR E 2 93 ? -10.087 50.862 -22.895 1.00 38.52 ? 93 THR D N 1 ATOM 9591 C CA . THR E 2 93 ? -10.611 50.308 -21.660 1.00 38.05 ? 93 THR D CA 1 ATOM 9592 C C . THR E 2 93 ? -9.473 49.691 -20.829 1.00 40.15 ? 93 THR D C 1 ATOM 9593 O O . THR E 2 93 ? -9.346 50.002 -19.647 1.00 45.77 ? 93 THR D O 1 ATOM 9594 C CB . THR E 2 93 ? -11.710 49.271 -21.915 1.00 36.13 ? 93 THR D CB 1 ATOM 9595 O OG1 . THR E 2 93 ? -12.800 49.902 -22.593 1.00 33.17 ? 93 THR D OG1 1 ATOM 9596 C CG2 . THR E 2 93 ? -12.228 48.708 -20.611 1.00 37.29 ? 93 THR D CG2 1 ATOM 9597 N N . TYR E 2 94 ? -8.683 48.822 -21.447 1.00 36.68 ? 94 TYR D N 1 ATOM 9598 C CA . TYR E 2 94 ? -7.624 48.114 -20.756 1.00 37.04 ? 94 TYR D CA 1 ATOM 9599 C C . TYR E 2 94 ? -6.588 49.103 -20.216 1.00 40.30 ? 94 TYR D C 1 ATOM 9600 O O . TYR E 2 94 ? -6.161 49.002 -19.038 1.00 37.22 ? 94 TYR D O 1 ATOM 9601 C CB . TYR E 2 94 ? -6.945 47.136 -21.684 1.00 37.11 ? 94 TYR D CB 1 ATOM 9602 C CG . TYR E 2 94 ? -6.027 46.157 -20.997 1.00 37.83 ? 94 TYR D CG 1 ATOM 9603 C CD1 . TYR E 2 94 ? -6.541 45.148 -20.197 1.00 37.74 ? 94 TYR D CD1 1 ATOM 9604 C CD2 . TYR E 2 94 ? -4.634 46.186 -21.191 1.00 38.53 ? 94 TYR D CD2 1 ATOM 9605 C CE1 . TYR E 2 94 ? -5.709 44.224 -19.565 1.00 37.22 ? 94 TYR D CE1 1 ATOM 9606 C CE2 . TYR E 2 94 ? -3.801 45.228 -20.584 1.00 37.95 ? 94 TYR D CE2 1 ATOM 9607 C CZ . TYR E 2 94 ? -4.352 44.262 -19.774 1.00 36.56 ? 94 TYR D CZ 1 ATOM 9608 O OH . TYR E 2 94 ? -3.580 43.327 -19.194 1.00 36.58 ? 94 TYR D OH 1 ATOM 9609 N N . ASN E 2 95 ? -6.200 50.066 -21.052 1.00 38.26 ? 95 ASN D N 1 ATOM 9610 C CA . ASN E 2 95 ? -5.222 51.055 -20.622 1.00 41.49 ? 95 ASN D CA 1 ATOM 9611 C C . ASN E 2 95 ? -5.729 51.887 -19.470 1.00 42.40 ? 95 ASN D C 1 ATOM 9612 O O . ASN E 2 95 ? -4.983 52.136 -18.529 1.00 41.89 ? 95 ASN D O 1 ATOM 9613 C CB . ASN E 2 95 ? -4.743 51.938 -21.772 1.00 43.48 ? 95 ASN D CB 1 ATOM 9614 C CG . ASN E 2 95 ? -3.886 51.156 -22.778 1.00 51.96 ? 95 ASN D CG 1 ATOM 9615 O OD1 . ASN E 2 95 ? -3.499 49.995 -22.545 1.00 49.96 ? 95 ASN D OD1 1 ATOM 9616 N ND2 . ASN E 2 95 ? -3.633 51.773 -23.929 1.00 59.58 ? 95 ASN D ND2 1 ATOM 9617 N N . ALA E 2 96 ? -6.980 52.328 -19.550 1.00 41.03 ? 96 ALA D N 1 ATOM 9618 C CA . ALA E 2 96 ? -7.519 53.220 -18.527 1.00 41.30 ? 96 ALA D CA 1 ATOM 9619 C C . ALA E 2 96 ? -7.625 52.457 -17.222 1.00 41.43 ? 96 ALA D C 1 ATOM 9620 O O . ALA E 2 96 ? -7.203 52.954 -16.193 1.00 37.77 ? 96 ALA D O 1 ATOM 9621 C CB . ALA E 2 96 ? -8.858 53.777 -18.930 1.00 41.74 ? 96 ALA D CB 1 ATOM 9622 N N . GLU E 2 97 ? -8.104 51.220 -17.282 1.00 43.05 ? 97 GLU D N 1 ATOM 9623 C CA . GLU E 2 97 ? -8.340 50.443 -16.071 1.00 43.56 ? 97 GLU D CA 1 ATOM 9624 C C . GLU E 2 97 ? -7.010 50.123 -15.391 1.00 45.20 ? 97 GLU D C 1 ATOM 9625 O O . GLU E 2 97 ? -6.873 50.241 -14.176 1.00 43.81 ? 97 GLU D O 1 ATOM 9626 C CB . GLU E 2 97 ? -9.115 49.162 -16.379 1.00 45.42 ? 97 GLU D CB 1 ATOM 9627 C CG . GLU E 2 97 ? -10.541 49.375 -16.927 1.00 50.09 ? 97 GLU D CG 1 ATOM 9628 C CD . GLU E 2 97 ? -11.631 49.599 -15.880 1.00 52.37 ? 97 GLU D CD 1 ATOM 9629 O OE1 . GLU E 2 97 ? -11.408 49.292 -14.695 1.00 61.02 ? 97 GLU D OE1 1 ATOM 9630 O OE2 . GLU E 2 97 ? -12.723 50.073 -16.230 1.00 52.46 ? 97 GLU D OE2 1 ATOM 9631 N N . LEU E 2 98 ? -6.025 49.715 -16.175 1.00 45.95 ? 98 LEU D N 1 ATOM 9632 C CA . LEU E 2 98 ? -4.731 49.369 -15.605 1.00 47.54 ? 98 LEU D CA 1 ATOM 9633 C C . LEU E 2 98 ? -3.918 50.561 -15.110 1.00 44.25 ? 98 LEU D C 1 ATOM 9634 O O . LEU E 2 98 ? -3.212 50.468 -14.128 1.00 42.53 ? 98 LEU D O 1 ATOM 9635 C CB . LEU E 2 98 ? -3.900 48.586 -16.592 1.00 49.58 ? 98 LEU D CB 1 ATOM 9636 C CG . LEU E 2 98 ? -4.236 47.106 -16.720 1.00 53.91 ? 98 LEU D CG 1 ATOM 9637 C CD1 . LEU E 2 98 ? -3.005 46.405 -17.254 1.00 58.55 ? 98 LEU D CD1 1 ATOM 9638 C CD2 . LEU E 2 98 ? -4.631 46.465 -15.426 1.00 54.91 ? 98 LEU D CD2 1 ATOM 9639 N N . LEU E 2 99 ? -4.009 51.649 -15.833 1.00 42.75 ? 99 LEU D N 1 ATOM 9640 C CA . LEU E 2 99 ? -3.432 52.891 -15.447 1.00 45.36 ? 99 LEU D CA 1 ATOM 9641 C C . LEU E 2 99 ? -3.953 53.322 -14.058 1.00 49.38 ? 99 LEU D C 1 ATOM 9642 O O . LEU E 2 99 ? -3.190 53.710 -13.186 1.00 51.60 ? 99 LEU D O 1 ATOM 9643 C CB . LEU E 2 99 ? -3.797 53.939 -16.478 1.00 45.52 ? 99 LEU D CB 1 ATOM 9644 C CG . LEU E 2 99 ? -3.549 55.364 -16.041 1.00 52.58 ? 99 LEU D CG 1 ATOM 9645 C CD1 . LEU E 2 99 ? -2.047 55.551 -16.029 1.00 52.83 ? 99 LEU D CD1 1 ATOM 9646 C CD2 . LEU E 2 99 ? -4.226 56.396 -16.946 1.00 55.15 ? 99 LEU D CD2 1 ATOM 9647 N N . VAL E 2 100 ? -5.255 53.262 -13.864 1.00 47.10 ? 100 VAL D N 1 ATOM 9648 C CA . VAL E 2 100 ? -5.854 53.601 -12.583 1.00 47.85 ? 100 VAL D CA 1 ATOM 9649 C C . VAL E 2 100 ? -5.341 52.664 -11.473 1.00 45.44 ? 100 VAL D C 1 ATOM 9650 O O . VAL E 2 100 ? -5.000 53.091 -10.400 1.00 47.59 ? 100 VAL D O 1 ATOM 9651 C CB . VAL E 2 100 ? -7.399 53.574 -12.699 1.00 47.12 ? 100 VAL D CB 1 ATOM 9652 C CG1 . VAL E 2 100 ? -8.083 53.511 -11.358 1.00 50.31 ? 100 VAL D CG1 1 ATOM 9653 C CG2 . VAL E 2 100 ? -7.859 54.814 -13.443 1.00 49.23 ? 100 VAL D CG2 1 ATOM 9654 N N . LEU E 2 101 ? -5.333 51.377 -11.739 1.00 46.00 ? 101 LEU D N 1 ATOM 9655 C CA . LEU E 2 101 ? -4.829 50.389 -10.793 1.00 43.56 ? 101 LEU D CA 1 ATOM 9656 C C . LEU E 2 101 ? -3.382 50.648 -10.380 1.00 47.41 ? 101 LEU D C 1 ATOM 9657 O O . LEU E 2 101 ? -3.036 50.542 -9.217 1.00 54.13 ? 101 LEU D O 1 ATOM 9658 C CB . LEU E 2 101 ? -4.950 49.012 -11.408 1.00 40.63 ? 101 LEU D CB 1 ATOM 9659 C CG . LEU E 2 101 ? -6.023 48.022 -10.964 1.00 44.30 ? 101 LEU D CG 1 ATOM 9660 C CD1 . LEU E 2 101 ? -7.348 48.636 -10.617 1.00 45.66 ? 101 LEU D CD1 1 ATOM 9661 C CD2 . LEU E 2 101 ? -6.197 46.950 -12.043 1.00 45.51 ? 101 LEU D CD2 1 ATOM 9662 N N . MET E 2 102 ? -2.536 50.975 -11.344 1.00 48.77 ? 102 MET D N 1 ATOM 9663 C CA . MET E 2 102 ? -1.109 51.102 -11.098 1.00 47.79 ? 102 MET D CA 1 ATOM 9664 C C . MET E 2 102 ? -0.805 52.393 -10.374 1.00 46.22 ? 102 MET D C 1 ATOM 9665 O O . MET E 2 102 ? 0.020 52.424 -9.476 1.00 41.80 ? 102 MET D O 1 ATOM 9666 C CB . MET E 2 102 ? -0.324 51.132 -12.412 1.00 50.87 ? 102 MET D CB 1 ATOM 9667 C CG . MET E 2 102 ? -0.220 49.802 -13.146 1.00 60.64 ? 102 MET D CG 1 ATOM 9668 S SD . MET E 2 102 ? 0.533 50.059 -14.798 1.00 67.06 ? 102 MET D SD 1 ATOM 9669 C CE . MET E 2 102 ? 0.627 48.357 -15.341 1.00 66.28 ? 102 MET D CE 1 ATOM 9670 N N . GLU E 2 103 ? -1.447 53.470 -10.812 1.00 45.56 ? 103 GLU D N 1 ATOM 9671 C CA . GLU E 2 103 ? -1.213 54.741 -10.205 1.00 49.01 ? 103 GLU D CA 1 ATOM 9672 C C . GLU E 2 103 ? -1.830 54.809 -8.798 1.00 49.34 ? 103 GLU D C 1 ATOM 9673 O O . GLU E 2 103 ? -1.277 55.438 -7.925 1.00 53.49 ? 103 GLU D O 1 ATOM 9674 C CB . GLU E 2 103 ? -1.621 55.882 -11.125 1.00 49.32 ? 103 GLU D CB 1 ATOM 9675 C CG . GLU E 2 103 ? -0.609 56.046 -12.263 1.00 57.43 ? 103 GLU D CG 1 ATOM 9676 C CD . GLU E 2 103 ? 0.809 56.397 -11.790 1.00 61.85 ? 103 GLU D CD 1 ATOM 9677 O OE1 . GLU E 2 103 ? 0.925 57.174 -10.820 1.00 66.63 ? 103 GLU D OE1 1 ATOM 9678 O OE2 . GLU E 2 103 ? 1.812 55.896 -12.362 1.00 68.03 ? 103 GLU D OE2 1 ATOM 9679 N N . ASN E 2 104 ? -2.918 54.097 -8.560 1.00 48.42 ? 104 ASN D N 1 ATOM 9680 C CA . ASN E 2 104 ? -3.404 53.964 -7.202 1.00 50.67 ? 104 ASN D CA 1 ATOM 9681 C C . ASN E 2 104 ? -2.386 53.281 -6.276 1.00 54.77 ? 104 ASN D C 1 ATOM 9682 O O . ASN E 2 104 ? -2.170 53.748 -5.167 1.00 50.29 ? 104 ASN D O 1 ATOM 9683 C CB . ASN E 2 104 ? -4.763 53.262 -7.158 1.00 46.30 ? 104 ASN D CB 1 ATOM 9684 C CG . ASN E 2 104 ? -5.879 54.174 -7.616 1.00 46.48 ? 104 ASN D CG 1 ATOM 9685 O OD1 . ASN E 2 104 ? -5.640 55.365 -7.832 1.00 46.38 ? 104 ASN D OD1 1 ATOM 9686 N ND2 . ASN E 2 104 ? -7.082 53.630 -7.809 1.00 43.66 ? 104 ASN D ND2 1 ATOM 9687 N N . GLU E 2 105 ? -1.780 52.186 -6.727 1.00 60.60 ? 105 GLU D N 1 ATOM 9688 C CA . GLU E 2 105 ? -0.765 51.506 -5.944 1.00 59.02 ? 105 GLU D CA 1 ATOM 9689 C C . GLU E 2 105 ? 0.311 52.499 -5.565 1.00 57.51 ? 105 GLU D C 1 ATOM 9690 O O . GLU E 2 105 ? 0.708 52.564 -4.407 1.00 55.42 ? 105 GLU D O 1 ATOM 9691 C CB . GLU E 2 105 ? -0.110 50.374 -6.705 1.00 67.56 ? 105 GLU D CB 1 ATOM 9692 C CG . GLU E 2 105 ? 0.674 49.459 -5.770 1.00 81.28 ? 105 GLU D CG 1 ATOM 9693 C CD . GLU E 2 105 ? 1.789 48.681 -6.449 1.00 98.91 ? 105 GLU D CD 1 ATOM 9694 O OE1 . GLU E 2 105 ? 1.550 47.527 -6.867 1.00 113.12 ? 105 GLU D OE1 1 ATOM 9695 O OE2 . GLU E 2 105 ? 2.919 49.216 -6.557 1.00 108.82 ? 105 GLU D OE2 1 ATOM 9696 N N . ARG E 2 106 ? 0.725 53.312 -6.529 1.00 55.17 ? 106 ARG D N 1 ATOM 9697 C CA . ARG E 2 106 ? 1.830 54.237 -6.325 1.00 61.78 ? 106 ARG D CA 1 ATOM 9698 C C . ARG E 2 106 ? 1.505 55.399 -5.416 1.00 61.88 ? 106 ARG D C 1 ATOM 9699 O O . ARG E 2 106 ? 2.357 55.863 -4.647 1.00 67.34 ? 106 ARG D O 1 ATOM 9700 C CB . ARG E 2 106 ? 2.326 54.798 -7.643 1.00 64.91 ? 106 ARG D CB 1 ATOM 9701 C CG . ARG E 2 106 ? 2.835 53.702 -8.548 1.00 79.61 ? 106 ARG D CG 1 ATOM 9702 C CD . ARG E 2 106 ? 3.977 54.152 -9.418 1.00 94.05 ? 106 ARG D CD 1 ATOM 9703 N NE . ARG E 2 106 ? 5.245 54.196 -8.682 1.00 111.83 ? 106 ARG D NE 1 ATOM 9704 C CZ . ARG E 2 106 ? 6.361 54.742 -9.165 1.00 122.34 ? 106 ARG D CZ 1 ATOM 9705 N NH1 . ARG E 2 106 ? 6.333 55.290 -10.380 1.00 133.92 ? 106 ARG D NH1 1 ATOM 9706 N NH2 . ARG E 2 106 ? 7.490 54.767 -8.444 1.00 108.09 ? 106 ARG D NH2 1 ATOM 9707 N N . THR E 2 107 ? 0.287 55.892 -5.537 1.00 52.97 ? 107 THR D N 1 ATOM 9708 C CA . THR E 2 107 ? -0.160 56.979 -4.724 1.00 50.16 ? 107 THR D CA 1 ATOM 9709 C C . THR E 2 107 ? -0.126 56.555 -3.242 1.00 49.93 ? 107 THR D C 1 ATOM 9710 O O . THR E 2 107 ? 0.403 57.278 -2.396 1.00 44.59 ? 107 THR D O 1 ATOM 9711 C CB . THR E 2 107 ? -1.543 57.461 -5.189 1.00 49.29 ? 107 THR D CB 1 ATOM 9712 O OG1 . THR E 2 107 ? -1.396 58.136 -6.461 1.00 49.97 ? 107 THR D OG1 1 ATOM 9713 C CG2 . THR E 2 107 ? -2.159 58.434 -4.178 1.00 52.66 ? 107 THR D CG2 1 ATOM 9714 N N . LEU E 2 108 ? -0.621 55.360 -2.956 1.00 48.91 ? 108 LEU D N 1 ATOM 9715 C CA . LEU E 2 108 ? -0.625 54.842 -1.603 1.00 52.86 ? 108 LEU D CA 1 ATOM 9716 C C . LEU E 2 108 ? 0.783 54.589 -1.081 1.00 55.75 ? 108 LEU D C 1 ATOM 9717 O O . LEU E 2 108 ? 1.076 54.896 0.079 1.00 57.98 ? 108 LEU D O 1 ATOM 9718 C CB . LEU E 2 108 ? -1.487 53.581 -1.502 1.00 53.76 ? 108 LEU D CB 1 ATOM 9719 C CG . LEU E 2 108 ? -2.981 53.780 -1.822 1.00 55.98 ? 108 LEU D CG 1 ATOM 9720 C CD1 . LEU E 2 108 ? -3.751 52.551 -1.364 1.00 58.27 ? 108 LEU D CD1 1 ATOM 9721 C CD2 . LEU E 2 108 ? -3.564 55.045 -1.206 1.00 56.09 ? 108 LEU D CD2 1 ATOM 9722 N N . ASP E 2 109 ? 1.658 54.063 -1.934 1.00 54.40 ? 109 ASP D N 1 ATOM 9723 C CA . ASP E 2 109 ? 3.050 53.872 -1.543 1.00 52.45 ? 109 ASP D CA 1 ATOM 9724 C C . ASP E 2 109 ? 3.742 55.234 -1.316 1.00 51.42 ? 109 ASP D C 1 ATOM 9725 O O . ASP E 2 109 ? 4.625 55.360 -0.473 1.00 47.82 ? 109 ASP D O 1 ATOM 9726 C CB . ASP E 2 109 ? 3.825 53.029 -2.569 1.00 51.04 ? 109 ASP D CB 1 ATOM 9727 C CG . ASP E 2 109 ? 3.426 51.525 -2.550 1.00 54.71 ? 109 ASP D CG 1 ATOM 9728 O OD1 . ASP E 2 109 ? 2.957 51.011 -1.502 1.00 49.65 ? 109 ASP D OD1 1 ATOM 9729 O OD2 . ASP E 2 109 ? 3.590 50.858 -3.618 1.00 55.77 ? 109 ASP D OD2 1 ATOM 9730 N N . PHE E 2 110 ? 3.327 56.248 -2.057 1.00 48.59 ? 110 PHE D N 1 ATOM 9731 C CA . PHE E 2 110 ? 3.900 57.580 -1.923 1.00 51.55 ? 110 PHE D CA 1 ATOM 9732 C C . PHE E 2 110 ? 3.564 58.158 -0.531 1.00 57.32 ? 110 PHE D C 1 ATOM 9733 O O . PHE E 2 110 ? 4.374 58.833 0.085 1.00 56.02 ? 110 PHE D O 1 ATOM 9734 C CB . PHE E 2 110 ? 3.318 58.465 -3.030 1.00 50.25 ? 110 PHE D CB 1 ATOM 9735 C CG . PHE E 2 110 ? 3.681 59.939 -2.956 1.00 48.85 ? 110 PHE D CG 1 ATOM 9736 C CD1 . PHE E 2 110 ? 5.003 60.357 -2.997 1.00 50.64 ? 110 PHE D CD1 1 ATOM 9737 C CD2 . PHE E 2 110 ? 2.673 60.910 -2.959 1.00 49.03 ? 110 PHE D CD2 1 ATOM 9738 C CE1 . PHE E 2 110 ? 5.324 61.709 -3.012 1.00 51.99 ? 110 PHE D CE1 1 ATOM 9739 C CE2 . PHE E 2 110 ? 2.983 62.268 -2.969 1.00 50.63 ? 110 PHE D CE2 1 ATOM 9740 C CZ . PHE E 2 110 ? 4.312 62.668 -3.010 1.00 52.80 ? 110 PHE D CZ 1 ATOM 9741 N N . HIS E 2 111 ? 2.349 57.911 -0.055 1.00 55.29 ? 111 HIS D N 1 ATOM 9742 C CA . HIS E 2 111 ? 1.945 58.432 1.243 1.00 55.78 ? 111 HIS D CA 1 ATOM 9743 C C . HIS E 2 111 ? 2.765 57.777 2.345 1.00 57.01 ? 111 HIS D C 1 ATOM 9744 O O . HIS E 2 111 ? 3.389 58.462 3.129 1.00 53.71 ? 111 HIS D O 1 ATOM 9745 C CB . HIS E 2 111 ? 0.445 58.255 1.445 1.00 52.58 ? 111 HIS D CB 1 ATOM 9746 C CG . HIS E 2 111 ? -0.350 59.283 0.714 1.00 54.48 ? 111 HIS D CG 1 ATOM 9747 N ND1 . HIS E 2 111 ? -1.493 59.002 0.005 1.00 57.69 ? 111 HIS D ND1 1 ATOM 9748 C CD2 . HIS E 2 111 ? -0.144 60.608 0.574 1.00 57.97 ? 111 HIS D CD2 1 ATOM 9749 C CE1 . HIS E 2 111 ? -1.955 60.113 -0.539 1.00 56.46 ? 111 HIS D CE1 1 ATOM 9750 N NE2 . HIS E 2 111 ? -1.148 61.101 -0.211 1.00 55.13 ? 111 HIS D NE2 1 ATOM 9751 N N . ASP E 2 112 ? 2.767 56.447 2.333 1.00 58.98 ? 112 ASP D N 1 ATOM 9752 C CA . ASP E 2 112 ? 3.641 55.602 3.132 1.00 62.87 ? 112 ASP D CA 1 ATOM 9753 C C . ASP E 2 112 ? 5.049 56.150 3.252 1.00 64.87 ? 112 ASP D C 1 ATOM 9754 O O . ASP E 2 112 ? 5.541 56.364 4.343 1.00 68.21 ? 112 ASP D O 1 ATOM 9755 C CB . ASP E 2 112 ? 3.755 54.259 2.463 1.00 70.04 ? 112 ASP D CB 1 ATOM 9756 C CG . ASP E 2 112 ? 3.501 53.142 3.388 1.00 80.89 ? 112 ASP D CG 1 ATOM 9757 O OD1 . ASP E 2 112 ? 2.314 52.948 3.703 1.00 100.81 ? 112 ASP D OD1 1 ATOM 9758 O OD2 . ASP E 2 112 ? 4.461 52.447 3.769 1.00 81.07 ? 112 ASP D OD2 1 ATOM 9759 N N . SER E 2 113 ? 5.667 56.408 2.106 1.00 64.40 ? 113 SER D N 1 ATOM 9760 C CA . SER E 2 113 ? 7.059 56.845 2.040 1.00 63.64 ? 113 SER D CA 1 ATOM 9761 C C . SER E 2 113 ? 7.216 58.225 2.676 1.00 61.79 ? 113 SER D C 1 ATOM 9762 O O . SER E 2 113 ? 8.228 58.489 3.323 1.00 66.37 ? 113 SER D O 1 ATOM 9763 C CB . SER E 2 113 ? 7.555 56.835 0.574 1.00 62.41 ? 113 SER D CB 1 ATOM 9764 O OG . SER E 2 113 ? 8.677 57.664 0.338 1.00 64.45 ? 113 SER D OG 1 ATOM 9765 N N . ASN E 2 114 ? 6.226 59.100 2.480 1.00 56.09 ? 114 ASN D N 1 ATOM 9766 C CA . ASN E 2 114 ? 6.274 60.439 3.041 1.00 54.45 ? 114 ASN D CA 1 ATOM 9767 C C . ASN E 2 114 ? 6.229 60.409 4.591 1.00 54.65 ? 114 ASN D C 1 ATOM 9768 O O . ASN E 2 114 ? 6.914 61.169 5.265 1.00 57.15 ? 114 ASN D O 1 ATOM 9769 C CB . ASN E 2 114 ? 5.126 61.293 2.479 1.00 55.76 ? 114 ASN D CB 1 ATOM 9770 C CG . ASN E 2 114 ? 5.325 61.717 1.030 1.00 55.42 ? 114 ASN D CG 1 ATOM 9771 O OD1 . ASN E 2 114 ? 6.409 61.674 0.504 1.00 59.27 ? 114 ASN D OD1 1 ATOM 9772 N ND2 . ASN E 2 114 ? 4.240 62.132 0.383 1.00 55.97 ? 114 ASN D ND2 1 ATOM 9773 N N . VAL E 2 115 ? 5.389 59.531 5.134 1.00 58.61 ? 115 VAL D N 1 ATOM 9774 C CA . VAL E 2 115 ? 5.193 59.365 6.569 1.00 63.13 ? 115 VAL D CA 1 ATOM 9775 C C . VAL E 2 115 ? 6.439 58.768 7.211 1.00 66.87 ? 115 VAL D C 1 ATOM 9776 O O . VAL E 2 115 ? 6.891 59.227 8.238 1.00 59.05 ? 115 VAL D O 1 ATOM 9777 C CB . VAL E 2 115 ? 3.974 58.460 6.850 1.00 66.82 ? 115 VAL D CB 1 ATOM 9778 C CG1 . VAL E 2 115 ? 3.955 57.962 8.293 1.00 72.22 ? 115 VAL D CG1 1 ATOM 9779 C CG2 . VAL E 2 115 ? 2.679 59.217 6.559 1.00 69.31 ? 115 VAL D CG2 1 ATOM 9780 N N . LYS E 2 116 ? 6.998 57.751 6.569 1.00 70.14 ? 116 LYS D N 1 ATOM 9781 C CA . LYS E 2 116 ? 8.232 57.127 7.027 1.00 70.27 ? 116 LYS D CA 1 ATOM 9782 C C . LYS E 2 116 ? 9.449 58.056 6.895 1.00 67.97 ? 116 LYS D C 1 ATOM 9783 O O . LYS E 2 116 ? 10.443 57.848 7.564 1.00 69.80 ? 116 LYS D O 1 ATOM 9784 C CB . LYS E 2 116 ? 8.472 55.810 6.289 1.00 72.88 ? 116 LYS D CB 1 ATOM 9785 C CG . LYS E 2 116 ? 9.729 55.002 6.706 1.00 79.04 ? 116 LYS D CG 1 ATOM 9786 C CD . LYS E 2 116 ? 10.836 55.201 5.667 1.00 84.77 ? 116 LYS D CD 1 ATOM 9787 C CE . LYS E 2 116 ? 11.537 53.894 5.291 1.00 86.54 ? 116 LYS D CE 1 ATOM 9788 N NZ . LYS E 2 116 ? 12.289 53.336 6.444 1.00 85.71 ? 116 LYS D NZ 1 ATOM 9789 N N . ASN E 2 117 ? 9.386 59.077 6.050 1.00 62.31 ? 117 ASN D N 1 ATOM 9790 C CA . ASN E 2 117 ? 10.451 60.069 6.027 1.00 63.61 ? 117 ASN D CA 1 ATOM 9791 C C . ASN E 2 117 ? 10.313 61.051 7.205 1.00 66.84 ? 117 ASN D C 1 ATOM 9792 O O . ASN E 2 117 ? 11.300 61.523 7.723 1.00 60.95 ? 117 ASN D O 1 ATOM 9793 C CB . ASN E 2 117 ? 10.474 60.855 4.725 1.00 64.33 ? 117 ASN D CB 1 ATOM 9794 C CG . ASN E 2 117 ? 10.961 60.034 3.540 1.00 76.18 ? 117 ASN D CG 1 ATOM 9795 O OD1 . ASN E 2 117 ? 11.627 58.988 3.680 1.00 69.94 ? 117 ASN D OD1 1 ATOM 9796 N ND2 . ASN E 2 117 ? 10.614 60.504 2.347 1.00 79.86 ? 117 ASN D ND2 1 ATOM 9797 N N . LEU E 2 118 ? 9.080 61.377 7.583 1.00 68.83 ? 118 LEU D N 1 ATOM 9798 C CA . LEU E 2 118 ? 8.868 62.197 8.750 1.00 73.28 ? 118 LEU D CA 1 ATOM 9799 C C . LEU E 2 118 ? 9.438 61.487 9.989 1.00 72.14 ? 118 LEU D C 1 ATOM 9800 O O . LEU E 2 118 ? 10.290 62.043 10.684 1.00 85.05 ? 118 LEU D O 1 ATOM 9801 C CB . LEU E 2 118 ? 7.373 62.511 8.946 1.00 77.43 ? 118 LEU D CB 1 ATOM 9802 C CG . LEU E 2 118 ? 6.767 63.810 8.395 1.00 78.11 ? 118 LEU D CG 1 ATOM 9803 C CD1 . LEU E 2 118 ? 5.516 64.109 9.206 1.00 82.37 ? 118 LEU D CD1 1 ATOM 9804 C CD2 . LEU E 2 118 ? 7.705 65.008 8.441 1.00 79.05 ? 118 LEU D CD2 1 ATOM 9805 N N . TYR E 2 119 ? 8.967 60.261 10.240 1.00 64.13 ? 119 TYR D N 1 ATOM 9806 C CA . TYR E 2 119 ? 9.437 59.403 11.339 1.00 64.87 ? 119 TYR D CA 1 ATOM 9807 C C . TYR E 2 119 ? 10.932 59.328 11.423 1.00 66.15 ? 119 TYR D C 1 ATOM 9808 O O . TYR E 2 119 ? 11.478 59.410 12.505 1.00 76.36 ? 119 TYR D O 1 ATOM 9809 C CB . TYR E 2 119 ? 8.906 57.978 11.187 1.00 66.40 ? 119 TYR D CB 1 ATOM 9810 C CG . TYR E 2 119 ? 9.232 57.071 12.380 1.00 73.63 ? 119 TYR D CG 1 ATOM 9811 C CD1 . TYR E 2 119 ? 8.370 57.012 13.493 1.00 76.69 ? 119 TYR D CD1 1 ATOM 9812 C CD2 . TYR E 2 119 ? 10.398 56.284 12.411 1.00 71.80 ? 119 TYR D CD2 1 ATOM 9813 C CE1 . TYR E 2 119 ? 8.644 56.186 14.582 1.00 77.60 ? 119 TYR D CE1 1 ATOM 9814 C CE2 . TYR E 2 119 ? 10.689 55.457 13.506 1.00 71.87 ? 119 TYR D CE2 1 ATOM 9815 C CZ . TYR E 2 119 ? 9.814 55.407 14.595 1.00 76.53 ? 119 TYR D CZ 1 ATOM 9816 O OH . TYR E 2 119 ? 10.071 54.602 15.699 1.00 71.05 ? 119 TYR D OH 1 ATOM 9817 N N . ASP E 2 120 ? 11.590 59.198 10.274 1.00 67.96 ? 120 ASP D N 1 ATOM 9818 C CA . ASP E 2 120 ? 13.049 59.088 10.206 1.00 70.98 ? 120 ASP D CA 1 ATOM 9819 C C . ASP E 2 120 ? 13.751 60.359 10.606 1.00 68.97 ? 120 ASP D C 1 ATOM 9820 O O . ASP E 2 120 ? 14.731 60.311 11.351 1.00 66.49 ? 120 ASP D O 1 ATOM 9821 C CB . ASP E 2 120 ? 13.547 58.706 8.795 1.00 76.03 ? 120 ASP D CB 1 ATOM 9822 C CG . ASP E 2 120 ? 13.390 57.212 8.505 1.00 84.23 ? 120 ASP D CG 1 ATOM 9823 O OD1 . ASP E 2 120 ? 13.257 56.443 9.494 1.00 96.44 ? 120 ASP D OD1 1 ATOM 9824 O OD2 . ASP E 2 120 ? 13.366 56.798 7.308 1.00 89.88 ? 120 ASP D OD2 1 ATOM 9825 N N . LYS E 2 121 ? 13.267 61.489 10.117 1.00 70.46 ? 121 LYS D N 1 ATOM 9826 C CA . LYS E 2 121 ? 13.947 62.740 10.395 1.00 82.66 ? 121 LYS D CA 1 ATOM 9827 C C . LYS E 2 121 ? 13.805 63.119 11.901 1.00 81.32 ? 121 LYS D C 1 ATOM 9828 O O . LYS E 2 121 ? 14.686 63.752 12.465 1.00 83.41 ? 121 LYS D O 1 ATOM 9829 C CB . LYS E 2 121 ? 13.525 63.829 9.395 1.00 87.11 ? 121 LYS D CB 1 ATOM 9830 C CG . LYS E 2 121 ? 12.994 65.142 9.955 1.00 96.99 ? 121 LYS D CG 1 ATOM 9831 C CD . LYS E 2 121 ? 12.917 66.223 8.872 1.00 105.12 ? 121 LYS D CD 1 ATOM 9832 C CE . LYS E 2 121 ? 12.366 65.729 7.529 1.00 114.13 ? 121 LYS D CE 1 ATOM 9833 N NZ . LYS E 2 121 ? 10.963 66.152 7.258 1.00 123.33 ? 121 LYS D NZ 1 ATOM 9834 N N . VAL E 2 122 ? 12.735 62.657 12.542 1.00 79.74 ? 122 VAL D N 1 ATOM 9835 C CA . VAL E 2 122 ? 12.597 62.752 13.994 1.00 79.22 ? 122 VAL D CA 1 ATOM 9836 C C . VAL E 2 122 ? 13.542 61.771 14.698 1.00 85.34 ? 122 VAL D C 1 ATOM 9837 O O . VAL E 2 122 ? 14.386 62.198 15.497 1.00 95.41 ? 122 VAL D O 1 ATOM 9838 C CB . VAL E 2 122 ? 11.143 62.538 14.452 1.00 67.21 ? 122 VAL D CB 1 ATOM 9839 C CG1 . VAL E 2 122 ? 11.065 62.214 15.938 1.00 67.55 ? 122 VAL D CG1 1 ATOM 9840 C CG2 . VAL E 2 122 ? 10.327 63.777 14.140 1.00 65.15 ? 122 VAL D CG2 1 ATOM 9841 N N . ARG E 2 123 ? 13.392 60.471 14.437 1.00 80.06 ? 123 ARG D N 1 ATOM 9842 C CA . ARG E 2 123 ? 14.350 59.480 14.949 1.00 82.88 ? 123 ARG D CA 1 ATOM 9843 C C . ARG E 2 123 ? 15.824 59.998 14.917 1.00 83.49 ? 123 ARG D C 1 ATOM 9844 O O . ARG E 2 123 ? 16.578 59.802 15.889 1.00 75.46 ? 123 ARG D O 1 ATOM 9845 C CB . ARG E 2 123 ? 14.192 58.162 14.197 1.00 87.33 ? 123 ARG D CB 1 ATOM 9846 C CG . ARG E 2 123 ? 15.066 57.012 14.668 1.00 95.00 ? 123 ARG D CG 1 ATOM 9847 C CD . ARG E 2 123 ? 15.235 55.963 13.589 1.00 109.80 ? 123 ARG D CD 1 ATOM 9848 N NE . ARG E 2 123 ? 16.652 55.966 13.191 1.00 124.57 ? 123 ARG D NE 1 ATOM 9849 C CZ . ARG E 2 123 ? 17.194 56.705 12.212 1.00 130.16 ? 123 ARG D CZ 1 ATOM 9850 N NH1 . ARG E 2 123 ? 16.448 57.498 11.436 1.00 120.49 ? 123 ARG D NH1 1 ATOM 9851 N NH2 . ARG E 2 123 ? 18.506 56.633 11.984 1.00 129.58 ? 123 ARG D NH2 1 ATOM 9852 N N . LEU E 2 124 ? 16.211 60.681 13.835 1.00 81.94 ? 124 LEU D N 1 ATOM 9853 C CA . LEU E 2 124 ? 17.573 61.235 13.689 1.00 88.23 ? 124 LEU D CA 1 ATOM 9854 C C . LEU E 2 124 ? 17.950 62.247 14.745 1.00 88.72 ? 124 LEU D C 1 ATOM 9855 O O . LEU E 2 124 ? 19.093 62.289 15.197 1.00 100.79 ? 124 LEU D O 1 ATOM 9856 C CB . LEU E 2 124 ? 17.751 61.969 12.359 1.00 90.10 ? 124 LEU D CB 1 ATOM 9857 C CG . LEU E 2 124 ? 18.133 61.192 11.097 1.00 99.99 ? 124 LEU D CG 1 ATOM 9858 C CD1 . LEU E 2 124 ? 18.717 62.159 10.062 1.00 100.63 ? 124 LEU D CD1 1 ATOM 9859 C CD2 . LEU E 2 124 ? 19.101 60.047 11.388 1.00 103.73 ? 124 LEU D CD2 1 ATOM 9860 N N . GLN E 2 125 ? 17.018 63.137 15.034 1.00 85.86 ? 125 GLN D N 1 ATOM 9861 C CA . GLN E 2 125 ? 17.268 64.249 15.942 1.00 81.89 ? 125 GLN D CA 1 ATOM 9862 C C . GLN E 2 125 ? 17.387 63.725 17.364 1.00 80.91 ? 125 GLN D C 1 ATOM 9863 O O . GLN E 2 125 ? 18.362 63.999 18.058 1.00 79.99 ? 125 GLN D O 1 ATOM 9864 C CB . GLN E 2 125 ? 16.132 65.232 15.827 1.00 76.89 ? 125 GLN D CB 1 ATOM 9865 C CG . GLN E 2 125 ? 16.082 65.969 14.504 1.00 77.01 ? 125 GLN D CG 1 ATOM 9866 C CD . GLN E 2 125 ? 15.091 67.119 14.552 1.00 77.47 ? 125 GLN D CD 1 ATOM 9867 O OE1 . GLN E 2 125 ? 13.869 66.939 14.380 1.00 74.59 ? 125 GLN D OE1 1 ATOM 9868 N NE2 . GLN E 2 125 ? 15.602 68.309 14.796 1.00 78.39 ? 125 GLN D NE2 1 ATOM 9869 N N . LEU E 2 126 ? 16.436 62.876 17.734 1.00 81.08 ? 126 LEU D N 1 ATOM 9870 C CA . LEU E 2 126 ? 16.311 62.357 19.092 1.00 86.15 ? 126 LEU D CA 1 ATOM 9871 C C . LEU E 2 126 ? 17.364 61.372 19.548 1.00 89.86 ? 126 LEU D C 1 ATOM 9872 O O . LEU E 2 126 ? 17.819 61.449 20.683 1.00 100.35 ? 126 LEU D O 1 ATOM 9873 C CB . LEU E 2 126 ? 14.949 61.703 19.277 1.00 87.21 ? 126 LEU D CB 1 ATOM 9874 C CG . LEU E 2 126 ? 13.742 62.611 19.016 1.00 86.22 ? 126 LEU D CG 1 ATOM 9875 C CD1 . LEU E 2 126 ? 12.492 62.055 19.664 1.00 83.90 ? 126 LEU D CD1 1 ATOM 9876 C CD2 . LEU E 2 126 ? 14.012 64.034 19.487 1.00 87.80 ? 126 LEU D CD2 1 ATOM 9877 N N . ARG E 2 127 ? 17.746 60.451 18.683 1.00 89.42 ? 127 ARG D N 1 ATOM 9878 C CA . ARG E 2 127 ? 18.745 59.442 19.036 1.00 91.69 ? 127 ARG D CA 1 ATOM 9879 C C . ARG E 2 127 ? 18.386 58.721 20.349 1.00 97.29 ? 127 ARG D C 1 ATOM 9880 O O . ARG E 2 127 ? 17.258 58.267 20.492 1.00 98.36 ? 127 ARG D O 1 ATOM 9881 C CB . ARG E 2 127 ? 20.139 60.085 19.056 1.00 91.61 ? 127 ARG D CB 1 ATOM 9882 C CG . ARG E 2 127 ? 20.484 60.681 17.693 1.00 94.05 ? 127 ARG D CG 1 ATOM 9883 C CD . ARG E 2 127 ? 21.620 61.704 17.626 1.00 99.66 ? 127 ARG D CD 1 ATOM 9884 N NE . ARG E 2 127 ? 21.361 62.732 16.603 1.00 102.50 ? 127 ARG D NE 1 ATOM 9885 C CZ . ARG E 2 127 ? 22.046 63.871 16.472 1.00 105.05 ? 127 ARG D CZ 1 ATOM 9886 N NH1 . ARG E 2 127 ? 23.033 64.170 17.324 1.00 117.96 ? 127 ARG D NH1 1 ATOM 9887 N NH2 . ARG E 2 127 ? 21.744 64.725 15.496 1.00 91.30 ? 127 ARG D NH2 1 ATOM 9888 N N . ASP E 2 128 ? 19.311 58.648 21.308 1.00 109.97 ? 128 ASP D N 1 ATOM 9889 C CA . ASP E 2 128 ? 19.073 57.945 22.581 1.00 116.55 ? 128 ASP D CA 1 ATOM 9890 C C . ASP E 2 128 ? 18.399 58.808 23.661 1.00 114.33 ? 128 ASP D C 1 ATOM 9891 O O . ASP E 2 128 ? 18.064 58.286 24.730 1.00 114.45 ? 128 ASP D O 1 ATOM 9892 C CB . ASP E 2 128 ? 20.369 57.319 23.139 1.00 127.24 ? 128 ASP D CB 1 ATOM 9893 C CG . ASP E 2 128 ? 21.506 58.328 23.314 1.00 131.84 ? 128 ASP D CG 1 ATOM 9894 O OD1 . ASP E 2 128 ? 21.303 59.549 23.135 1.00 137.50 ? 128 ASP D OD1 1 ATOM 9895 O OD2 . ASP E 2 128 ? 22.622 57.876 23.617 1.00 126.25 ? 128 ASP D OD2 1 ATOM 9896 N N . ASN E 2 129 ? 18.198 60.108 23.387 1.00 107.06 ? 129 ASN D N 1 ATOM 9897 C CA . ASN E 2 129 ? 17.386 60.969 24.272 1.00 95.15 ? 129 ASN D CA 1 ATOM 9898 C C . ASN E 2 129 ? 15.943 60.530 24.338 1.00 95.61 ? 129 ASN D C 1 ATOM 9899 O O . ASN E 2 129 ? 15.177 61.052 25.131 1.00 93.78 ? 129 ASN D O 1 ATOM 9900 C CB . ASN E 2 129 ? 17.407 62.441 23.835 1.00 89.84 ? 129 ASN D CB 1 ATOM 9901 C CG . ASN E 2 129 ? 18.742 63.109 24.087 1.00 93.84 ? 129 ASN D CG 1 ATOM 9902 O OD1 . ASN E 2 129 ? 19.696 62.477 24.542 1.00 97.45 ? 129 ASN D OD1 1 ATOM 9903 N ND2 . ASN E 2 129 ? 18.815 64.402 23.814 1.00 90.15 ? 129 ASN D ND2 1 ATOM 9904 N N . ALA E 2 130 ? 15.552 59.597 23.472 1.00 100.47 ? 130 ALA D N 1 ATOM 9905 C CA . ALA E 2 130 ? 14.221 59.006 23.547 1.00 96.63 ? 130 ALA D CA 1 ATOM 9906 C C . ALA E 2 130 ? 14.229 57.553 23.095 1.00 91.85 ? 130 ALA D C 1 ATOM 9907 O O . ALA E 2 130 ? 15.194 57.052 22.528 1.00 86.31 ? 130 ALA D O 1 ATOM 9908 C CB . ALA E 2 130 ? 13.216 59.820 22.748 1.00 96.17 ? 130 ALA D CB 1 ATOM 9909 N N . LYS E 2 131 ? 13.126 56.895 23.404 1.00 100.25 ? 131 LYS D N 1 ATOM 9910 C CA . LYS E 2 131 ? 12.941 55.463 23.243 1.00 108.12 ? 131 LYS D CA 1 ATOM 9911 C C . LYS E 2 131 ? 11.920 55.222 22.129 1.00 103.06 ? 131 LYS D C 1 ATOM 9912 O O . LYS E 2 131 ? 10.760 55.637 22.259 1.00 98.47 ? 131 LYS D O 1 ATOM 9913 C CB . LYS E 2 131 ? 12.414 54.926 24.576 1.00 112.46 ? 131 LYS D CB 1 ATOM 9914 C CG . LYS E 2 131 ? 12.145 53.435 24.693 1.00 114.23 ? 131 LYS D CG 1 ATOM 9915 C CD . LYS E 2 131 ? 11.336 53.198 25.972 1.00 119.10 ? 131 LYS D CD 1 ATOM 9916 C CE . LYS E 2 131 ? 11.576 51.844 26.626 1.00 120.43 ? 131 LYS D CE 1 ATOM 9917 N NZ . LYS E 2 131 ? 10.537 50.845 26.252 1.00 119.02 ? 131 LYS D NZ 1 ATOM 9918 N N . GLU E 2 132 ? 12.360 54.580 21.045 1.00 101.59 ? 132 GLU D N 1 ATOM 9919 C CA . GLU E 2 132 ? 11.464 54.170 19.970 1.00 109.40 ? 132 GLU D CA 1 ATOM 9920 C C . GLU E 2 132 ? 10.477 53.133 20.502 1.00 110.64 ? 132 GLU D C 1 ATOM 9921 O O . GLU E 2 132 ? 10.826 51.964 20.693 1.00 119.63 ? 132 GLU D O 1 ATOM 9922 C CB . GLU E 2 132 ? 12.244 53.567 18.798 1.00 120.94 ? 132 GLU D CB 1 ATOM 9923 C CG . GLU E 2 132 ? 13.051 54.557 17.961 1.00 127.89 ? 132 GLU D CG 1 ATOM 9924 C CD . GLU E 2 132 ? 13.745 53.913 16.740 1.00 139.42 ? 132 GLU D CD 1 ATOM 9925 O OE1 . GLU E 2 132 ? 13.069 53.218 15.943 1.00 141.54 ? 132 GLU D OE1 1 ATOM 9926 O OE2 . GLU E 2 132 ? 14.981 54.092 16.559 1.00 143.78 ? 132 GLU D OE2 1 ATOM 9927 N N . LEU E 2 133 ? 9.247 53.559 20.764 1.00 109.00 ? 133 LEU D N 1 ATOM 9928 C CA . LEU E 2 133 ? 8.211 52.646 21.268 1.00 112.80 ? 133 LEU D CA 1 ATOM 9929 C C . LEU E 2 133 ? 7.813 51.585 20.234 1.00 113.91 ? 133 LEU D C 1 ATOM 9930 O O . LEU E 2 133 ? 7.279 50.534 20.601 1.00 118.02 ? 133 LEU D O 1 ATOM 9931 C CB . LEU E 2 133 ? 6.969 53.417 21.739 1.00 116.38 ? 133 LEU D CB 1 ATOM 9932 C CG . LEU E 2 133 ? 7.001 54.037 23.149 1.00 120.74 ? 133 LEU D CG 1 ATOM 9933 C CD1 . LEU E 2 133 ? 5.826 54.994 23.322 1.00 120.72 ? 133 LEU D CD1 1 ATOM 9934 C CD2 . LEU E 2 133 ? 6.987 52.970 24.245 1.00 118.55 ? 133 LEU D CD2 1 ATOM 9935 N N . GLY E 2 134 ? 8.073 51.862 18.955 1.00 106.06 ? 134 GLY D N 1 ATOM 9936 C CA . GLY E 2 134 ? 7.804 50.908 17.881 1.00 101.52 ? 134 GLY D CA 1 ATOM 9937 C C . GLY E 2 134 ? 6.361 50.889 17.398 1.00 93.05 ? 134 GLY D C 1 ATOM 9938 O O . GLY E 2 134 ? 5.911 49.922 16.787 1.00 88.37 ? 134 GLY D O 1 ATOM 9939 N N . ASN E 2 135 ? 5.634 51.966 17.667 1.00 89.37 ? 135 ASN D N 1 ATOM 9940 C CA . ASN E 2 135 ? 4.261 52.140 17.176 1.00 84.03 ? 135 ASN D CA 1 ATOM 9941 C C . ASN E 2 135 ? 4.101 53.514 16.515 1.00 81.36 ? 135 ASN D C 1 ATOM 9942 O O . ASN E 2 135 ? 2.992 54.063 16.423 1.00 73.31 ? 135 ASN D O 1 ATOM 9943 C CB . ASN E 2 135 ? 3.259 51.962 18.333 1.00 87.80 ? 135 ASN D CB 1 ATOM 9944 C CG . ASN E 2 135 ? 3.423 53.007 19.446 1.00 86.72 ? 135 ASN D CG 1 ATOM 9945 O OD1 . ASN E 2 135 ? 4.372 53.817 19.451 1.00 79.32 ? 135 ASN D OD1 1 ATOM 9946 N ND2 . ASN E 2 135 ? 2.474 53.001 20.388 1.00 81.52 ? 135 ASN D ND2 1 ATOM 9947 N N . GLY E 2 136 ? 5.229 54.072 16.080 1.00 81.01 ? 136 GLY D N 1 ATOM 9948 C CA . GLY E 2 136 ? 5.264 55.417 15.535 1.00 84.23 ? 136 GLY D CA 1 ATOM 9949 C C . GLY E 2 136 ? 5.588 56.475 16.564 1.00 85.78 ? 136 GLY D C 1 ATOM 9950 O O . GLY E 2 136 ? 5.820 57.620 16.202 1.00 86.01 ? 136 GLY D O 1 ATOM 9951 N N . CYS E 2 137 ? 5.600 56.098 17.844 1.00 88.04 ? 137 CYS D N 1 ATOM 9952 C CA . CYS E 2 137 ? 5.829 57.059 18.921 1.00 91.71 ? 137 CYS D CA 1 ATOM 9953 C C . CYS E 2 137 ? 7.209 57.014 19.521 1.00 90.81 ? 137 CYS D C 1 ATOM 9954 O O . CYS E 2 137 ? 7.868 55.971 19.551 1.00 88.01 ? 137 CYS D O 1 ATOM 9955 C CB . CYS E 2 137 ? 4.804 56.886 20.023 1.00 91.05 ? 137 CYS D CB 1 ATOM 9956 S SG . CYS E 2 137 ? 3.192 57.254 19.386 1.00 87.54 ? 137 CYS D SG 1 ATOM 9957 N N . PHE E 2 138 ? 7.627 58.179 20.000 1.00 93.55 ? 138 PHE D N 1 ATOM 9958 C CA . PHE E 2 138 ? 8.881 58.332 20.723 1.00 100.42 ? 138 PHE D CA 1 ATOM 9959 C C . PHE E 2 138 ? 8.598 58.677 22.168 1.00 100.72 ? 138 PHE D C 1 ATOM 9960 O O . PHE E 2 138 ? 7.886 59.646 22.434 1.00 100.54 ? 138 PHE D O 1 ATOM 9961 C CB . PHE E 2 138 ? 9.701 59.452 20.103 1.00 100.92 ? 138 PHE D CB 1 ATOM 9962 C CG . PHE E 2 138 ? 10.228 59.109 18.762 1.00 110.11 ? 138 PHE D CG 1 ATOM 9963 C CD1 . PHE E 2 138 ? 11.431 58.435 18.637 1.00 116.45 ? 138 PHE D CD1 1 ATOM 9964 C CD2 . PHE E 2 138 ? 9.504 59.409 17.624 1.00 113.57 ? 138 PHE D CD2 1 ATOM 9965 C CE1 . PHE E 2 138 ? 11.920 58.094 17.388 1.00 116.70 ? 138 PHE D CE1 1 ATOM 9966 C CE2 . PHE E 2 138 ? 9.985 59.075 16.369 1.00 113.22 ? 138 PHE D CE2 1 ATOM 9967 C CZ . PHE E 2 138 ? 11.196 58.418 16.252 1.00 116.64 ? 138 PHE D CZ 1 ATOM 9968 N N . GLU E 2 139 ? 9.158 57.900 23.096 1.00 103.52 ? 139 GLU D N 1 ATOM 9969 C CA . GLU E 2 139 ? 9.053 58.223 24.524 1.00 103.49 ? 139 GLU D CA 1 ATOM 9970 C C . GLU E 2 139 ? 10.325 58.896 25.030 1.00 90.43 ? 139 GLU D C 1 ATOM 9971 O O . GLU E 2 139 ? 11.388 58.276 25.139 1.00 83.54 ? 139 GLU D O 1 ATOM 9972 C CB . GLU E 2 139 ? 8.742 56.985 25.360 1.00 117.14 ? 139 GLU D CB 1 ATOM 9973 C CG . GLU E 2 139 ? 8.188 57.343 26.731 1.00 123.78 ? 139 GLU D CG 1 ATOM 9974 C CD . GLU E 2 139 ? 8.039 56.139 27.627 1.00 129.57 ? 139 GLU D CD 1 ATOM 9975 O OE1 . GLU E 2 139 ? 8.886 55.935 28.533 1.00 133.57 ? 139 GLU D OE1 1 ATOM 9976 O OE2 . GLU E 2 139 ? 7.069 55.399 27.397 1.00 125.87 ? 139 GLU D OE2 1 ATOM 9977 N N . PHE E 2 140 ? 10.202 60.178 25.343 1.00 87.28 ? 140 PHE D N 1 ATOM 9978 C CA . PHE E 2 140 ? 11.345 60.955 25.812 1.00 96.19 ? 140 PHE D CA 1 ATOM 9979 C C . PHE E 2 140 ? 11.889 60.475 27.177 1.00 97.57 ? 140 PHE D C 1 ATOM 9980 O O . PHE E 2 140 ? 11.140 60.105 28.081 1.00 102.04 ? 140 PHE D O 1 ATOM 9981 C CB . PHE E 2 140 ? 10.974 62.435 25.922 1.00 97.24 ? 140 PHE D CB 1 ATOM 9982 C CG . PHE E 2 140 ? 10.865 63.164 24.607 1.00 91.27 ? 140 PHE D CG 1 ATOM 9983 C CD1 . PHE E 2 140 ? 9.632 63.309 23.973 1.00 92.80 ? 140 PHE D CD1 1 ATOM 9984 C CD2 . PHE E 2 140 ? 11.975 63.781 24.048 1.00 82.03 ? 140 PHE D CD2 1 ATOM 9985 C CE1 . PHE E 2 140 ? 9.519 64.019 22.782 1.00 88.75 ? 140 PHE D CE1 1 ATOM 9986 C CE2 . PHE E 2 140 ? 11.869 64.502 22.870 1.00 83.26 ? 140 PHE D CE2 1 ATOM 9987 C CZ . PHE E 2 140 ? 10.640 64.618 22.229 1.00 85.15 ? 140 PHE D CZ 1 ATOM 9988 N N . TYR E 2 141 ? 13.209 60.503 27.307 1.00 103.65 ? 141 TYR D N 1 ATOM 9989 C CA . TYR E 2 141 ? 13.900 60.239 28.579 1.00 106.35 ? 141 TYR D CA 1 ATOM 9990 C C . TYR E 2 141 ? 14.132 61.541 29.345 1.00 103.14 ? 141 TYR D C 1 ATOM 9991 O O . TYR E 2 141 ? 14.963 61.609 30.254 1.00 104.07 ? 141 TYR D O 1 ATOM 9992 C CB . TYR E 2 141 ? 15.256 59.577 28.318 1.00 108.14 ? 141 TYR D CB 1 ATOM 9993 C CG . TYR E 2 141 ? 15.185 58.144 27.848 1.00 107.41 ? 141 TYR D CG 1 ATOM 9994 C CD1 . TYR E 2 141 ? 14.274 57.235 28.401 1.00 106.31 ? 141 TYR D CD1 1 ATOM 9995 C CD2 . TYR E 2 141 ? 16.052 57.691 26.868 1.00 110.53 ? 141 TYR D CD2 1 ATOM 9996 C CE1 . TYR E 2 141 ? 14.229 55.919 27.966 1.00 109.74 ? 141 TYR D CE1 1 ATOM 9997 C CE2 . TYR E 2 141 ? 16.015 56.380 26.423 1.00 114.61 ? 141 TYR D CE2 1 ATOM 9998 C CZ . TYR E 2 141 ? 15.105 55.499 26.982 1.00 110.65 ? 141 TYR D CZ 1 ATOM 9999 O OH . TYR E 2 141 ? 15.068 54.205 26.556 1.00 110.70 ? 141 TYR D OH 1 ATOM 10000 N N . HIS E 2 142 ? 13.396 62.572 28.956 1.00 100.32 ? 142 HIS D N 1 ATOM 10001 C CA . HIS E 2 142 ? 13.531 63.888 29.532 1.00 100.91 ? 142 HIS D CA 1 ATOM 10002 C C . HIS E 2 142 ? 12.240 64.687 29.322 1.00 106.32 ? 142 HIS D C 1 ATOM 10003 O O . HIS E 2 142 ? 11.249 64.198 28.764 1.00 103.97 ? 142 HIS D O 1 ATOM 10004 C CB . HIS E 2 142 ? 14.766 64.624 28.965 1.00 100.42 ? 142 HIS D CB 1 ATOM 10005 C CG . HIS E 2 142 ? 14.561 65.227 27.613 1.00 97.45 ? 142 HIS D CG 1 ATOM 10006 N ND1 . HIS E 2 142 ? 15.050 64.645 26.467 1.00 96.63 ? 142 HIS D ND1 1 ATOM 10007 C CD2 . HIS E 2 142 ? 13.936 66.364 27.224 1.00 96.45 ? 142 HIS D CD2 1 ATOM 10008 C CE1 . HIS E 2 142 ? 14.725 65.392 25.427 1.00 94.01 ? 142 HIS D CE1 1 ATOM 10009 N NE2 . HIS E 2 142 ? 14.047 66.439 25.858 1.00 93.01 ? 142 HIS D NE2 1 ATOM 10010 N N . LYS E 2 143 ? 12.271 65.922 29.796 1.00 112.64 ? 143 LYS D N 1 ATOM 10011 C CA . LYS E 2 143 ? 11.097 66.761 29.901 1.00 113.70 ? 143 LYS D CA 1 ATOM 10012 C C . LYS E 2 143 ? 11.072 67.731 28.694 1.00 103.16 ? 143 LYS D C 1 ATOM 10013 O O . LYS E 2 143 ? 11.999 68.541 28.495 1.00 90.79 ? 143 LYS D O 1 ATOM 10014 C CB . LYS E 2 143 ? 11.139 67.407 31.308 1.00 121.05 ? 143 LYS D CB 1 ATOM 10015 C CG . LYS E 2 143 ? 11.270 66.323 32.401 1.00 129.61 ? 143 LYS D CG 1 ATOM 10016 C CD . LYS E 2 143 ? 10.091 66.264 33.364 1.00 133.53 ? 143 LYS D CD 1 ATOM 10017 C CE . LYS E 2 143 ? 10.141 67.352 34.432 1.00 135.66 ? 143 LYS D CE 1 ATOM 10018 N NZ . LYS E 2 143 ? 9.148 68.421 34.132 1.00 137.68 ? 143 LYS D NZ 1 ATOM 10019 N N . CYS E 2 144 ? 10.026 67.591 27.864 1.00 89.51 ? 144 CYS D N 1 ATOM 10020 C CA . CYS E 2 144 ? 9.941 68.264 26.561 1.00 89.37 ? 144 CYS D CA 1 ATOM 10021 C C . CYS E 2 144 ? 8.696 69.154 26.487 1.00 85.92 ? 144 CYS D C 1 ATOM 10022 O O . CYS E 2 144 ? 7.583 68.703 26.194 1.00 75.04 ? 144 CYS D O 1 ATOM 10023 C CB . CYS E 2 144 ? 9.963 67.216 25.424 1.00 90.62 ? 144 CYS D CB 1 ATOM 10024 S SG . CYS E 2 144 ? 10.244 67.801 23.714 1.00 81.20 ? 144 CYS D SG 1 ATOM 10025 N N . ASP E 2 145 ? 8.911 70.435 26.758 1.00 93.04 ? 145 ASP D N 1 ATOM 10026 C CA . ASP E 2 145 ? 7.821 71.395 26.824 1.00 98.99 ? 145 ASP D CA 1 ATOM 10027 C C . ASP E 2 145 ? 7.332 71.708 25.403 1.00 100.38 ? 145 ASP D C 1 ATOM 10028 O O . ASP E 2 145 ? 7.809 71.104 24.441 1.00 101.03 ? 145 ASP D O 1 ATOM 10029 C CB . ASP E 2 145 ? 8.220 72.650 27.631 1.00 98.74 ? 145 ASP D CB 1 ATOM 10030 C CG . ASP E 2 145 ? 9.284 73.498 26.948 1.00 105.82 ? 145 ASP D CG 1 ATOM 10031 O OD1 . ASP E 2 145 ? 9.339 74.716 27.237 1.00 113.19 ? 145 ASP D OD1 1 ATOM 10032 O OD2 . ASP E 2 145 ? 10.080 72.964 26.147 1.00 118.17 ? 145 ASP D OD2 1 ATOM 10033 N N . ASN E 2 146 ? 6.350 72.603 25.289 1.00 102.73 ? 146 ASN D N 1 ATOM 10034 C CA . ASN E 2 146 ? 5.731 72.945 23.998 1.00 106.26 ? 146 ASN D CA 1 ATOM 10035 C C . ASN E 2 146 ? 6.707 73.591 23.009 1.00 109.35 ? 146 ASN D C 1 ATOM 10036 O O . ASN E 2 146 ? 6.486 73.522 21.803 1.00 113.37 ? 146 ASN D O 1 ATOM 10037 C CB . ASN E 2 146 ? 4.489 73.855 24.170 1.00 101.24 ? 146 ASN D CB 1 ATOM 10038 C CG . ASN E 2 146 ? 3.213 73.103 24.593 1.00 100.05 ? 146 ASN D CG 1 ATOM 10039 O OD1 . ASN E 2 146 ? 2.212 73.748 24.883 1.00 103.72 ? 146 ASN D OD1 1 ATOM 10040 N ND2 . ASN E 2 146 ? 3.231 71.769 24.625 1.00 97.60 ? 146 ASN D ND2 1 ATOM 10041 N N . LYS E 2 147 ? 7.777 74.205 23.510 1.00 105.29 ? 147 LYS D N 1 ATOM 10042 C CA . LYS E 2 147 ? 8.817 74.772 22.631 1.00 105.11 ? 147 LYS D CA 1 ATOM 10043 C C . LYS E 2 147 ? 9.828 73.718 22.233 1.00 97.55 ? 147 LYS D C 1 ATOM 10044 O O . LYS E 2 147 ? 10.406 73.807 21.164 1.00 88.72 ? 147 LYS D O 1 ATOM 10045 C CB . LYS E 2 147 ? 9.511 75.951 23.289 1.00 111.16 ? 147 LYS D CB 1 ATOM 10046 C CG . LYS E 2 147 ? 8.446 76.821 23.917 1.00 123.08 ? 147 LYS D CG 1 ATOM 10047 C CD . LYS E 2 147 ? 8.870 78.242 24.189 1.00 125.32 ? 147 LYS D CD 1 ATOM 10048 C CE . LYS E 2 147 ? 7.873 78.929 25.120 1.00 121.58 ? 147 LYS D CE 1 ATOM 10049 N NZ . LYS E 2 147 ? 7.857 80.404 24.939 1.00 117.09 ? 147 LYS D NZ 1 ATOM 10050 N N . CYS E 2 148 ? 10.021 72.720 23.097 1.00 93.70 ? 148 CYS D N 1 ATOM 10051 C CA . CYS E 2 148 ? 10.856 71.561 22.781 1.00 91.63 ? 148 CYS D CA 1 ATOM 10052 C C . CYS E 2 148 ? 10.158 70.762 21.670 1.00 86.13 ? 148 CYS D C 1 ATOM 10053 O O . CYS E 2 148 ? 10.744 70.513 20.634 1.00 77.59 ? 148 CYS D O 1 ATOM 10054 C CB . CYS E 2 148 ? 11.115 70.691 24.029 1.00 87.13 ? 148 CYS D CB 1 ATOM 10055 S SG . CYS E 2 148 ? 11.862 69.056 23.741 1.00 81.43 ? 148 CYS D SG 1 ATOM 10056 N N . MET E 2 149 ? 8.905 70.384 21.912 1.00 85.02 ? 149 MET D N 1 ATOM 10057 C CA . MET E 2 149 ? 8.028 69.778 20.902 1.00 74.59 ? 149 MET D CA 1 ATOM 10058 C C . MET E 2 149 ? 8.063 70.538 19.564 1.00 75.09 ? 149 MET D C 1 ATOM 10059 O O . MET E 2 149 ? 8.369 69.969 18.526 1.00 79.07 ? 149 MET D O 1 ATOM 10060 C CB . MET E 2 149 ? 6.593 69.723 21.427 1.00 78.03 ? 149 MET D CB 1 ATOM 10061 C CG . MET E 2 149 ? 6.197 68.508 22.273 1.00 80.02 ? 149 MET D CG 1 ATOM 10062 S SD . MET E 2 149 ? 7.217 67.041 22.205 1.00 78.69 ? 149 MET D SD 1 ATOM 10063 C CE . MET E 2 149 ? 6.342 65.865 23.231 1.00 76.32 ? 149 MET D CE 1 ATOM 10064 N N . GLU E 2 150 ? 7.745 71.827 19.575 1.00 79.03 ? 150 GLU D N 1 ATOM 10065 C CA . GLU E 2 150 ? 7.826 72.656 18.353 1.00 81.80 ? 150 GLU D CA 1 ATOM 10066 C C . GLU E 2 150 ? 9.180 72.519 17.668 1.00 81.62 ? 150 GLU D C 1 ATOM 10067 O O . GLU E 2 150 ? 9.257 72.494 16.445 1.00 88.66 ? 150 GLU D O 1 ATOM 10068 C CB . GLU E 2 150 ? 7.529 74.136 18.655 1.00 88.41 ? 150 GLU D CB 1 ATOM 10069 C CG . GLU E 2 150 ? 7.756 75.122 17.508 1.00 96.42 ? 150 GLU D CG 1 ATOM 10070 C CD . GLU E 2 150 ? 6.682 75.007 16.421 1.00 108.10 ? 150 GLU D CD 1 ATOM 10071 O OE1 . GLU E 2 150 ? 6.030 76.015 16.074 1.00 124.57 ? 150 GLU D OE1 1 ATOM 10072 O OE2 . GLU E 2 150 ? 6.430 73.900 15.922 1.00 114.93 ? 150 GLU D OE2 1 ATOM 10073 N N . SER E 2 151 ? 10.242 72.411 18.453 1.00 80.18 ? 151 SER D N 1 ATOM 10074 C CA . SER E 2 151 ? 11.578 72.328 17.886 1.00 76.82 ? 151 SER D CA 1 ATOM 10075 C C . SER E 2 151 ? 11.796 71.024 17.106 1.00 70.17 ? 151 SER D C 1 ATOM 10076 O O . SER E 2 151 ? 12.421 71.059 16.064 1.00 66.02 ? 151 SER D O 1 ATOM 10077 C CB . SER E 2 151 ? 12.681 72.540 18.954 1.00 75.67 ? 151 SER D CB 1 ATOM 10078 O OG . SER E 2 151 ? 12.864 71.430 19.832 1.00 77.35 ? 151 SER D OG 1 ATOM 10079 N N . VAL E 2 152 ? 11.349 69.880 17.621 1.00 73.45 ? 152 VAL D N 1 ATOM 10080 C CA . VAL E 2 152 ? 11.509 68.628 16.858 1.00 82.23 ? 152 VAL D CA 1 ATOM 10081 C C . VAL E 2 152 ? 10.736 68.724 15.546 1.00 84.84 ? 152 VAL D C 1 ATOM 10082 O O . VAL E 2 152 ? 11.189 68.208 14.535 1.00 96.10 ? 152 VAL D O 1 ATOM 10083 C CB . VAL E 2 152 ? 11.066 67.330 17.578 1.00 85.39 ? 152 VAL D CB 1 ATOM 10084 C CG1 . VAL E 2 152 ? 12.186 66.738 18.396 1.00 92.48 ? 152 VAL D CG1 1 ATOM 10085 C CG2 . VAL E 2 152 ? 9.855 67.538 18.451 1.00 96.14 ? 152 VAL D CG2 1 ATOM 10086 N N . ARG E 2 153 ? 9.585 69.398 15.587 1.00 86.24 ? 153 ARG D N 1 ATOM 10087 C CA . ARG E 2 153 ? 8.701 69.584 14.420 1.00 90.44 ? 153 ARG D CA 1 ATOM 10088 C C . ARG E 2 153 ? 9.314 70.385 13.265 1.00 94.61 ? 153 ARG D C 1 ATOM 10089 O O . ARG E 2 153 ? 9.092 70.038 12.105 1.00 100.78 ? 153 ARG D O 1 ATOM 10090 C CB . ARG E 2 153 ? 7.358 70.213 14.828 1.00 84.03 ? 153 ARG D CB 1 ATOM 10091 C CG . ARG E 2 153 ? 6.398 69.270 15.544 1.00 84.38 ? 153 ARG D CG 1 ATOM 10092 C CD . ARG E 2 153 ? 4.989 69.864 15.624 1.00 84.01 ? 153 ARG D CD 1 ATOM 10093 N NE . ARG E 2 153 ? 4.517 69.840 17.002 1.00 87.29 ? 153 ARG D NE 1 ATOM 10094 C CZ . ARG E 2 153 ? 4.413 70.900 17.794 1.00 84.63 ? 153 ARG D CZ 1 ATOM 10095 N NH1 . ARG E 2 153 ? 4.693 72.129 17.353 1.00 80.71 ? 153 ARG D NH1 1 ATOM 10096 N NH2 . ARG E 2 153 ? 3.995 70.729 19.040 1.00 90.83 ? 153 ARG D NH2 1 ATOM 10097 N N . ASN E 2 154 ? 10.062 71.447 13.567 1.00 90.05 ? 154 ASN D N 1 ATOM 10098 C CA . ASN E 2 154 ? 10.742 72.206 12.504 1.00 90.22 ? 154 ASN D CA 1 ATOM 10099 C C . ASN E 2 154 ? 12.236 71.859 12.362 1.00 84.17 ? 154 ASN D C 1 ATOM 10100 O O . ASN E 2 154 ? 13.005 72.628 11.779 1.00 88.42 ? 154 ASN D O 1 ATOM 10101 C CB . ASN E 2 154 ? 10.495 73.722 12.619 1.00 94.65 ? 154 ASN D CB 1 ATOM 10102 C CG . ASN E 2 154 ? 10.938 74.303 13.950 1.00 111.57 ? 154 ASN D CG 1 ATOM 10103 O OD1 . ASN E 2 154 ? 11.682 73.679 14.711 1.00 115.79 ? 154 ASN D OD1 1 ATOM 10104 N ND2 . ASN E 2 154 ? 10.468 75.512 14.246 1.00 123.34 ? 154 ASN D ND2 1 ATOM 10105 N N . GLY E 2 155 ? 12.634 70.694 12.865 1.00 73.42 ? 155 GLY D N 1 ATOM 10106 C CA . GLY E 2 155 ? 13.970 70.171 12.622 1.00 68.89 ? 155 GLY D CA 1 ATOM 10107 C C . GLY E 2 155 ? 15.120 70.860 13.339 1.00 76.50 ? 155 GLY D C 1 ATOM 10108 O O . GLY E 2 155 ? 16.273 70.625 12.986 1.00 80.70 ? 155 GLY D O 1 ATOM 10109 N N . THR E 2 156 ? 14.826 71.660 14.372 1.00 80.35 ? 156 THR D N 1 ATOM 10110 C CA . THR E 2 156 ? 15.850 72.414 15.146 1.00 82.32 ? 156 THR D CA 1 ATOM 10111 C C . THR E 2 156 ? 16.151 71.891 16.563 1.00 82.97 ? 156 THR D C 1 ATOM 10112 O O . THR E 2 156 ? 17.039 72.408 17.235 1.00 89.36 ? 156 THR D O 1 ATOM 10113 C CB . THR E 2 156 ? 15.507 73.921 15.283 1.00 83.04 ? 156 THR D CB 1 ATOM 10114 O OG1 . THR E 2 156 ? 14.237 74.081 15.929 1.00 83.42 ? 156 THR D OG1 1 ATOM 10115 C CG2 . THR E 2 156 ? 15.514 74.615 13.909 1.00 82.88 ? 156 THR D CG2 1 ATOM 10116 N N . TYR E 2 157 ? 15.450 70.858 17.002 1.00 82.17 ? 157 TYR D N 1 ATOM 10117 C CA . TYR E 2 157 ? 15.732 70.215 18.293 1.00 82.42 ? 157 TYR D CA 1 ATOM 10118 C C . TYR E 2 157 ? 17.222 70.056 18.532 1.00 91.75 ? 157 TYR D C 1 ATOM 10119 O O . TYR E 2 157 ? 17.929 69.539 17.685 1.00 92.58 ? 157 TYR D O 1 ATOM 10120 C CB . TYR E 2 157 ? 15.085 68.835 18.343 1.00 82.29 ? 157 TYR D CB 1 ATOM 10121 C CG . TYR E 2 157 ? 15.471 67.948 19.521 1.00 80.19 ? 157 TYR D CG 1 ATOM 10122 C CD1 . TYR E 2 157 ? 14.711 67.932 20.685 1.00 85.06 ? 157 TYR D CD1 1 ATOM 10123 C CD2 . TYR E 2 157 ? 16.557 67.095 19.452 1.00 78.68 ? 157 TYR D CD2 1 ATOM 10124 C CE1 . TYR E 2 157 ? 15.047 67.107 21.756 1.00 85.23 ? 157 TYR D CE1 1 ATOM 10125 C CE2 . TYR E 2 157 ? 16.893 66.263 20.506 1.00 83.36 ? 157 TYR D CE2 1 ATOM 10126 C CZ . TYR E 2 157 ? 16.143 66.278 21.672 1.00 84.74 ? 157 TYR D CZ 1 ATOM 10127 O OH . TYR E 2 157 ? 16.472 65.442 22.738 1.00 84.64 ? 157 TYR D OH 1 ATOM 10128 N N . ASP E 2 158 ? 17.692 70.487 19.704 1.00 111.39 ? 158 ASP D N 1 ATOM 10129 C CA . ASP E 2 158 ? 19.131 70.472 20.052 1.00 110.52 ? 158 ASP D CA 1 ATOM 10130 C C . ASP E 2 158 ? 19.444 69.327 21.039 1.00 112.26 ? 158 ASP D C 1 ATOM 10131 O O . ASP E 2 158 ? 19.028 69.348 22.195 1.00 107.25 ? 158 ASP D O 1 ATOM 10132 C CB . ASP E 2 158 ? 19.565 71.864 20.577 1.00 113.06 ? 158 ASP D CB 1 ATOM 10133 C CG . ASP E 2 158 ? 20.956 71.891 21.263 1.00 119.37 ? 158 ASP D CG 1 ATOM 10134 O OD1 . ASP E 2 158 ? 21.015 72.164 22.489 1.00 111.66 ? 158 ASP D OD1 1 ATOM 10135 O OD2 . ASP E 2 158 ? 21.986 71.725 20.573 1.00 112.82 ? 158 ASP D OD2 1 ATOM 10136 N N . TYR E 2 159 ? 20.185 68.335 20.547 1.00 113.03 ? 159 TYR D N 1 ATOM 10137 C CA . TYR E 2 159 ? 20.512 67.098 21.286 1.00 109.34 ? 159 TYR D CA 1 ATOM 10138 C C . TYR E 2 159 ? 21.376 67.312 22.537 1.00 108.35 ? 159 TYR D C 1 ATOM 10139 O O . TYR E 2 159 ? 21.073 66.730 23.572 1.00 92.39 ? 159 TYR D O 1 ATOM 10140 C CB . TYR E 2 159 ? 21.177 66.083 20.317 1.00 109.64 ? 159 TYR D CB 1 ATOM 10141 C CG . TYR E 2 159 ? 21.690 64.790 20.939 1.00 108.83 ? 159 TYR D CG 1 ATOM 10142 C CD1 . TYR E 2 159 ? 20.799 63.799 21.340 1.00 104.58 ? 159 TYR D CD1 1 ATOM 10143 C CD2 . TYR E 2 159 ? 23.063 64.549 21.106 1.00 107.13 ? 159 TYR D CD2 1 ATOM 10144 C CE1 . TYR E 2 159 ? 21.247 62.611 21.899 1.00 108.15 ? 159 TYR D CE1 1 ATOM 10145 C CE2 . TYR E 2 159 ? 23.518 63.362 21.667 1.00 108.89 ? 159 TYR D CE2 1 ATOM 10146 C CZ . TYR E 2 159 ? 22.604 62.397 22.066 1.00 104.03 ? 159 TYR D CZ 1 ATOM 10147 O OH . TYR E 2 159 ? 23.007 61.215 22.645 1.00 90.07 ? 159 TYR D OH 1 ATOM 10148 N N . PRO E 2 160 ? 22.469 68.106 22.438 1.00 114.89 ? 160 PRO D N 1 ATOM 10149 C CA . PRO E 2 160 ? 23.305 68.357 23.621 1.00 119.08 ? 160 PRO D CA 1 ATOM 10150 C C . PRO E 2 160 ? 22.502 68.830 24.833 1.00 109.16 ? 160 PRO D C 1 ATOM 10151 O O . PRO E 2 160 ? 22.592 68.241 25.901 1.00 104.17 ? 160 PRO D O 1 ATOM 10152 C CB . PRO E 2 160 ? 24.287 69.452 23.154 1.00 123.95 ? 160 PRO D CB 1 ATOM 10153 C CG . PRO E 2 160 ? 24.169 69.529 21.671 1.00 122.64 ? 160 PRO D CG 1 ATOM 10154 C CD . PRO E 2 160 ? 23.138 68.547 21.202 1.00 118.46 ? 160 PRO D CD 1 ATOM 10155 N N . GLN E 2 161 ? 21.717 69.881 24.649 1.00 104.91 ? 161 GLN D N 1 ATOM 10156 C CA . GLN E 2 161 ? 20.878 70.422 25.709 1.00 98.78 ? 161 GLN D CA 1 ATOM 10157 C C . GLN E 2 161 ? 20.297 69.376 26.673 1.00 98.55 ? 161 GLN D C 1 ATOM 10158 O O . GLN E 2 161 ? 20.172 69.652 27.875 1.00 110.42 ? 161 GLN D O 1 ATOM 10159 C CB . GLN E 2 161 ? 19.741 71.252 25.107 1.00 101.67 ? 161 GLN D CB 1 ATOM 10160 C CG . GLN E 2 161 ? 19.798 72.750 25.378 1.00 103.27 ? 161 GLN D CG 1 ATOM 10161 C CD . GLN E 2 161 ? 18.570 73.230 26.121 1.00 102.23 ? 161 GLN D CD 1 ATOM 10162 O OE1 . GLN E 2 161 ? 17.456 73.164 25.607 1.00 95.79 ? 161 GLN D OE1 1 ATOM 10163 N NE2 . GLN E 2 161 ? 18.763 73.694 27.352 1.00 111.09 ? 161 GLN D NE2 1 ATOM 10164 N N . TYR E 2 162 ? 19.929 68.197 26.170 1.00 86.56 ? 162 TYR D N 1 ATOM 10165 C CA . TYR E 2 162 ? 19.196 67.200 26.985 1.00 90.11 ? 162 TYR D CA 1 ATOM 10166 C C . TYR E 2 162 ? 19.936 65.878 27.264 1.00 86.71 ? 162 TYR D C 1 ATOM 10167 O O . TYR E 2 162 ? 19.421 65.036 28.007 1.00 79.84 ? 162 TYR D O 1 ATOM 10168 C CB . TYR E 2 162 ? 17.810 66.899 26.351 1.00 94.94 ? 162 TYR D CB 1 ATOM 10169 C CG . TYR E 2 162 ? 16.923 68.124 26.108 1.00 100.11 ? 162 TYR D CG 1 ATOM 10170 C CD1 . TYR E 2 162 ? 16.999 68.830 24.910 1.00 104.40 ? 162 TYR D CD1 1 ATOM 10171 C CD2 . TYR E 2 162 ? 16.012 68.574 27.076 1.00 98.20 ? 162 TYR D CD2 1 ATOM 10172 C CE1 . TYR E 2 162 ? 16.213 69.952 24.677 1.00 104.16 ? 162 TYR D CE1 1 ATOM 10173 C CE2 . TYR E 2 162 ? 15.219 69.698 26.853 1.00 96.17 ? 162 TYR D CE2 1 ATOM 10174 C CZ . TYR E 2 162 ? 15.332 70.387 25.649 1.00 101.15 ? 162 TYR D CZ 1 ATOM 10175 O OH . TYR E 2 162 ? 14.567 71.503 25.389 1.00 99.13 ? 162 TYR D OH 1 ATOM 10176 N N . SER E 2 163 ? 21.133 65.697 26.698 1.00 100.24 ? 163 SER D N 1 ATOM 10177 C CA . SER E 2 163 ? 21.822 64.377 26.712 1.00 106.26 ? 163 SER D CA 1 ATOM 10178 C C . SER E 2 163 ? 21.874 63.789 28.101 1.00 112.49 ? 163 SER D C 1 ATOM 10179 O O . SER E 2 163 ? 21.530 62.627 28.344 1.00 108.13 ? 163 SER D O 1 ATOM 10180 C CB . SER E 2 163 ? 23.274 64.470 26.197 1.00 102.93 ? 163 SER D CB 1 ATOM 10181 O OG . SER E 2 163 ? 23.467 65.523 25.280 1.00 107.75 ? 163 SER D OG 1 ATOM 10182 N N . GLU E 2 164 ? 22.323 64.633 29.012 1.00 122.77 ? 164 GLU D N 1 ATOM 10183 C CA . GLU E 2 164 ? 22.717 64.208 30.332 1.00 121.97 ? 164 GLU D CA 1 ATOM 10184 C C . GLU E 2 164 ? 21.519 63.882 31.248 1.00 109.67 ? 164 GLU D C 1 ATOM 10185 O O . GLU E 2 164 ? 21.518 62.843 31.902 1.00 102.55 ? 164 GLU D O 1 ATOM 10186 C CB . GLU E 2 164 ? 23.729 65.230 30.865 1.00 130.65 ? 164 GLU D CB 1 ATOM 10187 C CG . GLU E 2 164 ? 24.989 65.265 30.003 1.00 138.63 ? 164 GLU D CG 1 ATOM 10188 C CD . GLU E 2 164 ? 26.170 65.964 30.634 1.00 131.02 ? 164 GLU D CD 1 ATOM 10189 O OE1 . GLU E 2 164 ? 26.210 66.043 31.873 1.00 125.76 ? 164 GLU D OE1 1 ATOM 10190 O OE2 . GLU E 2 164 ? 27.057 66.415 29.876 1.00 127.61 ? 164 GLU D OE2 1 ATOM 10191 N N . GLU E 2 165 ? 20.473 64.704 31.219 1.00 96.41 ? 165 GLU D N 1 ATOM 10192 C CA . GLU E 2 165 ? 19.201 64.366 31.880 1.00 94.00 ? 165 GLU D CA 1 ATOM 10193 C C . GLU E 2 165 ? 18.632 63.011 31.409 1.00 104.06 ? 165 GLU D C 1 ATOM 10194 O O . GLU E 2 165 ? 17.965 62.278 32.174 1.00 103.25 ? 165 GLU D O 1 ATOM 10195 C CB . GLU E 2 165 ? 18.184 65.488 31.635 1.00 86.82 ? 165 GLU D CB 1 ATOM 10196 C CG . GLU E 2 165 ? 16.789 65.237 32.197 1.00 84.93 ? 165 GLU D CG 1 ATOM 10197 C CD . GLU E 2 165 ? 15.815 66.358 31.868 1.00 83.70 ? 165 GLU D CD 1 ATOM 10198 O OE1 . GLU E 2 165 ? 16.240 67.359 31.239 1.00 84.97 ? 165 GLU D OE1 1 ATOM 10199 O OE2 . GLU E 2 165 ? 14.620 66.244 32.244 1.00 79.67 ? 165 GLU D OE2 1 ATOM 10200 N N . ALA E 2 166 ? 18.865 62.720 30.130 1.00 111.02 ? 166 ALA D N 1 ATOM 10201 C CA . ALA E 2 166 ? 18.434 61.473 29.518 1.00 116.10 ? 166 ALA D CA 1 ATOM 10202 C C . ALA E 2 166 ? 19.410 60.357 29.871 1.00 113.56 ? 166 ALA D C 1 ATOM 10203 O O . ALA E 2 166 ? 19.000 59.279 30.247 1.00 105.96 ? 166 ALA D O 1 ATOM 10204 C CB . ALA E 2 166 ? 18.294 61.648 28.002 1.00 126.02 ? 166 ALA D CB 1 ATOM 10205 N N . ARG E 2 167 ? 20.697 60.639 29.741 1.00 129.54 ? 167 ARG D N 1 ATOM 10206 C CA . ARG E 2 167 ? 21.788 59.744 30.192 1.00 145.93 ? 167 ARG D CA 1 ATOM 10207 C C . ARG E 2 167 ? 21.627 59.140 31.608 1.00 151.26 ? 167 ARG D C 1 ATOM 10208 O O . ARG E 2 167 ? 22.113 58.037 31.880 1.00 151.90 ? 167 ARG D O 1 ATOM 10209 C CB . ARG E 2 167 ? 23.139 60.514 30.107 1.00 148.57 ? 167 ARG D CB 1 ATOM 10210 C CG . ARG E 2 167 ? 23.891 60.263 28.806 1.00 153.52 ? 167 ARG D CG 1 ATOM 10211 C CD . ARG E 2 167 ? 25.233 60.961 28.650 1.00 152.31 ? 167 ARG D CD 1 ATOM 10212 N NE . ARG E 2 167 ? 25.933 61.059 29.918 1.00 156.21 ? 167 ARG D NE 1 ATOM 10213 C CZ . ARG E 2 167 ? 26.853 61.978 30.184 1.00 146.73 ? 167 ARG D CZ 1 ATOM 10214 N NH1 . ARG E 2 167 ? 27.203 62.880 29.266 1.00 142.54 ? 167 ARG D NH1 1 ATOM 10215 N NH2 . ARG E 2 167 ? 27.411 61.984 31.381 1.00 139.12 ? 167 ARG D NH2 1 ATOM 10216 N N . LEU E 2 168 ? 20.966 59.873 32.500 1.00 155.99 ? 168 LEU D N 1 ATOM 10217 C CA . LEU E 2 168 ? 20.812 59.455 33.903 1.00 159.29 ? 168 LEU D CA 1 ATOM 10218 C C . LEU E 2 168 ? 19.403 58.959 34.279 1.00 154.97 ? 168 LEU D C 1 ATOM 10219 O O . LEU E 2 168 ? 19.264 58.213 35.253 1.00 141.89 ? 168 LEU D O 1 ATOM 10220 C CB . LEU E 2 168 ? 21.311 60.575 34.844 1.00 162.94 ? 168 LEU D CB 1 ATOM 10221 C CG . LEU E 2 168 ? 22.827 60.695 35.163 1.00 165.80 ? 168 LEU D CG 1 ATOM 10222 C CD1 . LEU E 2 168 ? 23.518 59.394 35.585 1.00 164.60 ? 168 LEU D CD1 1 ATOM 10223 C CD2 . LEU E 2 168 ? 23.606 61.335 34.018 1.00 167.42 ? 168 LEU D CD2 1 ATOM 10224 N N . LYS E 2 169 ? 18.375 59.336 33.508 1.00 157.29 ? 169 LYS D N 1 ATOM 10225 C CA . LYS E 2 169 ? 17.039 58.692 33.620 1.00 158.03 ? 169 LYS D CA 1 ATOM 10226 C C . LYS E 2 169 ? 17.055 57.246 33.068 1.00 167.34 ? 169 LYS D C 1 ATOM 10227 O O . LYS E 2 169 ? 16.156 56.431 33.323 1.00 164.48 ? 169 LYS D O 1 ATOM 10228 C CB . LYS E 2 169 ? 15.948 59.558 32.939 1.00 145.56 ? 169 LYS D CB 1 ATOM 10229 C CG . LYS E 2 169 ? 14.614 58.867 32.624 1.00 134.86 ? 169 LYS D CG 1 ATOM 10230 C CD . LYS E 2 169 ? 13.943 58.245 33.843 1.00 129.63 ? 169 LYS D CD 1 ATOM 10231 C CE . LYS E 2 169 ? 12.424 58.271 33.747 1.00 123.13 ? 169 LYS D CE 1 ATOM 10232 N NZ . LYS E 2 169 ? 11.882 59.614 34.081 1.00 120.58 ? 169 LYS D NZ 1 ATOM 10233 N N . ARG E 2 170 ? 18.089 56.917 32.311 1.00 169.53 ? 170 ARG D N 1 ATOM 10234 C CA . ARG E 2 170 ? 18.133 55.629 31.648 1.00 169.42 ? 170 ARG D CA 1 ATOM 10235 C C . ARG E 2 170 ? 18.388 54.458 32.647 1.00 165.97 ? 170 ARG D C 1 ATOM 10236 O O . ARG E 2 170 ? 17.431 53.747 33.003 1.00 141.54 ? 170 ARG D O 1 ATOM 10237 C CB . ARG E 2 170 ? 19.111 55.734 30.452 1.00 167.62 ? 170 ARG D CB 1 ATOM 10238 C CG . ARG E 2 170 ? 18.643 55.045 29.166 1.00 157.91 ? 170 ARG D CG 1 ATOM 10239 C CD . ARG E 2 170 ? 19.648 55.090 28.026 1.00 145.76 ? 170 ARG D CD 1 ATOM 10240 N NE . ARG E 2 170 ? 19.823 56.418 27.415 1.00 138.32 ? 170 ARG D NE 1 ATOM 10241 C CZ . ARG E 2 170 ? 20.981 57.073 27.302 1.00 132.33 ? 170 ARG D CZ 1 ATOM 10242 N NH1 . ARG E 2 170 ? 22.117 56.552 27.757 1.00 128.88 ? 170 ARG D NH1 1 ATOM 10243 N NH2 . ARG E 2 170 ? 21.017 58.269 26.720 1.00 129.60 ? 170 ARG D NH2 1 ATOM 10244 N N . GLU E 2 171 ? 19.613 54.319 33.169 1.00 166.07 ? 171 GLU D N 1 ATOM 10245 C CA . GLU E 2 171 ? 20.034 53.104 33.926 1.00 161.80 ? 171 GLU D CA 1 ATOM 10246 C C . GLU E 2 171 ? 19.363 52.875 35.288 1.00 156.94 ? 171 GLU D C 1 ATOM 10247 O O . GLU E 2 171 ? 19.854 52.067 36.077 1.00 138.63 ? 171 GLU D O 1 ATOM 10248 C CB . GLU E 2 171 ? 21.570 53.038 34.110 1.00 160.73 ? 171 GLU D CB 1 ATOM 10249 C CG . GLU E 2 171 ? 22.422 53.808 33.104 1.00 160.64 ? 171 GLU D CG 1 ATOM 10250 C CD . GLU E 2 171 ? 22.617 55.251 33.548 1.00 160.93 ? 171 GLU D CD 1 ATOM 10251 O OE1 . GLU E 2 171 ? 23.742 55.772 33.419 1.00 156.20 ? 171 GLU D OE1 1 ATOM 10252 O OE2 . GLU E 2 171 ? 21.639 55.859 34.049 1.00 156.13 ? 171 GLU D OE2 1 ATOM 10253 N N . GLU E 2 172 ? 18.238 53.551 35.527 1.00 159.54 ? 172 GLU D N 1 ATOM 10254 C CA . GLU E 2 172 ? 17.498 53.507 36.807 1.00 162.42 ? 172 GLU D CA 1 ATOM 10255 C C . GLU E 2 172 ? 16.584 52.276 37.074 1.00 165.15 ? 172 GLU D C 1 ATOM 10256 O O . GLU E 2 172 ? 16.530 51.713 38.196 1.00 157.46 ? 172 GLU D O 1 ATOM 10257 C CB . GLU E 2 172 ? 16.665 54.799 36.918 1.00 157.09 ? 172 GLU D CB 1 ATOM 10258 C CG . GLU E 2 172 ? 17.507 56.016 37.286 1.00 151.47 ? 172 GLU D CG 1 ATOM 10259 C CD . GLU E 2 172 ? 16.719 57.280 37.610 1.00 144.56 ? 172 GLU D CD 1 ATOM 10260 O OE1 . GLU E 2 172 ? 17.386 58.222 38.083 1.00 135.53 ? 172 GLU D OE1 1 ATOM 10261 O OE2 . GLU E 2 172 ? 15.475 57.359 37.404 1.00 133.60 ? 172 GLU D OE2 1 ATOM 10262 N N . ILE E 2 173 ? 15.894 51.852 36.018 1.00 162.96 ? 173 ILE D N 1 ATOM 10263 C CA . ILE E 2 173 ? 14.805 50.855 36.126 1.00 153.25 ? 173 ILE D CA 1 ATOM 10264 C C . ILE E 2 173 ? 15.371 49.435 35.981 1.00 141.92 ? 173 ILE D C 1 ATOM 10265 O O . ILE E 2 173 ? 16.376 49.082 36.601 1.00 126.28 ? 173 ILE D O 1 ATOM 10266 C CB . ILE E 2 173 ? 13.621 51.030 35.105 1.00 146.49 ? 173 ILE D CB 1 ATOM 10267 C CG1 . ILE E 2 173 ? 13.497 52.459 34.516 1.00 142.88 ? 173 ILE D CG1 1 ATOM 10268 C CG2 . ILE E 2 173 ? 12.306 50.602 35.764 1.00 140.75 ? 173 ILE D CG2 1 ATOM 10269 C CD1 . ILE E 2 173 ? 12.713 52.535 33.211 1.00 134.06 ? 173 ILE D CD1 1 ATOM 10270 N N . GLY F 2 12 ? 21.170 68.417 -1.230 1.00 73.36 ? 12 GLY F N 1 ATOM 10271 C CA . GLY F 2 12 ? 21.864 68.796 -2.528 1.00 80.42 ? 12 GLY F CA 1 ATOM 10272 C C . GLY F 2 12 ? 22.909 67.809 -3.092 1.00 81.50 ? 12 GLY F C 1 ATOM 10273 O O . GLY F 2 12 ? 23.276 66.836 -2.425 1.00 85.26 ? 12 GLY F O 1 ATOM 10274 N N . GLY F 2 13 ? 23.377 68.060 -4.323 1.00 85.29 ? 13 GLY F N 1 ATOM 10275 C CA . GLY F 2 13 ? 24.394 67.217 -5.005 1.00 87.48 ? 13 GLY F CA 1 ATOM 10276 C C . GLY F 2 13 ? 25.761 67.884 -5.068 1.00 88.41 ? 13 GLY F C 1 ATOM 10277 O O . GLY F 2 13 ? 25.869 69.052 -4.700 1.00 91.15 ? 13 GLY F O 1 ATOM 10278 N N . TRP F 2 14 ? 26.789 67.175 -5.567 1.00 88.65 ? 14 TRP F N 1 ATOM 10279 C CA . TRP F 2 14 ? 28.218 67.647 -5.509 1.00 87.99 ? 14 TRP F CA 1 ATOM 10280 C C . TRP F 2 14 ? 28.938 67.899 -6.845 1.00 85.72 ? 14 TRP F C 1 ATOM 10281 O O . TRP F 2 14 ? 29.455 66.963 -7.464 1.00 85.17 ? 14 TRP F O 1 ATOM 10282 C CB . TRP F 2 14 ? 29.112 66.655 -4.748 1.00 84.39 ? 14 TRP F CB 1 ATOM 10283 C CG . TRP F 2 14 ? 28.792 66.440 -3.326 1.00 82.71 ? 14 TRP F CG 1 ATOM 10284 C CD1 . TRP F 2 14 ? 28.203 67.320 -2.452 1.00 80.03 ? 14 TRP F CD1 1 ATOM 10285 C CD2 . TRP F 2 14 ? 29.091 65.265 -2.578 1.00 75.68 ? 14 TRP F CD2 1 ATOM 10286 N NE1 . TRP F 2 14 ? 28.092 66.746 -1.215 1.00 78.04 ? 14 TRP F NE1 1 ATOM 10287 C CE2 . TRP F 2 14 ? 28.651 65.492 -1.257 1.00 73.94 ? 14 TRP F CE2 1 ATOM 10288 C CE3 . TRP F 2 14 ? 29.684 64.037 -2.899 1.00 68.36 ? 14 TRP F CE3 1 ATOM 10289 C CZ2 . TRP F 2 14 ? 28.776 64.533 -0.252 1.00 72.57 ? 14 TRP F CZ2 1 ATOM 10290 C CZ3 . TRP F 2 14 ? 29.807 63.078 -1.904 1.00 69.89 ? 14 TRP F CZ3 1 ATOM 10291 C CH2 . TRP F 2 14 ? 29.357 63.337 -0.590 1.00 70.03 ? 14 TRP F CH2 1 ATOM 10292 N N . GLN F 2 15 ? 29.030 69.164 -7.251 1.00 86.97 ? 15 GLN F N 1 ATOM 10293 C CA . GLN F 2 15 ? 29.750 69.539 -8.476 1.00 88.38 ? 15 GLN F CA 1 ATOM 10294 C C . GLN F 2 15 ? 31.125 68.909 -8.550 1.00 89.65 ? 15 GLN F C 1 ATOM 10295 O O . GLN F 2 15 ? 31.633 68.664 -9.635 1.00 83.40 ? 15 GLN F O 1 ATOM 10296 C CB . GLN F 2 15 ? 29.931 71.059 -8.555 1.00 95.34 ? 15 GLN F CB 1 ATOM 10297 C CG . GLN F 2 15 ? 28.751 71.892 -9.077 1.00 101.56 ? 15 GLN F CG 1 ATOM 10298 C CD . GLN F 2 15 ? 28.599 71.871 -10.611 1.00 101.52 ? 15 GLN F CD 1 ATOM 10299 O OE1 . GLN F 2 15 ? 29.418 71.284 -11.335 1.00 106.61 ? 15 GLN F OE1 1 ATOM 10300 N NE2 . GLN F 2 15 ? 27.537 72.506 -11.107 1.00 86.33 ? 15 GLN F NE2 1 ATOM 10301 N N . GLY F 2 16 ? 31.745 68.688 -7.393 1.00 98.19 ? 16 GLY F N 1 ATOM 10302 C CA . GLY F 2 16 ? 33.090 68.119 -7.321 1.00 101.91 ? 16 GLY F CA 1 ATOM 10303 C C . GLY F 2 16 ? 33.168 66.712 -7.883 1.00 103.29 ? 16 GLY F C 1 ATOM 10304 O O . GLY F 2 16 ? 33.950 66.456 -8.786 1.00 114.84 ? 16 GLY F O 1 ATOM 10305 N N . MET F 2 17 ? 32.347 65.804 -7.365 1.00 106.11 ? 17 MET F N 1 ATOM 10306 C CA . MET F 2 17 ? 32.450 64.380 -7.715 1.00 108.30 ? 17 MET F CA 1 ATOM 10307 C C . MET F 2 17 ? 32.239 64.197 -9.215 1.00 110.28 ? 17 MET F C 1 ATOM 10308 O O . MET F 2 17 ? 31.142 64.399 -9.712 1.00 119.41 ? 17 MET F O 1 ATOM 10309 C CB . MET F 2 17 ? 31.415 63.545 -6.976 1.00 102.56 ? 17 MET F CB 1 ATOM 10310 C CG . MET F 2 17 ? 31.726 62.070 -7.110 1.00 103.11 ? 17 MET F CG 1 ATOM 10311 S SD . MET F 2 17 ? 30.455 60.988 -6.455 1.00 107.23 ? 17 MET F SD 1 ATOM 10312 C CE . MET F 2 17 ? 30.796 61.160 -4.720 1.00 114.31 ? 17 MET F CE 1 ATOM 10313 N N . VAL F 2 18 ? 33.296 63.816 -9.922 1.00 107.12 ? 18 VAL F N 1 ATOM 10314 C CA . VAL F 2 18 ? 33.247 63.655 -11.388 1.00 107.01 ? 18 VAL F CA 1 ATOM 10315 C C . VAL F 2 18 ? 33.462 62.205 -11.846 1.00 103.32 ? 18 VAL F C 1 ATOM 10316 O O . VAL F 2 18 ? 33.173 61.896 -12.987 1.00 115.25 ? 18 VAL F O 1 ATOM 10317 C CB . VAL F 2 18 ? 34.242 64.600 -12.149 1.00 112.08 ? 18 VAL F CB 1 ATOM 10318 C CG1 . VAL F 2 18 ? 33.641 65.974 -12.456 1.00 115.89 ? 18 VAL F CG1 1 ATOM 10319 C CG2 . VAL F 2 18 ? 35.566 64.737 -11.410 1.00 115.81 ? 18 VAL F CG2 1 ATOM 10320 N N . ASP F 2 19 ? 33.943 61.300 -10.995 1.00 98.83 ? 19 ASP F N 1 ATOM 10321 C CA . ASP F 2 19 ? 34.268 59.933 -11.472 1.00 99.24 ? 19 ASP F CA 1 ATOM 10322 C C . ASP F 2 19 ? 33.134 58.918 -11.259 1.00 87.72 ? 19 ASP F C 1 ATOM 10323 O O . ASP F 2 19 ? 33.340 57.712 -11.425 1.00 77.92 ? 19 ASP F O 1 ATOM 10324 C CB . ASP F 2 19 ? 35.616 59.414 -10.898 1.00 111.24 ? 19 ASP F CB 1 ATOM 10325 C CG . ASP F 2 19 ? 35.733 59.588 -9.380 1.00 122.30 ? 19 ASP F CG 1 ATOM 10326 O OD1 . ASP F 2 19 ? 35.091 60.499 -8.816 1.00 136.43 ? 19 ASP F OD1 1 ATOM 10327 O OD2 . ASP F 2 19 ? 36.464 58.811 -8.736 1.00 119.97 ? 19 ASP F OD2 1 ATOM 10328 N N . GLY F 2 20 ? 31.934 59.404 -10.935 1.00 81.93 ? 20 GLY F N 1 ATOM 10329 C CA . GLY F 2 20 ? 30.789 58.519 -10.718 1.00 78.76 ? 20 GLY F CA 1 ATOM 10330 C C . GLY F 2 20 ? 29.458 59.197 -10.382 1.00 75.91 ? 20 GLY F C 1 ATOM 10331 O O . GLY F 2 20 ? 29.337 60.408 -10.437 1.00 77.02 ? 20 GLY F O 1 ATOM 10332 N N . TRP F 2 21 ? 28.455 58.401 -10.034 1.00 74.56 ? 21 TRP F N 1 ATOM 10333 C CA . TRP F 2 21 ? 27.095 58.921 -9.778 1.00 82.79 ? 21 TRP F CA 1 ATOM 10334 C C . TRP F 2 21 ? 26.787 59.087 -8.292 1.00 77.32 ? 21 TRP F C 1 ATOM 10335 O O . TRP F 2 21 ? 26.146 60.073 -7.880 1.00 63.51 ? 21 TRP F O 1 ATOM 10336 C CB . TRP F 2 21 ? 26.006 58.036 -10.437 1.00 82.97 ? 21 TRP F CB 1 ATOM 10337 C CG . TRP F 2 21 ? 25.682 58.379 -11.882 1.00 82.57 ? 21 TRP F CG 1 ATOM 10338 C CD1 . TRP F 2 21 ? 26.170 59.421 -12.618 1.00 85.14 ? 21 TRP F CD1 1 ATOM 10339 C CD2 . TRP F 2 21 ? 24.769 57.690 -12.736 1.00 84.16 ? 21 TRP F CD2 1 ATOM 10340 N NE1 . TRP F 2 21 ? 25.627 59.415 -13.879 1.00 85.65 ? 21 TRP F NE1 1 ATOM 10341 C CE2 . TRP F 2 21 ? 24.763 58.363 -13.976 1.00 85.16 ? 21 TRP F CE2 1 ATOM 10342 C CE3 . TRP F 2 21 ? 23.950 56.573 -12.571 1.00 85.45 ? 21 TRP F CE3 1 ATOM 10343 C CZ2 . TRP F 2 21 ? 23.980 57.953 -15.045 1.00 93.30 ? 21 TRP F CZ2 1 ATOM 10344 C CZ3 . TRP F 2 21 ? 23.169 56.157 -13.640 1.00 94.86 ? 21 TRP F CZ3 1 ATOM 10345 C CH2 . TRP F 2 21 ? 23.191 56.847 -14.865 1.00 96.34 ? 21 TRP F CH2 1 ATOM 10346 N N . TYR F 2 22 ? 27.217 58.094 -7.517 1.00 74.20 ? 22 TYR F N 1 ATOM 10347 C CA . TYR F 2 22 ? 27.093 58.127 -6.079 1.00 80.97 ? 22 TYR F CA 1 ATOM 10348 C C . TYR F 2 22 ? 28.444 57.913 -5.408 1.00 88.28 ? 22 TYR F C 1 ATOM 10349 O O . TYR F 2 22 ? 29.245 57.108 -5.869 1.00 91.28 ? 22 TYR F O 1 ATOM 10350 C CB . TYR F 2 22 ? 26.174 57.021 -5.610 1.00 78.05 ? 22 TYR F CB 1 ATOM 10351 C CG . TYR F 2 22 ? 25.002 56.702 -6.500 1.00 76.21 ? 22 TYR F CG 1 ATOM 10352 C CD1 . TYR F 2 22 ? 24.015 57.643 -6.766 1.00 70.65 ? 22 TYR F CD1 1 ATOM 10353 C CD2 . TYR F 2 22 ? 24.866 55.432 -7.043 1.00 72.77 ? 22 TYR F CD2 1 ATOM 10354 C CE1 . TYR F 2 22 ? 22.950 57.338 -7.567 1.00 63.82 ? 22 TYR F CE1 1 ATOM 10355 C CE2 . TYR F 2 22 ? 23.798 55.119 -7.822 1.00 66.23 ? 22 TYR F CE2 1 ATOM 10356 C CZ . TYR F 2 22 ? 22.852 56.075 -8.079 1.00 66.00 ? 22 TYR F CZ 1 ATOM 10357 O OH . TYR F 2 22 ? 21.795 55.683 -8.844 1.00 63.81 ? 22 TYR F OH 1 ATOM 10358 N N . GLY F 2 23 ? 28.691 58.613 -4.304 1.00 96.36 ? 23 GLY F N 1 ATOM 10359 C CA . GLY F 2 23 ? 29.932 58.405 -3.548 1.00 99.32 ? 23 GLY F CA 1 ATOM 10360 C C . GLY F 2 23 ? 30.079 59.130 -2.209 1.00 93.16 ? 23 GLY F C 1 ATOM 10361 O O . GLY F 2 23 ? 29.105 59.436 -1.522 1.00 83.29 ? 23 GLY F O 1 ATOM 10362 N N . TYR F 2 24 ? 31.329 59.423 -1.872 1.00 92.47 ? 24 TYR F N 1 ATOM 10363 C CA . TYR F 2 24 ? 31.702 59.907 -0.551 1.00 86.99 ? 24 TYR F CA 1 ATOM 10364 C C . TYR F 2 24 ? 32.573 61.155 -0.589 1.00 86.79 ? 24 TYR F C 1 ATOM 10365 O O . TYR F 2 24 ? 33.435 61.266 -1.449 1.00 91.07 ? 24 TYR F O 1 ATOM 10366 C CB . TYR F 2 24 ? 32.494 58.826 0.148 1.00 78.62 ? 24 TYR F CB 1 ATOM 10367 C CG . TYR F 2 24 ? 31.893 57.439 0.078 1.00 77.76 ? 24 TYR F CG 1 ATOM 10368 C CD1 . TYR F 2 24 ? 30.900 57.044 0.966 1.00 80.21 ? 24 TYR F CD1 1 ATOM 10369 C CD2 . TYR F 2 24 ? 32.335 56.515 -0.860 1.00 79.87 ? 24 TYR F CD2 1 ATOM 10370 C CE1 . TYR F 2 24 ? 30.371 55.764 0.920 1.00 82.11 ? 24 TYR F CE1 1 ATOM 10371 C CE2 . TYR F 2 24 ? 31.816 55.231 -0.916 1.00 77.17 ? 24 TYR F CE2 1 ATOM 10372 C CZ . TYR F 2 24 ? 30.831 54.862 -0.029 1.00 77.66 ? 24 TYR F CZ 1 ATOM 10373 O OH . TYR F 2 24 ? 30.293 53.602 -0.091 1.00 74.29 ? 24 TYR F OH 1 ATOM 10374 N N . HIS F 2 25 ? 32.329 62.091 0.330 1.00 90.87 ? 25 HIS F N 1 ATOM 10375 C CA . HIS F 2 25 ? 33.270 63.185 0.617 1.00 95.78 ? 25 HIS F CA 1 ATOM 10376 C C . HIS F 2 25 ? 33.790 62.962 2.008 1.00 93.53 ? 25 HIS F C 1 ATOM 10377 O O . HIS F 2 25 ? 33.012 62.817 2.954 1.00 88.66 ? 25 HIS F O 1 ATOM 10378 C CB . HIS F 2 25 ? 32.612 64.564 0.538 1.00 100.82 ? 25 HIS F CB 1 ATOM 10379 C CG . HIS F 2 25 ? 33.570 65.714 0.665 1.00 107.71 ? 25 HIS F CG 1 ATOM 10380 N ND1 . HIS F 2 25 ? 33.306 66.820 1.447 1.00 114.00 ? 25 HIS F ND1 1 ATOM 10381 C CD2 . HIS F 2 25 ? 34.772 65.944 0.086 1.00 108.19 ? 25 HIS F CD2 1 ATOM 10382 C CE1 . HIS F 2 25 ? 34.310 67.672 1.355 1.00 113.82 ? 25 HIS F CE1 1 ATOM 10383 N NE2 . HIS F 2 25 ? 35.212 67.165 0.534 1.00 113.41 ? 25 HIS F NE2 1 ATOM 10384 N N . HIS F 2 26 ? 35.111 62.920 2.122 1.00 101.43 ? 26 HIS F N 1 ATOM 10385 C CA . HIS F 2 26 ? 35.752 62.673 3.396 1.00 105.57 ? 26 HIS F CA 1 ATOM 10386 C C . HIS F 2 26 ? 36.558 63.888 3.830 1.00 108.91 ? 26 HIS F C 1 ATOM 10387 O O . HIS F 2 26 ? 37.325 64.449 3.053 1.00 118.23 ? 26 HIS F O 1 ATOM 10388 C CB . HIS F 2 26 ? 36.627 61.424 3.337 1.00 101.51 ? 26 HIS F CB 1 ATOM 10389 C CG . HIS F 2 26 ? 37.928 61.618 2.624 1.00 106.52 ? 26 HIS F CG 1 ATOM 10390 N ND1 . HIS F 2 26 ? 38.121 61.226 1.319 1.00 110.03 ? 26 HIS F ND1 1 ATOM 10391 C CD2 . HIS F 2 26 ? 39.097 62.167 3.031 1.00 107.07 ? 26 HIS F CD2 1 ATOM 10392 C CE1 . HIS F 2 26 ? 39.353 61.525 0.952 1.00 112.07 ? 26 HIS F CE1 1 ATOM 10393 N NE2 . HIS F 2 26 ? 39.965 62.100 1.971 1.00 109.24 ? 26 HIS F NE2 1 ATOM 10394 N N . SER F 2 27 ? 36.352 64.286 5.079 1.00 107.76 ? 27 SER F N 1 ATOM 10395 C CA . SER F 2 27 ? 36.941 65.496 5.637 1.00 103.83 ? 27 SER F CA 1 ATOM 10396 C C . SER F 2 27 ? 37.733 65.135 6.908 1.00 97.50 ? 27 SER F C 1 ATOM 10397 O O . SER F 2 27 ? 37.158 65.015 7.975 1.00 96.50 ? 27 SER F O 1 ATOM 10398 C CB . SER F 2 27 ? 35.822 66.510 5.941 1.00 105.63 ? 27 SER F CB 1 ATOM 10399 O OG . SER F 2 27 ? 36.234 67.827 5.676 1.00 103.16 ? 27 SER F OG 1 ATOM 10400 N N . ASN F 2 28 ? 39.045 64.944 6.766 1.00 99.93 ? 28 ASN F N 1 ATOM 10401 C CA . ASN F 2 28 ? 39.941 64.626 7.903 1.00 99.80 ? 28 ASN F CA 1 ATOM 10402 C C . ASN F 2 28 ? 41.237 65.460 7.919 1.00 102.43 ? 28 ASN F C 1 ATOM 10403 O O . ASN F 2 28 ? 41.334 66.470 7.219 1.00 96.97 ? 28 ASN F O 1 ATOM 10404 C CB . ASN F 2 28 ? 40.230 63.115 7.971 1.00 91.23 ? 28 ASN F CB 1 ATOM 10405 C CG . ASN F 2 28 ? 41.259 62.644 6.951 1.00 89.31 ? 28 ASN F CG 1 ATOM 10406 O OD1 . ASN F 2 28 ? 41.695 63.388 6.061 1.00 90.99 ? 28 ASN F OD1 1 ATOM 10407 N ND2 . ASN F 2 28 ? 41.594 61.363 7.036 1.00 82.15 ? 28 ASN F ND2 1 ATOM 10408 N N . GLU F 2 29 ? 42.229 65.036 8.701 1.00 116.52 ? 29 GLU F N 1 ATOM 10409 C CA . GLU F 2 29 ? 43.469 65.823 8.876 1.00 130.91 ? 29 GLU F CA 1 ATOM 10410 C C . GLU F 2 29 ? 44.290 65.959 7.597 1.00 129.57 ? 29 GLU F C 1 ATOM 10411 O O . GLU F 2 29 ? 44.820 67.037 7.330 1.00 124.50 ? 29 GLU F O 1 ATOM 10412 C CB . GLU F 2 29 ? 44.384 65.226 9.959 1.00 141.08 ? 29 GLU F CB 1 ATOM 10413 C CG . GLU F 2 29 ? 44.959 66.240 10.939 1.00 148.24 ? 29 GLU F CG 1 ATOM 10414 C CD . GLU F 2 29 ? 44.144 66.337 12.215 1.00 152.87 ? 29 GLU F CD 1 ATOM 10415 O OE1 . GLU F 2 29 ? 43.972 65.299 12.892 1.00 147.11 ? 29 GLU F OE1 1 ATOM 10416 O OE2 . GLU F 2 29 ? 43.671 67.448 12.541 1.00 163.27 ? 29 GLU F OE2 1 ATOM 10417 N N . GLN F 2 30 ? 44.375 64.874 6.816 1.00 124.64 ? 30 GLN F N 1 ATOM 10418 C CA . GLN F 2 30 ? 45.283 64.796 5.661 1.00 123.35 ? 30 GLN F CA 1 ATOM 10419 C C . GLN F 2 30 ? 44.769 65.586 4.465 1.00 124.69 ? 30 GLN F C 1 ATOM 10420 O O . GLN F 2 30 ? 45.405 65.599 3.410 1.00 128.96 ? 30 GLN F O 1 ATOM 10421 C CB . GLN F 2 30 ? 45.540 63.344 5.220 1.00 119.51 ? 30 GLN F CB 1 ATOM 10422 C CG . GLN F 2 30 ? 46.299 62.481 6.207 1.00 114.61 ? 30 GLN F CG 1 ATOM 10423 C CD . GLN F 2 30 ? 45.377 61.725 7.122 1.00 115.93 ? 30 GLN F CD 1 ATOM 10424 O OE1 . GLN F 2 30 ? 45.124 60.545 6.906 1.00 110.68 ? 30 GLN F OE1 1 ATOM 10425 N NE2 . GLN F 2 30 ? 44.872 62.394 8.156 1.00 120.86 ? 30 GLN F NE2 1 ATOM 10426 N N . GLY F 2 31 ? 43.631 66.248 4.638 1.00 125.32 ? 31 GLY F N 1 ATOM 10427 C CA . GLY F 2 31 ? 42.978 66.966 3.558 1.00 122.19 ? 31 GLY F CA 1 ATOM 10428 C C . GLY F 2 31 ? 41.733 66.203 3.186 1.00 118.74 ? 31 GLY F C 1 ATOM 10429 O O . GLY F 2 31 ? 41.553 65.044 3.594 1.00 111.28 ? 31 GLY F O 1 ATOM 10430 N N . SER F 2 32 ? 40.864 66.867 2.429 1.00 116.74 ? 32 SER F N 1 ATOM 10431 C CA . SER F 2 32 ? 39.581 66.299 2.020 1.00 108.52 ? 32 SER F CA 1 ATOM 10432 C C . SER F 2 32 ? 39.593 65.855 0.558 1.00 104.41 ? 32 SER F C 1 ATOM 10433 O O . SER F 2 32 ? 40.586 66.017 -0.142 1.00 107.43 ? 32 SER F O 1 ATOM 10434 C CB . SER F 2 32 ? 38.470 67.320 2.277 1.00 105.87 ? 32 SER F CB 1 ATOM 10435 O OG . SER F 2 32 ? 38.736 68.517 1.580 1.00 102.27 ? 32 SER F OG 1 ATOM 10436 N N . GLY F 2 33 ? 38.480 65.297 0.107 1.00 101.10 ? 33 GLY F N 1 ATOM 10437 C CA . GLY F 2 33 ? 38.381 64.787 -1.253 1.00 100.05 ? 33 GLY F CA 1 ATOM 10438 C C . GLY F 2 33 ? 37.191 63.869 -1.478 1.00 97.47 ? 33 GLY F C 1 ATOM 10439 O O . GLY F 2 33 ? 36.602 63.324 -0.541 1.00 97.44 ? 33 GLY F O 1 ATOM 10440 N N . TYR F 2 34 ? 36.837 63.705 -2.745 1.00 96.17 ? 34 TYR F N 1 ATOM 10441 C CA . TYR F 2 34 ? 35.665 62.929 -3.133 1.00 90.64 ? 34 TYR F CA 1 ATOM 10442 C C . TYR F 2 34 ? 36.098 61.569 -3.651 1.00 90.99 ? 34 TYR F C 1 ATOM 10443 O O . TYR F 2 34 ? 37.116 61.457 -4.309 1.00 105.07 ? 34 TYR F O 1 ATOM 10444 C CB . TYR F 2 34 ? 34.886 63.658 -4.227 1.00 87.14 ? 34 TYR F CB 1 ATOM 10445 C CG . TYR F 2 34 ? 34.376 65.023 -3.841 1.00 85.79 ? 34 TYR F CG 1 ATOM 10446 C CD1 . TYR F 2 34 ? 35.119 66.181 -4.113 1.00 89.79 ? 34 TYR F CD1 1 ATOM 10447 C CD2 . TYR F 2 34 ? 33.148 65.169 -3.233 1.00 86.13 ? 34 TYR F CD2 1 ATOM 10448 C CE1 . TYR F 2 34 ? 34.651 67.443 -3.774 1.00 88.00 ? 34 TYR F CE1 1 ATOM 10449 C CE2 . TYR F 2 34 ? 32.662 66.427 -2.900 1.00 91.78 ? 34 TYR F CE2 1 ATOM 10450 C CZ . TYR F 2 34 ? 33.418 67.555 -3.169 1.00 91.19 ? 34 TYR F CZ 1 ATOM 10451 O OH . TYR F 2 34 ? 32.917 68.774 -2.819 1.00 88.20 ? 34 TYR F OH 1 ATOM 10452 N N . ALA F 2 35 ? 35.318 60.536 -3.373 1.00 91.51 ? 35 ALA F N 1 ATOM 10453 C CA . ALA F 2 35 ? 35.538 59.229 -4.001 1.00 91.00 ? 35 ALA F CA 1 ATOM 10454 C C . ALA F 2 35 ? 34.214 58.569 -4.415 1.00 89.16 ? 35 ALA F C 1 ATOM 10455 O O . ALA F 2 35 ? 33.322 58.350 -3.597 1.00 89.40 ? 35 ALA F O 1 ATOM 10456 C CB . ALA F 2 35 ? 36.342 58.325 -3.082 1.00 89.75 ? 35 ALA F CB 1 ATOM 10457 N N . ALA F 2 36 ? 34.075 58.277 -5.700 1.00 85.96 ? 36 ALA F N 1 ATOM 10458 C CA . ALA F 2 36 ? 32.840 57.683 -6.196 1.00 85.93 ? 36 ALA F CA 1 ATOM 10459 C C . ALA F 2 36 ? 32.748 56.226 -5.770 1.00 79.60 ? 36 ALA F C 1 ATOM 10460 O O . ALA F 2 36 ? 33.758 55.533 -5.723 1.00 77.55 ? 36 ALA F O 1 ATOM 10461 C CB . ALA F 2 36 ? 32.778 57.783 -7.711 1.00 91.72 ? 36 ALA F CB 1 ATOM 10462 N N . ASP F 2 37 ? 31.543 55.774 -5.439 1.00 76.98 ? 37 ASP F N 1 ATOM 10463 C CA . ASP F 2 37 ? 31.290 54.355 -5.242 1.00 76.93 ? 37 ASP F CA 1 ATOM 10464 C C . ASP F 2 37 ? 31.114 53.710 -6.613 1.00 81.00 ? 37 ASP F C 1 ATOM 10465 O O . ASP F 2 37 ? 30.121 53.919 -7.272 1.00 84.49 ? 37 ASP F O 1 ATOM 10466 C CB . ASP F 2 37 ? 30.059 54.118 -4.381 1.00 76.30 ? 37 ASP F CB 1 ATOM 10467 C CG . ASP F 2 37 ? 29.947 52.688 -3.937 1.00 82.30 ? 37 ASP F CG 1 ATOM 10468 O OD1 . ASP F 2 37 ? 30.801 52.263 -3.135 1.00 94.13 ? 37 ASP F OD1 1 ATOM 10469 O OD2 . ASP F 2 37 ? 29.014 51.978 -4.365 1.00 82.61 ? 37 ASP F OD2 1 ATOM 10470 N N . LYS F 2 38 ? 32.106 52.936 -7.025 1.00 88.48 ? 38 LYS F N 1 ATOM 10471 C CA . LYS F 2 38 ? 32.128 52.287 -8.321 1.00 90.33 ? 38 LYS F CA 1 ATOM 10472 C C . LYS F 2 38 ? 30.948 51.326 -8.510 1.00 84.77 ? 38 LYS F C 1 ATOM 10473 O O . LYS F 2 38 ? 30.221 51.425 -9.484 1.00 71.05 ? 38 LYS F O 1 ATOM 10474 C CB . LYS F 2 38 ? 33.443 51.514 -8.491 1.00 102.38 ? 38 LYS F CB 1 ATOM 10475 C CG . LYS F 2 38 ? 33.578 50.709 -9.782 1.00 115.00 ? 38 LYS F CG 1 ATOM 10476 C CD . LYS F 2 38 ? 34.101 51.515 -10.970 1.00 120.16 ? 38 LYS F CD 1 ATOM 10477 C CE . LYS F 2 38 ? 33.475 51.021 -12.260 1.00 119.39 ? 38 LYS F CE 1 ATOM 10478 N NZ . LYS F 2 38 ? 33.889 51.869 -13.401 1.00 114.82 ? 38 LYS F NZ 1 ATOM 10479 N N . GLU F 2 39 ? 30.784 50.382 -7.594 1.00 82.83 ? 39 GLU F N 1 ATOM 10480 C CA . GLU F 2 39 ? 29.854 49.291 -7.816 1.00 85.26 ? 39 GLU F CA 1 ATOM 10481 C C . GLU F 2 39 ? 28.433 49.800 -8.037 1.00 88.09 ? 39 GLU F C 1 ATOM 10482 O O . GLU F 2 39 ? 27.799 49.456 -9.029 1.00 89.92 ? 39 GLU F O 1 ATOM 10483 C CB . GLU F 2 39 ? 29.873 48.299 -6.655 1.00 94.22 ? 39 GLU F CB 1 ATOM 10484 C CG . GLU F 2 39 ? 28.899 47.130 -6.836 1.00 104.27 ? 39 GLU F CG 1 ATOM 10485 C CD . GLU F 2 39 ? 28.911 46.143 -5.678 1.00 108.95 ? 39 GLU F CD 1 ATOM 10486 O OE1 . GLU F 2 39 ? 30.014 45.783 -5.208 1.00 115.57 ? 39 GLU F OE1 1 ATOM 10487 O OE2 . GLU F 2 39 ? 27.814 45.716 -5.245 1.00 105.05 ? 39 GLU F OE2 1 ATOM 10488 N N . SER F 2 40 ? 27.932 50.611 -7.113 1.00 83.40 ? 40 SER F N 1 ATOM 10489 C CA . SER F 2 40 ? 26.534 51.043 -7.173 1.00 75.31 ? 40 SER F CA 1 ATOM 10490 C C . SER F 2 40 ? 26.293 52.058 -8.301 1.00 71.59 ? 40 SER F C 1 ATOM 10491 O O . SER F 2 40 ? 25.186 52.133 -8.822 1.00 67.41 ? 40 SER F O 1 ATOM 10492 C CB . SER F 2 40 ? 26.050 51.605 -5.827 1.00 71.98 ? 40 SER F CB 1 ATOM 10493 O OG . SER F 2 40 ? 26.565 52.902 -5.595 1.00 69.53 ? 40 SER F OG 1 ATOM 10494 N N . THR F 2 41 ? 27.311 52.842 -8.655 1.00 66.35 ? 41 THR F N 1 ATOM 10495 C CA . THR F 2 41 ? 27.275 53.682 -9.863 1.00 68.74 ? 41 THR F CA 1 ATOM 10496 C C . THR F 2 41 ? 27.094 52.840 -11.140 1.00 73.30 ? 41 THR F C 1 ATOM 10497 O O . THR F 2 41 ? 26.280 53.175 -12.001 1.00 74.72 ? 41 THR F O 1 ATOM 10498 C CB . THR F 2 41 ? 28.549 54.535 -9.998 1.00 69.36 ? 41 THR F CB 1 ATOM 10499 O OG1 . THR F 2 41 ? 28.492 55.636 -9.079 1.00 72.65 ? 41 THR F OG1 1 ATOM 10500 C CG2 . THR F 2 41 ? 28.735 55.072 -11.422 1.00 68.03 ? 41 THR F CG2 1 ATOM 10501 N N . GLN F 2 42 ? 27.843 51.747 -11.247 1.00 73.56 ? 42 GLN F N 1 ATOM 10502 C CA . GLN F 2 42 ? 27.717 50.825 -12.378 1.00 71.28 ? 42 GLN F CA 1 ATOM 10503 C C . GLN F 2 42 ? 26.341 50.164 -12.435 1.00 73.85 ? 42 GLN F C 1 ATOM 10504 O O . GLN F 2 42 ? 25.783 49.970 -13.506 1.00 67.56 ? 42 GLN F O 1 ATOM 10505 C CB . GLN F 2 42 ? 28.785 49.734 -12.318 1.00 70.83 ? 42 GLN F CB 1 ATOM 10506 C CG . GLN F 2 42 ? 29.064 49.066 -13.660 1.00 76.16 ? 42 GLN F CG 1 ATOM 10507 C CD . GLN F 2 42 ? 29.541 50.057 -14.725 1.00 79.10 ? 42 GLN F CD 1 ATOM 10508 O OE1 . GLN F 2 42 ? 30.621 50.658 -14.609 1.00 81.22 ? 42 GLN F OE1 1 ATOM 10509 N NE2 . GLN F 2 42 ? 28.723 50.251 -15.757 1.00 76.38 ? 42 GLN F NE2 1 ATOM 10510 N N . LYS F 2 43 ? 25.806 49.818 -11.277 1.00 79.76 ? 43 LYS F N 1 ATOM 10511 C CA . LYS F 2 43 ? 24.489 49.197 -11.186 1.00 81.50 ? 43 LYS F CA 1 ATOM 10512 C C . LYS F 2 43 ? 23.416 50.104 -11.760 1.00 76.93 ? 43 LYS F C 1 ATOM 10513 O O . LYS F 2 43 ? 22.518 49.650 -12.466 1.00 88.72 ? 43 LYS F O 1 ATOM 10514 C CB . LYS F 2 43 ? 24.156 48.902 -9.726 1.00 92.62 ? 43 LYS F CB 1 ATOM 10515 C CG . LYS F 2 43 ? 23.011 47.924 -9.531 1.00 107.20 ? 43 LYS F CG 1 ATOM 10516 C CD . LYS F 2 43 ? 23.456 46.462 -9.717 1.00 120.42 ? 43 LYS F CD 1 ATOM 10517 C CE . LYS F 2 43 ? 22.704 45.455 -8.808 1.00 123.99 ? 43 LYS F CE 1 ATOM 10518 N NZ . LYS F 2 43 ? 23.587 44.960 -7.704 1.00 124.79 ? 43 LYS F NZ 1 ATOM 10519 N N . ALA F 2 44 ? 23.507 51.379 -11.424 1.00 68.99 ? 44 ALA F N 1 ATOM 10520 C CA . ALA F 2 44 ? 22.586 52.377 -11.916 1.00 66.48 ? 44 ALA F CA 1 ATOM 10521 C C . ALA F 2 44 ? 22.760 52.652 -13.402 1.00 62.03 ? 44 ALA F C 1 ATOM 10522 O O . ALA F 2 44 ? 21.787 52.837 -14.091 1.00 61.58 ? 44 ALA F O 1 ATOM 10523 C CB . ALA F 2 44 ? 22.744 53.672 -11.125 1.00 68.17 ? 44 ALA F CB 1 ATOM 10524 N N . ILE F 2 45 ? 23.988 52.727 -13.882 1.00 59.36 ? 45 ILE F N 1 ATOM 10525 C CA . ILE F 2 45 ? 24.232 52.923 -15.307 1.00 62.06 ? 45 ILE F CA 1 ATOM 10526 C C . ILE F 2 45 ? 23.666 51.748 -16.112 1.00 60.64 ? 45 ILE F C 1 ATOM 10527 O O . ILE F 2 45 ? 23.018 51.948 -17.122 1.00 51.15 ? 45 ILE F O 1 ATOM 10528 C CB . ILE F 2 45 ? 25.732 53.136 -15.616 1.00 67.14 ? 45 ILE F CB 1 ATOM 10529 C CG1 . ILE F 2 45 ? 26.112 54.601 -15.354 1.00 75.27 ? 45 ILE F CG1 1 ATOM 10530 C CG2 . ILE F 2 45 ? 26.077 52.782 -17.051 1.00 62.10 ? 45 ILE F CG2 1 ATOM 10531 C CD1 . ILE F 2 45 ? 27.615 54.868 -15.367 1.00 76.58 ? 45 ILE F CD1 1 ATOM 10532 N N . ASP F 2 46 ? 23.916 50.526 -15.666 1.00 61.01 ? 46 ASP F N 1 ATOM 10533 C CA . ASP F 2 46 ? 23.373 49.365 -16.356 1.00 62.36 ? 46 ASP F CA 1 ATOM 10534 C C . ASP F 2 46 ? 21.841 49.419 -16.396 1.00 66.07 ? 46 ASP F C 1 ATOM 10535 O O . ASP F 2 46 ? 21.242 49.129 -17.423 1.00 66.30 ? 46 ASP F O 1 ATOM 10536 C CB . ASP F 2 46 ? 23.801 48.052 -15.688 1.00 64.81 ? 46 ASP F CB 1 ATOM 10537 C CG . ASP F 2 46 ? 25.287 47.782 -15.818 1.00 70.92 ? 46 ASP F CG 1 ATOM 10538 O OD1 . ASP F 2 46 ? 25.992 48.595 -16.477 1.00 70.31 ? 46 ASP F OD1 1 ATOM 10539 O OD2 . ASP F 2 46 ? 25.748 46.761 -15.234 1.00 78.01 ? 46 ASP F OD2 1 ATOM 10540 N N . GLY F 2 47 ? 21.231 49.784 -15.267 1.00 65.54 ? 47 GLY F N 1 ATOM 10541 C CA . GLY F 2 47 ? 19.800 49.701 -15.095 1.00 58.88 ? 47 GLY F CA 1 ATOM 10542 C C . GLY F 2 47 ? 19.089 50.756 -15.910 1.00 61.30 ? 47 GLY F C 1 ATOM 10543 O O . GLY F 2 47 ? 18.136 50.470 -16.623 1.00 61.31 ? 47 GLY F O 1 ATOM 10544 N N . VAL F 2 48 ? 19.595 51.973 -15.829 1.00 58.89 ? 48 VAL F N 1 ATOM 10545 C CA . VAL F 2 48 ? 19.056 53.082 -16.574 1.00 55.37 ? 48 VAL F CA 1 ATOM 10546 C C . VAL F 2 48 ? 19.275 52.877 -18.064 1.00 54.09 ? 48 VAL F C 1 ATOM 10547 O O . VAL F 2 48 ? 18.405 53.213 -18.878 1.00 57.37 ? 48 VAL F O 1 ATOM 10548 C CB . VAL F 2 48 ? 19.652 54.405 -16.067 1.00 55.72 ? 48 VAL F CB 1 ATOM 10549 C CG1 . VAL F 2 48 ? 19.533 55.533 -17.082 1.00 54.47 ? 48 VAL F CG1 1 ATOM 10550 C CG2 . VAL F 2 48 ? 18.971 54.795 -14.767 1.00 53.82 ? 48 VAL F CG2 1 ATOM 10551 N N . THR F 2 49 ? 20.402 52.289 -18.428 1.00 53.50 ? 49 THR F N 1 ATOM 10552 C CA . THR F 2 49 ? 20.677 51.966 -19.831 1.00 60.16 ? 49 THR F CA 1 ATOM 10553 C C . THR F 2 49 ? 19.720 50.866 -20.363 1.00 63.01 ? 49 THR F C 1 ATOM 10554 O O . THR F 2 49 ? 19.196 50.966 -21.467 1.00 59.97 ? 49 THR F O 1 ATOM 10555 C CB . THR F 2 49 ? 22.147 51.563 -20.031 1.00 64.10 ? 49 THR F CB 1 ATOM 10556 O OG1 . THR F 2 49 ? 22.979 52.715 -19.830 1.00 68.49 ? 49 THR F OG1 1 ATOM 10557 C CG2 . THR F 2 49 ? 22.400 50.996 -21.437 1.00 65.17 ? 49 THR F CG2 1 ATOM 10558 N N . ASN F 2 50 ? 19.470 49.849 -19.554 1.00 61.67 ? 50 ASN F N 1 ATOM 10559 C CA . ASN F 2 50 ? 18.495 48.851 -19.899 1.00 62.37 ? 50 ASN F CA 1 ATOM 10560 C C . ASN F 2 50 ? 17.091 49.392 -20.053 1.00 58.55 ? 50 ASN F C 1 ATOM 10561 O O . ASN F 2 50 ? 16.346 48.903 -20.878 1.00 59.67 ? 50 ASN F O 1 ATOM 10562 C CB . ASN F 2 50 ? 18.427 47.771 -18.857 1.00 71.24 ? 50 ASN F CB 1 ATOM 10563 C CG . ASN F 2 50 ? 18.873 46.467 -19.396 1.00 84.77 ? 50 ASN F CG 1 ATOM 10564 O OD1 . ASN F 2 50 ? 18.047 45.619 -19.753 1.00 86.85 ? 50 ASN F OD1 1 ATOM 10565 N ND2 . ASN F 2 50 ? 20.193 46.310 -19.522 1.00 88.13 ? 50 ASN F ND2 1 ATOM 10566 N N . LYS F 2 51 ? 16.747 50.387 -19.238 1.00 54.29 ? 51 LYS F N 1 ATOM 10567 C CA . LYS F 2 51 ? 15.438 50.963 -19.251 1.00 53.51 ? 51 LYS F CA 1 ATOM 10568 C C . LYS F 2 51 ? 15.171 51.658 -20.569 1.00 52.16 ? 51 LYS F C 1 ATOM 10569 O O . LYS F 2 51 ? 14.166 51.394 -21.238 1.00 50.11 ? 51 LYS F O 1 ATOM 10570 C CB . LYS F 2 51 ? 15.274 51.960 -18.152 1.00 54.25 ? 51 LYS F CB 1 ATOM 10571 C CG . LYS F 2 51 ? 14.013 52.802 -18.306 1.00 54.46 ? 51 LYS F CG 1 ATOM 10572 C CD . LYS F 2 51 ? 13.866 53.806 -17.185 1.00 57.70 ? 51 LYS F CD 1 ATOM 10573 C CE . LYS F 2 51 ? 13.699 53.138 -15.813 1.00 60.27 ? 51 LYS F CE 1 ATOM 10574 N NZ . LYS F 2 51 ? 12.956 54.028 -14.891 1.00 62.75 ? 51 LYS F NZ 1 ATOM 10575 N N . VAL F 2 52 ? 16.102 52.504 -20.959 1.00 48.56 ? 52 VAL F N 1 ATOM 10576 C CA . VAL F 2 52 ? 15.997 53.234 -22.217 1.00 49.90 ? 52 VAL F CA 1 ATOM 10577 C C . VAL F 2 52 ? 15.923 52.270 -23.409 1.00 48.86 ? 52 VAL F C 1 ATOM 10578 O O . VAL F 2 52 ? 15.041 52.381 -24.268 1.00 42.41 ? 52 VAL F O 1 ATOM 10579 C CB . VAL F 2 52 ? 17.190 54.187 -22.383 1.00 51.74 ? 52 VAL F CB 1 ATOM 10580 C CG1 . VAL F 2 52 ? 17.230 54.781 -23.772 1.00 50.59 ? 52 VAL F CG1 1 ATOM 10581 C CG2 . VAL F 2 52 ? 17.099 55.304 -21.356 1.00 54.15 ? 52 VAL F CG2 1 ATOM 10582 N N . ASN F 2 53 ? 16.843 51.315 -23.444 1.00 46.86 ? 53 ASN F N 1 ATOM 10583 C CA . ASN F 2 53 ? 16.851 50.339 -24.525 1.00 49.33 ? 53 ASN F CA 1 ATOM 10584 C C . ASN F 2 53 ? 15.564 49.509 -24.586 1.00 48.36 ? 53 ASN F C 1 ATOM 10585 O O . ASN F 2 53 ? 15.141 49.123 -25.645 1.00 49.65 ? 53 ASN F O 1 ATOM 10586 C CB . ASN F 2 53 ? 18.076 49.407 -24.423 1.00 50.94 ? 53 ASN F CB 1 ATOM 10587 C CG . ASN F 2 53 ? 19.389 50.114 -24.781 1.00 51.17 ? 53 ASN F CG 1 ATOM 10588 O OD1 . ASN F 2 53 ? 19.400 51.168 -25.417 1.00 53.95 ? 53 ASN F OD1 1 ATOM 10589 N ND2 . ASN F 2 53 ? 20.484 49.567 -24.313 1.00 53.05 ? 53 ASN F ND2 1 ATOM 10590 N N . SER F 2 54 ? 14.972 49.214 -23.440 1.00 46.08 ? 54 SER F N 1 ATOM 10591 C CA . SER F 2 54 ? 13.770 48.402 -23.385 1.00 45.31 ? 54 SER F CA 1 ATOM 10592 C C . SER F 2 54 ? 12.639 49.199 -23.995 1.00 45.87 ? 54 SER F C 1 ATOM 10593 O O . SER F 2 54 ? 11.851 48.690 -24.768 1.00 53.30 ? 54 SER F O 1 ATOM 10594 C CB . SER F 2 54 ? 13.441 48.068 -21.931 1.00 47.16 ? 54 SER F CB 1 ATOM 10595 O OG . SER F 2 54 ? 14.280 47.076 -21.393 1.00 44.21 ? 54 SER F OG 1 ATOM 10596 N N . ILE F 2 55 ? 12.581 50.477 -23.665 1.00 44.62 ? 55 ILE F N 1 ATOM 10597 C CA . ILE F 2 55 ? 11.559 51.362 -24.207 1.00 43.03 ? 55 ILE F CA 1 ATOM 10598 C C . ILE F 2 55 ? 11.675 51.523 -25.723 1.00 43.59 ? 55 ILE F C 1 ATOM 10599 O O . ILE F 2 55 ? 10.669 51.680 -26.417 1.00 45.06 ? 55 ILE F O 1 ATOM 10600 C CB . ILE F 2 55 ? 11.597 52.712 -23.488 1.00 41.40 ? 55 ILE F CB 1 ATOM 10601 C CG1 . ILE F 2 55 ? 11.044 52.533 -22.069 1.00 39.96 ? 55 ILE F CG1 1 ATOM 10602 C CG2 . ILE F 2 55 ? 10.792 53.761 -24.230 1.00 42.34 ? 55 ILE F CG2 1 ATOM 10603 C CD1 . ILE F 2 55 ? 11.300 53.682 -21.152 1.00 39.17 ? 55 ILE F CD1 1 ATOM 10604 N N . ILE F 2 56 ? 12.903 51.466 -26.213 1.00 44.13 ? 56 ILE F N 1 ATOM 10605 C CA . ILE F 2 56 ? 13.205 51.584 -27.638 1.00 43.78 ? 56 ILE F CA 1 ATOM 10606 C C . ILE F 2 56 ? 13.011 50.248 -28.334 1.00 43.83 ? 56 ILE F C 1 ATOM 10607 O O . ILE F 2 56 ? 12.348 50.167 -29.366 1.00 43.80 ? 56 ILE F O 1 ATOM 10608 C CB . ILE F 2 56 ? 14.666 52.077 -27.831 1.00 45.81 ? 56 ILE F CB 1 ATOM 10609 C CG1 . ILE F 2 56 ? 14.794 53.521 -27.356 1.00 48.38 ? 56 ILE F CG1 1 ATOM 10610 C CG2 . ILE F 2 56 ? 15.163 51.956 -29.267 1.00 43.55 ? 56 ILE F CG2 1 ATOM 10611 C CD1 . ILE F 2 56 ? 16.217 54.047 -27.349 1.00 48.89 ? 56 ILE F CD1 1 ATOM 10612 N N . ASP F 2 57 ? 13.597 49.191 -27.767 1.00 48.90 ? 57 ASP F N 1 ATOM 10613 C CA . ASP F 2 57 ? 13.754 47.889 -28.472 1.00 50.21 ? 57 ASP F CA 1 ATOM 10614 C C . ASP F 2 57 ? 12.452 47.110 -28.551 1.00 49.85 ? 57 ASP F C 1 ATOM 10615 O O . ASP F 2 57 ? 12.305 46.266 -29.414 1.00 52.46 ? 57 ASP F O 1 ATOM 10616 C CB . ASP F 2 57 ? 14.828 46.980 -27.804 1.00 48.88 ? 57 ASP F CB 1 ATOM 10617 C CG . ASP F 2 57 ? 16.263 47.547 -27.888 1.00 54.61 ? 57 ASP F CG 1 ATOM 10618 O OD1 . ASP F 2 57 ? 16.517 48.495 -28.684 1.00 58.89 ? 57 ASP F OD1 1 ATOM 10619 O OD2 . ASP F 2 57 ? 17.135 47.047 -27.117 1.00 57.36 ? 57 ASP F OD2 1 ATOM 10620 N N . LYS F 2 58 ? 11.531 47.346 -27.615 1.00 50.61 ? 58 LYS F N 1 ATOM 10621 C CA . LYS F 2 58 ? 10.254 46.606 -27.559 1.00 49.79 ? 58 LYS F CA 1 ATOM 10622 C C . LYS F 2 58 ? 9.217 47.060 -28.605 1.00 51.39 ? 58 LYS F C 1 ATOM 10623 O O . LYS F 2 58 ? 8.197 46.397 -28.813 1.00 47.36 ? 58 LYS F O 1 ATOM 10624 C CB . LYS F 2 58 ? 9.645 46.747 -26.170 1.00 50.68 ? 58 LYS F CB 1 ATOM 10625 C CG . LYS F 2 58 ? 9.651 45.481 -25.315 1.00 49.10 ? 58 LYS F CG 1 ATOM 10626 C CD . LYS F 2 58 ? 10.972 44.785 -25.244 1.00 46.27 ? 58 LYS F CD 1 ATOM 10627 C CE . LYS F 2 58 ? 10.821 43.288 -25.407 1.00 45.52 ? 58 LYS F CE 1 ATOM 10628 N NZ . LYS F 2 58 ? 10.675 42.600 -24.121 1.00 46.79 ? 58 LYS F NZ 1 ATOM 10629 N N . MET F 2 59 ? 9.461 48.206 -29.243 1.00 49.08 ? 59 MET F N 1 ATOM 10630 C CA . MET F 2 59 ? 8.590 48.682 -30.333 1.00 45.64 ? 59 MET F CA 1 ATOM 10631 C C . MET F 2 59 ? 8.650 47.766 -31.520 1.00 46.96 ? 59 MET F C 1 ATOM 10632 O O . MET F 2 59 ? 9.710 47.538 -32.104 1.00 49.91 ? 59 MET F O 1 ATOM 10633 C CB . MET F 2 59 ? 9.009 50.099 -30.765 1.00 46.32 ? 59 MET F CB 1 ATOM 10634 C CG . MET F 2 59 ? 8.065 50.769 -31.739 1.00 44.89 ? 59 MET F CG 1 ATOM 10635 S SD . MET F 2 59 ? 6.319 50.803 -31.243 1.00 43.90 ? 59 MET F SD 1 ATOM 10636 C CE . MET F 2 59 ? 6.368 52.134 -30.039 1.00 43.92 ? 59 MET F CE 1 ATOM 10637 N N . ASN F 2 60 ? 7.510 47.224 -31.868 1.00 51.15 ? 60 ASN F N 1 ATOM 10638 C CA . ASN F 2 60 ? 7.383 46.500 -33.099 1.00 54.02 ? 60 ASN F CA 1 ATOM 10639 C C . ASN F 2 60 ? 7.049 47.463 -34.237 1.00 53.80 ? 60 ASN F C 1 ATOM 10640 O O . ASN F 2 60 ? 6.086 48.237 -34.182 1.00 58.57 ? 60 ASN F O 1 ATOM 10641 C CB . ASN F 2 60 ? 6.308 45.440 -32.974 1.00 60.48 ? 60 ASN F CB 1 ATOM 10642 C CG . ASN F 2 60 ? 6.296 44.503 -34.138 1.00 58.63 ? 60 ASN F CG 1 ATOM 10643 O OD1 . ASN F 2 60 ? 7.265 43.786 -34.375 1.00 62.14 ? 60 ASN F OD1 1 ATOM 10644 N ND2 . ASN F 2 60 ? 5.188 44.490 -34.874 1.00 64.78 ? 60 ASN F ND2 1 ATOM 10645 N N . THR F 2 61 ? 7.846 47.377 -35.281 1.00 53.81 ? 61 THR F N 1 ATOM 10646 C CA . THR F 2 61 ? 7.787 48.275 -36.408 1.00 56.24 ? 61 THR F CA 1 ATOM 10647 C C . THR F 2 61 ? 7.402 47.422 -37.606 1.00 49.68 ? 61 THR F C 1 ATOM 10648 O O . THR F 2 61 ? 7.954 46.360 -37.812 1.00 45.72 ? 61 THR F O 1 ATOM 10649 C CB . THR F 2 61 ? 9.176 48.947 -36.577 1.00 61.05 ? 61 THR F CB 1 ATOM 10650 O OG1 . THR F 2 61 ? 9.019 50.360 -36.477 1.00 66.00 ? 61 THR F OG1 1 ATOM 10651 C CG2 . THR F 2 61 ? 9.901 48.541 -37.900 1.00 66.26 ? 61 THR F CG2 1 ATOM 10652 N N . GLN F 2 62 ? 6.442 47.857 -38.401 1.00 50.06 ? 62 GLN F N 1 ATOM 10653 C CA . GLN F 2 62 ? 6.221 47.164 -39.654 1.00 44.70 ? 62 GLN F CA 1 ATOM 10654 C C . GLN F 2 62 ? 5.979 48.041 -40.853 1.00 40.01 ? 62 GLN F C 1 ATOM 10655 O O . GLN F 2 62 ? 5.591 49.188 -40.738 1.00 37.84 ? 62 GLN F O 1 ATOM 10656 C CB . GLN F 2 62 ? 5.129 46.095 -39.555 1.00 50.11 ? 62 GLN F CB 1 ATOM 10657 C CG . GLN F 2 62 ? 4.025 46.276 -38.563 1.00 49.60 ? 62 GLN F CG 1 ATOM 10658 C CD . GLN F 2 62 ? 3.161 45.027 -38.492 1.00 54.37 ? 62 GLN F CD 1 ATOM 10659 O OE1 . GLN F 2 62 ? 3.147 44.200 -39.413 1.00 58.86 ? 62 GLN F OE1 1 ATOM 10660 N NE2 . GLN F 2 62 ? 2.430 44.881 -37.396 1.00 59.54 ? 62 GLN F NE2 1 ATOM 10661 N N . PHE F 2 63 ? 6.216 47.456 -42.028 1.00 37.94 ? 63 PHE F N 1 ATOM 10662 C CA . PHE F 2 63 ? 6.037 48.178 -43.258 1.00 38.05 ? 63 PHE F CA 1 ATOM 10663 C C . PHE F 2 63 ? 4.576 48.562 -43.442 1.00 38.51 ? 63 PHE F C 1 ATOM 10664 O O . PHE F 2 63 ? 3.703 47.696 -43.372 1.00 36.68 ? 63 PHE F O 1 ATOM 10665 C CB . PHE F 2 63 ? 6.468 47.358 -44.442 1.00 38.90 ? 63 PHE F CB 1 ATOM 10666 C CG . PHE F 2 63 ? 6.295 48.085 -45.734 1.00 41.35 ? 63 PHE F CG 1 ATOM 10667 C CD1 . PHE F 2 63 ? 7.318 48.868 -46.241 1.00 43.36 ? 63 PHE F CD1 1 ATOM 10668 C CD2 . PHE F 2 63 ? 5.087 48.009 -46.432 1.00 42.91 ? 63 PHE F CD2 1 ATOM 10669 C CE1 . PHE F 2 63 ? 7.156 49.552 -47.438 1.00 45.38 ? 63 PHE F CE1 1 ATOM 10670 C CE2 . PHE F 2 63 ? 4.902 48.700 -47.613 1.00 43.32 ? 63 PHE F CE2 1 ATOM 10671 C CZ . PHE F 2 63 ? 5.955 49.471 -48.120 1.00 45.87 ? 63 PHE F CZ 1 ATOM 10672 N N . GLU F 2 64 ? 4.313 49.845 -43.664 1.00 38.05 ? 64 GLU F N 1 ATOM 10673 C CA . GLU F 2 64 ? 2.996 50.274 -44.155 1.00 36.53 ? 64 GLU F CA 1 ATOM 10674 C C . GLU F 2 64 ? 3.145 51.393 -45.162 1.00 35.59 ? 64 GLU F C 1 ATOM 10675 O O . GLU F 2 64 ? 4.114 52.164 -45.103 1.00 36.93 ? 64 GLU F O 1 ATOM 10676 C CB . GLU F 2 64 ? 2.095 50.768 -43.032 1.00 36.62 ? 64 GLU F CB 1 ATOM 10677 C CG . GLU F 2 64 ? 1.937 49.821 -41.842 1.00 39.93 ? 64 GLU F CG 1 ATOM 10678 C CD . GLU F 2 64 ? 1.189 48.522 -42.153 1.00 38.82 ? 64 GLU F CD 1 ATOM 10679 O OE1 . GLU F 2 64 ? 0.535 48.379 -43.228 1.00 37.30 ? 64 GLU F OE1 1 ATOM 10680 O OE2 . GLU F 2 64 ? 1.292 47.623 -41.281 1.00 36.80 ? 64 GLU F OE2 1 ATOM 10681 N N . ALA F 2 65 ? 2.178 51.474 -46.070 1.00 32.15 ? 65 ALA F N 1 ATOM 10682 C CA . ALA F 2 65 ? 2.135 52.493 -47.062 1.00 34.03 ? 65 ALA F CA 1 ATOM 10683 C C . ALA F 2 65 ? 0.876 53.341 -46.840 1.00 37.16 ? 65 ALA F C 1 ATOM 10684 O O . ALA F 2 65 ? -0.246 52.861 -47.055 1.00 37.25 ? 65 ALA F O 1 ATOM 10685 C CB . ALA F 2 65 ? 2.133 51.891 -48.467 1.00 34.11 ? 65 ALA F CB 1 ATOM 10686 N N . VAL F 2 66 ? 1.082 54.584 -46.390 1.00 34.44 ? 66 VAL F N 1 ATOM 10687 C CA . VAL F 2 66 ? -0.007 55.468 -46.006 1.00 36.46 ? 66 VAL F CA 1 ATOM 10688 C C . VAL F 2 66 ? -0.197 56.590 -47.004 1.00 39.22 ? 66 VAL F C 1 ATOM 10689 O O . VAL F 2 66 ? 0.727 57.370 -47.233 1.00 39.16 ? 66 VAL F O 1 ATOM 10690 C CB . VAL F 2 66 ? 0.255 56.154 -44.667 1.00 35.64 ? 66 VAL F CB 1 ATOM 10691 C CG1 . VAL F 2 66 ? -0.936 56.990 -44.308 1.00 36.39 ? 66 VAL F CG1 1 ATOM 10692 C CG2 . VAL F 2 66 ? 0.562 55.142 -43.557 1.00 36.32 ? 66 VAL F CG2 1 ATOM 10693 N N . GLY F 2 67 ? -1.379 56.627 -47.621 1.00 40.22 ? 67 GLY F N 1 ATOM 10694 C CA . GLY F 2 67 ? -1.687 57.625 -48.626 1.00 42.43 ? 67 GLY F CA 1 ATOM 10695 C C . GLY F 2 67 ? -3.124 58.103 -48.560 1.00 39.40 ? 67 GLY F C 1 ATOM 10696 O O . GLY F 2 67 ? -3.750 58.025 -47.533 1.00 42.86 ? 67 GLY F O 1 ATOM 10697 N N . ARG F 2 68 ? -3.621 58.601 -49.680 1.00 36.73 ? 68 ARG F N 1 ATOM 10698 C CA . ARG F 2 68 ? -4.966 59.096 -49.787 1.00 37.99 ? 68 ARG F CA 1 ATOM 10699 C C . ARG F 2 68 ? -5.517 58.613 -51.115 1.00 39.09 ? 68 ARG F C 1 ATOM 10700 O O . ARG F 2 68 ? -5.530 59.345 -52.070 1.00 38.94 ? 68 ARG F O 1 ATOM 10701 C CB . ARG F 2 68 ? -4.949 60.616 -49.714 1.00 38.42 ? 68 ARG F CB 1 ATOM 10702 C CG . ARG F 2 68 ? -4.524 61.149 -48.334 1.00 39.94 ? 68 ARG F CG 1 ATOM 10703 C CD . ARG F 2 68 ? -5.543 60.777 -47.281 1.00 39.81 ? 68 ARG F CD 1 ATOM 10704 N NE . ARG F 2 68 ? -5.288 61.295 -45.950 1.00 42.27 ? 68 ARG F NE 1 ATOM 10705 C CZ . ARG F 2 68 ? -4.820 60.592 -44.925 1.00 42.18 ? 68 ARG F CZ 1 ATOM 10706 N NH1 . ARG F 2 68 ? -4.451 59.325 -45.067 1.00 41.31 ? 68 ARG F NH1 1 ATOM 10707 N NH2 . ARG F 2 68 ? -4.668 61.191 -43.745 1.00 41.79 ? 68 ARG F NH2 1 ATOM 10708 N N . GLU F 2 69 ? -5.941 57.356 -51.161 1.00 40.90 ? 69 GLU F N 1 ATOM 10709 C CA . GLU F 2 69 ? -6.239 56.685 -52.420 1.00 41.32 ? 69 GLU F CA 1 ATOM 10710 C C . GLU F 2 69 ? -7.733 56.739 -52.794 1.00 38.77 ? 69 GLU F C 1 ATOM 10711 O O . GLU F 2 69 ? -8.115 56.239 -53.854 1.00 37.89 ? 69 GLU F O 1 ATOM 10712 C CB . GLU F 2 69 ? -5.811 55.203 -52.329 1.00 45.20 ? 69 GLU F CB 1 ATOM 10713 C CG . GLU F 2 69 ? -4.306 54.918 -52.462 1.00 53.15 ? 69 GLU F CG 1 ATOM 10714 C CD . GLU F 2 69 ? -3.833 54.370 -53.863 1.00 63.65 ? 69 GLU F CD 1 ATOM 10715 O OE1 . GLU F 2 69 ? -4.471 54.585 -55.009 1.00 55.21 ? 69 GLU F OE1 1 ATOM 10716 O OE2 . GLU F 2 69 ? -2.746 53.727 -53.775 1.00 53.35 ? 69 GLU F OE2 1 ATOM 10717 N N . PHE F 2 70 ? -8.566 57.336 -51.942 1.00 36.07 ? 70 PHE F N 1 ATOM 10718 C CA . PHE F 2 70 ? -10.007 57.408 -52.187 1.00 37.46 ? 70 PHE F CA 1 ATOM 10719 C C . PHE F 2 70 ? -10.491 58.671 -52.904 1.00 39.85 ? 70 PHE F C 1 ATOM 10720 O O . PHE F 2 70 ? -10.034 59.770 -52.639 1.00 41.25 ? 70 PHE F O 1 ATOM 10721 C CB . PHE F 2 70 ? -10.766 57.162 -50.884 1.00 36.05 ? 70 PHE F CB 1 ATOM 10722 C CG . PHE F 2 70 ? -10.458 55.811 -50.298 1.00 37.07 ? 70 PHE F CG 1 ATOM 10723 C CD1 . PHE F 2 70 ? -9.593 55.678 -49.218 1.00 38.80 ? 70 PHE F CD1 1 ATOM 10724 C CD2 . PHE F 2 70 ? -10.958 54.665 -50.890 1.00 35.35 ? 70 PHE F CD2 1 ATOM 10725 C CE1 . PHE F 2 70 ? -9.263 54.436 -48.708 1.00 37.58 ? 70 PHE F CE1 1 ATOM 10726 C CE2 . PHE F 2 70 ? -10.652 53.407 -50.364 1.00 37.53 ? 70 PHE F CE2 1 ATOM 10727 C CZ . PHE F 2 70 ? -9.784 53.295 -49.279 1.00 36.17 ? 70 PHE F CZ 1 ATOM 10728 N N . ASN F 2 71 ? -11.453 58.504 -53.802 1.00 39.66 ? 71 ASN F N 1 ATOM 10729 C CA . ASN F 2 71 ? -11.921 59.638 -54.601 1.00 40.96 ? 71 ASN F CA 1 ATOM 10730 C C . ASN F 2 71 ? -13.078 60.429 -53.967 1.00 39.69 ? 71 ASN F C 1 ATOM 10731 O O . ASN F 2 71 ? -13.483 60.167 -52.849 1.00 40.63 ? 71 ASN F O 1 ATOM 10732 C CB . ASN F 2 71 ? -12.261 59.183 -56.034 1.00 39.29 ? 71 ASN F CB 1 ATOM 10733 C CG . ASN F 2 71 ? -13.542 58.351 -56.104 1.00 40.54 ? 71 ASN F CG 1 ATOM 10734 O OD1 . ASN F 2 71 ? -14.530 58.557 -55.357 1.00 40.61 ? 71 ASN F OD1 1 ATOM 10735 N ND2 . ASN F 2 71 ? -13.536 57.397 -57.020 1.00 37.07 ? 71 ASN F ND2 1 ATOM 10736 N N . ASN F 2 72 ? -13.612 61.391 -54.714 1.00 43.46 ? 72 ASN F N 1 ATOM 10737 C CA . ASN F 2 72 ? -14.577 62.358 -54.200 1.00 43.14 ? 72 ASN F CA 1 ATOM 10738 C C . ASN F 2 72 ? -15.960 61.740 -53.916 1.00 43.09 ? 72 ASN F C 1 ATOM 10739 O O . ASN F 2 72 ? -16.778 62.342 -53.235 1.00 44.75 ? 72 ASN F O 1 ATOM 10740 C CB . ASN F 2 72 ? -14.693 63.537 -55.172 1.00 46.67 ? 72 ASN F CB 1 ATOM 10741 C CG . ASN F 2 72 ? -15.503 64.702 -54.608 1.00 55.38 ? 72 ASN F CG 1 ATOM 10742 O OD1 . ASN F 2 72 ? -15.217 65.211 -53.514 1.00 59.42 ? 72 ASN F OD1 1 ATOM 10743 N ND2 . ASN F 2 72 ? -16.551 65.119 -55.349 1.00 57.76 ? 72 ASN F ND2 1 ATOM 10744 N N . LEU F 2 73 ? -16.224 60.549 -54.437 1.00 40.42 ? 73 LEU F N 1 ATOM 10745 C CA . LEU F 2 73 ? -17.441 59.803 -54.080 1.00 38.75 ? 73 LEU F CA 1 ATOM 10746 C C . LEU F 2 73 ? -17.137 58.568 -53.212 1.00 37.84 ? 73 LEU F C 1 ATOM 10747 O O . LEU F 2 73 ? -17.860 57.550 -53.297 1.00 33.93 ? 73 LEU F O 1 ATOM 10748 C CB . LEU F 2 73 ? -18.206 59.404 -55.352 1.00 38.46 ? 73 LEU F CB 1 ATOM 10749 C CG . LEU F 2 73 ? -18.882 60.617 -56.024 1.00 40.94 ? 73 LEU F CG 1 ATOM 10750 C CD1 . LEU F 2 73 ? -19.500 60.291 -57.377 1.00 37.31 ? 73 LEU F CD1 1 ATOM 10751 C CD2 . LEU F 2 73 ? -19.939 61.257 -55.089 1.00 43.02 ? 73 LEU F CD2 1 ATOM 10752 N N . GLU F 2 74 ? -16.047 58.669 -52.424 1.00 35.76 ? 74 GLU F N 1 ATOM 10753 C CA . GLU F 2 74 ? -15.643 57.657 -51.472 1.00 35.20 ? 74 GLU F CA 1 ATOM 10754 C C . GLU F 2 74 ? -15.231 58.310 -50.182 1.00 33.57 ? 74 GLU F C 1 ATOM 10755 O O . GLU F 2 74 ? -14.295 57.870 -49.503 1.00 30.45 ? 74 GLU F O 1 ATOM 10756 C CB . GLU F 2 74 ? -14.483 56.799 -52.036 1.00 37.24 ? 74 GLU F CB 1 ATOM 10757 C CG . GLU F 2 74 ? -14.855 55.951 -53.261 1.00 38.48 ? 74 GLU F CG 1 ATOM 10758 C CD . GLU F 2 74 ? -13.654 55.269 -53.925 1.00 41.92 ? 74 GLU F CD 1 ATOM 10759 O OE1 . GLU F 2 74 ? -12.536 55.872 -53.978 1.00 37.69 ? 74 GLU F OE1 1 ATOM 10760 O OE2 . GLU F 2 74 ? -13.830 54.108 -54.381 1.00 40.69 ? 74 GLU F OE2 1 ATOM 10761 N N . ARG F 2 75 ? -15.946 59.374 -49.843 1.00 35.66 ? 75 ARG F N 1 ATOM 10762 C CA . ARG F 2 75 ? -15.637 60.138 -48.662 1.00 34.75 ? 75 ARG F CA 1 ATOM 10763 C C . ARG F 2 75 ? -16.001 59.386 -47.404 1.00 32.53 ? 75 ARG F C 1 ATOM 10764 O O . ARG F 2 75 ? -15.388 59.607 -46.357 1.00 32.60 ? 75 ARG F O 1 ATOM 10765 C CB . ARG F 2 75 ? -16.353 61.492 -48.675 1.00 39.63 ? 75 ARG F CB 1 ATOM 10766 C CG . ARG F 2 75 ? -15.898 62.476 -49.741 1.00 47.91 ? 75 ARG F CG 1 ATOM 10767 C CD . ARG F 2 75 ? -14.439 62.782 -49.563 1.00 58.46 ? 75 ARG F CD 1 ATOM 10768 N NE . ARG F 2 75 ? -13.954 63.844 -50.444 1.00 72.81 ? 75 ARG F NE 1 ATOM 10769 C CZ . ARG F 2 75 ? -12.748 63.846 -51.038 1.00 83.37 ? 75 ARG F CZ 1 ATOM 10770 N NH1 . ARG F 2 75 ? -11.885 62.833 -50.873 1.00 90.69 ? 75 ARG F NH1 1 ATOM 10771 N NH2 . ARG F 2 75 ? -12.408 64.854 -51.834 1.00 82.02 ? 75 ARG F NH2 1 ATOM 10772 N N . ARG F 2 76 ? -16.997 58.511 -47.451 1.00 32.62 ? 76 ARG F N 1 ATOM 10773 C CA . ARG F 2 76 ? -17.322 57.738 -46.233 1.00 31.25 ? 76 ARG F CA 1 ATOM 10774 C C . ARG F 2 76 ? -16.162 56.842 -45.835 1.00 32.68 ? 76 ARG F C 1 ATOM 10775 O O . ARG F 2 76 ? -15.778 56.796 -44.670 1.00 31.37 ? 76 ARG F O 1 ATOM 10776 C CB . ARG F 2 76 ? -18.591 56.929 -46.422 1.00 30.02 ? 76 ARG F CB 1 ATOM 10777 C CG . ARG F 2 76 ? -19.806 57.812 -46.544 1.00 30.86 ? 76 ARG F CG 1 ATOM 10778 C CD . ARG F 2 76 ? -21.004 57.058 -47.032 1.00 31.25 ? 76 ARG F CD 1 ATOM 10779 N NE . ARG F 2 76 ? -20.710 56.403 -48.281 1.00 30.61 ? 76 ARG F NE 1 ATOM 10780 C CZ . ARG F 2 76 ? -21.166 55.215 -48.631 1.00 30.67 ? 76 ARG F CZ 1 ATOM 10781 N NH1 . ARG F 2 76 ? -21.991 54.520 -47.845 1.00 31.79 ? 76 ARG F NH1 1 ATOM 10782 N NH2 . ARG F 2 76 ? -20.814 54.736 -49.800 1.00 31.47 ? 76 ARG F NH2 1 ATOM 10783 N N . ILE F 2 77 ? -15.579 56.158 -46.814 1.00 33.61 ? 77 ILE F N 1 ATOM 10784 C CA . ILE F 2 77 ? -14.420 55.316 -46.557 1.00 36.71 ? 77 ILE F CA 1 ATOM 10785 C C . ILE F 2 77 ? -13.226 56.167 -46.116 1.00 36.15 ? 77 ILE F C 1 ATOM 10786 O O . ILE F 2 77 ? -12.511 55.804 -45.176 1.00 36.16 ? 77 ILE F O 1 ATOM 10787 C CB . ILE F 2 77 ? -14.016 54.482 -47.791 1.00 39.12 ? 77 ILE F CB 1 ATOM 10788 C CG1 . ILE F 2 77 ? -15.116 53.508 -48.135 1.00 45.09 ? 77 ILE F CG1 1 ATOM 10789 C CG2 . ILE F 2 77 ? -12.804 53.644 -47.496 1.00 39.72 ? 77 ILE F CG2 1 ATOM 10790 C CD1 . ILE F 2 77 ? -15.054 53.000 -49.567 1.00 49.87 ? 77 ILE F CD1 1 ATOM 10791 N N . GLU F 2 78 ? -12.978 57.268 -46.807 1.00 37.00 ? 78 GLU F N 1 ATOM 10792 C CA . GLU F 2 78 ? -11.905 58.162 -46.409 1.00 39.73 ? 78 GLU F CA 1 ATOM 10793 C C . GLU F 2 78 ? -12.118 58.562 -44.947 1.00 37.51 ? 78 GLU F C 1 ATOM 10794 O O . GLU F 2 78 ? -11.163 58.579 -44.172 1.00 35.73 ? 78 GLU F O 1 ATOM 10795 C CB . GLU F 2 78 ? -11.839 59.371 -47.329 1.00 47.63 ? 78 GLU F CB 1 ATOM 10796 C CG . GLU F 2 78 ? -10.756 60.420 -47.027 1.00 55.01 ? 78 GLU F CG 1 ATOM 10797 C CD . GLU F 2 78 ? -10.804 61.619 -48.025 1.00 68.73 ? 78 GLU F CD 1 ATOM 10798 O OE1 . GLU F 2 78 ? -11.826 62.390 -48.044 1.00 65.64 ? 78 GLU F OE1 1 ATOM 10799 O OE2 . GLU F 2 78 ? -9.817 61.805 -48.805 1.00 76.09 ? 78 GLU F OE2 1 ATOM 10800 N N . ASN F 2 79 ? -13.363 58.829 -44.545 1.00 34.34 ? 79 ASN F N 1 ATOM 10801 C CA . ASN F 2 79 ? -13.587 59.175 -43.139 1.00 36.64 ? 79 ASN F CA 1 ATOM 10802 C C . ASN F 2 79 ? -13.211 58.037 -42.210 1.00 34.71 ? 79 ASN F C 1 ATOM 10803 O O . ASN F 2 79 ? -12.735 58.237 -41.097 1.00 35.75 ? 79 ASN F O 1 ATOM 10804 C CB . ASN F 2 79 ? -15.012 59.656 -42.903 1.00 38.13 ? 79 ASN F CB 1 ATOM 10805 C CG . ASN F 2 79 ? -15.262 60.094 -41.479 1.00 38.63 ? 79 ASN F CG 1 ATOM 10806 O OD1 . ASN F 2 79 ? -16.159 59.592 -40.827 1.00 53.17 ? 79 ASN F OD1 1 ATOM 10807 N ND2 . ASN F 2 79 ? -14.524 61.021 -41.016 1.00 40.55 ? 79 ASN F ND2 1 ATOM 10808 N N . LEU F 2 80 ? -13.459 56.831 -42.670 1.00 35.85 ? 80 LEU F N 1 ATOM 10809 C CA . LEU F 2 80 ? -13.181 55.661 -41.870 1.00 36.14 ? 80 LEU F CA 1 ATOM 10810 C C . LEU F 2 80 ? -11.666 55.585 -41.651 1.00 37.27 ? 80 LEU F C 1 ATOM 10811 O O . LEU F 2 80 ? -11.195 55.394 -40.523 1.00 37.36 ? 80 LEU F O 1 ATOM 10812 C CB . LEU F 2 80 ? -13.745 54.420 -42.557 1.00 37.86 ? 80 LEU F CB 1 ATOM 10813 C CG . LEU F 2 80 ? -13.449 53.018 -42.051 1.00 42.29 ? 80 LEU F CG 1 ATOM 10814 C CD1 . LEU F 2 80 ? -13.671 52.953 -40.570 1.00 47.07 ? 80 LEU F CD1 1 ATOM 10815 C CD2 . LEU F 2 80 ? -14.399 52.023 -42.701 1.00 45.39 ? 80 LEU F CD2 1 ATOM 10816 N N . ASN F 2 81 ? -10.899 55.836 -42.699 1.00 35.30 ? 81 ASN F N 1 ATOM 10817 C CA . ASN F 2 81 ? -9.443 55.866 -42.564 1.00 35.23 ? 81 ASN F CA 1 ATOM 10818 C C . ASN F 2 81 ? -8.973 56.995 -41.670 1.00 36.90 ? 81 ASN F C 1 ATOM 10819 O O . ASN F 2 81 ? -8.074 56.824 -40.868 1.00 43.51 ? 81 ASN F O 1 ATOM 10820 C CB . ASN F 2 81 ? -8.799 56.023 -43.914 1.00 36.26 ? 81 ASN F CB 1 ATOM 10821 C CG . ASN F 2 81 ? -7.300 56.139 -43.825 1.00 37.71 ? 81 ASN F CG 1 ATOM 10822 O OD1 . ASN F 2 81 ? -6.596 55.173 -43.589 1.00 35.55 ? 81 ASN F OD1 1 ATOM 10823 N ND2 . ASN F 2 81 ? -6.808 57.339 -44.000 1.00 42.35 ? 81 ASN F ND2 1 ATOM 10824 N N . LYS F 2 82 ? -9.582 58.165 -41.790 1.00 38.81 ? 82 LYS F N 1 ATOM 10825 C CA . LYS F 2 82 ? -9.243 59.236 -40.897 1.00 40.55 ? 82 LYS F CA 1 ATOM 10826 C C . LYS F 2 82 ? -9.450 58.835 -39.412 1.00 41.72 ? 82 LYS F C 1 ATOM 10827 O O . LYS F 2 82 ? -8.634 59.174 -38.565 1.00 35.45 ? 82 LYS F O 1 ATOM 10828 C CB . LYS F 2 82 ? -10.083 60.464 -41.192 1.00 45.25 ? 82 LYS F CB 1 ATOM 10829 C CG . LYS F 2 82 ? -9.804 61.670 -40.281 1.00 47.46 ? 82 LYS F CG 1 ATOM 10830 C CD . LYS F 2 82 ? -10.799 62.769 -40.617 1.00 52.07 ? 82 LYS F CD 1 ATOM 10831 C CE . LYS F 2 82 ? -10.829 63.994 -39.701 1.00 52.20 ? 82 LYS F CE 1 ATOM 10832 N NZ . LYS F 2 82 ? -9.871 64.094 -38.586 1.00 53.79 ? 82 LYS F NZ 1 ATOM 10833 N N . LYS F 2 83 ? -10.582 58.200 -39.096 1.00 40.14 ? 83 LYS F N 1 ATOM 10834 C CA . LYS F 2 83 ? -10.888 57.935 -37.701 1.00 43.62 ? 83 LYS F CA 1 ATOM 10835 C C . LYS F 2 83 ? -9.875 56.920 -37.179 1.00 42.99 ? 83 LYS F C 1 ATOM 10836 O O . LYS F 2 83 ? -9.452 56.983 -36.035 1.00 39.80 ? 83 LYS F O 1 ATOM 10837 C CB . LYS F 2 83 ? -12.302 57.387 -37.515 1.00 44.46 ? 83 LYS F CB 1 ATOM 10838 C CG . LYS F 2 83 ? -13.415 58.391 -37.706 1.00 45.49 ? 83 LYS F CG 1 ATOM 10839 C CD . LYS F 2 83 ? -14.760 57.791 -37.357 1.00 42.67 ? 83 LYS F CD 1 ATOM 10840 C CE . LYS F 2 83 ? -15.231 56.930 -38.500 1.00 43.22 ? 83 LYS F CE 1 ATOM 10841 N NZ . LYS F 2 83 ? -16.412 56.124 -38.164 1.00 42.40 ? 83 LYS F NZ 1 ATOM 10842 N N . MET F 2 84 ? -9.457 56.008 -38.052 1.00 43.58 ? 84 MET F N 1 ATOM 10843 C CA . MET F 2 84 ? -8.453 55.012 -37.687 1.00 42.10 ? 84 MET F CA 1 ATOM 10844 C C . MET F 2 84 ? -7.095 55.668 -37.424 1.00 40.63 ? 84 MET F C 1 ATOM 10845 O O . MET F 2 84 ? -6.515 55.467 -36.350 1.00 37.39 ? 84 MET F O 1 ATOM 10846 C CB . MET F 2 84 ? -8.320 53.952 -38.780 1.00 45.17 ? 84 MET F CB 1 ATOM 10847 C CG . MET F 2 84 ? -7.425 52.777 -38.393 1.00 49.71 ? 84 MET F CG 1 ATOM 10848 S SD . MET F 2 84 ? -6.686 52.016 -39.818 1.00 51.79 ? 84 MET F SD 1 ATOM 10849 C CE . MET F 2 84 ? -5.394 53.182 -40.145 1.00 52.42 ? 84 MET F CE 1 ATOM 10850 N N . GLU F 2 85 ? -6.602 56.436 -38.392 1.00 39.24 ? 85 GLU F N 1 ATOM 10851 C CA . GLU F 2 85 ? -5.317 57.172 -38.245 1.00 41.84 ? 85 GLU F CA 1 ATOM 10852 C C . GLU F 2 85 ? -5.290 58.024 -36.988 1.00 40.12 ? 85 GLU F C 1 ATOM 10853 O O . GLU F 2 85 ? -4.376 57.938 -36.203 1.00 43.93 ? 85 GLU F O 1 ATOM 10854 C CB . GLU F 2 85 ? -5.078 58.127 -39.406 1.00 43.14 ? 85 GLU F CB 1 ATOM 10855 C CG . GLU F 2 85 ? -4.402 57.525 -40.607 1.00 48.84 ? 85 GLU F CG 1 ATOM 10856 C CD . GLU F 2 85 ? -4.002 58.560 -41.650 1.00 49.95 ? 85 GLU F CD 1 ATOM 10857 O OE1 . GLU F 2 85 ? -3.876 59.757 -41.332 1.00 60.06 ? 85 GLU F OE1 1 ATOM 10858 O OE2 . GLU F 2 85 ? -3.797 58.152 -42.797 1.00 43.36 ? 85 GLU F OE2 1 ATOM 10859 N N . ASP F 2 86 ? -6.299 58.873 -36.834 1.00 39.73 ? 86 ASP F N 1 ATOM 10860 C CA . ASP F 2 86 ? -6.402 59.763 -35.663 1.00 38.28 ? 86 ASP F CA 1 ATOM 10861 C C . ASP F 2 86 ? -6.482 58.961 -34.371 1.00 35.84 ? 86 ASP F C 1 ATOM 10862 O O . ASP F 2 86 ? -5.883 59.303 -33.371 1.00 36.14 ? 86 ASP F O 1 ATOM 10863 C CB . ASP F 2 86 ? -7.625 60.670 -35.805 1.00 38.07 ? 86 ASP F CB 1 ATOM 10864 C CG . ASP F 2 86 ? -7.524 61.611 -37.017 1.00 41.34 ? 86 ASP F CG 1 ATOM 10865 O OD1 . ASP F 2 86 ? -6.455 61.710 -37.658 1.00 42.53 ? 86 ASP F OD1 1 ATOM 10866 O OD2 . ASP F 2 86 ? -8.524 62.257 -37.347 1.00 43.31 ? 86 ASP F OD2 1 ATOM 10867 N N . GLY F 2 87 ? -7.237 57.866 -34.421 1.00 36.62 ? 87 GLY F N 1 ATOM 10868 C CA . GLY F 2 87 ? -7.358 56.929 -33.310 1.00 35.65 ? 87 GLY F CA 1 ATOM 10869 C C . GLY F 2 87 ? -6.012 56.414 -32.819 1.00 36.30 ? 87 GLY F C 1 ATOM 10870 O O . GLY F 2 87 ? -5.738 56.477 -31.641 1.00 36.50 ? 87 GLY F O 1 ATOM 10871 N N . PHE F 2 88 ? -5.177 55.941 -33.737 1.00 35.22 ? 88 PHE F N 1 ATOM 10872 C CA . PHE F 2 88 ? -3.873 55.437 -33.375 1.00 37.15 ? 88 PHE F CA 1 ATOM 10873 C C . PHE F 2 88 ? -2.975 56.554 -32.927 1.00 38.34 ? 88 PHE F C 1 ATOM 10874 O O . PHE F 2 88 ? -2.168 56.384 -32.001 1.00 40.68 ? 88 PHE F O 1 ATOM 10875 C CB . PHE F 2 88 ? -3.195 54.624 -34.504 1.00 37.55 ? 88 PHE F CB 1 ATOM 10876 C CG . PHE F 2 88 ? -3.768 53.244 -34.686 1.00 36.41 ? 88 PHE F CG 1 ATOM 10877 C CD1 . PHE F 2 88 ? -3.708 52.317 -33.669 1.00 37.42 ? 88 PHE F CD1 1 ATOM 10878 C CD2 . PHE F 2 88 ? -4.346 52.866 -35.882 1.00 38.13 ? 88 PHE F CD2 1 ATOM 10879 C CE1 . PHE F 2 88 ? -4.230 51.035 -33.826 1.00 37.16 ? 88 PHE F CE1 1 ATOM 10880 C CE2 . PHE F 2 88 ? -4.893 51.588 -36.044 1.00 36.39 ? 88 PHE F CE2 1 ATOM 10881 C CZ . PHE F 2 88 ? -4.845 50.685 -35.010 1.00 35.86 ? 88 PHE F CZ 1 ATOM 10882 N N . LEU F 2 89 ? -3.059 57.693 -33.583 1.00 41.17 ? 89 LEU F N 1 ATOM 10883 C CA . LEU F 2 89 ? -2.272 58.847 -33.108 1.00 44.14 ? 89 LEU F CA 1 ATOM 10884 C C . LEU F 2 89 ? -2.615 59.226 -31.640 1.00 42.29 ? 89 LEU F C 1 ATOM 10885 O O . LEU F 2 89 ? -1.733 59.487 -30.835 1.00 40.41 ? 89 LEU F O 1 ATOM 10886 C CB . LEU F 2 89 ? -2.445 60.031 -34.034 1.00 43.46 ? 89 LEU F CB 1 ATOM 10887 C CG . LEU F 2 89 ? -1.666 61.267 -33.584 1.00 48.44 ? 89 LEU F CG 1 ATOM 10888 C CD1 . LEU F 2 89 ? -0.809 61.822 -34.688 1.00 49.39 ? 89 LEU F CD1 1 ATOM 10889 C CD2 . LEU F 2 89 ? -2.612 62.339 -33.086 1.00 47.39 ? 89 LEU F CD2 1 ATOM 10890 N N . ASP F 2 90 ? -3.897 59.184 -31.295 1.00 43.65 ? 90 ASP F N 1 ATOM 10891 C CA . ASP F 2 90 ? -4.313 59.469 -29.942 1.00 44.70 ? 90 ASP F CA 1 ATOM 10892 C C . ASP F 2 90 ? -3.770 58.386 -28.972 1.00 43.43 ? 90 ASP F C 1 ATOM 10893 O O . ASP F 2 90 ? -3.201 58.713 -27.932 1.00 37.31 ? 90 ASP F O 1 ATOM 10894 C CB . ASP F 2 90 ? -5.843 59.568 -29.867 1.00 46.94 ? 90 ASP F CB 1 ATOM 10895 C CG . ASP F 2 90 ? -6.414 60.812 -30.591 1.00 50.58 ? 90 ASP F CG 1 ATOM 10896 O OD1 . ASP F 2 90 ? -5.645 61.718 -30.962 1.00 51.63 ? 90 ASP F OD1 1 ATOM 10897 O OD2 . ASP F 2 90 ? -7.654 60.891 -30.792 1.00 52.53 ? 90 ASP F OD2 1 ATOM 10898 N N . VAL F 2 91 ? -3.909 57.102 -29.341 1.00 40.92 ? 91 VAL F N 1 ATOM 10899 C CA . VAL F 2 91 ? -3.339 56.001 -28.539 1.00 38.40 ? 91 VAL F CA 1 ATOM 10900 C C . VAL F 2 91 ? -1.831 56.154 -28.315 1.00 39.23 ? 91 VAL F C 1 ATOM 10901 O O . VAL F 2 91 ? -1.358 56.123 -27.178 1.00 39.96 ? 91 VAL F O 1 ATOM 10902 C CB . VAL F 2 91 ? -3.640 54.632 -29.149 1.00 38.00 ? 91 VAL F CB 1 ATOM 10903 C CG1 . VAL F 2 91 ? -2.864 53.520 -28.474 1.00 37.32 ? 91 VAL F CG1 1 ATOM 10904 C CG2 . VAL F 2 91 ? -5.126 54.331 -29.053 1.00 38.04 ? 91 VAL F CG2 1 ATOM 10905 N N . TRP F 2 92 ? -1.063 56.342 -29.371 1.00 39.12 ? 92 TRP F N 1 ATOM 10906 C CA . TRP F 2 92 ? 0.396 56.402 -29.202 1.00 37.85 ? 92 TRP F CA 1 ATOM 10907 C C . TRP F 2 92 ? 0.816 57.675 -28.459 1.00 41.56 ? 92 TRP F C 1 ATOM 10908 O O . TRP F 2 92 ? 1.777 57.653 -27.678 1.00 40.23 ? 92 TRP F O 1 ATOM 10909 C CB . TRP F 2 92 ? 1.137 56.282 -30.528 1.00 35.33 ? 92 TRP F CB 1 ATOM 10910 C CG . TRP F 2 92 ? 1.103 54.930 -31.125 1.00 34.82 ? 92 TRP F CG 1 ATOM 10911 C CD1 . TRP F 2 92 ? 0.516 54.579 -32.311 1.00 37.34 ? 92 TRP F CD1 1 ATOM 10912 C CD2 . TRP F 2 92 ? 1.669 53.739 -30.600 1.00 34.62 ? 92 TRP F CD2 1 ATOM 10913 N NE1 . TRP F 2 92 ? 0.688 53.248 -32.551 1.00 36.10 ? 92 TRP F NE1 1 ATOM 10914 C CE2 . TRP F 2 92 ? 1.385 52.711 -31.501 1.00 36.37 ? 92 TRP F CE2 1 ATOM 10915 C CE3 . TRP F 2 92 ? 2.416 53.440 -29.464 1.00 35.49 ? 92 TRP F CE3 1 ATOM 10916 C CZ2 . TRP F 2 92 ? 1.806 51.421 -31.285 1.00 36.75 ? 92 TRP F CZ2 1 ATOM 10917 C CZ3 . TRP F 2 92 ? 2.828 52.155 -29.259 1.00 34.11 ? 92 TRP F CZ3 1 ATOM 10918 C CH2 . TRP F 2 92 ? 2.548 51.177 -30.151 1.00 34.76 ? 92 TRP F CH2 1 ATOM 10919 N N . THR F 2 93 ? 0.132 58.790 -28.699 1.00 42.12 ? 93 THR F N 1 ATOM 10920 C CA . THR F 2 93 ? 0.527 60.026 -28.015 1.00 42.84 ? 93 THR F CA 1 ATOM 10921 C C . THR F 2 93 ? 0.384 59.894 -26.500 1.00 43.73 ? 93 THR F C 1 ATOM 10922 O O . THR F 2 93 ? 1.320 60.166 -25.753 1.00 41.65 ? 93 THR F O 1 ATOM 10923 C CB . THR F 2 93 ? -0.254 61.224 -28.510 1.00 42.50 ? 93 THR F CB 1 ATOM 10924 O OG1 . THR F 2 93 ? -0.031 61.379 -29.911 1.00 43.25 ? 93 THR F OG1 1 ATOM 10925 C CG2 . THR F 2 93 ? 0.188 62.484 -27.792 1.00 43.46 ? 93 THR F CG2 1 ATOM 10926 N N . TYR F 2 94 ? -0.787 59.436 -26.076 1.00 44.08 ? 94 TYR F N 1 ATOM 10927 C CA . TYR F 2 94 ? -1.086 59.280 -24.658 1.00 45.73 ? 94 TYR F CA 1 ATOM 10928 C C . TYR F 2 94 ? -0.154 58.284 -23.989 1.00 46.95 ? 94 TYR F C 1 ATOM 10929 O O . TYR F 2 94 ? 0.378 58.552 -22.918 1.00 48.48 ? 94 TYR F O 1 ATOM 10930 C CB . TYR F 2 94 ? -2.535 58.829 -24.466 1.00 45.37 ? 94 TYR F CB 1 ATOM 10931 C CG . TYR F 2 94 ? -3.051 58.969 -23.041 1.00 45.09 ? 94 TYR F CG 1 ATOM 10932 C CD1 . TYR F 2 94 ? -3.283 60.222 -22.493 1.00 41.13 ? 94 TYR F CD1 1 ATOM 10933 C CD2 . TYR F 2 94 ? -3.380 57.842 -22.277 1.00 43.55 ? 94 TYR F CD2 1 ATOM 10934 C CE1 . TYR F 2 94 ? -3.785 60.358 -21.233 1.00 40.36 ? 94 TYR F CE1 1 ATOM 10935 C CE2 . TYR F 2 94 ? -3.895 57.981 -21.013 1.00 43.98 ? 94 TYR F CE2 1 ATOM 10936 C CZ . TYR F 2 94 ? -4.088 59.253 -20.505 1.00 42.55 ? 94 TYR F CZ 1 ATOM 10937 O OH . TYR F 2 94 ? -4.531 59.403 -19.229 1.00 45.20 ? 94 TYR F OH 1 ATOM 10938 N N . ASN F 2 95 ? 0.043 57.138 -24.632 1.00 48.76 ? 95 ASN F N 1 ATOM 10939 C CA . ASN F 2 95 ? 0.907 56.117 -24.087 1.00 48.47 ? 95 ASN F CA 1 ATOM 10940 C C . ASN F 2 95 ? 2.341 56.587 -23.973 1.00 48.04 ? 95 ASN F C 1 ATOM 10941 O O . ASN F 2 95 ? 2.986 56.345 -22.957 1.00 42.76 ? 95 ASN F O 1 ATOM 10942 C CB . ASN F 2 95 ? 0.815 54.804 -24.871 1.00 52.43 ? 95 ASN F CB 1 ATOM 10943 C CG . ASN F 2 95 ? -0.546 54.109 -24.676 1.00 66.58 ? 95 ASN F CG 1 ATOM 10944 O OD1 . ASN F 2 95 ? -1.375 54.520 -23.848 1.00 63.91 ? 95 ASN F OD1 1 ATOM 10945 N ND2 . ASN F 2 95 ? -0.792 53.070 -25.473 1.00 75.01 ? 95 ASN F ND2 1 ATOM 10946 N N . ALA F 2 96 ? 2.827 57.275 -24.997 1.00 45.10 ? 96 ALA F N 1 ATOM 10947 C CA . ALA F 2 96 ? 4.189 57.696 -24.998 1.00 43.54 ? 96 ALA F CA 1 ATOM 10948 C C . ALA F 2 96 ? 4.377 58.738 -23.917 1.00 45.67 ? 96 ALA F C 1 ATOM 10949 O O . ALA F 2 96 ? 5.365 58.682 -23.188 1.00 40.45 ? 96 ALA F O 1 ATOM 10950 C CB . ALA F 2 96 ? 4.601 58.248 -26.357 1.00 44.79 ? 96 ALA F CB 1 ATOM 10951 N N . GLU F 2 97 ? 3.454 59.695 -23.836 1.00 45.19 ? 97 GLU F N 1 ATOM 10952 C CA . GLU F 2 97 ? 3.617 60.809 -22.919 1.00 45.96 ? 97 GLU F CA 1 ATOM 10953 C C . GLU F 2 97 ? 3.572 60.300 -21.486 1.00 48.35 ? 97 GLU F C 1 ATOM 10954 O O . GLU F 2 97 ? 4.389 60.685 -20.655 1.00 48.93 ? 97 GLU F O 1 ATOM 10955 C CB . GLU F 2 97 ? 2.551 61.871 -23.132 1.00 46.89 ? 97 GLU F CB 1 ATOM 10956 C CG . GLU F 2 97 ? 2.634 62.594 -24.467 1.00 47.99 ? 97 GLU F CG 1 ATOM 10957 C CD . GLU F 2 97 ? 3.566 63.779 -24.508 1.00 49.23 ? 97 GLU F CD 1 ATOM 10958 O OE1 . GLU F 2 97 ? 4.108 64.199 -23.461 1.00 53.95 ? 97 GLU F OE1 1 ATOM 10959 O OE2 . GLU F 2 97 ? 3.767 64.332 -25.613 1.00 52.53 ? 97 GLU F OE2 1 ATOM 10960 N N . LEU F 2 98 ? 2.625 59.418 -21.201 1.00 47.47 ? 98 LEU F N 1 ATOM 10961 C CA . LEU F 2 98 ? 2.489 58.897 -19.861 1.00 47.61 ? 98 LEU F CA 1 ATOM 10962 C C . LEU F 2 98 ? 3.623 57.972 -19.463 1.00 52.74 ? 98 LEU F C 1 ATOM 10963 O O . LEU F 2 98 ? 4.035 57.932 -18.299 1.00 50.30 ? 98 LEU F O 1 ATOM 10964 C CB . LEU F 2 98 ? 1.180 58.167 -19.698 1.00 47.08 ? 98 LEU F CB 1 ATOM 10965 C CG . LEU F 2 98 ? -0.016 59.075 -19.464 1.00 48.85 ? 98 LEU F CG 1 ATOM 10966 C CD1 . LEU F 2 98 ? -1.066 58.258 -18.757 1.00 52.46 ? 98 LEU F CD1 1 ATOM 10967 C CD2 . LEU F 2 98 ? 0.302 60.288 -18.615 1.00 49.65 ? 98 LEU F CD2 1 ATOM 10968 N N . LEU F 2 99 ? 4.072 57.177 -20.416 1.00 53.40 ? 99 LEU F N 1 ATOM 10969 C CA . LEU F 2 99 ? 5.206 56.302 -20.209 1.00 52.74 ? 99 LEU F CA 1 ATOM 10970 C C . LEU F 2 99 ? 6.455 57.109 -19.798 1.00 53.82 ? 99 LEU F C 1 ATOM 10971 O O . LEU F 2 99 ? 7.147 56.750 -18.850 1.00 52.21 ? 99 LEU F O 1 ATOM 10972 C CB . LEU F 2 99 ? 5.462 55.551 -21.484 1.00 51.76 ? 99 LEU F CB 1 ATOM 10973 C CG . LEU F 2 99 ? 6.804 54.865 -21.559 1.00 56.77 ? 99 LEU F CG 1 ATOM 10974 C CD1 . LEU F 2 99 ? 6.723 53.676 -20.634 1.00 56.15 ? 99 LEU F CD1 1 ATOM 10975 C CD2 . LEU F 2 99 ? 7.151 54.437 -22.978 1.00 59.36 ? 99 LEU F CD2 1 ATOM 10976 N N . VAL F 2 100 ? 6.730 58.197 -20.509 1.00 50.27 ? 100 VAL F N 1 ATOM 10977 C CA . VAL F 2 100 ? 7.867 59.055 -20.201 1.00 46.77 ? 100 VAL F CA 1 ATOM 10978 C C . VAL F 2 100 ? 7.716 59.694 -18.784 1.00 48.44 ? 100 VAL F C 1 ATOM 10979 O O . VAL F 2 100 ? 8.607 59.661 -17.988 1.00 42.26 ? 100 VAL F O 1 ATOM 10980 C CB . VAL F 2 100 ? 7.997 60.122 -21.282 1.00 47.76 ? 100 VAL F CB 1 ATOM 10981 C CG1 . VAL F 2 100 ? 8.866 61.270 -20.826 1.00 51.88 ? 100 VAL F CG1 1 ATOM 10982 C CG2 . VAL F 2 100 ? 8.570 59.508 -22.532 1.00 50.59 ? 100 VAL F CG2 1 ATOM 10983 N N . LEU F 2 101 ? 6.542 60.225 -18.483 1.00 48.64 ? 101 LEU F N 1 ATOM 10984 C CA . LEU F 2 101 ? 6.222 60.730 -17.158 1.00 51.60 ? 101 LEU F CA 1 ATOM 10985 C C . LEU F 2 101 ? 6.430 59.716 -16.016 1.00 51.81 ? 101 LEU F C 1 ATOM 10986 O O . LEU F 2 101 ? 7.004 60.047 -15.005 1.00 60.40 ? 101 LEU F O 1 ATOM 10987 C CB . LEU F 2 101 ? 4.757 61.197 -17.129 1.00 50.94 ? 101 LEU F CB 1 ATOM 10988 C CG . LEU F 2 101 ? 4.391 62.677 -17.207 1.00 52.62 ? 101 LEU F CG 1 ATOM 10989 C CD1 . LEU F 2 101 ? 5.286 63.495 -18.103 1.00 53.08 ? 101 LEU F CD1 1 ATOM 10990 C CD2 . LEU F 2 101 ? 2.935 62.808 -17.615 1.00 52.71 ? 101 LEU F CD2 1 ATOM 10991 N N . MET F 2 102 ? 5.955 58.491 -16.191 1.00 53.09 ? 102 MET F N 1 ATOM 10992 C CA . MET F 2 102 ? 5.985 57.473 -15.151 1.00 50.90 ? 102 MET F CA 1 ATOM 10993 C C . MET F 2 102 ? 7.388 56.931 -14.958 1.00 55.22 ? 102 MET F C 1 ATOM 10994 O O . MET F 2 102 ? 7.835 56.719 -13.825 1.00 55.44 ? 102 MET F O 1 ATOM 10995 C CB . MET F 2 102 ? 5.109 56.280 -15.507 1.00 51.91 ? 102 MET F CB 1 ATOM 10996 C CG . MET F 2 102 ? 3.607 56.518 -15.435 1.00 59.66 ? 102 MET F CG 1 ATOM 10997 S SD . MET F 2 102 ? 2.745 55.067 -16.147 1.00 67.71 ? 102 MET F SD 1 ATOM 10998 C CE . MET F 2 102 ? 1.060 55.527 -15.817 1.00 68.18 ? 102 MET F CE 1 ATOM 10999 N N . GLU F 2 103 ? 8.081 56.672 -16.063 1.00 53.72 ? 103 GLU F N 1 ATOM 11000 C CA . GLU F 2 103 ? 9.433 56.152 -15.970 1.00 56.52 ? 103 GLU F CA 1 ATOM 11001 C C . GLU F 2 103 ? 10.437 57.208 -15.497 1.00 51.88 ? 103 GLU F C 1 ATOM 11002 O O . GLU F 2 103 ? 11.344 56.893 -14.745 1.00 56.48 ? 103 GLU F O 1 ATOM 11003 C CB . GLU F 2 103 ? 9.849 55.451 -17.249 1.00 57.96 ? 103 GLU F CB 1 ATOM 11004 C CG . GLU F 2 103 ? 9.123 54.100 -17.381 1.00 59.87 ? 103 GLU F CG 1 ATOM 11005 C CD . GLU F 2 103 ? 9.473 53.090 -16.280 1.00 60.26 ? 103 GLU F CD 1 ATOM 11006 O OE1 . GLU F 2 103 ? 10.627 53.083 -15.849 1.00 58.41 ? 103 GLU F OE1 1 ATOM 11007 O OE2 . GLU F 2 103 ? 8.602 52.317 -15.814 1.00 63.11 ? 103 GLU F OE2 1 ATOM 11008 N N . ASN F 2 104 ? 10.206 58.464 -15.815 1.00 48.25 ? 104 ASN F N 1 ATOM 11009 C CA . ASN F 2 104 ? 10.973 59.500 -15.176 1.00 52.48 ? 104 ASN F CA 1 ATOM 11010 C C . ASN F 2 104 ? 10.814 59.543 -13.634 1.00 55.61 ? 104 ASN F C 1 ATOM 11011 O O . ASN F 2 104 ? 11.812 59.654 -12.920 1.00 51.38 ? 104 ASN F O 1 ATOM 11012 C CB . ASN F 2 104 ? 10.667 60.850 -15.806 1.00 52.03 ? 104 ASN F CB 1 ATOM 11013 C CG . ASN F 2 104 ? 11.280 60.971 -17.168 1.00 48.91 ? 104 ASN F CG 1 ATOM 11014 O OD1 . ASN F 2 104 ? 12.057 60.102 -17.570 1.00 44.55 ? 104 ASN F OD1 1 ATOM 11015 N ND2 . ASN F 2 104 ? 10.945 62.054 -17.894 1.00 48.16 ? 104 ASN F ND2 1 ATOM 11016 N N . GLU F 2 105 ? 9.583 59.443 -13.138 1.00 55.54 ? 105 GLU F N 1 ATOM 11017 C CA . GLU F 2 105 ? 9.346 59.374 -11.711 1.00 58.57 ? 105 GLU F CA 1 ATOM 11018 C C . GLU F 2 105 ? 10.202 58.277 -11.133 1.00 57.74 ? 105 GLU F C 1 ATOM 11019 O O . GLU F 2 105 ? 10.858 58.477 -10.109 1.00 68.40 ? 105 GLU F O 1 ATOM 11020 C CB . GLU F 2 105 ? 7.881 59.077 -11.375 1.00 63.69 ? 105 GLU F CB 1 ATOM 11021 C CG . GLU F 2 105 ? 7.524 59.311 -9.916 1.00 77.18 ? 105 GLU F CG 1 ATOM 11022 C CD . GLU F 2 105 ? 6.264 58.595 -9.450 1.00 89.80 ? 105 GLU F CD 1 ATOM 11023 O OE1 . GLU F 2 105 ? 5.178 59.202 -9.472 1.00 107.80 ? 105 GLU F OE1 1 ATOM 11024 O OE2 . GLU F 2 105 ? 6.353 57.430 -9.027 1.00 100.57 ? 105 GLU F OE2 1 ATOM 11025 N N . ARG F 2 106 ? 10.193 57.118 -11.777 1.00 53.99 ? 106 ARG F N 1 ATOM 11026 C CA . ARG F 2 106 ? 10.858 55.939 -11.221 1.00 55.97 ? 106 ARG F CA 1 ATOM 11027 C C . ARG F 2 106 ? 12.367 56.015 -11.255 1.00 53.10 ? 106 ARG F C 1 ATOM 11028 O O . ARG F 2 106 ? 13.035 55.516 -10.360 1.00 49.90 ? 106 ARG F O 1 ATOM 11029 C CB . ARG F 2 106 ? 10.433 54.677 -11.963 1.00 63.57 ? 106 ARG F CB 1 ATOM 11030 C CG . ARG F 2 106 ? 8.959 54.419 -11.841 1.00 73.02 ? 106 ARG F CG 1 ATOM 11031 C CD . ARG F 2 106 ? 8.655 52.949 -11.815 1.00 87.29 ? 106 ARG F CD 1 ATOM 11032 N NE . ARG F 2 106 ? 9.041 52.338 -10.541 1.00 102.71 ? 106 ARG F NE 1 ATOM 11033 C CZ . ARG F 2 106 ? 9.002 51.027 -10.316 1.00 120.08 ? 106 ARG F CZ 1 ATOM 11034 N NH1 . ARG F 2 106 ? 8.612 50.210 -11.297 1.00 136.25 ? 106 ARG F NH1 1 ATOM 11035 N NH2 . ARG F 2 106 ? 9.361 50.523 -9.130 1.00 116.88 ? 106 ARG F NH2 1 ATOM 11036 N N . THR F 2 107 ? 12.891 56.605 -12.314 1.00 49.62 ? 107 THR F N 1 ATOM 11037 C CA . THR F 2 107 ? 14.285 56.754 -12.462 1.00 52.21 ? 107 THR F CA 1 ATOM 11038 C C . THR F 2 107 ? 14.817 57.627 -11.309 1.00 58.55 ? 107 THR F C 1 ATOM 11039 O O . THR F 2 107 ? 15.807 57.271 -10.652 1.00 55.42 ? 107 THR F O 1 ATOM 11040 C CB . THR F 2 107 ? 14.613 57.324 -13.847 1.00 54.76 ? 107 THR F CB 1 ATOM 11041 O OG1 . THR F 2 107 ? 14.345 56.316 -14.841 1.00 54.65 ? 107 THR F OG1 1 ATOM 11042 C CG2 . THR F 2 107 ? 16.094 57.764 -13.936 1.00 56.20 ? 107 THR F CG2 1 ATOM 11043 N N . LEU F 2 108 ? 14.146 58.741 -11.041 1.00 57.47 ? 108 LEU F N 1 ATOM 11044 C CA . LEU F 2 108 ? 14.556 59.620 -9.947 1.00 57.36 ? 108 LEU F CA 1 ATOM 11045 C C . LEU F 2 108 ? 14.440 58.944 -8.578 1.00 56.34 ? 108 LEU F C 1 ATOM 11046 O O . LEU F 2 108 ? 15.310 59.096 -7.727 1.00 60.17 ? 108 LEU F O 1 ATOM 11047 C CB . LEU F 2 108 ? 13.767 60.920 -9.985 1.00 56.88 ? 108 LEU F CB 1 ATOM 11048 C CG . LEU F 2 108 ? 13.964 61.775 -11.248 1.00 61.02 ? 108 LEU F CG 1 ATOM 11049 C CD1 . LEU F 2 108 ? 13.375 63.167 -11.005 1.00 65.40 ? 108 LEU F CD1 1 ATOM 11050 C CD2 . LEU F 2 108 ? 15.412 61.872 -11.695 1.00 58.68 ? 108 LEU F CD2 1 ATOM 11051 N N . ASP F 2 109 ? 13.375 58.190 -8.365 1.00 56.57 ? 109 ASP F N 1 ATOM 11052 C CA . ASP F 2 109 ? 13.217 57.432 -7.118 1.00 59.39 ? 109 ASP F CA 1 ATOM 11053 C C . ASP F 2 109 ? 14.311 56.363 -7.008 1.00 62.73 ? 109 ASP F C 1 ATOM 11054 O O . ASP F 2 109 ? 14.734 56.000 -5.914 1.00 65.94 ? 109 ASP F O 1 ATOM 11055 C CB . ASP F 2 109 ? 11.801 56.805 -6.993 1.00 59.68 ? 109 ASP F CB 1 ATOM 11056 C CG . ASP F 2 109 ? 10.693 57.855 -6.715 1.00 64.22 ? 109 ASP F CG 1 ATOM 11057 O OD1 . ASP F 2 109 ? 10.987 58.931 -6.151 1.00 65.08 ? 109 ASP F OD1 1 ATOM 11058 O OD2 . ASP F 2 109 ? 9.522 57.594 -7.061 1.00 68.58 ? 109 ASP F OD2 1 ATOM 11059 N N . PHE F 2 110 ? 14.748 55.844 -8.148 1.00 58.03 ? 110 PHE F N 1 ATOM 11060 C CA . PHE F 2 110 ? 15.776 54.808 -8.177 1.00 56.92 ? 110 PHE F CA 1 ATOM 11061 C C . PHE F 2 110 ? 17.114 55.374 -7.694 1.00 58.14 ? 110 PHE F C 1 ATOM 11062 O O . PHE F 2 110 ? 17.844 54.716 -6.979 1.00 50.65 ? 110 PHE F O 1 ATOM 11063 C CB . PHE F 2 110 ? 15.894 54.269 -9.604 1.00 51.04 ? 110 PHE F CB 1 ATOM 11064 C CG . PHE F 2 110 ? 17.020 53.300 -9.828 1.00 47.08 ? 110 PHE F CG 1 ATOM 11065 C CD1 . PHE F 2 110 ? 17.078 52.084 -9.132 1.00 48.73 ? 110 PHE F CD1 1 ATOM 11066 C CD2 . PHE F 2 110 ? 17.978 53.560 -10.788 1.00 42.84 ? 110 PHE F CD2 1 ATOM 11067 C CE1 . PHE F 2 110 ? 18.115 51.171 -9.374 1.00 49.09 ? 110 PHE F CE1 1 ATOM 11068 C CE2 . PHE F 2 110 ? 18.995 52.654 -11.045 1.00 43.70 ? 110 PHE F CE2 1 ATOM 11069 C CZ . PHE F 2 110 ? 19.072 51.447 -10.353 1.00 43.52 ? 110 PHE F CZ 1 ATOM 11070 N N . HIS F 2 111 ? 17.402 56.610 -8.068 1.00 58.23 ? 111 HIS F N 1 ATOM 11071 C CA . HIS F 2 111 ? 18.624 57.234 -7.646 1.00 62.05 ? 111 HIS F CA 1 ATOM 11072 C C . HIS F 2 111 ? 18.617 57.457 -6.137 1.00 67.12 ? 111 HIS F C 1 ATOM 11073 O O . HIS F 2 111 ? 19.514 57.002 -5.442 1.00 59.06 ? 111 HIS F O 1 ATOM 11074 C CB . HIS F 2 111 ? 18.856 58.507 -8.421 1.00 61.04 ? 111 HIS F CB 1 ATOM 11075 C CG . HIS F 2 111 ? 19.364 58.245 -9.790 1.00 57.78 ? 111 HIS F CG 1 ATOM 11076 N ND1 . HIS F 2 111 ? 18.913 58.908 -10.908 1.00 63.34 ? 111 HIS F ND1 1 ATOM 11077 C CD2 . HIS F 2 111 ? 20.280 57.362 -10.223 1.00 58.73 ? 111 HIS F CD2 1 ATOM 11078 C CE1 . HIS F 2 111 ? 19.554 58.460 -11.972 1.00 62.38 ? 111 HIS F CE1 1 ATOM 11079 N NE2 . HIS F 2 111 ? 20.391 57.520 -11.579 1.00 65.14 ? 111 HIS F NE2 1 ATOM 11080 N N . ASP F 2 112 ? 17.576 58.128 -5.664 1.00 69.13 ? 112 ASP F N 1 ATOM 11081 C CA . ASP F 2 112 ? 17.244 58.236 -4.250 1.00 69.59 ? 112 ASP F CA 1 ATOM 11082 C C . ASP F 2 112 ? 17.537 56.966 -3.468 1.00 68.66 ? 112 ASP F C 1 ATOM 11083 O O . ASP F 2 112 ? 18.237 57.001 -2.470 1.00 68.36 ? 112 ASP F O 1 ATOM 11084 C CB . ASP F 2 112 ? 15.746 58.487 -4.121 1.00 75.83 ? 112 ASP F CB 1 ATOM 11085 C CG . ASP F 2 112 ? 15.429 59.625 -3.246 1.00 80.49 ? 112 ASP F CG 1 ATOM 11086 O OD1 . ASP F 2 112 ? 15.666 60.752 -3.715 1.00 90.69 ? 112 ASP F OD1 1 ATOM 11087 O OD2 . ASP F 2 112 ? 14.918 59.400 -2.124 1.00 89.42 ? 112 ASP F OD2 1 ATOM 11088 N N . SER F 2 113 ? 16.942 55.860 -3.910 1.00 66.40 ? 113 SER F N 1 ATOM 11089 C CA . SER F 2 113 ? 17.001 54.566 -3.201 1.00 68.94 ? 113 SER F CA 1 ATOM 11090 C C . SER F 2 113 ? 18.442 54.045 -3.170 1.00 69.84 ? 113 SER F C 1 ATOM 11091 O O . SER F 2 113 ? 18.870 53.495 -2.172 1.00 77.17 ? 113 SER F O 1 ATOM 11092 C CB . SER F 2 113 ? 16.040 53.532 -3.845 1.00 65.41 ? 113 SER F CB 1 ATOM 11093 O OG . SER F 2 113 ? 16.339 52.172 -3.530 1.00 60.99 ? 113 SER F OG 1 ATOM 11094 N N . ASN F 2 114 ? 19.184 54.269 -4.248 1.00 64.26 ? 114 ASN F N 1 ATOM 11095 C CA . ASN F 2 114 ? 20.579 53.877 -4.317 1.00 60.31 ? 114 ASN F CA 1 ATOM 11096 C C . ASN F 2 114 ? 21.489 54.664 -3.317 1.00 61.66 ? 114 ASN F C 1 ATOM 11097 O O . ASN F 2 114 ? 22.370 54.092 -2.672 1.00 53.03 ? 114 ASN F O 1 ATOM 11098 C CB . ASN F 2 114 ? 21.091 54.053 -5.742 1.00 57.46 ? 114 ASN F CB 1 ATOM 11099 C CG . ASN F 2 114 ? 20.516 53.052 -6.702 1.00 60.37 ? 114 ASN F CG 1 ATOM 11100 O OD1 . ASN F 2 114 ? 19.964 52.026 -6.310 1.00 67.65 ? 114 ASN F OD1 1 ATOM 11101 N ND2 . ASN F 2 114 ? 20.643 53.340 -7.993 1.00 61.02 ? 114 ASN F ND2 1 ATOM 11102 N N . VAL F 2 115 ? 21.250 55.966 -3.207 1.00 62.70 ? 115 VAL F N 1 ATOM 11103 C CA . VAL F 2 115 ? 21.984 56.846 -2.321 1.00 62.87 ? 115 VAL F CA 1 ATOM 11104 C C . VAL F 2 115 ? 21.661 56.503 -0.864 1.00 68.33 ? 115 VAL F C 1 ATOM 11105 O O . VAL F 2 115 ? 22.534 56.425 -0.039 1.00 67.75 ? 115 VAL F O 1 ATOM 11106 C CB . VAL F 2 115 ? 21.644 58.314 -2.623 1.00 65.83 ? 115 VAL F CB 1 ATOM 11107 C CG1 . VAL F 2 115 ? 22.120 59.241 -1.510 1.00 68.64 ? 115 VAL F CG1 1 ATOM 11108 C CG2 . VAL F 2 115 ? 22.269 58.748 -3.934 1.00 66.33 ? 115 VAL F CG2 1 ATOM 11109 N N . LYS F 2 116 ? 20.391 56.279 -0.563 1.00 73.83 ? 116 LYS F N 1 ATOM 11110 C CA . LYS F 2 116 ? 19.964 55.893 0.781 1.00 75.34 ? 116 LYS F CA 1 ATOM 11111 C C . LYS F 2 116 ? 20.439 54.501 1.185 1.00 70.84 ? 116 LYS F C 1 ATOM 11112 O O . LYS F 2 116 ? 20.457 54.175 2.360 1.00 70.74 ? 116 LYS F O 1 ATOM 11113 C CB . LYS F 2 116 ? 18.440 55.974 0.903 1.00 77.28 ? 116 LYS F CB 1 ATOM 11114 C CG . LYS F 2 116 ? 17.898 55.646 2.275 1.00 88.24 ? 116 LYS F CG 1 ATOM 11115 C CD . LYS F 2 116 ? 16.464 56.162 2.474 1.00 106.26 ? 116 LYS F CD 1 ATOM 11116 C CE . LYS F 2 116 ? 16.266 56.780 3.853 1.00 110.84 ? 116 LYS F CE 1 ATOM 11117 N NZ . LYS F 2 116 ? 16.433 55.781 4.941 1.00 113.72 ? 116 LYS F NZ 1 ATOM 11118 N N . ASN F 2 117 ? 20.768 53.659 0.221 1.00 69.48 ? 117 ASN F N 1 ATOM 11119 C CA . ASN F 2 117 ? 21.332 52.374 0.567 1.00 73.39 ? 117 ASN F CA 1 ATOM 11120 C C . ASN F 2 117 ? 22.796 52.551 0.933 1.00 74.00 ? 117 ASN F C 1 ATOM 11121 O O . ASN F 2 117 ? 23.310 51.815 1.765 1.00 68.62 ? 117 ASN F O 1 ATOM 11122 C CB . ASN F 2 117 ? 21.202 51.365 -0.568 1.00 73.86 ? 117 ASN F CB 1 ATOM 11123 C CG . ASN F 2 117 ? 19.772 50.868 -0.764 1.00 82.65 ? 117 ASN F CG 1 ATOM 11124 O OD1 . ASN F 2 117 ? 18.914 50.971 0.121 1.00 80.08 ? 117 ASN F OD1 1 ATOM 11125 N ND2 . ASN F 2 117 ? 19.514 50.308 -1.946 1.00 90.20 ? 117 ASN F ND2 1 ATOM 11126 N N . LEU F 2 118 ? 23.476 53.481 0.265 1.00 68.00 ? 118 LEU F N 1 ATOM 11127 C CA . LEU F 2 118 ? 24.858 53.760 0.604 1.00 72.95 ? 118 LEU F CA 1 ATOM 11128 C C . LEU F 2 118 ? 24.929 54.289 2.051 1.00 71.89 ? 118 LEU F C 1 ATOM 11129 O O . LEU F 2 118 ? 25.596 53.709 2.897 1.00 63.72 ? 118 LEU F O 1 ATOM 11130 C CB . LEU F 2 118 ? 25.475 54.770 -0.374 1.00 72.93 ? 118 LEU F CB 1 ATOM 11131 C CG . LEU F 2 118 ? 26.258 54.286 -1.596 1.00 74.11 ? 118 LEU F CG 1 ATOM 11132 C CD1 . LEU F 2 118 ? 27.191 55.420 -2.001 1.00 80.01 ? 118 LEU F CD1 1 ATOM 11133 C CD2 . LEU F 2 118 ? 27.056 53.014 -1.358 1.00 75.35 ? 118 LEU F CD2 1 ATOM 11134 N N . TYR F 2 119 ? 24.191 55.370 2.299 1.00 74.11 ? 119 TYR F N 1 ATOM 11135 C CA . TYR F 2 119 ? 24.044 55.996 3.609 1.00 73.62 ? 119 TYR F CA 1 ATOM 11136 C C . TYR F 2 119 ? 23.764 54.978 4.691 1.00 71.84 ? 119 TYR F C 1 ATOM 11137 O O . TYR F 2 119 ? 24.333 55.075 5.753 1.00 82.54 ? 119 TYR F O 1 ATOM 11138 C CB . TYR F 2 119 ? 22.920 57.040 3.599 1.00 76.95 ? 119 TYR F CB 1 ATOM 11139 C CG . TYR F 2 119 ? 22.810 57.866 4.867 1.00 77.87 ? 119 TYR F CG 1 ATOM 11140 C CD1 . TYR F 2 119 ? 23.524 59.056 5.010 1.00 73.68 ? 119 TYR F CD1 1 ATOM 11141 C CD2 . TYR F 2 119 ? 21.990 57.453 5.932 1.00 82.31 ? 119 TYR F CD2 1 ATOM 11142 C CE1 . TYR F 2 119 ? 23.439 59.817 6.170 1.00 73.55 ? 119 TYR F CE1 1 ATOM 11143 C CE2 . TYR F 2 119 ? 21.913 58.207 7.106 1.00 85.47 ? 119 TYR F CE2 1 ATOM 11144 C CZ . TYR F 2 119 ? 22.638 59.395 7.226 1.00 81.49 ? 119 TYR F CZ 1 ATOM 11145 O OH . TYR F 2 119 ? 22.580 60.182 8.392 1.00 86.66 ? 119 TYR F OH 1 ATOM 11146 N N . ASP F 2 120 ? 22.888 54.024 4.424 1.00 72.68 ? 120 ASP F N 1 ATOM 11147 C CA . ASP F 2 120 ? 22.480 53.021 5.417 1.00 81.02 ? 120 ASP F CA 1 ATOM 11148 C C . ASP F 2 120 ? 23.610 52.076 5.741 1.00 79.18 ? 120 ASP F C 1 ATOM 11149 O O . ASP F 2 120 ? 23.803 51.735 6.899 1.00 84.70 ? 120 ASP F O 1 ATOM 11150 C CB . ASP F 2 120 ? 21.290 52.143 4.949 1.00 84.68 ? 120 ASP F CB 1 ATOM 11151 C CG . ASP F 2 120 ? 19.943 52.647 5.369 1.00 84.85 ? 120 ASP F CG 1 ATOM 11152 O OD1 . ASP F 2 120 ? 19.778 53.850 5.680 1.00 86.92 ? 120 ASP F OD1 1 ATOM 11153 O OD2 . ASP F 2 120 ? 19.038 51.778 5.363 1.00 83.66 ? 120 ASP F OD2 1 ATOM 11154 N N . LYS F 2 121 ? 24.327 51.618 4.725 1.00 85.25 ? 121 LYS F N 1 ATOM 11155 C CA . LYS F 2 121 ? 25.373 50.623 4.943 1.00 89.48 ? 121 LYS F CA 1 ATOM 11156 C C . LYS F 2 121 ? 26.557 51.257 5.722 1.00 83.57 ? 121 LYS F C 1 ATOM 11157 O O . LYS F 2 121 ? 27.209 50.577 6.490 1.00 67.64 ? 121 LYS F O 1 ATOM 11158 C CB . LYS F 2 121 ? 25.747 49.910 3.619 1.00 95.87 ? 121 LYS F CB 1 ATOM 11159 C CG . LYS F 2 121 ? 27.203 49.941 3.171 1.00 107.33 ? 121 LYS F CG 1 ATOM 11160 C CD . LYS F 2 121 ? 27.481 48.921 2.060 1.00 112.77 ? 121 LYS F CD 1 ATOM 11161 C CE . LYS F 2 121 ? 26.405 48.871 0.975 1.00 111.43 ? 121 LYS F CE 1 ATOM 11162 N NZ . LYS F 2 121 ? 26.806 49.528 -0.302 1.00 114.56 ? 121 LYS F NZ 1 ATOM 11163 N N . VAL F 2 122 ? 26.753 52.570 5.566 1.00 79.92 ? 122 VAL F N 1 ATOM 11164 C CA . VAL F 2 122 ? 27.670 53.351 6.404 1.00 77.53 ? 122 VAL F CA 1 ATOM 11165 C C . VAL F 2 122 ? 27.119 53.513 7.834 1.00 80.57 ? 122 VAL F C 1 ATOM 11166 O O . VAL F 2 122 ? 27.749 53.096 8.778 1.00 73.93 ? 122 VAL F O 1 ATOM 11167 C CB . VAL F 2 122 ? 27.999 54.730 5.779 1.00 72.78 ? 122 VAL F CB 1 ATOM 11168 C CG1 . VAL F 2 122 ? 28.595 55.696 6.810 1.00 75.54 ? 122 VAL F CG1 1 ATOM 11169 C CG2 . VAL F 2 122 ? 28.953 54.556 4.617 1.00 67.35 ? 122 VAL F CG2 1 ATOM 11170 N N . ARG F 2 123 ? 25.948 54.131 7.980 1.00 84.66 ? 123 ARG F N 1 ATOM 11171 C CA . ARG F 2 123 ? 25.243 54.202 9.274 1.00 81.32 ? 123 ARG F CA 1 ATOM 11172 C C . ARG F 2 123 ? 25.366 52.906 10.081 1.00 77.31 ? 123 ARG F C 1 ATOM 11173 O O . ARG F 2 123 ? 25.620 52.968 11.283 1.00 82.98 ? 123 ARG F O 1 ATOM 11174 C CB . ARG F 2 123 ? 23.773 54.581 9.046 1.00 83.98 ? 123 ARG F CB 1 ATOM 11175 C CG . ARG F 2 123 ? 22.844 54.644 10.259 1.00 86.06 ? 123 ARG F CG 1 ATOM 11176 C CD . ARG F 2 123 ? 21.390 54.768 9.793 1.00 89.73 ? 123 ARG F CD 1 ATOM 11177 N NE . ARG F 2 123 ? 20.474 53.772 10.331 1.00 96.62 ? 123 ARG F NE 1 ATOM 11178 C CZ . ARG F 2 123 ? 20.377 52.514 9.894 1.00 105.82 ? 123 ARG F CZ 1 ATOM 11179 N NH1 . ARG F 2 123 ? 21.157 52.062 8.924 1.00 115.20 ? 123 ARG F NH1 1 ATOM 11180 N NH2 . ARG F 2 123 ? 19.499 51.687 10.442 1.00 109.07 ? 123 ARG F NH2 1 ATOM 11181 N N . LEU F 2 124 ? 25.230 51.749 9.437 1.00 73.87 ? 124 LEU F N 1 ATOM 11182 C CA . LEU F 2 124 ? 25.308 50.463 10.160 1.00 78.04 ? 124 LEU F CA 1 ATOM 11183 C C . LEU F 2 124 ? 26.697 50.086 10.678 1.00 73.92 ? 124 LEU F C 1 ATOM 11184 O O . LEU F 2 124 ? 26.810 49.433 11.716 1.00 68.65 ? 124 LEU F O 1 ATOM 11185 C CB . LEU F 2 124 ? 24.794 49.302 9.314 1.00 83.98 ? 124 LEU F CB 1 ATOM 11186 C CG . LEU F 2 124 ? 23.283 49.084 9.196 1.00 96.73 ? 124 LEU F CG 1 ATOM 11187 C CD1 . LEU F 2 124 ? 23.013 47.647 8.732 1.00 101.01 ? 124 LEU F CD1 1 ATOM 11188 C CD2 . LEU F 2 124 ? 22.527 49.397 10.490 1.00 101.88 ? 124 LEU F CD2 1 ATOM 11189 N N . GLN F 2 125 ? 27.736 50.483 9.949 1.00 68.42 ? 125 GLN F N 1 ATOM 11190 C CA . GLN F 2 125 ? 29.107 50.249 10.361 1.00 72.21 ? 125 GLN F CA 1 ATOM 11191 C C . GLN F 2 125 ? 29.481 51.148 11.569 1.00 70.22 ? 125 GLN F C 1 ATOM 11192 O O . GLN F 2 125 ? 29.953 50.669 12.591 1.00 69.88 ? 125 GLN F O 1 ATOM 11193 C CB . GLN F 2 125 ? 30.032 50.525 9.182 1.00 73.31 ? 125 GLN F CB 1 ATOM 11194 C CG . GLN F 2 125 ? 29.910 49.534 8.025 1.00 71.87 ? 125 GLN F CG 1 ATOM 11195 C CD . GLN F 2 125 ? 31.049 49.684 7.018 1.00 77.06 ? 125 GLN F CD 1 ATOM 11196 O OE1 . GLN F 2 125 ? 31.041 50.572 6.160 1.00 77.05 ? 125 GLN F OE1 1 ATOM 11197 N NE2 . GLN F 2 125 ? 32.084 48.860 7.181 1.00 79.52 ? 125 GLN F NE2 1 ATOM 11198 N N . LEU F 2 126 ? 29.184 52.438 11.438 1.00 67.09 ? 126 LEU F N 1 ATOM 11199 C CA . LEU F 2 126 ? 29.564 53.462 12.388 1.00 67.53 ? 126 LEU F CA 1 ATOM 11200 C C . LEU F 2 126 ? 28.854 53.411 13.707 1.00 71.16 ? 126 LEU F C 1 ATOM 11201 O O . LEU F 2 126 ? 29.469 53.647 14.724 1.00 81.29 ? 126 LEU F O 1 ATOM 11202 C CB . LEU F 2 126 ? 29.367 54.859 11.786 1.00 64.98 ? 126 LEU F CB 1 ATOM 11203 C CG . LEU F 2 126 ? 30.170 55.142 10.512 1.00 64.93 ? 126 LEU F CG 1 ATOM 11204 C CD1 . LEU F 2 126 ? 30.316 56.634 10.254 1.00 66.59 ? 126 LEU F CD1 1 ATOM 11205 C CD2 . LEU F 2 126 ? 31.538 54.478 10.556 1.00 62.94 ? 126 LEU F CD2 1 ATOM 11206 N N . ARG F 2 127 ? 27.561 53.155 13.686 1.00 77.79 ? 127 ARG F N 1 ATOM 11207 C CA . ARG F 2 127 ? 26.758 53.170 14.893 1.00 80.07 ? 127 ARG F CA 1 ATOM 11208 C C . ARG F 2 127 ? 26.992 54.442 15.720 1.00 84.60 ? 127 ARG F C 1 ATOM 11209 O O . ARG F 2 127 ? 26.895 55.558 15.206 1.00 88.34 ? 127 ARG F O 1 ATOM 11210 C CB . ARG F 2 127 ? 27.082 51.929 15.698 1.00 79.16 ? 127 ARG F CB 1 ATOM 11211 C CG . ARG F 2 127 ? 27.112 50.655 14.884 1.00 82.62 ? 127 ARG F CG 1 ATOM 11212 C CD . ARG F 2 127 ? 26.878 49.527 15.859 1.00 92.05 ? 127 ARG F CD 1 ATOM 11213 N NE . ARG F 2 127 ? 27.809 48.428 15.671 1.00 102.84 ? 127 ARG F NE 1 ATOM 11214 C CZ . ARG F 2 127 ? 28.064 47.492 16.588 1.00 109.93 ? 127 ARG F CZ 1 ATOM 11215 N NH1 . ARG F 2 127 ? 27.449 47.503 17.773 1.00 108.27 ? 127 ARG F NH1 1 ATOM 11216 N NH2 . ARG F 2 127 ? 28.948 46.537 16.318 1.00 111.76 ? 127 ARG F NH2 1 ATOM 11217 N N . ASP F 2 128 ? 27.312 54.277 16.997 1.00 87.62 ? 128 ASP F N 1 ATOM 11218 C CA . ASP F 2 128 ? 27.493 55.419 17.904 1.00 86.40 ? 128 ASP F CA 1 ATOM 11219 C C . ASP F 2 128 ? 28.930 55.992 17.896 1.00 80.05 ? 128 ASP F C 1 ATOM 11220 O O . ASP F 2 128 ? 29.184 57.015 18.560 1.00 77.86 ? 128 ASP F O 1 ATOM 11221 C CB . ASP F 2 128 ? 27.047 55.061 19.335 1.00 85.67 ? 128 ASP F CB 1 ATOM 11222 C CG . ASP F 2 128 ? 27.709 53.797 19.868 1.00 89.01 ? 128 ASP F CG 1 ATOM 11223 O OD1 . ASP F 2 128 ? 28.668 53.270 19.227 1.00 82.76 ? 128 ASP F OD1 1 ATOM 11224 O OD2 . ASP F 2 128 ? 27.249 53.339 20.942 1.00 86.25 ? 128 ASP F OD2 1 ATOM 11225 N N . ASN F 2 129 ? 29.848 55.371 17.144 1.00 66.92 ? 129 ASN F N 1 ATOM 11226 C CA . ASN F 2 129 ? 31.169 55.975 16.909 1.00 65.30 ? 129 ASN F CA 1 ATOM 11227 C C . ASN F 2 129 ? 31.104 57.268 16.119 1.00 65.71 ? 129 ASN F C 1 ATOM 11228 O O . ASN F 2 129 ? 32.118 57.948 15.948 1.00 72.10 ? 129 ASN F O 1 ATOM 11229 C CB . ASN F 2 129 ? 32.128 55.031 16.205 1.00 66.72 ? 129 ASN F CB 1 ATOM 11230 C CG . ASN F 2 129 ? 32.559 53.877 17.073 1.00 69.67 ? 129 ASN F CG 1 ATOM 11231 O OD1 . ASN F 2 129 ? 32.126 53.729 18.205 1.00 77.65 ? 129 ASN F OD1 1 ATOM 11232 N ND2 . ASN F 2 129 ? 33.482 53.072 16.556 1.00 74.18 ? 129 ASN F ND2 1 ATOM 11233 N N . ALA F 2 130 ? 29.933 57.593 15.595 1.00 70.88 ? 130 ALA F N 1 ATOM 11234 C CA . ALA F 2 130 ? 29.756 58.871 14.932 1.00 76.01 ? 130 ALA F CA 1 ATOM 11235 C C . ALA F 2 130 ? 28.337 59.377 15.102 1.00 77.71 ? 130 ALA F C 1 ATOM 11236 O O . ALA F 2 130 ? 27.435 58.650 15.545 1.00 75.64 ? 130 ALA F O 1 ATOM 11237 C CB . ALA F 2 130 ? 30.144 58.786 13.454 1.00 78.29 ? 130 ALA F CB 1 ATOM 11238 N N . LYS F 2 131 ? 28.196 60.649 14.744 1.00 84.22 ? 131 LYS F N 1 ATOM 11239 C CA . LYS F 2 131 ? 27.029 61.455 15.000 1.00 93.86 ? 131 LYS F CA 1 ATOM 11240 C C . LYS F 2 131 ? 26.368 61.792 13.651 1.00 92.66 ? 131 LYS F C 1 ATOM 11241 O O . LYS F 2 131 ? 26.970 62.464 12.802 1.00 85.08 ? 131 LYS F O 1 ATOM 11242 C CB . LYS F 2 131 ? 27.508 62.715 15.720 1.00 99.31 ? 131 LYS F CB 1 ATOM 11243 C CG . LYS F 2 131 ? 26.485 63.679 16.285 1.00 109.42 ? 131 LYS F CG 1 ATOM 11244 C CD . LYS F 2 131 ? 27.236 64.934 16.745 1.00 121.87 ? 131 LYS F CD 1 ATOM 11245 C CE . LYS F 2 131 ? 26.647 65.599 17.986 1.00 128.06 ? 131 LYS F CE 1 ATOM 11246 N NZ . LYS F 2 131 ? 25.758 66.741 17.643 1.00 131.51 ? 131 LYS F NZ 1 ATOM 11247 N N . GLU F 2 132 ? 25.146 61.297 13.464 1.00 78.33 ? 132 GLU F N 1 ATOM 11248 C CA . GLU F 2 132 ? 24.373 61.614 12.289 1.00 81.41 ? 132 GLU F CA 1 ATOM 11249 C C . GLU F 2 132 ? 24.018 63.101 12.303 1.00 81.02 ? 132 GLU F C 1 ATOM 11250 O O . GLU F 2 132 ? 23.114 63.524 13.021 1.00 86.01 ? 132 GLU F O 1 ATOM 11251 C CB . GLU F 2 132 ? 23.097 60.775 12.236 1.00 84.56 ? 132 GLU F CB 1 ATOM 11252 C CG . GLU F 2 132 ? 23.318 59.301 11.910 1.00 81.75 ? 132 GLU F CG 1 ATOM 11253 C CD . GLU F 2 132 ? 22.024 58.613 11.574 1.00 83.32 ? 132 GLU F CD 1 ATOM 11254 O OE1 . GLU F 2 132 ? 21.512 58.863 10.450 1.00 91.11 ? 132 GLU F OE1 1 ATOM 11255 O OE2 . GLU F 2 132 ? 21.514 57.853 12.418 1.00 83.78 ? 132 GLU F OE2 1 ATOM 11256 N N . LEU F 2 133 ? 24.725 63.887 11.504 1.00 78.37 ? 133 LEU F N 1 ATOM 11257 C CA . LEU F 2 133 ? 24.450 65.322 11.408 1.00 83.22 ? 133 LEU F CA 1 ATOM 11258 C C . LEU F 2 133 ? 23.065 65.629 10.808 1.00 91.78 ? 133 LEU F C 1 ATOM 11259 O O . LEU F 2 133 ? 22.530 66.715 11.030 1.00 90.06 ? 133 LEU F O 1 ATOM 11260 C CB . LEU F 2 133 ? 25.546 66.033 10.600 1.00 85.56 ? 133 LEU F CB 1 ATOM 11261 C CG . LEU F 2 133 ? 26.855 66.375 11.332 1.00 89.76 ? 133 LEU F CG 1 ATOM 11262 C CD1 . LEU F 2 133 ? 27.915 66.811 10.325 1.00 90.73 ? 133 LEU F CD1 1 ATOM 11263 C CD2 . LEU F 2 133 ? 26.643 67.448 12.401 1.00 86.15 ? 133 LEU F CD2 1 ATOM 11264 N N . GLY F 2 134 ? 22.512 64.679 10.035 1.00 94.54 ? 134 GLY F N 1 ATOM 11265 C CA . GLY F 2 134 ? 21.183 64.816 9.439 1.00 93.16 ? 134 GLY F CA 1 ATOM 11266 C C . GLY F 2 134 ? 21.126 65.556 8.110 1.00 92.35 ? 134 GLY F C 1 ATOM 11267 O O . GLY F 2 134 ? 20.050 65.998 7.673 1.00 85.13 ? 134 GLY F O 1 ATOM 11268 N N . ASN F 2 135 ? 22.281 65.695 7.470 1.00 87.68 ? 135 ASN F N 1 ATOM 11269 C CA . ASN F 2 135 ? 22.373 66.328 6.161 1.00 81.18 ? 135 ASN F CA 1 ATOM 11270 C C . ASN F 2 135 ? 23.179 65.423 5.224 1.00 77.35 ? 135 ASN F C 1 ATOM 11271 O O . ASN F 2 135 ? 23.743 65.873 4.208 1.00 71.36 ? 135 ASN F O 1 ATOM 11272 C CB . ASN F 2 135 ? 23.013 67.718 6.290 1.00 85.03 ? 135 ASN F CB 1 ATOM 11273 C CG . ASN F 2 135 ? 24.445 67.668 6.813 1.00 88.23 ? 135 ASN F CG 1 ATOM 11274 O OD1 . ASN F 2 135 ? 24.959 66.603 7.226 1.00 90.29 ? 135 ASN F OD1 1 ATOM 11275 N ND2 . ASN F 2 135 ? 25.115 68.810 6.766 1.00 92.53 ? 135 ASN F ND2 1 ATOM 11276 N N . GLY F 2 136 ? 23.197 64.133 5.560 1.00 70.36 ? 136 GLY F N 1 ATOM 11277 C CA . GLY F 2 136 ? 23.900 63.143 4.773 1.00 74.80 ? 136 GLY F CA 1 ATOM 11278 C C . GLY F 2 136 ? 25.266 62.887 5.301 1.00 80.51 ? 136 GLY F C 1 ATOM 11279 O O . GLY F 2 136 ? 25.935 61.954 4.854 1.00 87.81 ? 136 GLY F O 1 ATOM 11280 N N . CYS F 2 137 ? 25.690 63.704 6.258 1.00 90.00 ? 137 CYS F N 1 ATOM 11281 C CA . CYS F 2 137 ? 27.050 63.596 6.793 1.00 93.23 ? 137 CYS F CA 1 ATOM 11282 C C . CYS F 2 137 ? 27.109 62.923 8.152 1.00 90.06 ? 137 CYS F C 1 ATOM 11283 O O . CYS F 2 137 ? 26.175 63.015 8.955 1.00 90.36 ? 137 CYS F O 1 ATOM 11284 C CB . CYS F 2 137 ? 27.707 64.964 6.852 1.00 96.27 ? 137 CYS F CB 1 ATOM 11285 S SG . CYS F 2 137 ? 27.828 65.694 5.209 1.00 96.80 ? 137 CYS F SG 1 ATOM 11286 N N . PHE F 2 138 ? 28.227 62.237 8.372 1.00 90.79 ? 138 PHE F N 1 ATOM 11287 C CA . PHE F 2 138 ? 28.550 61.615 9.650 1.00 94.78 ? 138 PHE F CA 1 ATOM 11288 C C . PHE F 2 138 ? 29.716 62.355 10.287 1.00 101.30 ? 138 PHE F C 1 ATOM 11289 O O . PHE F 2 138 ? 30.762 62.502 9.660 1.00 101.07 ? 138 PHE F O 1 ATOM 11290 C CB . PHE F 2 138 ? 28.946 60.167 9.458 1.00 85.15 ? 138 PHE F CB 1 ATOM 11291 C CG . PHE F 2 138 ? 27.816 59.303 9.062 1.00 86.96 ? 138 PHE F CG 1 ATOM 11292 C CD1 . PHE F 2 138 ? 27.016 58.715 10.020 1.00 86.96 ? 138 PHE F CD1 1 ATOM 11293 C CD2 . PHE F 2 138 ? 27.541 59.085 7.729 1.00 82.57 ? 138 PHE F CD2 1 ATOM 11294 C CE1 . PHE F 2 138 ? 25.958 57.903 9.665 1.00 87.77 ? 138 PHE F CE1 1 ATOM 11295 C CE2 . PHE F 2 138 ? 26.491 58.283 7.361 1.00 79.84 ? 138 PHE F CE2 1 ATOM 11296 C CZ . PHE F 2 138 ? 25.696 57.687 8.325 1.00 88.09 ? 138 PHE F CZ 1 ATOM 11297 N N . GLU F 2 139 ? 29.531 62.823 11.525 1.00 111.51 ? 139 GLU F N 1 ATOM 11298 C CA . GLU F 2 139 ? 30.624 63.440 12.284 1.00 108.47 ? 139 GLU F CA 1 ATOM 11299 C C . GLU F 2 139 ? 31.217 62.430 13.262 1.00 96.14 ? 139 GLU F C 1 ATOM 11300 O O . GLU F 2 139 ? 30.595 62.034 14.237 1.00 88.40 ? 139 GLU F O 1 ATOM 11301 C CB . GLU F 2 139 ? 30.172 64.708 13.020 1.00 106.92 ? 139 GLU F CB 1 ATOM 11302 C CG . GLU F 2 139 ? 31.355 65.593 13.406 1.00 105.95 ? 139 GLU F CG 1 ATOM 11303 C CD . GLU F 2 139 ? 30.993 66.781 14.266 1.00 98.60 ? 139 GLU F CD 1 ATOM 11304 O OE1 . GLU F 2 139 ? 30.028 66.671 15.055 1.00 100.53 ? 139 GLU F OE1 1 ATOM 11305 O OE2 . GLU F 2 139 ? 31.681 67.818 14.143 1.00 92.11 ? 139 GLU F OE2 1 ATOM 11306 N N . PHE F 2 140 ? 32.438 62.019 12.981 1.00 96.46 ? 140 PHE F N 1 ATOM 11307 C CA . PHE F 2 140 ? 33.123 61.054 13.822 1.00 99.96 ? 140 PHE F CA 1 ATOM 11308 C C . PHE F 2 140 ? 33.391 61.587 15.253 1.00 103.86 ? 140 PHE F C 1 ATOM 11309 O O . PHE F 2 140 ? 33.729 62.754 15.467 1.00 98.95 ? 140 PHE F O 1 ATOM 11310 C CB . PHE F 2 140 ? 34.459 60.656 13.180 1.00 96.94 ? 140 PHE F CB 1 ATOM 11311 C CG . PHE F 2 140 ? 34.341 59.723 12.009 1.00 98.11 ? 140 PHE F CG 1 ATOM 11312 C CD1 . PHE F 2 140 ? 34.330 60.211 10.701 1.00 96.93 ? 140 PHE F CD1 1 ATOM 11313 C CD2 . PHE F 2 140 ? 34.300 58.345 12.205 1.00 94.76 ? 140 PHE F CD2 1 ATOM 11314 C CE1 . PHE F 2 140 ? 34.241 59.343 9.623 1.00 91.61 ? 140 PHE F CE1 1 ATOM 11315 C CE2 . PHE F 2 140 ? 34.213 57.470 11.123 1.00 88.27 ? 140 PHE F CE2 1 ATOM 11316 C CZ . PHE F 2 140 ? 34.187 57.969 9.837 1.00 88.16 ? 140 PHE F CZ 1 ATOM 11317 N N . TYR F 2 141 ? 33.261 60.695 16.227 1.00 106.30 ? 141 TYR F N 1 ATOM 11318 C CA . TYR F 2 141 ? 33.639 60.970 17.610 1.00 101.17 ? 141 TYR F CA 1 ATOM 11319 C C . TYR F 2 141 ? 35.097 60.577 17.862 1.00 101.47 ? 141 TYR F C 1 ATOM 11320 O O . TYR F 2 141 ? 35.512 60.387 19.009 1.00 104.45 ? 141 TYR F O 1 ATOM 11321 C CB . TYR F 2 141 ? 32.725 60.184 18.560 1.00 99.89 ? 141 TYR F CB 1 ATOM 11322 C CG . TYR F 2 141 ? 31.305 60.680 18.675 1.00 93.17 ? 141 TYR F CG 1 ATOM 11323 C CD1 . TYR F 2 141 ? 31.022 62.047 18.728 1.00 96.51 ? 141 TYR F CD1 1 ATOM 11324 C CD2 . TYR F 2 141 ? 30.252 59.783 18.793 1.00 85.80 ? 141 TYR F CD2 1 ATOM 11325 C CE1 . TYR F 2 141 ? 29.733 62.499 18.873 1.00 92.26 ? 141 TYR F CE1 1 ATOM 11326 C CE2 . TYR F 2 141 ? 28.962 60.225 18.924 1.00 89.01 ? 141 TYR F CE2 1 ATOM 11327 C CZ . TYR F 2 141 ? 28.711 61.586 18.979 1.00 92.76 ? 141 TYR F CZ 1 ATOM 11328 O OH . TYR F 2 141 ? 27.424 62.044 19.107 1.00 96.54 ? 141 TYR F OH 1 ATOM 11329 N N . HIS F 2 142 ? 35.858 60.432 16.782 1.00 99.68 ? 142 HIS F N 1 ATOM 11330 C CA . HIS F 2 142 ? 37.251 59.983 16.840 1.00 100.92 ? 142 HIS F CA 1 ATOM 11331 C C . HIS F 2 142 ? 38.076 60.434 15.612 1.00 93.45 ? 142 HIS F C 1 ATOM 11332 O O . HIS F 2 142 ? 37.568 61.150 14.750 1.00 82.33 ? 142 HIS F O 1 ATOM 11333 C CB . HIS F 2 142 ? 37.313 58.443 17.068 1.00 104.99 ? 142 HIS F CB 1 ATOM 11334 C CG . HIS F 2 142 ? 37.041 57.610 15.848 1.00 105.38 ? 142 HIS F CG 1 ATOM 11335 N ND1 . HIS F 2 142 ? 35.839 56.967 15.620 1.00 108.87 ? 142 HIS F ND1 1 ATOM 11336 C CD2 . HIS F 2 142 ? 37.831 57.296 14.799 1.00 111.35 ? 142 HIS F CD2 1 ATOM 11337 C CE1 . HIS F 2 142 ? 35.899 56.304 14.478 1.00 100.61 ? 142 HIS F CE1 1 ATOM 11338 N NE2 . HIS F 2 142 ? 37.097 56.489 13.960 1.00 106.01 ? 142 HIS F NE2 1 ATOM 11339 N N . LYS F 2 143 ? 39.333 59.995 15.554 1.00 98.88 ? 143 LYS F N 1 ATOM 11340 C CA . LYS F 2 143 ? 40.282 60.371 14.496 1.00 106.37 ? 143 LYS F CA 1 ATOM 11341 C C . LYS F 2 143 ? 40.284 59.308 13.419 1.00 102.14 ? 143 LYS F C 1 ATOM 11342 O O . LYS F 2 143 ? 40.657 58.160 13.675 1.00 95.10 ? 143 LYS F O 1 ATOM 11343 C CB . LYS F 2 143 ? 41.724 60.555 15.026 1.00 105.98 ? 143 LYS F CB 1 ATOM 11344 C CG . LYS F 2 143 ? 42.266 61.951 14.859 1.00 113.09 ? 143 LYS F CG 1 ATOM 11345 C CD . LYS F 2 143 ? 43.736 62.104 15.236 1.00 126.44 ? 143 LYS F CD 1 ATOM 11346 C CE . LYS F 2 143 ? 43.977 62.196 16.748 1.00 129.17 ? 143 LYS F CE 1 ATOM 11347 N NZ . LYS F 2 143 ? 44.531 60.921 17.282 1.00 131.89 ? 143 LYS F NZ 1 ATOM 11348 N N . CYS F 2 144 ? 39.880 59.718 12.219 1.00 103.45 ? 144 CYS F N 1 ATOM 11349 C CA . CYS F 2 144 ? 39.692 58.804 11.094 1.00 100.44 ? 144 CYS F CA 1 ATOM 11350 C C . CYS F 2 144 ? 40.604 59.224 9.947 1.00 97.82 ? 144 CYS F C 1 ATOM 11351 O O . CYS F 2 144 ? 40.293 60.115 9.153 1.00 92.92 ? 144 CYS F O 1 ATOM 11352 C CB . CYS F 2 144 ? 38.216 58.780 10.686 1.00 96.64 ? 144 CYS F CB 1 ATOM 11353 S SG . CYS F 2 144 ? 37.667 57.462 9.563 1.00 102.51 ? 144 CYS F SG 1 ATOM 11354 N N . ASP F 2 145 ? 41.759 58.576 9.890 1.00 100.32 ? 145 ASP F N 1 ATOM 11355 C CA . ASP F 2 145 ? 42.771 58.918 8.905 1.00 101.10 ? 145 ASP F CA 1 ATOM 11356 C C . ASP F 2 145 ? 42.316 58.419 7.518 1.00 96.74 ? 145 ASP F C 1 ATOM 11357 O O . ASP F 2 145 ? 41.206 57.896 7.382 1.00 95.79 ? 145 ASP F O 1 ATOM 11358 C CB . ASP F 2 145 ? 44.164 58.396 9.331 1.00 98.49 ? 145 ASP F CB 1 ATOM 11359 C CG . ASP F 2 145 ? 44.268 56.873 9.342 1.00 96.61 ? 145 ASP F CG 1 ATOM 11360 O OD1 . ASP F 2 145 ? 45.390 56.365 9.196 1.00 101.95 ? 145 ASP F OD1 1 ATOM 11361 O OD2 . ASP F 2 145 ? 43.249 56.186 9.501 1.00 89.47 ? 145 ASP F OD2 1 ATOM 11362 N N . ASN F 2 146 ? 43.159 58.610 6.502 1.00 92.73 ? 146 ASN F N 1 ATOM 11363 C CA . ASN F 2 146 ? 42.837 58.226 5.116 1.00 86.28 ? 146 ASN F CA 1 ATOM 11364 C C . ASN F 2 146 ? 42.640 56.711 4.909 1.00 86.69 ? 146 ASN F C 1 ATOM 11365 O O . ASN F 2 146 ? 41.930 56.297 3.983 1.00 95.74 ? 146 ASN F O 1 ATOM 11366 C CB . ASN F 2 146 ? 43.893 58.754 4.128 1.00 80.46 ? 146 ASN F CB 1 ATOM 11367 C CG . ASN F 2 146 ? 43.760 60.264 3.807 1.00 78.93 ? 146 ASN F CG 1 ATOM 11368 O OD1 . ASN F 2 146 ? 44.616 60.796 3.102 1.00 91.19 ? 146 ASN F OD1 1 ATOM 11369 N ND2 . ASN F 2 146 ? 42.702 60.931 4.257 1.00 70.19 ? 146 ASN F ND2 1 ATOM 11370 N N . LYS F 2 147 ? 43.213 55.894 5.785 1.00 85.08 ? 147 LYS F N 1 ATOM 11371 C CA . LYS F 2 147 ? 42.985 54.441 5.745 1.00 87.63 ? 147 LYS F CA 1 ATOM 11372 C C . LYS F 2 147 ? 41.689 54.068 6.475 1.00 80.71 ? 147 LYS F C 1 ATOM 11373 O O . LYS F 2 147 ? 41.059 53.064 6.167 1.00 79.01 ? 147 LYS F O 1 ATOM 11374 C CB . LYS F 2 147 ? 44.165 53.660 6.355 1.00 92.97 ? 147 LYS F CB 1 ATOM 11375 C CG . LYS F 2 147 ? 45.568 54.195 6.038 1.00 107.00 ? 147 LYS F CG 1 ATOM 11376 C CD . LYS F 2 147 ? 46.650 53.530 6.889 1.00 114.58 ? 147 LYS F CD 1 ATOM 11377 C CE . LYS F 2 147 ? 47.611 54.571 7.444 1.00 120.51 ? 147 LYS F CE 1 ATOM 11378 N NZ . LYS F 2 147 ? 48.942 53.998 7.775 1.00 131.28 ? 147 LYS F NZ 1 ATOM 11379 N N . CYS F 2 148 ? 41.327 54.855 7.482 1.00 83.90 ? 148 CYS F N 1 ATOM 11380 C CA . CYS F 2 148 ? 40.065 54.658 8.207 1.00 80.92 ? 148 CYS F CA 1 ATOM 11381 C C . CYS F 2 148 ? 38.917 54.992 7.257 1.00 78.40 ? 148 CYS F C 1 ATOM 11382 O O . CYS F 2 148 ? 38.025 54.189 7.067 1.00 71.57 ? 148 CYS F O 1 ATOM 11383 C CB . CYS F 2 148 ? 40.006 55.534 9.476 1.00 81.59 ? 148 CYS F CB 1 ATOM 11384 S SG . CYS F 2 148 ? 38.365 55.681 10.282 1.00 76.22 ? 148 CYS F SG 1 ATOM 11385 N N . MET F 2 149 ? 38.980 56.189 6.680 1.00 78.55 ? 149 MET F N 1 ATOM 11386 C CA . MET F 2 149 ? 38.099 56.613 5.606 1.00 84.27 ? 149 MET F CA 1 ATOM 11387 C C . MET F 2 149 ? 37.945 55.532 4.506 1.00 87.25 ? 149 MET F C 1 ATOM 11388 O O . MET F 2 149 ? 36.835 55.068 4.215 1.00 85.04 ? 149 MET F O 1 ATOM 11389 C CB . MET F 2 149 ? 38.626 57.931 4.990 1.00 88.62 ? 149 MET F CB 1 ATOM 11390 C CG . MET F 2 149 ? 38.206 59.243 5.659 1.00 88.58 ? 149 MET F CG 1 ATOM 11391 S SD . MET F 2 149 ? 36.774 59.198 6.749 1.00 94.64 ? 149 MET F SD 1 ATOM 11392 C CE . MET F 2 149 ? 36.573 60.909 7.220 1.00 95.84 ? 149 MET F CE 1 ATOM 11393 N N . GLU F 2 150 ? 39.047 55.122 3.892 1.00 90.32 ? 150 GLU F N 1 ATOM 11394 C CA . GLU F 2 150 ? 38.993 54.022 2.909 1.00 89.28 ? 150 GLU F CA 1 ATOM 11395 C C . GLU F 2 150 ? 38.251 52.787 3.448 1.00 81.63 ? 150 GLU F C 1 ATOM 11396 O O . GLU F 2 150 ? 37.558 52.112 2.705 1.00 86.98 ? 150 GLU F O 1 ATOM 11397 C CB . GLU F 2 150 ? 40.407 53.637 2.433 1.00 94.17 ? 150 GLU F CB 1 ATOM 11398 C CG . GLU F 2 150 ? 40.515 52.351 1.583 1.00 103.70 ? 150 GLU F CG 1 ATOM 11399 C CD . GLU F 2 150 ? 39.656 52.261 0.317 1.00 109.94 ? 150 GLU F CD 1 ATOM 11400 O OE1 . GLU F 2 150 ? 39.736 51.199 -0.335 1.00 118.31 ? 150 GLU F OE1 1 ATOM 11401 O OE2 . GLU F 2 150 ? 38.877 53.170 -0.025 1.00 106.58 ? 150 GLU F OE2 1 ATOM 11402 N N . SER F 2 151 ? 38.408 52.486 4.728 1.00 73.61 ? 151 SER F N 1 ATOM 11403 C CA . SER F 2 151 ? 37.799 51.288 5.312 1.00 71.01 ? 151 SER F CA 1 ATOM 11404 C C . SER F 2 151 ? 36.276 51.365 5.364 1.00 73.82 ? 151 SER F C 1 ATOM 11405 O O . SER F 2 151 ? 35.610 50.378 5.082 1.00 74.14 ? 151 SER F O 1 ATOM 11406 C CB . SER F 2 151 ? 38.375 50.965 6.708 1.00 70.13 ? 151 SER F CB 1 ATOM 11407 O OG . SER F 2 151 ? 37.944 51.854 7.741 1.00 61.95 ? 151 SER F OG 1 ATOM 11408 N N . VAL F 2 152 ? 35.714 52.519 5.714 1.00 73.92 ? 152 VAL F N 1 ATOM 11409 C CA . VAL F 2 152 ? 34.247 52.634 5.692 1.00 82.76 ? 152 VAL F CA 1 ATOM 11410 C C . VAL F 2 152 ? 33.728 52.463 4.268 1.00 81.55 ? 152 VAL F C 1 ATOM 11411 O O . VAL F 2 152 ? 32.668 51.896 4.071 1.00 73.11 ? 152 VAL F O 1 ATOM 11412 C CB . VAL F 2 152 ? 33.669 53.968 6.243 1.00 88.83 ? 152 VAL F CB 1 ATOM 11413 C CG1 . VAL F 2 152 ? 33.430 53.882 7.728 1.00 94.97 ? 152 VAL F CG1 1 ATOM 11414 C CG2 . VAL F 2 152 ? 34.542 55.162 5.921 1.00 89.09 ? 152 VAL F CG2 1 ATOM 11415 N N . ARG F 2 153 ? 34.486 52.986 3.301 1.00 84.11 ? 153 ARG F N 1 ATOM 11416 C CA . ARG F 2 153 ? 34.134 52.926 1.885 1.00 80.54 ? 153 ARG F CA 1 ATOM 11417 C C . ARG F 2 153 ? 34.032 51.495 1.347 1.00 76.85 ? 153 ARG F C 1 ATOM 11418 O O . ARG F 2 153 ? 33.090 51.207 0.625 1.00 77.76 ? 153 ARG F O 1 ATOM 11419 C CB . ARG F 2 153 ? 35.107 53.751 1.047 1.00 81.89 ? 153 ARG F CB 1 ATOM 11420 C CG . ARG F 2 153 ? 34.894 55.247 1.160 1.00 83.42 ? 153 ARG F CG 1 ATOM 11421 C CD . ARG F 2 153 ? 35.664 56.001 0.086 1.00 90.89 ? 153 ARG F CD 1 ATOM 11422 N NE . ARG F 2 153 ? 36.496 57.058 0.671 1.00 107.27 ? 153 ARG F NE 1 ATOM 11423 C CZ . ARG F 2 153 ? 37.826 57.017 0.778 1.00 117.52 ? 153 ARG F CZ 1 ATOM 11424 N NH1 . ARG F 2 153 ? 38.521 55.976 0.318 1.00 126.63 ? 153 ARG F NH1 1 ATOM 11425 N NH2 . ARG F 2 153 ? 38.479 58.032 1.336 1.00 121.38 ? 153 ARG F NH2 1 ATOM 11426 N N . ASN F 2 154 ? 34.961 50.606 1.694 1.00 78.40 ? 154 ASN F N 1 ATOM 11427 C CA . ASN F 2 154 ? 34.892 49.201 1.212 1.00 82.21 ? 154 ASN F CA 1 ATOM 11428 C C . ASN F 2 154 ? 34.247 48.231 2.213 1.00 76.48 ? 154 ASN F C 1 ATOM 11429 O O . ASN F 2 154 ? 34.435 47.024 2.148 1.00 82.56 ? 154 ASN F O 1 ATOM 11430 C CB . ASN F 2 154 ? 36.256 48.685 0.679 1.00 88.40 ? 154 ASN F CB 1 ATOM 11431 C CG . ASN F 2 154 ? 37.384 48.766 1.700 1.00 91.55 ? 154 ASN F CG 1 ATOM 11432 O OD1 . ASN F 2 154 ? 37.147 48.927 2.892 1.00 92.16 ? 154 ASN F OD1 1 ATOM 11433 N ND2 . ASN F 2 154 ? 38.629 48.650 1.218 1.00 94.76 ? 154 ASN F ND2 1 ATOM 11434 N N . GLY F 2 155 ? 33.498 48.778 3.155 1.00 73.62 ? 155 GLY F N 1 ATOM 11435 C CA . GLY F 2 155 ? 32.719 47.965 4.084 1.00 74.46 ? 155 GLY F CA 1 ATOM 11436 C C . GLY F 2 155 ? 33.476 47.191 5.165 1.00 82.05 ? 155 GLY F C 1 ATOM 11437 O O . GLY F 2 155 ? 32.877 46.325 5.800 1.00 77.32 ? 155 GLY F O 1 ATOM 11438 N N . THR F 2 156 ? 34.747 47.542 5.425 1.00 86.09 ? 156 THR F N 1 ATOM 11439 C CA . THR F 2 156 ? 35.585 46.828 6.411 1.00 90.88 ? 156 THR F CA 1 ATOM 11440 C C . THR F 2 156 ? 35.876 47.592 7.709 1.00 93.10 ? 156 THR F C 1 ATOM 11441 O O . THR F 2 156 ? 36.552 47.065 8.608 1.00 81.68 ? 156 THR F O 1 ATOM 11442 C CB . THR F 2 156 ? 36.952 46.396 5.819 1.00 94.09 ? 156 THR F CB 1 ATOM 11443 O OG1 . THR F 2 156 ? 37.666 47.546 5.330 1.00 97.67 ? 156 THR F OG1 1 ATOM 11444 C CG2 . THR F 2 156 ? 36.769 45.350 4.716 1.00 91.98 ? 156 THR F CG2 1 ATOM 11445 N N . TYR F 2 157 ? 35.403 48.830 7.804 1.00 94.22 ? 157 TYR F N 1 ATOM 11446 C CA . TYR F 2 157 ? 35.561 49.635 9.029 1.00 93.36 ? 157 TYR F CA 1 ATOM 11447 C C . TYR F 2 157 ? 35.316 48.797 10.257 1.00 91.67 ? 157 TYR F C 1 ATOM 11448 O O . TYR F 2 157 ? 34.317 48.115 10.359 1.00 77.81 ? 157 TYR F O 1 ATOM 11449 C CB . TYR F 2 157 ? 34.580 50.790 9.035 1.00 87.97 ? 157 TYR F CB 1 ATOM 11450 C CG . TYR F 2 157 ? 34.464 51.538 10.341 1.00 87.53 ? 157 TYR F CG 1 ATOM 11451 C CD1 . TYR F 2 157 ? 35.249 52.663 10.597 1.00 92.64 ? 157 TYR F CD1 1 ATOM 11452 C CD2 . TYR F 2 157 ? 33.548 51.152 11.310 1.00 85.54 ? 157 TYR F CD2 1 ATOM 11453 C CE1 . TYR F 2 157 ? 35.130 53.377 11.778 1.00 87.69 ? 157 TYR F CE1 1 ATOM 11454 C CE2 . TYR F 2 157 ? 33.421 51.857 12.496 1.00 82.44 ? 157 TYR F CE2 1 ATOM 11455 C CZ . TYR F 2 157 ? 34.218 52.965 12.727 1.00 85.13 ? 157 TYR F CZ 1 ATOM 11456 O OH . TYR F 2 157 ? 34.120 53.680 13.898 1.00 84.31 ? 157 TYR F OH 1 ATOM 11457 N N . ASP F 2 158 ? 36.247 48.836 11.197 1.00 105.86 ? 158 ASP F N 1 ATOM 11458 C CA . ASP F 2 158 ? 36.106 47.964 12.355 1.00 109.49 ? 158 ASP F CA 1 ATOM 11459 C C . ASP F 2 158 ? 35.796 48.778 13.632 1.00 105.34 ? 158 ASP F C 1 ATOM 11460 O O . ASP F 2 158 ? 36.545 49.677 14.039 1.00 96.52 ? 158 ASP F O 1 ATOM 11461 C CB . ASP F 2 158 ? 37.218 46.878 12.398 1.00 113.63 ? 158 ASP F CB 1 ATOM 11462 C CG . ASP F 2 158 ? 38.263 47.121 13.433 1.00 111.68 ? 158 ASP F CG 1 ATOM 11463 O OD1 . ASP F 2 158 ? 39.268 47.771 13.095 1.00 115.97 ? 158 ASP F OD1 1 ATOM 11464 O OD2 . ASP F 2 158 ? 38.100 46.606 14.568 1.00 107.19 ? 158 ASP F OD2 1 ATOM 11465 N N . TYR F 2 159 ? 34.592 48.519 14.149 1.00 103.92 ? 159 TYR F N 1 ATOM 11466 C CA . TYR F 2 159 ? 33.959 49.281 15.232 1.00 101.73 ? 159 TYR F CA 1 ATOM 11467 C C . TYR F 2 159 ? 34.693 49.191 16.576 1.00 99.81 ? 159 TYR F C 1 ATOM 11468 O O . TYR F 2 159 ? 34.905 50.218 17.199 1.00 100.71 ? 159 TYR F O 1 ATOM 11469 C CB . TYR F 2 159 ? 32.496 48.829 15.387 1.00 101.00 ? 159 TYR F CB 1 ATOM 11470 C CG . TYR F 2 159 ? 31.729 49.421 16.546 1.00 102.98 ? 159 TYR F CG 1 ATOM 11471 C CD1 . TYR F 2 159 ? 31.284 50.732 16.492 1.00 104.52 ? 159 TYR F CD1 1 ATOM 11472 C CD2 . TYR F 2 159 ? 31.414 48.659 17.686 1.00 105.02 ? 159 TYR F CD2 1 ATOM 11473 C CE1 . TYR F 2 159 ? 30.568 51.285 17.540 1.00 101.46 ? 159 TYR F CE1 1 ATOM 11474 C CE2 . TYR F 2 159 ? 30.690 49.204 18.740 1.00 103.73 ? 159 TYR F CE2 1 ATOM 11475 C CZ . TYR F 2 159 ? 30.271 50.519 18.652 1.00 100.15 ? 159 TYR F CZ 1 ATOM 11476 O OH . TYR F 2 159 ? 29.561 51.081 19.662 1.00 91.76 ? 159 TYR F OH 1 ATOM 11477 N N . PRO F 2 160 ? 35.081 47.978 17.025 1.00 87.67 ? 160 PRO F N 1 ATOM 11478 C CA . PRO F 2 160 ? 35.908 47.876 18.239 1.00 89.68 ? 160 PRO F CA 1 ATOM 11479 C C . PRO F 2 160 ? 37.138 48.825 18.287 1.00 86.02 ? 160 PRO F C 1 ATOM 11480 O O . PRO F 2 160 ? 37.281 49.589 19.225 1.00 79.55 ? 160 PRO F O 1 ATOM 11481 C CB . PRO F 2 160 ? 36.380 46.413 18.238 1.00 91.37 ? 160 PRO F CB 1 ATOM 11482 C CG . PRO F 2 160 ? 35.591 45.707 17.193 1.00 88.53 ? 160 PRO F CG 1 ATOM 11483 C CD . PRO F 2 160 ? 34.669 46.662 16.518 1.00 83.41 ? 160 PRO F CD 1 ATOM 11484 N N . GLN F 2 161 ? 37.993 48.774 17.274 1.00 82.67 ? 161 GLN F N 1 ATOM 11485 C CA . GLN F 2 161 ? 39.160 49.661 17.177 1.00 90.03 ? 161 GLN F CA 1 ATOM 11486 C C . GLN F 2 161 ? 38.971 51.081 17.710 1.00 87.08 ? 161 GLN F C 1 ATOM 11487 O O . GLN F 2 161 ? 39.894 51.646 18.313 1.00 83.50 ? 161 GLN F O 1 ATOM 11488 C CB . GLN F 2 161 ? 39.638 49.759 15.733 1.00 97.95 ? 161 GLN F CB 1 ATOM 11489 C CG . GLN F 2 161 ? 41.033 49.207 15.488 1.00 104.93 ? 161 GLN F CG 1 ATOM 11490 C CD . GLN F 2 161 ? 42.026 50.312 15.193 1.00 113.75 ? 161 GLN F CD 1 ATOM 11491 O OE1 . GLN F 2 161 ? 41.953 50.944 14.142 1.00 115.73 ? 161 GLN F OE1 1 ATOM 11492 N NE2 . GLN F 2 161 ? 42.965 50.544 16.111 1.00 112.25 ? 161 GLN F NE2 1 ATOM 11493 N N . TYR F 2 162 ? 37.785 51.652 17.528 1.00 79.92 ? 162 TYR F N 1 ATOM 11494 C CA . TYR F 2 162 ? 37.556 53.056 17.919 1.00 77.25 ? 162 TYR F CA 1 ATOM 11495 C C . TYR F 2 162 ? 36.544 53.303 19.050 1.00 74.60 ? 162 TYR F C 1 ATOM 11496 O O . TYR F 2 162 ? 36.377 54.452 19.466 1.00 75.13 ? 162 TYR F O 1 ATOM 11497 C CB . TYR F 2 162 ? 37.135 53.858 16.688 1.00 78.69 ? 162 TYR F CB 1 ATOM 11498 C CG . TYR F 2 162 ? 38.108 53.769 15.572 1.00 78.28 ? 162 TYR F CG 1 ATOM 11499 C CD1 . TYR F 2 162 ? 37.999 52.769 14.617 1.00 81.15 ? 162 TYR F CD1 1 ATOM 11500 C CD2 . TYR F 2 162 ? 39.185 54.667 15.492 1.00 83.53 ? 162 TYR F CD2 1 ATOM 11501 C CE1 . TYR F 2 162 ? 38.921 52.677 13.590 1.00 85.76 ? 162 TYR F CE1 1 ATOM 11502 C CE2 . TYR F 2 162 ? 40.111 54.588 14.478 1.00 84.95 ? 162 TYR F CE2 1 ATOM 11503 C CZ . TYR F 2 162 ? 39.979 53.589 13.530 1.00 89.93 ? 162 TYR F CZ 1 ATOM 11504 O OH . TYR F 2 162 ? 40.888 53.498 12.501 1.00 94.44 ? 162 TYR F OH 1 ATOM 11505 N N . SER F 2 163 ? 35.872 52.255 19.548 1.00 78.29 ? 163 SER F N 1 ATOM 11506 C CA . SER F 2 163 ? 34.664 52.434 20.412 1.00 81.39 ? 163 SER F CA 1 ATOM 11507 C C . SER F 2 163 ? 34.987 53.364 21.543 1.00 82.67 ? 163 SER F C 1 ATOM 11508 O O . SER F 2 163 ? 34.230 54.266 21.856 1.00 81.14 ? 163 SER F O 1 ATOM 11509 C CB . SER F 2 163 ? 34.113 51.114 21.005 1.00 84.02 ? 163 SER F CB 1 ATOM 11510 O OG . SER F 2 163 ? 35.112 50.117 21.070 1.00 87.92 ? 163 SER F OG 1 ATOM 11511 N N . GLU F 2 164 ? 36.124 53.101 22.168 1.00 86.13 ? 164 GLU F N 1 ATOM 11512 C CA . GLU F 2 164 ? 36.443 53.700 23.437 1.00 82.00 ? 164 GLU F CA 1 ATOM 11513 C C . GLU F 2 164 ? 36.905 55.132 23.317 1.00 75.21 ? 164 GLU F C 1 ATOM 11514 O O . GLU F 2 164 ? 36.372 55.968 24.042 1.00 73.00 ? 164 GLU F O 1 ATOM 11515 C CB . GLU F 2 164 ? 37.344 52.776 24.240 1.00 85.18 ? 164 GLU F CB 1 ATOM 11516 C CG . GLU F 2 164 ? 36.432 51.797 25.042 1.00 90.37 ? 164 GLU F CG 1 ATOM 11517 C CD . GLU F 2 164 ? 35.935 50.556 24.282 1.00 99.26 ? 164 GLU F CD 1 ATOM 11518 O OE1 . GLU F 2 164 ? 36.766 49.652 24.065 1.00 111.60 ? 164 GLU F OE1 1 ATOM 11519 O OE2 . GLU F 2 164 ? 34.717 50.430 23.946 1.00 95.68 ? 164 GLU F OE2 1 ATOM 11520 N N . GLU F 2 165 ? 37.779 55.450 22.364 1.00 69.32 ? 165 GLU F N 1 ATOM 11521 C CA . GLU F 2 165 ? 38.042 56.861 22.036 1.00 70.33 ? 165 GLU F CA 1 ATOM 11522 C C . GLU F 2 165 ? 36.749 57.684 21.723 1.00 87.29 ? 165 GLU F C 1 ATOM 11523 O O . GLU F 2 165 ? 36.641 58.883 22.072 1.00 93.32 ? 165 GLU F O 1 ATOM 11524 C CB . GLU F 2 165 ? 38.984 56.938 20.859 1.00 65.52 ? 165 GLU F CB 1 ATOM 11525 C CG . GLU F 2 165 ? 39.288 58.352 20.408 1.00 65.39 ? 165 GLU F CG 1 ATOM 11526 C CD . GLU F 2 165 ? 40.194 58.389 19.205 1.00 74.65 ? 165 GLU F CD 1 ATOM 11527 O OE1 . GLU F 2 165 ? 40.614 57.305 18.713 1.00 86.15 ? 165 GLU F OE1 1 ATOM 11528 O OE2 . GLU F 2 165 ? 40.466 59.502 18.715 1.00 79.81 ? 165 GLU F OE2 1 ATOM 11529 N N . ALA F 2 166 ? 35.763 57.015 21.107 1.00 95.17 ? 166 ALA F N 1 ATOM 11530 C CA . ALA F 2 166 ? 34.435 57.591 20.850 1.00 94.12 ? 166 ALA F CA 1 ATOM 11531 C C . ALA F 2 166 ? 33.540 57.571 22.099 1.00 89.40 ? 166 ALA F C 1 ATOM 11532 O O . ALA F 2 166 ? 32.952 58.589 22.443 1.00 92.07 ? 166 ALA F O 1 ATOM 11533 C CB . ALA F 2 166 ? 33.742 56.858 19.705 1.00 92.26 ? 166 ALA F CB 1 ATOM 11534 N N . ARG F 2 167 ? 33.422 56.410 22.753 1.00 90.28 ? 167 ARG F N 1 ATOM 11535 C CA . ARG F 2 167 ? 32.638 56.257 23.996 1.00 97.57 ? 167 ARG F CA 1 ATOM 11536 C C . ARG F 2 167 ? 32.979 57.289 25.050 1.00 100.74 ? 167 ARG F C 1 ATOM 11537 O O . ARG F 2 167 ? 32.169 57.526 25.941 1.00 107.51 ? 167 ARG F O 1 ATOM 11538 C CB . ARG F 2 167 ? 32.745 54.856 24.640 1.00 103.32 ? 167 ARG F CB 1 ATOM 11539 C CG . ARG F 2 167 ? 31.486 54.478 25.423 1.00 109.40 ? 167 ARG F CG 1 ATOM 11540 C CD . ARG F 2 167 ? 31.691 53.443 26.520 1.00 113.18 ? 167 ARG F CD 1 ATOM 11541 N NE . ARG F 2 167 ? 32.908 53.710 27.299 1.00 124.19 ? 167 ARG F NE 1 ATOM 11542 C CZ . ARG F 2 167 ? 33.969 52.898 27.420 1.00 127.51 ? 167 ARG F CZ 1 ATOM 11543 N NH1 . ARG F 2 167 ? 33.994 51.697 26.839 1.00 121.04 ? 167 ARG F NH1 1 ATOM 11544 N NH2 . ARG F 2 167 ? 35.017 53.288 28.158 1.00 127.01 ? 167 ARG F NH2 1 ATOM 11545 N N . LEU F 2 168 ? 34.163 57.895 24.969 1.00 104.15 ? 168 LEU F N 1 ATOM 11546 C CA . LEU F 2 168 ? 34.548 58.853 25.966 1.00 117.35 ? 168 LEU F CA 1 ATOM 11547 C C . LEU F 2 168 ? 34.530 60.311 25.463 1.00 114.59 ? 168 LEU F C 1 ATOM 11548 O O . LEU F 2 168 ? 34.292 61.227 26.266 1.00 114.70 ? 168 LEU F O 1 ATOM 11549 C CB . LEU F 2 168 ? 35.879 58.403 26.620 1.00 131.45 ? 168 LEU F CB 1 ATOM 11550 C CG . LEU F 2 168 ? 35.924 57.203 27.628 1.00 135.08 ? 168 LEU F CG 1 ATOM 11551 C CD1 . LEU F 2 168 ? 34.637 57.057 28.436 1.00 137.84 ? 168 LEU F CD1 1 ATOM 11552 C CD2 . LEU F 2 168 ? 36.306 55.853 27.019 1.00 128.73 ? 168 LEU F CD2 1 ATOM 11553 N N . LYS F 2 169 ? 34.714 60.536 24.157 1.00 102.85 ? 169 LYS F N 1 ATOM 11554 C CA . LYS F 2 169 ? 34.362 61.842 23.527 1.00 100.89 ? 169 LYS F CA 1 ATOM 11555 C C . LYS F 2 169 ? 32.812 62.056 23.419 1.00 99.56 ? 169 LYS F C 1 ATOM 11556 O O . LYS F 2 169 ? 32.326 63.188 23.220 1.00 94.00 ? 169 LYS F O 1 ATOM 11557 C CB . LYS F 2 169 ? 35.055 61.975 22.157 1.00 93.26 ? 169 LYS F CB 1 ATOM 11558 C CG . LYS F 2 169 ? 34.602 63.123 21.243 1.00 94.08 ? 169 LYS F CG 1 ATOM 11559 C CD . LYS F 2 169 ? 34.843 64.512 21.809 1.00 97.80 ? 169 LYS F CD 1 ATOM 11560 C CE . LYS F 2 169 ? 35.228 65.516 20.728 1.00 97.15 ? 169 LYS F CE 1 ATOM 11561 N NZ . LYS F 2 169 ? 36.658 65.362 20.328 1.00 96.43 ? 169 LYS F NZ 1 ATOM 11562 N N . ARG F 2 170 ? 32.047 60.978 23.581 1.00 101.22 ? 170 ARG F N 1 ATOM 11563 C CA . ARG F 2 170 ? 30.583 61.053 23.515 1.00 109.87 ? 170 ARG F CA 1 ATOM 11564 C C . ARG F 2 170 ? 30.025 61.439 24.871 1.00 116.40 ? 170 ARG F C 1 ATOM 11565 O O . ARG F 2 170 ? 29.196 62.340 24.969 1.00 121.11 ? 170 ARG F O 1 ATOM 11566 C CB . ARG F 2 170 ? 29.955 59.723 23.098 1.00 103.16 ? 170 ARG F CB 1 ATOM 11567 C CG . ARG F 2 170 ? 28.504 59.865 22.648 1.00 99.76 ? 170 ARG F CG 1 ATOM 11568 C CD . ARG F 2 170 ? 27.788 58.522 22.608 1.00 94.96 ? 170 ARG F CD 1 ATOM 11569 N NE . ARG F 2 170 ? 28.605 57.517 21.918 1.00 87.93 ? 170 ARG F NE 1 ATOM 11570 C CZ . ARG F 2 170 ? 29.033 56.369 22.444 1.00 84.28 ? 170 ARG F CZ 1 ATOM 11571 N NH1 . ARG F 2 170 ? 28.715 56.015 23.685 1.00 84.59 ? 170 ARG F NH1 1 ATOM 11572 N NH2 . ARG F 2 170 ? 29.782 55.554 21.717 1.00 88.48 ? 170 ARG F NH2 1 ATOM 11573 N N . GLU F 2 171 ? 30.481 60.748 25.915 1.00 124.54 ? 171 GLU F N 1 ATOM 11574 C CA . GLU F 2 171 ? 30.053 61.056 27.283 1.00 131.34 ? 171 GLU F CA 1 ATOM 11575 C C . GLU F 2 171 ? 30.773 62.313 27.863 1.00 133.72 ? 171 GLU F C 1 ATOM 11576 O O . GLU F 2 171 ? 30.596 62.653 29.034 1.00 145.38 ? 171 GLU F O 1 ATOM 11577 C CB . GLU F 2 171 ? 30.166 59.817 28.184 1.00 130.66 ? 171 GLU F CB 1 ATOM 11578 C CG . GLU F 2 171 ? 29.454 58.591 27.633 1.00 130.27 ? 171 GLU F CG 1 ATOM 11579 C CD . GLU F 2 171 ? 29.598 57.374 28.528 1.00 131.71 ? 171 GLU F CD 1 ATOM 11580 O OE1 . GLU F 2 171 ? 28.636 56.588 28.618 1.00 134.95 ? 171 GLU F OE1 1 ATOM 11581 O OE2 . GLU F 2 171 ? 30.657 57.200 29.165 1.00 130.94 ? 171 GLU F OE2 1 ATOM 11582 N N . GLU F 2 172 ? 31.573 62.989 27.028 1.00 123.77 ? 172 GLU F N 1 ATOM 11583 C CA . GLU F 2 172 ? 32.032 64.372 27.239 1.00 123.46 ? 172 GLU F CA 1 ATOM 11584 C C . GLU F 2 172 ? 31.003 65.466 26.861 1.00 129.59 ? 172 GLU F C 1 ATOM 11585 O O . GLU F 2 172 ? 31.244 66.638 27.104 1.00 123.14 ? 172 GLU F O 1 ATOM 11586 C CB . GLU F 2 172 ? 33.302 64.567 26.401 1.00 129.09 ? 172 GLU F CB 1 ATOM 11587 C CG . GLU F 2 172 ? 34.103 65.841 26.620 1.00 130.53 ? 172 GLU F CG 1 ATOM 11588 C CD . GLU F 2 172 ? 34.917 66.177 25.384 1.00 127.79 ? 172 GLU F CD 1 ATOM 11589 O OE1 . GLU F 2 172 ? 36.061 65.701 25.277 1.00 121.07 ? 172 GLU F OE1 1 ATOM 11590 O OE2 . GLU F 2 172 ? 34.390 66.869 24.492 1.00 126.77 ? 172 GLU F OE2 1 ATOM 11591 N N . ILE F 2 173 ? 29.891 65.089 26.221 1.00 144.05 ? 173 ILE F N 1 ATOM 11592 C CA . ILE F 2 173 ? 28.811 66.016 25.812 1.00 141.32 ? 173 ILE F CA 1 ATOM 11593 C C . ILE F 2 173 ? 27.418 65.417 26.091 1.00 129.75 ? 173 ILE F C 1 ATOM 11594 O O . ILE F 2 173 ? 27.085 65.032 27.218 1.00 124.54 ? 173 ILE F O 1 ATOM 11595 C CB . ILE F 2 173 ? 28.908 66.349 24.288 1.00 140.53 ? 173 ILE F CB 1 ATOM 11596 C CG1 . ILE F 2 173 ? 30.325 66.069 23.724 1.00 133.53 ? 173 ILE F CG1 1 ATOM 11597 C CG2 . ILE F 2 173 ? 28.479 67.790 24.031 1.00 142.34 ? 173 ILE F CG2 1 ATOM 11598 C CD1 . ILE F 2 173 ? 30.383 65.886 22.220 1.00 122.38 ? 173 ILE F CD1 1 HETATM 11599 C C1 . NAG G 3 . ? 19.046 35.364 -21.980 1.00 99.62 ? 401 NAG A C1 1 HETATM 11600 C C2 . NAG G 3 . ? 20.161 35.560 -23.014 1.00 113.08 ? 401 NAG A C2 1 HETATM 11601 C C3 . NAG G 3 . ? 19.880 34.836 -24.361 1.00 112.51 ? 401 NAG A C3 1 HETATM 11602 C C4 . NAG G 3 . ? 19.521 33.376 -24.080 1.00 108.46 ? 401 NAG A C4 1 HETATM 11603 C C5 . NAG G 3 . ? 18.245 33.443 -23.224 1.00 106.06 ? 401 NAG A C5 1 HETATM 11604 C C6 . NAG G 3 . ? 17.522 32.099 -23.065 1.00 103.74 ? 401 NAG A C6 1 HETATM 11605 C C7 . NAG G 3 . ? 21.181 37.737 -22.458 1.00 109.41 ? 401 NAG A C7 1 HETATM 11606 C C8 . NAG G 3 . ? 21.195 39.210 -22.781 1.00 108.42 ? 401 NAG A C8 1 HETATM 11607 N N2 . NAG G 3 . ? 20.325 37.000 -23.179 1.00 111.93 ? 401 NAG A N2 1 HETATM 11608 O O3 . NAG G 3 . ? 20.953 34.889 -25.286 1.00 117.13 ? 401 NAG A O3 1 HETATM 11609 O O4 . NAG G 3 . ? 19.432 32.585 -25.267 1.00 100.31 ? 401 NAG A O4 1 HETATM 11610 O O5 . NAG G 3 . ? 18.606 34.009 -21.963 1.00 103.64 ? 401 NAG A O5 1 HETATM 11611 O O6 . NAG G 3 . ? 18.049 31.404 -21.946 1.00 105.65 ? 401 NAG A O6 1 HETATM 11612 O O7 . NAG G 3 . ? 21.927 37.275 -21.585 1.00 97.83 ? 401 NAG A O7 1 HETATM 11613 C C1 . FUC H 4 . ? 18.241 29.976 -22.156 1.00 116.01 ? 402 FUC A C1 1 HETATM 11614 C C2 . FUC H 4 . ? 19.721 29.598 -22.364 1.00 116.67 ? 402 FUC A C2 1 HETATM 11615 C C3 . FUC H 4 . ? 20.471 30.115 -21.130 1.00 115.74 ? 402 FUC A C3 1 HETATM 11616 C C4 . FUC H 4 . ? 19.900 29.414 -19.888 1.00 112.37 ? 402 FUC A C4 1 HETATM 11617 C C5 . FUC H 4 . ? 18.365 29.511 -19.786 1.00 106.28 ? 402 FUC A C5 1 HETATM 11618 C C6 . FUC H 4 . ? 17.758 28.606 -18.700 1.00 95.30 ? 402 FUC A C6 1 HETATM 11619 O O2 . FUC H 4 . ? 20.282 30.028 -23.603 1.00 113.93 ? 402 FUC A O2 1 HETATM 11620 O O3 . FUC H 4 . ? 21.869 29.926 -21.238 1.00 115.27 ? 402 FUC A O3 1 HETATM 11621 O O4 . FUC H 4 . ? 20.300 28.061 -19.926 1.00 116.16 ? 402 FUC A O4 1 HETATM 11622 O O5 . FUC H 4 . ? 17.760 29.226 -21.045 1.00 113.02 ? 402 FUC A O5 1 HETATM 11623 C C1 . NAG I 3 . ? -48.905 38.254 -52.383 1.00 54.85 ? 403 NAG A C1 1 HETATM 11624 C C2 . NAG I 3 . ? -49.330 39.652 -52.827 1.00 57.23 ? 403 NAG A C2 1 HETATM 11625 C C3 . NAG I 3 . ? -49.914 40.344 -51.600 1.00 69.59 ? 403 NAG A C3 1 HETATM 11626 C C4 . NAG I 3 . ? -51.093 39.501 -51.085 1.00 78.75 ? 403 NAG A C4 1 HETATM 11627 C C5 . NAG I 3 . ? -50.633 38.054 -50.800 1.00 82.78 ? 403 NAG A C5 1 HETATM 11628 C C6 . NAG I 3 . ? -51.747 37.080 -50.416 1.00 91.53 ? 403 NAG A C6 1 HETATM 11629 C C7 . NAG I 3 . ? -47.955 41.119 -54.255 1.00 50.85 ? 403 NAG A C7 1 HETATM 11630 C C8 . NAG I 3 . ? -46.788 42.067 -54.205 1.00 46.25 ? 403 NAG A C8 1 HETATM 11631 N N2 . NAG I 3 . ? -48.233 40.551 -53.076 1.00 54.48 ? 403 NAG A N2 1 HETATM 11632 O O3 . NAG I 3 . ? -50.125 41.759 -51.796 1.00 59.48 ? 403 NAG A O3 1 HETATM 11633 O O4 . NAG I 3 . ? -51.653 40.040 -49.903 1.00 86.16 ? 403 NAG A O4 1 HETATM 11634 O O5 . NAG I 3 . ? -49.995 37.508 -51.931 1.00 65.53 ? 403 NAG A O5 1 HETATM 11635 O O6 . NAG I 3 . ? -52.655 36.980 -51.504 1.00 108.64 ? 403 NAG A O6 1 HETATM 11636 O O7 . NAG I 3 . ? -48.586 40.911 -55.311 1.00 45.87 ? 403 NAG A O7 1 HETATM 11637 C C1 . NAG J 3 . ? -53.059 40.062 -50.122 1.00 98.79 ? 404 NAG A C1 1 HETATM 11638 C C2 . NAG J 3 . ? -53.837 40.224 -48.810 1.00 101.27 ? 404 NAG A C2 1 HETATM 11639 C C3 . NAG J 3 . ? -55.184 40.950 -48.952 1.00 109.49 ? 404 NAG A C3 1 HETATM 11640 C C4 . NAG J 3 . ? -55.326 41.755 -50.254 1.00 114.31 ? 404 NAG A C4 1 HETATM 11641 C C5 . NAG J 3 . ? -54.707 40.951 -51.399 1.00 112.29 ? 404 NAG A C5 1 HETATM 11642 C C6 . NAG J 3 . ? -54.949 41.447 -52.821 1.00 107.85 ? 404 NAG A C6 1 HETATM 11643 C C7 . NAG J 3 . ? -53.436 38.279 -47.360 1.00 98.41 ? 404 NAG A C7 1 HETATM 11644 C C8 . NAG J 3 . ? -53.869 36.877 -46.987 1.00 96.33 ? 404 NAG A C8 1 HETATM 11645 N N2 . NAG J 3 . ? -54.128 38.875 -48.327 1.00 100.86 ? 404 NAG A N2 1 HETATM 11646 O O3 . NAG J 3 . ? -55.416 41.759 -47.812 1.00 108.40 ? 404 NAG A O3 1 HETATM 11647 O O4 . NAG J 3 . ? -56.683 42.046 -50.504 1.00 123.11 ? 404 NAG A O4 1 HETATM 11648 O O5 . NAG J 3 . ? -53.333 41.013 -51.124 1.00 101.89 ? 404 NAG A O5 1 HETATM 11649 O O6 . NAG J 3 . ? -55.141 42.836 -52.825 1.00 98.57 ? 404 NAG A O6 1 HETATM 11650 O O7 . NAG J 3 . ? -52.489 38.840 -46.801 1.00 88.91 ? 404 NAG A O7 1 HETATM 11651 C C1 . FUC K 4 . ? -53.799 36.114 -51.259 1.00 111.99 ? 405 FUC A C1 1 HETATM 11652 C C2 . FUC K 4 . ? -54.724 36.190 -52.477 1.00 112.15 ? 405 FUC A C2 1 HETATM 11653 C C3 . FUC K 4 . ? -54.051 35.559 -53.715 1.00 105.99 ? 405 FUC A C3 1 HETATM 11654 C C4 . FUC K 4 . ? -53.387 34.190 -53.437 1.00 110.23 ? 405 FUC A C4 1 HETATM 11655 C C5 . FUC K 4 . ? -52.723 34.087 -52.038 1.00 116.22 ? 405 FUC A C5 1 HETATM 11656 C C6 . FUC K 4 . ? -52.370 32.653 -51.603 1.00 111.43 ? 405 FUC A C6 1 HETATM 11657 O O2 . FUC K 4 . ? -55.093 37.544 -52.709 1.00 97.54 ? 405 FUC A O2 1 HETATM 11658 O O3 . FUC K 4 . ? -54.962 35.480 -54.794 1.00 91.15 ? 405 FUC A O3 1 HETATM 11659 O O4 . FUC K 4 . ? -54.285 33.125 -53.685 1.00 100.77 ? 405 FUC A O4 1 HETATM 11660 O O5 . FUC K 4 . ? -53.497 34.740 -51.027 1.00 119.71 ? 405 FUC A O5 1 HETATM 11661 C C1 . NAG L 3 . ? -10.283 24.618 -21.532 1.00 91.75 ? 406 NAG A C1 1 HETATM 11662 C C2 . NAG L 3 . ? -11.700 23.979 -21.411 1.00 105.35 ? 406 NAG A C2 1 HETATM 11663 C C3 . NAG L 3 . ? -11.587 22.486 -20.982 1.00 105.03 ? 406 NAG A C3 1 HETATM 11664 C C4 . NAG L 3 . ? -10.442 22.145 -19.987 1.00 109.97 ? 406 NAG A C4 1 HETATM 11665 C C5 . NAG L 3 . ? -9.770 23.447 -19.513 1.00 108.78 ? 406 NAG A C5 1 HETATM 11666 C C6 . NAG L 3 . ? -8.664 23.273 -18.463 1.00 105.30 ? 406 NAG A C6 1 HETATM 11667 C C7 . NAG L 3 . ? -13.518 25.821 -21.005 1.00 107.29 ? 406 NAG A C7 1 HETATM 11668 C C8 . NAG L 3 . ? -14.339 26.480 -19.936 1.00 99.08 ? 406 NAG A C8 1 HETATM 11669 N N2 . NAG L 3 . ? -12.653 24.817 -20.602 1.00 114.39 ? 406 NAG A N2 1 HETATM 11670 O O3 . NAG L 3 . ? -11.383 21.741 -22.163 1.00 102.22 ? 406 NAG A O3 1 HETATM 11671 O O4 . NAG L 3 . ? -10.840 21.318 -18.893 1.00 104.37 ? 406 NAG A O4 1 HETATM 11672 O O5 . NAG L 3 . ? -9.270 24.077 -20.683 1.00 98.04 ? 406 NAG A O5 1 HETATM 11673 O O6 . NAG L 3 . ? -7.480 22.781 -19.040 1.00 95.00 ? 406 NAG A O6 1 HETATM 11674 O O7 . NAG L 3 . ? -13.718 26.278 -22.144 1.00 100.33 ? 406 NAG A O7 1 HETATM 11675 C C1 . NAG M 3 . ? -15.959 45.383 -3.329 1.00 114.36 ? 401 NAG C C1 1 HETATM 11676 C C2 . NAG M 3 . ? -16.167 43.869 -3.323 1.00 126.33 ? 401 NAG C C2 1 HETATM 11677 C C3 . NAG M 3 . ? -17.264 43.527 -4.345 1.00 128.60 ? 401 NAG C C3 1 HETATM 11678 C C4 . NAG M 3 . ? -18.515 44.443 -4.210 1.00 132.46 ? 401 NAG C C4 1 HETATM 11679 C C5 . NAG M 3 . ? -18.216 45.934 -3.873 1.00 131.58 ? 401 NAG C C5 1 HETATM 11680 C C6 . NAG M 3 . ? -19.410 46.729 -3.293 1.00 137.14 ? 401 NAG C C6 1 HETATM 11681 C C7 . NAG M 3 . ? -14.520 42.017 -2.882 1.00 115.33 ? 401 NAG C C7 1 HETATM 11682 C C8 . NAG M 3 . ? -13.101 41.547 -3.074 1.00 103.45 ? 401 NAG C C8 1 HETATM 11683 N N2 . NAG M 3 . ? -14.845 43.207 -3.426 1.00 123.79 ? 401 NAG C N2 1 HETATM 11684 O O3 . NAG M 3 . ? -17.628 42.171 -4.167 1.00 119.33 ? 401 NAG C O3 1 HETATM 11685 O O4 . NAG M 3 . ? -19.315 44.343 -5.384 1.00 116.89 ? 401 NAG C O4 1 HETATM 11686 O O5 . NAG M 3 . ? -17.148 46.051 -2.957 1.00 115.42 ? 401 NAG C O5 1 HETATM 11687 O O6 . NAG M 3 . ? -19.008 47.784 -2.407 1.00 146.27 ? 401 NAG C O6 1 HETATM 11688 O O7 . NAG M 3 . ? -15.319 41.299 -2.270 1.00 114.87 ? 401 NAG C O7 1 HETATM 11689 C C1 . FUC N 4 . ? -20.085 48.712 -2.045 1.00 155.02 ? 402 FUC C C1 1 HETATM 11690 C C2 . FUC N 4 . ? -20.487 48.599 -0.568 1.00 155.31 ? 402 FUC C C2 1 HETATM 11691 C C3 . FUC N 4 . ? -19.482 49.225 0.408 1.00 163.37 ? 402 FUC C C3 1 HETATM 11692 C C4 . FUC N 4 . ? -18.950 50.612 -0.010 1.00 169.60 ? 402 FUC C C4 1 HETATM 11693 C C5 . FUC N 4 . ? -18.965 50.902 -1.534 1.00 172.53 ? 402 FUC C C5 1 HETATM 11694 C C6 . FUC N 4 . ? -19.216 52.392 -1.826 1.00 167.74 ? 402 FUC C C6 1 HETATM 11695 O O2 . FUC N 4 . ? -20.697 47.242 -0.236 1.00 142.74 ? 402 FUC C O2 1 HETATM 11696 O O3 . FUC N 4 . ? -20.066 49.320 1.695 1.00 156.83 ? 402 FUC C O3 1 HETATM 11697 O O4 . FUC N 4 . ? -19.561 51.655 0.749 1.00 148.57 ? 402 FUC C O4 1 HETATM 11698 O O5 . FUC N 4 . ? -19.842 50.092 -2.339 1.00 166.37 ? 402 FUC C O5 1 HETATM 11699 C C1 . NAG O 3 . ? -21.229 80.381 -68.347 1.00 76.61 ? 403 NAG C C1 1 HETATM 11700 C C2 . NAG O 3 . ? -20.311 80.127 -69.514 1.00 78.77 ? 403 NAG C C2 1 HETATM 11701 C C3 . NAG O 3 . ? -19.015 80.937 -69.354 1.00 85.97 ? 403 NAG C C3 1 HETATM 11702 C C4 . NAG O 3 . ? -19.342 82.424 -69.167 1.00 92.01 ? 403 NAG C C4 1 HETATM 11703 C C5 . NAG O 3 . ? -20.317 82.597 -67.986 1.00 98.01 ? 403 NAG C C5 1 HETATM 11704 C C6 . NAG O 3 . ? -20.770 84.048 -67.776 1.00 101.97 ? 403 NAG C C6 1 HETATM 11705 C C7 . NAG O 3 . ? -20.274 77.805 -70.330 1.00 77.56 ? 403 NAG C C7 1 HETATM 11706 C C8 . NAG O 3 . ? -19.791 76.420 -69.989 1.00 75.20 ? 403 NAG C C8 1 HETATM 11707 N N2 . NAG O 3 . ? -19.984 78.729 -69.425 1.00 81.63 ? 403 NAG C N2 1 HETATM 11708 O O3 . NAG O 3 . ? -18.090 80.654 -70.411 1.00 79.48 ? 403 NAG C O3 1 HETATM 11709 O O4 . NAG O 3 . ? -18.163 83.157 -68.886 1.00 100.80 ? 403 NAG C O4 1 HETATM 11710 O O5 . NAG O 3 . ? -21.454 81.747 -68.045 1.00 80.22 ? 403 NAG C O5 1 HETATM 11711 O O6 . NAG O 3 . ? -21.474 84.471 -68.921 1.00 111.97 ? 403 NAG C O6 1 HETATM 11712 O O7 . NAG O 3 . ? -20.899 78.038 -71.364 1.00 74.34 ? 403 NAG C O7 1 HETATM 11713 C C1 . NAG P 3 . ? -17.812 84.067 -69.954 1.00 113.08 ? 404 NAG C C1 1 HETATM 11714 C C2 . NAG P 3 . ? -16.669 84.996 -69.491 1.00 116.63 ? 404 NAG C C2 1 HETATM 11715 C C3 . NAG P 3 . ? -15.853 85.501 -70.692 1.00 124.69 ? 404 NAG C C3 1 HETATM 11716 C C4 . NAG P 3 . ? -15.414 84.398 -71.674 1.00 122.52 ? 404 NAG C C4 1 HETATM 11717 C C5 . NAG P 3 . ? -16.160 83.062 -71.480 1.00 118.89 ? 404 NAG C C5 1 HETATM 11718 C C6 . NAG P 3 . ? -15.461 82.080 -70.494 1.00 112.44 ? 404 NAG C C6 1 HETATM 11719 C C7 . NAG P 3 . ? -17.393 86.191 -67.414 1.00 101.72 ? 404 NAG C C7 1 HETATM 11720 C C8 . NAG P 3 . ? -17.903 87.483 -66.819 1.00 103.36 ? 404 NAG C C8 1 HETATM 11721 N N2 . NAG P 3 . ? -17.159 86.161 -68.738 1.00 109.45 ? 404 NAG C N2 1 HETATM 11722 O O3 . NAG P 3 . ? -14.727 86.232 -70.241 1.00 128.43 ? 404 NAG C O3 1 HETATM 11723 O O4 . NAG P 3 . ? -15.632 84.869 -72.998 1.00 114.95 ? 404 NAG C O4 1 HETATM 11724 O O5 . NAG P 3 . ? -17.524 83.349 -71.159 1.00 117.79 ? 404 NAG C O5 1 HETATM 11725 O O6 . NAG P 3 . ? -15.648 80.696 -70.751 1.00 97.31 ? 404 NAG C O6 1 HETATM 11726 O O7 . NAG P 3 . ? -17.226 85.227 -66.676 1.00 83.96 ? 404 NAG C O7 1 HETATM 11727 C C1 . FUC Q 4 . ? -21.468 85.910 -69.064 1.00 128.13 ? 405 FUC C C1 1 HETATM 11728 C C2 . FUC Q 4 . ? -21.933 86.264 -70.489 1.00 128.32 ? 405 FUC C C2 1 HETATM 11729 C C3 . FUC Q 4 . ? -23.460 86.181 -70.651 1.00 130.52 ? 405 FUC C C3 1 HETATM 11730 C C4 . FUC Q 4 . ? -24.218 86.933 -69.534 1.00 135.05 ? 405 FUC C C4 1 HETATM 11731 C C5 . FUC Q 4 . ? -23.664 86.484 -68.157 1.00 140.91 ? 405 FUC C C5 1 HETATM 11732 C C6 . FUC Q 4 . ? -24.357 87.142 -66.953 1.00 132.46 ? 405 FUC C C6 1 HETATM 11733 O O2 . FUC Q 4 . ? -21.296 85.418 -71.427 1.00 117.27 ? 405 FUC C O2 1 HETATM 11734 O O3 . FUC Q 4 . ? -23.861 86.622 -71.932 1.00 123.08 ? 405 FUC C O3 1 HETATM 11735 O O4 . FUC Q 4 . ? -24.251 88.346 -69.725 1.00 118.57 ? 405 FUC C O4 1 HETATM 11736 O O5 . FUC Q 4 . ? -22.236 86.592 -68.067 1.00 143.26 ? 405 FUC C O5 1 HETATM 11737 C C1 . NAG R 3 . ? -19.313 73.311 -18.956 1.00 89.91 ? 406 NAG C C1 1 HETATM 11738 C C2 . NAG R 3 . ? -19.857 74.681 -19.389 1.00 98.94 ? 406 NAG C C2 1 HETATM 11739 C C3 . NAG R 3 . ? -19.272 75.859 -18.592 1.00 103.88 ? 406 NAG C C3 1 HETATM 11740 C C4 . NAG R 3 . ? -19.202 75.537 -17.096 1.00 105.36 ? 406 NAG C C4 1 HETATM 11741 C C5 . NAG R 3 . ? -18.348 74.256 -17.012 1.00 102.03 ? 406 NAG C C5 1 HETATM 11742 C C6 . NAG R 3 . ? -17.837 73.829 -15.629 1.00 101.07 ? 406 NAG C C6 1 HETATM 11743 C C7 . NAG R 3 . ? -20.565 74.835 -21.759 1.00 105.39 ? 406 NAG C C7 1 HETATM 11744 C C8 . NAG R 3 . ? -20.125 74.974 -23.204 1.00 102.27 ? 406 NAG C C8 1 HETATM 11745 N N2 . NAG R 3 . ? -19.602 74.825 -20.824 1.00 102.16 ? 406 NAG C N2 1 HETATM 11746 O O3 . NAG R 3 . ? -20.032 77.032 -18.794 1.00 107.20 ? 406 NAG C O3 1 HETATM 11747 O O4 . NAG R 3 . ? -18.775 76.679 -16.353 1.00 105.33 ? 406 NAG C O4 1 HETATM 11748 O O5 . NAG R 3 . ? -19.183 73.242 -17.554 1.00 93.83 ? 406 NAG C O5 1 HETATM 11749 O O6 . NAG R 3 . ? -18.906 73.677 -14.715 1.00 101.37 ? 406 NAG C O6 1 HETATM 11750 O O7 . NAG R 3 . ? -21.769 74.739 -21.466 1.00 100.19 ? 406 NAG C O7 1 HETATM 11751 C C1 . NAG S 3 . ? 7.968 75.241 -17.274 1.00 108.55 ? 401 NAG E C1 1 HETATM 11752 C C2 . NAG S 3 . ? 6.858 76.280 -16.938 1.00 104.66 ? 401 NAG E C2 1 HETATM 11753 C C3 . NAG S 3 . ? 6.223 77.023 -18.132 1.00 108.81 ? 401 NAG E C3 1 HETATM 11754 C C4 . NAG S 3 . ? 7.343 77.618 -18.976 1.00 116.84 ? 401 NAG E C4 1 HETATM 11755 C C5 . NAG S 3 . ? 8.148 76.397 -19.420 1.00 126.23 ? 401 NAG E C5 1 HETATM 11756 C C6 . NAG S 3 . ? 9.052 76.759 -20.596 1.00 130.57 ? 401 NAG E C6 1 HETATM 11757 C C7 . NAG S 3 . ? 5.784 75.322 -14.982 1.00 108.60 ? 401 NAG E C7 1 HETATM 11758 C C8 . NAG S 3 . ? 4.524 74.678 -14.444 1.00 100.84 ? 401 NAG E C8 1 HETATM 11759 N N2 . NAG S 3 . ? 5.751 75.652 -16.266 1.00 108.28 ? 401 NAG E N2 1 HETATM 11760 O O3 . NAG S 3 . ? 5.268 77.992 -17.744 1.00 103.45 ? 401 NAG E O3 1 HETATM 11761 O O4 . NAG S 3 . ? 6.890 78.388 -20.080 1.00 110.24 ? 401 NAG E O4 1 HETATM 11762 O O5 . NAG S 3 . ? 8.820 75.805 -18.288 1.00 123.59 ? 401 NAG E O5 1 HETATM 11763 O O6 . NAG S 3 . ? 10.359 76.343 -20.293 1.00 146.21 ? 401 NAG E O6 1 HETATM 11764 O O7 . NAG S 3 . ? 6.787 75.523 -14.284 1.00 110.05 ? 401 NAG E O7 1 HETATM 11765 C C1 . FUC T 4 . ? 11.320 77.315 -20.750 1.00 156.20 ? 402 FUC E C1 1 HETATM 11766 C C2 . FUC T 4 . ? 11.661 78.310 -19.624 1.00 152.80 ? 402 FUC E C2 1 HETATM 11767 C C3 . FUC T 4 . ? 12.496 77.609 -18.554 1.00 147.57 ? 402 FUC E C3 1 HETATM 11768 C C4 . FUC T 4 . ? 13.736 76.975 -19.212 1.00 150.88 ? 402 FUC E C4 1 HETATM 11769 C C5 . FUC T 4 . ? 13.287 75.986 -20.298 1.00 149.95 ? 402 FUC E C5 1 HETATM 11770 C C6 . FUC T 4 . ? 14.455 75.299 -21.011 1.00 136.12 ? 402 FUC E C6 1 HETATM 11771 O O2 . FUC T 4 . ? 10.511 78.890 -19.039 1.00 146.86 ? 402 FUC E O2 1 HETATM 11772 O O3 . FUC T 4 . ? 12.816 78.499 -17.504 1.00 121.77 ? 402 FUC E O3 1 HETATM 11773 O O4 . FUC T 4 . ? 14.559 77.956 -19.799 1.00 147.11 ? 402 FUC E O4 1 HETATM 11774 O O5 . FUC T 4 . ? 12.486 76.665 -21.253 1.00 161.74 ? 402 FUC E O5 1 HETATM 11775 C C1 . NAG U 3 . ? -2.424 31.619 -77.052 1.00 58.72 ? 403 NAG E C1 1 HETATM 11776 C C2 . NAG U 3 . ? -3.499 30.549 -77.094 1.00 64.56 ? 403 NAG E C2 1 HETATM 11777 C C3 . NAG U 3 . ? -2.987 29.268 -76.470 1.00 68.83 ? 403 NAG E C3 1 HETATM 11778 C C4 . NAG U 3 . ? -1.717 28.858 -77.204 1.00 72.31 ? 403 NAG E C4 1 HETATM 11779 C C5 . NAG U 3 . ? -0.749 30.012 -77.111 1.00 74.54 ? 403 NAG E C5 1 HETATM 11780 C C6 . NAG U 3 . ? 0.582 29.608 -77.725 1.00 87.21 ? 403 NAG E C6 1 HETATM 11781 C C7 . NAG U 3 . ? -5.684 31.548 -76.838 1.00 64.77 ? 403 NAG E C7 1 HETATM 11782 C C8 . NAG U 3 . ? -6.772 31.879 -75.850 1.00 59.16 ? 403 NAG E C8 1 HETATM 11783 N N2 . NAG U 3 . ? -4.634 30.949 -76.301 1.00 64.51 ? 403 NAG E N2 1 HETATM 11784 O O3 . NAG U 3 . ? -4.048 28.331 -76.451 1.00 68.00 ? 403 NAG E O3 1 HETATM 11785 O O4 . NAG U 3 . ? -0.999 27.809 -76.574 1.00 88.66 ? 403 NAG E O4 1 HETATM 11786 O O5 . NAG U 3 . ? -1.327 31.111 -77.750 1.00 58.92 ? 403 NAG E O5 1 HETATM 11787 O O6 . NAG U 3 . ? 0.315 28.557 -78.675 1.00 117.00 ? 403 NAG E O6 1 HETATM 11788 O O7 . NAG U 3 . ? -5.764 31.816 -78.055 1.00 64.05 ? 403 NAG E O7 1 HETATM 11789 C C1 . NAG V 3 . ? -1.454 26.544 -77.037 1.00 101.08 ? 404 NAG E C1 1 HETATM 11790 C C2 . NAG V 3 . ? -0.408 25.440 -77.032 1.00 104.72 ? 404 NAG E C2 1 HETATM 11791 C C3 . NAG V 3 . ? -0.880 24.562 -78.196 1.00 109.80 ? 404 NAG E C3 1 HETATM 11792 C C4 . NAG V 3 . ? -2.386 24.235 -78.027 1.00 116.53 ? 404 NAG E C4 1 HETATM 11793 C C5 . NAG V 3 . ? -3.256 25.124 -77.062 1.00 118.60 ? 404 NAG E C5 1 HETATM 11794 C C6 . NAG V 3 . ? -4.222 24.369 -76.127 1.00 114.77 ? 404 NAG E C6 1 HETATM 11795 C C7 . NAG V 3 . ? 1.624 26.376 -75.977 1.00 102.24 ? 404 NAG E C7 1 HETATM 11796 C C8 . NAG V 3 . ? 3.065 26.794 -76.170 1.00 98.29 ? 404 NAG E C8 1 HETATM 11797 N N2 . NAG V 3 . ? 0.983 25.893 -77.070 1.00 106.18 ? 404 NAG E N2 1 HETATM 11798 O O3 . NAG V 3 . ? -0.146 23.359 -78.312 1.00 109.12 ? 404 NAG E O3 1 HETATM 11799 O O4 . NAG V 3 . ? -2.949 24.289 -79.322 1.00 105.49 ? 404 NAG E O4 1 HETATM 11800 O O5 . NAG V 3 . ? -2.506 26.027 -76.261 1.00 103.98 ? 404 NAG E O5 1 HETATM 11801 O O6 . NAG V 3 . ? -5.406 25.128 -75.909 1.00 103.57 ? 404 NAG E O6 1 HETATM 11802 O O7 . NAG V 3 . ? 1.091 26.506 -74.857 1.00 82.59 ? 404 NAG E O7 1 HETATM 11803 C C1 . FUC W 4 . ? 1.174 28.655 -79.882 1.00 128.04 ? 405 FUC E C1 1 HETATM 11804 C C2 . FUC W 4 . ? 0.429 28.148 -81.130 1.00 128.58 ? 405 FUC E C2 1 HETATM 11805 C C3 . FUC W 4 . ? -0.238 29.357 -81.802 1.00 125.52 ? 405 FUC E C3 1 HETATM 11806 C C4 . FUC W 4 . ? 0.806 30.457 -82.055 1.00 131.27 ? 405 FUC E C4 1 HETATM 11807 C C5 . FUC W 4 . ? 1.647 30.782 -80.804 1.00 129.28 ? 405 FUC E C5 1 HETATM 11808 C C6 . FUC W 4 . ? 2.788 31.775 -81.017 1.00 124.12 ? 405 FUC E C6 1 HETATM 11809 O O2 . FUC W 4 . ? -0.507 27.151 -80.760 1.00 128.22 ? 405 FUC E O2 1 HETATM 11810 O O3 . FUC W 4 . ? -0.857 28.975 -83.009 1.00 103.01 ? 405 FUC E O3 1 HETATM 11811 O O4 . FUC W 4 . ? 1.657 29.990 -83.070 1.00 141.78 ? 405 FUC E O4 1 HETATM 11812 O O5 . FUC W 4 . ? 2.202 29.572 -80.287 1.00 126.88 ? 405 FUC E O5 1 HETATM 11813 C C1 . NAG X 3 . ? 21.825 57.497 -41.421 1.00 107.31 ? 406 NAG E C1 1 HETATM 11814 C C2 . NAG X 3 . ? 22.486 57.008 -42.729 1.00 119.22 ? 406 NAG E C2 1 HETATM 11815 C C3 . NAG X 3 . ? 23.829 57.707 -43.075 1.00 118.56 ? 406 NAG E C3 1 HETATM 11816 C C4 . NAG X 3 . ? 24.760 58.053 -41.881 1.00 116.39 ? 406 NAG E C4 1 HETATM 11817 C C5 . NAG X 3 . ? 24.064 57.649 -40.559 1.00 112.13 ? 406 NAG E C5 1 HETATM 11818 C C6 . NAG X 3 . ? 24.832 58.076 -39.311 1.00 106.76 ? 406 NAG E C6 1 HETATM 11819 C C7 . NAG X 3 . ? 21.814 54.632 -43.252 1.00 136.22 ? 406 NAG E C7 1 HETATM 11820 C C8 . NAG X 3 . ? 22.075 53.175 -42.932 1.00 132.35 ? 406 NAG E C8 1 HETATM 11821 N N2 . NAG X 3 . ? 22.581 55.540 -42.604 1.00 131.15 ? 406 NAG E N2 1 HETATM 11822 O O3 . NAG X 3 . ? 23.491 58.896 -43.760 1.00 109.89 ? 406 NAG E O3 1 HETATM 11823 O O4 . NAG X 3 . ? 26.128 57.614 -42.043 1.00 92.70 ? 406 NAG E O4 1 HETATM 11824 O O5 . NAG X 3 . ? 22.734 58.186 -40.560 1.00 106.76 ? 406 NAG E O5 1 HETATM 11825 O O6 . NAG X 3 . ? 24.087 59.055 -38.626 1.00 89.44 ? 406 NAG E O6 1 HETATM 11826 O O7 . NAG X 3 . ? 20.934 54.910 -44.083 1.00 125.53 ? 406 NAG E O7 1 HETATM 11827 O O . HOH Y 5 . ? 8.347 38.366 -24.986 1.00 49.16 ? 501 HOH A O 1 HETATM 11828 O O . HOH Y 5 . ? -21.390 28.144 -80.589 1.00 61.53 ? 502 HOH A O 1 HETATM 11829 O O . HOH Y 5 . ? -44.445 24.553 -77.877 1.00 42.64 ? 503 HOH A O 1 HETATM 11830 O O . HOH Y 5 . ? -32.320 42.998 -54.193 1.00 34.69 ? 504 HOH A O 1 HETATM 11831 O O . HOH Y 5 . ? 15.847 32.935 -3.483 1.00 52.97 ? 505 HOH A O 1 HETATM 11832 O O . HOH Y 5 . ? -14.440 24.902 -49.994 1.00 38.59 ? 506 HOH A O 1 HETATM 11833 O O . HOH Y 5 . ? -12.573 22.758 -28.722 1.00 56.24 ? 507 HOH A O 1 HETATM 11834 O O . HOH Y 5 . ? -33.001 37.837 -44.312 1.00 41.73 ? 508 HOH A O 1 HETATM 11835 O O . HOH Y 5 . ? -40.617 20.817 -68.632 1.00 52.88 ? 509 HOH A O 1 HETATM 11836 O O . HOH Y 5 . ? -15.240 29.137 -61.438 1.00 46.88 ? 510 HOH A O 1 HETATM 11837 O O . HOH Y 5 . ? -11.519 37.505 -33.518 1.00 28.81 ? 511 HOH A O 1 HETATM 11838 O O . HOH Y 5 . ? -27.014 42.314 -55.370 1.00 35.32 ? 512 HOH A O 1 HETATM 11839 O O . HOH Y 5 . ? -17.512 22.477 -71.712 1.00 45.77 ? 513 HOH A O 1 HETATM 11840 O O . HOH Y 5 . ? 13.207 25.496 -1.176 1.00 54.36 ? 514 HOH A O 1 HETATM 11841 O O . HOH Y 5 . ? -33.659 30.889 -71.509 1.00 32.36 ? 515 HOH A O 1 HETATM 11842 O O . HOH Y 5 . ? -43.572 39.238 -64.989 1.00 42.39 ? 516 HOH A O 1 HETATM 11843 O O . HOH Y 5 . ? -15.810 31.551 -52.985 1.00 25.29 ? 517 HOH A O 1 HETATM 11844 O O . HOH Y 5 . ? -5.604 27.143 -26.281 1.00 38.70 ? 518 HOH A O 1 HETATM 11845 O O . HOH Y 5 . ? -33.291 30.775 -57.200 1.00 37.59 ? 519 HOH A O 1 HETATM 11846 O O . HOH Y 5 . ? -46.069 35.558 -46.324 1.00 40.94 ? 520 HOH A O 1 HETATM 11847 O O . HOH Y 5 . ? -3.423 23.061 -37.718 1.00 45.14 ? 521 HOH A O 1 HETATM 11848 O O . HOH Y 5 . ? 27.781 37.469 21.645 1.00 59.02 ? 522 HOH A O 1 HETATM 11849 O O . HOH Y 5 . ? 5.234 40.354 -11.886 1.00 43.62 ? 523 HOH A O 1 HETATM 11850 O O . HOH Y 5 . ? -14.299 23.545 -46.551 1.00 41.31 ? 524 HOH A O 1 HETATM 11851 O O . HOH Y 5 . ? -20.324 13.553 -61.857 1.00 60.14 ? 525 HOH A O 1 HETATM 11852 O O . HOH Y 5 . ? 11.452 33.844 -19.724 1.00 56.67 ? 526 HOH A O 1 HETATM 11853 O O . HOH Y 5 . ? -36.384 35.819 -42.583 1.00 30.18 ? 527 HOH A O 1 HETATM 11854 O O . HOH Y 5 . ? -37.925 26.410 -62.761 1.00 28.86 ? 528 HOH A O 1 HETATM 11855 O O . HOH Y 5 . ? -33.487 23.129 -71.246 1.00 47.93 ? 529 HOH A O 1 HETATM 11856 O O . HOH Y 5 . ? 1.958 29.914 -30.854 1.00 48.51 ? 530 HOH A O 1 HETATM 11857 O O . HOH Y 5 . ? -17.694 34.053 -77.477 1.00 30.49 ? 531 HOH A O 1 HETATM 11858 O O . HOH Y 5 . ? -16.031 35.333 -65.568 1.00 36.24 ? 532 HOH A O 1 HETATM 11859 O O . HOH Y 5 . ? 3.116 30.071 -17.311 1.00 58.32 ? 533 HOH A O 1 HETATM 11860 O O . HOH Y 5 . ? -34.821 42.780 -49.827 1.00 36.67 ? 534 HOH A O 1 HETATM 11861 O O . HOH Y 5 . ? -7.043 31.497 -43.283 1.00 31.76 ? 535 HOH A O 1 HETATM 11862 O O . HOH Y 5 . ? -32.812 20.190 -60.216 1.00 43.41 ? 536 HOH A O 1 HETATM 11863 O O . HOH Y 5 . ? -19.279 40.088 -39.512 1.00 33.27 ? 537 HOH A O 1 HETATM 11864 O O . HOH Y 5 . ? -22.594 30.487 -32.574 1.00 38.16 ? 538 HOH A O 1 HETATM 11865 O O . HOH Y 5 . ? -7.384 37.223 -32.647 1.00 38.54 ? 539 HOH A O 1 HETATM 11866 O O . HOH Y 5 . ? -10.802 33.491 -40.515 1.00 31.23 ? 540 HOH A O 1 HETATM 11867 O O . HOH Y 5 . ? -43.211 27.868 -70.584 1.00 51.55 ? 541 HOH A O 1 HETATM 11868 O O . HOH Y 5 . ? -23.674 33.566 -86.259 1.00 48.89 ? 542 HOH A O 1 HETATM 11869 O O . HOH Y 5 . ? -17.650 27.933 -76.747 1.00 51.08 ? 543 HOH A O 1 HETATM 11870 O O . HOH Y 5 . ? -39.767 22.491 -51.683 1.00 41.58 ? 544 HOH A O 1 HETATM 11871 O O . HOH Y 5 . ? -22.046 24.072 -73.494 1.00 45.35 ? 545 HOH A O 1 HETATM 11872 O O . HOH Y 5 . ? -11.643 25.472 -27.802 1.00 53.29 ? 546 HOH A O 1 HETATM 11873 O O . HOH Y 5 . ? -34.565 23.375 -42.247 1.00 65.82 ? 547 HOH A O 1 HETATM 11874 O O . HOH Y 5 . ? -12.427 35.254 -45.970 1.00 34.56 ? 548 HOH A O 1 HETATM 11875 O O . HOH Y 5 . ? -39.447 38.695 -78.574 1.00 45.99 ? 549 HOH A O 1 HETATM 11876 O O . HOH Y 5 . ? -7.899 37.702 -20.522 1.00 52.42 ? 550 HOH A O 1 HETATM 11877 O O . HOH Y 5 . ? -17.772 16.952 -69.604 1.00 42.37 ? 551 HOH A O 1 HETATM 11878 O O . HOH Y 5 . ? -28.227 40.953 -76.931 1.00 38.49 ? 552 HOH A O 1 HETATM 11879 O O . HOH Y 5 . ? -11.812 22.732 -45.212 1.00 39.14 ? 553 HOH A O 1 HETATM 11880 O O . HOH Y 5 . ? -3.992 42.784 -32.154 1.00 31.35 ? 554 HOH A O 1 HETATM 11881 O O . HOH Y 5 . ? -21.535 31.273 -64.241 1.00 35.00 ? 555 HOH A O 1 HETATM 11882 O O . HOH Y 5 . ? -36.893 44.228 -50.885 1.00 28.11 ? 556 HOH A O 1 HETATM 11883 O O . HOH Y 5 . ? -36.625 42.067 -53.556 1.00 29.29 ? 557 HOH A O 1 HETATM 11884 O O . HOH Y 5 . ? -33.692 45.595 -54.349 1.00 42.53 ? 558 HOH A O 1 HETATM 11885 O O . HOH Y 5 . ? -29.425 28.476 -85.807 1.00 60.18 ? 559 HOH A O 1 HETATM 11886 O O . HOH Y 5 . ? -38.577 41.964 -51.276 1.00 32.54 ? 560 HOH A O 1 HETATM 11887 O O . HOH Y 5 . ? -23.849 41.618 -47.171 1.00 31.47 ? 561 HOH A O 1 HETATM 11888 O O . HOH Y 5 . ? -40.292 42.371 -64.483 1.00 48.41 ? 562 HOH A O 1 HETATM 11889 O O . HOH Y 5 . ? -17.050 22.119 -61.019 1.00 33.48 ? 563 HOH A O 1 HETATM 11890 O O . HOH Y 5 . ? -15.088 39.269 -82.539 1.00 48.17 ? 564 HOH A O 1 HETATM 11891 O O . HOH Y 5 . ? -20.504 42.414 -58.133 1.00 39.17 ? 565 HOH A O 1 HETATM 11892 O O . HOH Y 5 . ? -46.849 31.665 -53.393 1.00 50.63 ? 566 HOH A O 1 HETATM 11893 O O . HOH Y 5 . ? -12.111 38.261 -30.794 1.00 37.82 ? 567 HOH A O 1 HETATM 11894 O O . HOH Y 5 . ? -25.555 43.796 -75.457 1.00 44.09 ? 568 HOH A O 1 HETATM 11895 O O . HOH Y 5 . ? -20.557 44.579 -53.690 1.00 35.70 ? 569 HOH A O 1 HETATM 11896 O O . HOH Y 5 . ? -11.152 40.339 -28.157 1.00 41.29 ? 570 HOH A O 1 HETATM 11897 O O . HOH Y 5 . ? -16.360 24.688 -61.210 1.00 37.62 ? 571 HOH A O 1 HETATM 11898 O O . HOH Y 5 . ? -20.030 28.470 -75.008 1.00 36.99 ? 572 HOH A O 1 HETATM 11899 O O . HOH Y 5 . ? -23.230 38.219 -62.448 1.00 37.59 ? 573 HOH A O 1 HETATM 11900 O O . HOH Y 5 . ? -18.603 46.476 -48.327 1.00 35.91 ? 574 HOH A O 1 HETATM 11901 O O . HOH Y 5 . ? 9.497 38.493 -18.699 1.00 45.63 ? 575 HOH A O 1 HETATM 11902 O O . HOH Y 5 . ? -30.986 23.282 -66.981 1.00 37.45 ? 576 HOH A O 1 HETATM 11903 O O . HOH Y 5 . ? -39.609 21.147 -71.642 1.00 60.26 ? 577 HOH A O 1 HETATM 11904 O O . HOH Y 5 . ? -38.850 48.019 -57.642 1.00 35.41 ? 578 HOH A O 1 HETATM 11905 O O . HOH Y 5 . ? -45.391 23.159 -75.822 1.00 56.93 ? 579 HOH A O 1 HETATM 11906 O O . HOH Y 5 . ? 7.269 30.454 -21.050 1.00 58.74 ? 580 HOH A O 1 HETATM 11907 O O . HOH Y 5 . ? -32.369 19.084 -53.308 1.00 44.56 ? 581 HOH A O 1 HETATM 11908 O O . HOH Y 5 . ? -6.320 41.165 -31.512 1.00 35.14 ? 582 HOH A O 1 HETATM 11909 O O . HOH Y 5 . ? -29.408 36.108 -83.628 1.00 50.11 ? 583 HOH A O 1 HETATM 11910 O O . HOH Y 5 . ? -24.592 22.603 -35.102 1.00 44.19 ? 584 HOH A O 1 HETATM 11911 O O . HOH Y 5 . ? -17.261 39.390 -66.664 1.00 37.91 ? 585 HOH A O 1 HETATM 11912 O O . HOH Y 5 . ? -19.411 18.061 -32.141 1.00 53.14 ? 586 HOH A O 1 HETATM 11913 O O . HOH Y 5 . ? -29.958 39.092 -77.555 1.00 41.50 ? 587 HOH A O 1 HETATM 11914 O O . HOH Y 5 . ? -19.901 15.623 -70.507 1.00 51.46 ? 588 HOH A O 1 HETATM 11915 O O . HOH Y 5 . ? -19.800 37.596 -68.267 1.00 37.64 ? 589 HOH A O 1 HETATM 11916 O O . HOH Y 5 . ? -31.105 22.606 -64.356 1.00 36.95 ? 590 HOH A O 1 HETATM 11917 O O . HOH Y 5 . ? -30.687 46.788 -64.350 1.00 42.30 ? 591 HOH A O 1 HETATM 11918 O O . HOH Y 5 . ? -19.913 41.922 -53.161 1.00 23.31 ? 592 HOH A O 1 HETATM 11919 O O . HOH Y 5 . ? 8.388 37.565 -21.271 1.00 34.85 ? 593 HOH A O 1 HETATM 11920 O O . HOH Y 5 . ? -25.237 21.835 -47.099 1.00 38.25 ? 594 HOH A O 1 HETATM 11921 O O . HOH Y 5 . ? -40.023 33.005 -80.666 1.00 48.72 ? 595 HOH A O 1 HETATM 11922 O O . HOH Y 5 . ? -39.181 50.860 -53.392 1.00 39.03 ? 596 HOH A O 1 HETATM 11923 O O . HOH Y 5 . ? -25.713 22.211 -53.727 1.00 46.93 ? 597 HOH A O 1 HETATM 11924 O O . HOH Y 5 . ? -7.708 24.711 -51.337 1.00 62.46 ? 598 HOH A O 1 HETATM 11925 O O . HOH Y 5 . ? -24.867 20.807 -51.917 1.00 46.88 ? 599 HOH A O 1 HETATM 11926 O O . HOH Y 5 . ? -20.806 26.895 -26.215 1.00 56.53 ? 600 HOH A O 1 HETATM 11927 O O . HOH Y 5 . ? -14.880 20.214 -27.543 1.00 55.91 ? 601 HOH A O 1 HETATM 11928 O O . HOH Y 5 . ? -32.713 47.560 -59.183 1.00 39.57 ? 602 HOH A O 1 HETATM 11929 O O . HOH Y 5 . ? 0.160 28.492 -24.008 1.00 43.79 ? 603 HOH A O 1 HETATM 11930 O O . HOH Y 5 . ? -44.336 27.254 -55.641 1.00 43.20 ? 604 HOH A O 1 HETATM 11931 O O . HOH Y 5 . ? -46.867 32.810 -56.315 1.00 52.02 ? 605 HOH A O 1 HETATM 11932 O O . HOH Y 5 . ? -29.644 20.540 -63.671 1.00 39.53 ? 606 HOH A O 1 HETATM 11933 O O . HOH Y 5 . ? -21.976 40.443 -61.797 1.00 45.19 ? 607 HOH A O 1 HETATM 11934 O O . HOH Y 5 . ? -15.992 31.727 -64.498 1.00 32.84 ? 608 HOH A O 1 HETATM 11935 O O . HOH Y 5 . ? 5.914 29.005 -11.443 1.00 62.43 ? 609 HOH A O 1 HETATM 11936 O O . HOH Y 5 . ? -8.985 30.347 -69.958 1.00 56.48 ? 610 HOH A O 1 HETATM 11937 O O . HOH Y 5 . ? -32.973 22.629 -46.894 1.00 41.96 ? 611 HOH A O 1 HETATM 11938 O O . HOH Y 5 . ? -26.462 30.694 -36.432 1.00 42.88 ? 612 HOH A O 1 HETATM 11939 O O . HOH Y 5 . ? -23.491 20.713 -32.827 1.00 48.89 ? 613 HOH A O 1 HETATM 11940 O O . HOH Y 5 . ? -21.120 22.170 -29.431 1.00 55.60 ? 614 HOH A O 1 HETATM 11941 O O . HOH Y 5 . ? -4.243 30.065 -42.543 1.00 38.35 ? 615 HOH A O 1 HETATM 11942 O O . HOH Y 5 . ? -11.485 26.154 -72.098 1.00 41.16 ? 616 HOH A O 1 HETATM 11943 O O . HOH Y 5 . ? -9.539 32.816 -42.859 1.00 31.71 ? 617 HOH A O 1 HETATM 11944 O O . HOH Y 5 . ? -26.768 45.188 -57.103 1.00 44.64 ? 618 HOH A O 1 HETATM 11945 O O . HOH Y 5 . ? -29.779 41.734 -58.412 1.00 29.24 ? 619 HOH A O 1 HETATM 11946 O O . HOH Y 5 . ? -5.602 25.277 -42.897 1.00 48.97 ? 620 HOH A O 1 HETATM 11947 O O . HOH Y 5 . ? -11.287 30.945 -53.575 1.00 58.72 ? 621 HOH A O 1 HETATM 11948 O O . HOH Y 5 . ? -23.480 39.001 -34.760 1.00 48.22 ? 622 HOH A O 1 HETATM 11949 O O . HOH Y 5 . ? -22.091 44.857 -58.797 1.00 50.10 ? 623 HOH A O 1 HETATM 11950 O O . HOH Y 5 . ? -19.099 39.907 -57.393 1.00 43.44 ? 624 HOH A O 1 HETATM 11951 O O . HOH Y 5 . ? -19.637 41.685 -80.421 1.00 49.00 ? 625 HOH A O 1 HETATM 11952 O O . HOH Y 5 . ? -21.654 20.922 -74.200 1.00 45.41 ? 626 HOH A O 1 HETATM 11953 O O . HOH Y 5 . ? -27.378 40.674 -57.593 1.00 25.87 ? 627 HOH A O 1 HETATM 11954 O O . HOH Y 5 . ? -28.353 22.943 -53.411 1.00 42.24 ? 628 HOH A O 1 HETATM 11955 O O . HOH Y 5 . ? -32.282 42.296 -51.661 1.00 29.82 ? 629 HOH A O 1 HETATM 11956 O O . HOH Y 5 . ? -40.811 36.369 -78.044 1.00 47.70 ? 630 HOH A O 1 HETATM 11957 O O . HOH Y 5 . ? -36.827 50.558 -57.460 1.00 37.52 ? 631 HOH A O 1 HETATM 11958 O O . HOH Y 5 . ? -33.834 37.663 -41.749 1.00 39.57 ? 632 HOH A O 1 HETATM 11959 O O . HOH Y 5 . ? 0.168 32.363 -37.949 1.00 45.90 ? 633 HOH A O 1 HETATM 11960 O O . HOH Y 5 . ? -10.790 33.054 -25.497 1.00 46.60 ? 634 HOH A O 1 HETATM 11961 O O . HOH Y 5 . ? -41.391 47.889 -50.096 1.00 52.86 ? 635 HOH A O 1 HETATM 11962 O O . HOH Y 5 . ? -15.159 29.255 -64.277 1.00 39.07 ? 636 HOH A O 1 HETATM 11963 O O . HOH Y 5 . ? -47.120 33.674 -63.167 1.00 39.88 ? 637 HOH A O 1 HETATM 11964 O O . HOH Y 5 . ? -43.446 29.326 -64.287 1.00 56.29 ? 638 HOH A O 1 HETATM 11965 O O . HOH Y 5 . ? -44.758 29.303 -66.581 1.00 50.34 ? 639 HOH A O 1 HETATM 11966 O O . HOH Y 5 . ? -13.115 26.811 -25.518 1.00 56.42 ? 640 HOH A O 1 HETATM 11967 O O . HOH Y 5 . ? -33.905 44.410 -76.076 1.00 53.08 ? 641 HOH A O 1 HETATM 11968 O O . HOH Y 5 . ? 14.127 44.694 -24.661 1.00 51.50 ? 642 HOH A O 1 HETATM 11969 O O . HOH Y 5 . ? -21.308 42.403 -40.615 1.00 44.56 ? 643 HOH A O 1 HETATM 11970 O O . HOH Y 5 . ? -29.168 42.078 -53.913 1.00 46.49 ? 644 HOH A O 1 HETATM 11971 O O . HOH Y 5 . ? -13.364 28.753 -56.302 1.00 53.60 ? 645 HOH A O 1 HETATM 11972 O O . HOH Y 5 . ? 2.773 38.480 -36.209 1.00 52.15 ? 646 HOH A O 1 HETATM 11973 O O . HOH Y 5 . ? -44.473 31.026 -39.681 1.00 60.40 ? 647 HOH A O 1 HETATM 11974 O O . HOH Y 5 . ? -44.883 32.498 -69.215 1.00 48.29 ? 648 HOH A O 1 HETATM 11975 O O . HOH Y 5 . ? -50.715 34.263 -49.070 1.00 54.80 ? 649 HOH A O 1 HETATM 11976 O O . HOH Y 5 . ? -33.341 42.913 -47.763 1.00 45.06 ? 650 HOH A O 1 HETATM 11977 O O . HOH Y 5 . ? -36.092 43.480 -77.282 1.00 49.06 ? 651 HOH A O 1 HETATM 11978 O O . HOH Y 5 . ? -3.606 28.978 -51.537 1.00 51.16 ? 652 HOH A O 1 HETATM 11979 O O . HOH Y 5 . ? -12.282 34.442 -51.361 1.00 46.01 ? 653 HOH A O 1 HETATM 11980 O O . HOH Y 5 . ? -30.262 45.860 -60.506 1.00 45.62 ? 654 HOH A O 1 HETATM 11981 O O . HOH Y 5 . ? -19.053 40.190 -36.678 1.00 43.28 ? 655 HOH A O 1 HETATM 11982 O O . HOH Y 5 . ? -17.896 30.230 -80.118 1.00 56.19 ? 656 HOH A O 1 HETATM 11983 O O . HOH Y 5 . ? -27.349 33.112 -36.217 1.00 33.09 ? 657 HOH A O 1 HETATM 11984 O O . HOH Y 5 . ? -7.250 39.802 -34.151 1.00 56.21 ? 658 HOH A O 1 HETATM 11985 O O . HOH Y 5 . ? -32.997 46.805 -51.604 1.00 58.54 ? 659 HOH A O 1 HETATM 11986 O O . HOH Y 5 . ? -0.558 33.611 -40.096 1.00 55.03 ? 660 HOH A O 1 HETATM 11987 O O . HOH Y 5 . ? -16.950 33.223 -79.880 1.00 49.06 ? 661 HOH A O 1 HETATM 11988 O O . HOH Y 5 . ? -33.347 49.555 -73.630 1.00 58.16 ? 662 HOH A O 1 HETATM 11989 O O . HOH Y 5 . ? -4.392 23.405 -40.333 1.00 66.90 ? 663 HOH A O 1 HETATM 11990 O O . HOH Y 5 . ? -27.424 20.720 -55.578 1.00 50.68 ? 664 HOH A O 1 HETATM 11991 O O . HOH Y 5 . ? -30.938 44.680 -76.482 1.00 58.77 ? 665 HOH A O 1 HETATM 11992 O O . HOH Y 5 . ? -10.397 40.193 -33.283 1.00 34.39 ? 666 HOH A O 1 HETATM 11993 O O . HOH Y 5 . ? -26.351 24.704 -75.095 1.00 51.97 ? 667 HOH A O 1 HETATM 11994 O O . HOH Y 5 . ? -8.582 24.068 -15.149 1.00 60.21 ? 668 HOH A O 1 HETATM 11995 O O . HOH Y 5 . ? -13.954 30.764 -54.753 1.00 46.00 ? 669 HOH A O 1 HETATM 11996 O O . HOH Y 5 . ? -27.269 44.986 -61.814 1.00 55.59 ? 670 HOH A O 1 HETATM 11997 O O . HOH Y 5 . ? -31.050 39.356 -44.958 1.00 55.35 ? 671 HOH A O 1 HETATM 11998 O O . HOH Y 5 . ? -8.609 42.429 -30.801 1.00 42.73 ? 672 HOH A O 1 HETATM 11999 O O . HOH Y 5 . ? -2.282 35.339 -42.139 1.00 47.34 ? 673 HOH A O 1 HETATM 12000 O O . HOH Y 5 . ? -5.962 32.564 -45.723 1.00 38.70 ? 674 HOH A O 1 HETATM 12001 O O . HOH Y 5 . ? -26.904 44.796 -64.371 1.00 56.30 ? 675 HOH A O 1 HETATM 12002 O O . HOH Y 5 . ? -5.906 30.590 -47.588 1.00 45.99 ? 676 HOH A O 1 HETATM 12003 O O . HOH Y 5 . ? -14.601 34.088 -56.274 1.00 49.84 ? 677 HOH A O 1 HETATM 12004 O O . HOH Z 5 . ? -43.273 72.295 -59.465 1.00 53.09 ? 501 HOH C O 1 HETATM 12005 O O . HOH Z 5 . ? -45.926 54.627 -63.644 1.00 46.39 ? 502 HOH C O 1 HETATM 12006 O O . HOH Z 5 . ? -53.237 59.781 -52.286 1.00 39.72 ? 503 HOH C O 1 HETATM 12007 O O . HOH Z 5 . ? -21.243 64.922 -60.813 1.00 39.63 ? 504 HOH C O 1 HETATM 12008 O O . HOH Z 5 . ? -19.018 65.004 -62.309 1.00 45.40 ? 505 HOH C O 1 HETATM 12009 O O . HOH Z 5 . ? -35.733 62.912 -39.885 1.00 38.41 ? 506 HOH C O 1 HETATM 12010 O O . HOH Z 5 . ? -19.513 76.609 -53.393 1.00 47.68 ? 507 HOH C O 1 HETATM 12011 O O . HOH Z 5 . ? -49.706 58.159 -59.666 1.00 47.17 ? 508 HOH C O 1 HETATM 12012 O O . HOH Z 5 . ? -31.503 61.387 -23.555 1.00 55.99 ? 509 HOH C O 1 HETATM 12013 O O . HOH Z 5 . ? -48.464 70.344 -52.818 1.00 45.27 ? 510 HOH C O 1 HETATM 12014 O O . HOH Z 5 . ? -2.355 55.925 2.685 1.00 49.90 ? 511 HOH C O 1 HETATM 12015 O O . HOH Z 5 . ? -51.689 69.579 -44.799 1.00 56.83 ? 512 HOH C O 1 HETATM 12016 O O . HOH Z 5 . ? -36.376 66.600 -27.566 1.00 58.75 ? 513 HOH C O 1 HETATM 12017 O O . HOH Z 5 . ? -32.272 59.005 -45.128 1.00 42.05 ? 514 HOH C O 1 HETATM 12018 O O . HOH Z 5 . ? -13.952 88.458 -71.277 1.00 67.63 ? 515 HOH C O 1 HETATM 12019 O O . HOH Z 5 . ? -10.188 49.847 3.263 1.00 55.21 ? 516 HOH C O 1 HETATM 12020 O O . HOH Z 5 . ? -44.799 45.640 -68.095 1.00 54.80 ? 517 HOH C O 1 HETATM 12021 O O . HOH Z 5 . ? -49.367 69.827 -56.543 1.00 44.50 ? 518 HOH C O 1 HETATM 12022 O O . HOH Z 5 . ? -52.418 64.188 -63.965 1.00 50.46 ? 519 HOH C O 1 HETATM 12023 O O . HOH Z 5 . ? -51.235 70.325 -60.990 1.00 53.21 ? 520 HOH C O 1 HETATM 12024 O O . HOH Z 5 . ? -25.457 57.823 -39.352 1.00 37.77 ? 521 HOH C O 1 HETATM 12025 O O . HOH Z 5 . ? -50.577 55.995 -55.111 1.00 53.58 ? 522 HOH C O 1 HETATM 12026 O O . HOH Z 5 . ? -27.597 81.240 -65.663 1.00 60.09 ? 523 HOH C O 1 HETATM 12027 O O . HOH Z 5 . ? -21.918 55.606 -53.628 1.00 41.22 ? 524 HOH C O 1 HETATM 12028 O O . HOH Z 5 . ? -47.168 68.461 -62.847 1.00 48.50 ? 525 HOH C O 1 HETATM 12029 O O . HOH Z 5 . ? 7.209 59.753 33.958 1.00 65.01 ? 526 HOH C O 1 HETATM 12030 O O . HOH Z 5 . ? -42.862 73.772 -57.160 1.00 43.22 ? 527 HOH C O 1 HETATM 12031 O O . HOH Z 5 . ? -38.367 58.015 -56.288 1.00 48.03 ? 528 HOH C O 1 HETATM 12032 O O . HOH Z 5 . ? -15.180 66.562 -24.929 1.00 42.97 ? 529 HOH C O 1 HETATM 12033 O O . HOH Z 5 . ? -16.784 59.234 -28.442 1.00 41.31 ? 530 HOH C O 1 HETATM 12034 O O . HOH Z 5 . ? -32.576 70.310 -58.991 1.00 49.67 ? 531 HOH C O 1 HETATM 12035 O O . HOH Z 5 . ? -40.970 63.963 -68.875 1.00 41.97 ? 532 HOH C O 1 HETATM 12036 O O . HOH Z 5 . ? -52.581 69.097 -74.585 1.00 45.83 ? 533 HOH C O 1 HETATM 12037 O O . HOH Z 5 . ? -44.825 47.904 -63.396 1.00 41.24 ? 534 HOH C O 1 HETATM 12038 O O . HOH Z 5 . ? -21.396 50.552 -26.975 1.00 49.50 ? 535 HOH C O 1 HETATM 12039 O O . HOH Z 5 . ? -36.947 51.493 -54.933 1.00 33.61 ? 536 HOH C O 1 HETATM 12040 O O . HOH Z 5 . ? -43.526 69.463 -59.507 1.00 42.86 ? 537 HOH C O 1 HETATM 12041 O O . HOH Z 5 . ? -19.616 62.391 -50.321 1.00 41.09 ? 538 HOH C O 1 HETATM 12042 O O . HOH Z 5 . ? -38.560 73.347 -64.492 1.00 42.44 ? 539 HOH C O 1 HETATM 12043 O O . HOH Z 5 . ? -41.114 60.452 -39.330 1.00 56.52 ? 540 HOH C O 1 HETATM 12044 O O . HOH Z 5 . ? -38.835 54.316 -73.426 1.00 43.21 ? 541 HOH C O 1 HETATM 12045 O O . HOH Z 5 . ? -54.496 69.701 -78.270 1.00 56.53 ? 542 HOH C O 1 HETATM 12046 O O . HOH Z 5 . ? -5.916 49.966 3.673 1.00 65.09 ? 543 HOH C O 1 HETATM 12047 O O . HOH Z 5 . ? -39.174 64.041 -79.667 1.00 46.75 ? 544 HOH C O 1 HETATM 12048 O O . HOH Z 5 . ? -23.333 60.962 -57.893 1.00 44.86 ? 545 HOH C O 1 HETATM 12049 O O . HOH Z 5 . ? -16.400 69.986 -31.625 1.00 47.39 ? 546 HOH C O 1 HETATM 12050 O O . HOH Z 5 . ? -19.367 71.306 -62.631 1.00 39.96 ? 547 HOH C O 1 HETATM 12051 O O . HOH Z 5 . ? -46.837 67.889 -65.977 1.00 47.03 ? 548 HOH C O 1 HETATM 12052 O O . HOH Z 5 . ? -19.060 73.767 -43.286 1.00 66.60 ? 549 HOH C O 1 HETATM 12053 O O . HOH Z 5 . ? -44.547 67.669 -61.592 1.00 32.84 ? 550 HOH C O 1 HETATM 12054 O O . HOH Z 5 . ? -44.416 61.053 -47.630 1.00 43.40 ? 551 HOH C O 1 HETATM 12055 O O . HOH Z 5 . ? -14.816 62.150 -8.626 1.00 48.00 ? 552 HOH C O 1 HETATM 12056 O O . HOH Z 5 . ? -37.406 48.770 -70.646 1.00 43.11 ? 553 HOH C O 1 HETATM 12057 O O . HOH Z 5 . ? -16.261 61.891 -31.833 1.00 30.37 ? 554 HOH C O 1 HETATM 12058 O O . HOH Z 5 . ? -46.227 63.265 -49.674 1.00 51.17 ? 555 HOH C O 1 HETATM 12059 O O . HOH Z 5 . ? -14.048 63.013 -30.631 1.00 40.05 ? 556 HOH C O 1 HETATM 12060 O O . HOH Z 5 . ? -53.323 60.639 -74.195 1.00 54.36 ? 557 HOH C O 1 HETATM 12061 O O . HOH Z 5 . ? -24.037 60.129 -34.433 1.00 40.48 ? 558 HOH C O 1 HETATM 12062 O O . HOH Z 5 . ? -25.285 56.094 -21.428 1.00 45.90 ? 559 HOH C O 1 HETATM 12063 O O . HOH Z 5 . ? -14.580 67.747 -16.585 1.00 54.39 ? 560 HOH C O 1 HETATM 12064 O O . HOH Z 5 . ? -47.260 53.675 -61.223 1.00 33.58 ? 561 HOH C O 1 HETATM 12065 O O . HOH Z 5 . ? -41.072 72.901 -73.659 1.00 38.18 ? 562 HOH C O 1 HETATM 12066 O O . HOH Z 5 . ? -50.805 67.307 -46.058 1.00 47.51 ? 563 HOH C O 1 HETATM 12067 O O . HOH Z 5 . ? -37.602 56.575 -44.387 1.00 57.88 ? 564 HOH C O 1 HETATM 12068 O O . HOH Z 5 . ? -27.652 57.005 -33.200 1.00 34.02 ? 565 HOH C O 1 HETATM 12069 O O . HOH Z 5 . ? -13.589 66.418 -67.546 1.00 41.43 ? 566 HOH C O 1 HETATM 12070 O O . HOH Z 5 . ? -21.121 68.701 -62.774 1.00 34.02 ? 567 HOH C O 1 HETATM 12071 O O . HOH Z 5 . ? -15.682 62.188 -13.721 1.00 62.47 ? 568 HOH C O 1 HETATM 12072 O O . HOH Z 5 . ? -12.712 54.142 -27.919 1.00 34.02 ? 569 HOH C O 1 HETATM 12073 O O . HOH Z 5 . ? -26.198 54.717 -70.056 1.00 56.58 ? 570 HOH C O 1 HETATM 12074 O O . HOH Z 5 . ? -11.124 62.686 -29.186 1.00 51.00 ? 571 HOH C O 1 HETATM 12075 O O . HOH Z 5 . ? -42.457 59.268 -48.598 1.00 48.13 ? 572 HOH C O 1 HETATM 12076 O O . HOH Z 5 . ? -38.336 66.758 -81.323 1.00 50.50 ? 573 HOH C O 1 HETATM 12077 O O . HOH Z 5 . ? -16.645 63.177 -41.606 1.00 56.46 ? 574 HOH C O 1 HETATM 12078 O O . HOH Z 5 . ? -37.741 57.168 -36.114 1.00 55.97 ? 575 HOH C O 1 HETATM 12079 O O . HOH Z 5 . ? -13.342 49.785 -5.340 1.00 50.96 ? 576 HOH C O 1 HETATM 12080 O O . HOH Z 5 . ? -17.190 60.768 -70.240 1.00 41.94 ? 577 HOH C O 1 HETATM 12081 O O . HOH Z 5 . ? -26.697 62.583 -17.374 1.00 49.48 ? 578 HOH C O 1 HETATM 12082 O O . HOH Z 5 . ? -49.011 51.561 -60.938 1.00 34.46 ? 579 HOH C O 1 HETATM 12083 O O . HOH Z 5 . ? -10.182 52.379 -8.244 1.00 40.60 ? 580 HOH C O 1 HETATM 12084 O O . HOH Z 5 . ? -36.002 51.881 -59.908 1.00 46.31 ? 581 HOH C O 1 HETATM 12085 O O . HOH Z 5 . ? -29.429 54.556 -58.708 1.00 40.54 ? 582 HOH C O 1 HETATM 12086 O O . HOH Z 5 . ? -1.838 58.309 12.266 1.00 54.81 ? 583 HOH C O 1 HETATM 12087 O O . HOH Z 5 . ? -15.169 64.780 -47.648 1.00 62.64 ? 584 HOH C O 1 HETATM 12088 O O . HOH Z 5 . ? -19.412 61.783 -14.392 1.00 55.87 ? 585 HOH C O 1 HETATM 12089 O O . HOH Z 5 . ? -39.147 53.834 -52.851 1.00 40.26 ? 586 HOH C O 1 HETATM 12090 O O . HOH Z 5 . ? -17.193 55.681 -49.288 1.00 50.24 ? 587 HOH C O 1 HETATM 12091 O O . HOH Z 5 . ? -44.831 52.658 -75.823 1.00 45.03 ? 588 HOH C O 1 HETATM 12092 O O . HOH Z 5 . ? -21.155 74.719 -41.096 1.00 49.00 ? 589 HOH C O 1 HETATM 12093 O O . HOH Z 5 . ? -17.505 69.258 -62.014 1.00 41.08 ? 590 HOH C O 1 HETATM 12094 O O . HOH Z 5 . ? -25.561 61.763 -61.491 1.00 45.63 ? 591 HOH C O 1 HETATM 12095 O O . HOH Z 5 . ? -13.146 56.724 -28.432 1.00 34.86 ? 592 HOH C O 1 HETATM 12096 O O . HOH Z 5 . ? -52.156 59.088 -58.995 1.00 47.89 ? 593 HOH C O 1 HETATM 12097 O O . HOH Z 5 . ? -26.415 54.509 -54.985 1.00 42.92 ? 594 HOH C O 1 HETATM 12098 O O . HOH Z 5 . ? -32.904 78.922 -49.103 1.00 51.03 ? 595 HOH C O 1 HETATM 12099 O O . HOH Z 5 . ? -35.347 64.189 -34.319 1.00 45.65 ? 596 HOH C O 1 HETATM 12100 O O . HOH Z 5 . ? -45.263 46.886 -72.480 1.00 56.33 ? 597 HOH C O 1 HETATM 12101 O O . HOH Z 5 . ? -20.577 66.354 -58.603 1.00 32.84 ? 598 HOH C O 1 HETATM 12102 O O . HOH Z 5 . ? -19.541 51.543 -22.637 1.00 49.57 ? 599 HOH C O 1 HETATM 12103 O O . HOH Z 5 . ? -26.228 58.247 -34.826 1.00 30.32 ? 600 HOH C O 1 HETATM 12104 O O . HOH Z 5 . ? -49.252 48.197 -73.044 1.00 54.77 ? 601 HOH C O 1 HETATM 12105 O O . HOH Z 5 . ? -23.593 56.680 -51.826 1.00 34.32 ? 602 HOH C O 1 HETATM 12106 O O . HOH Z 5 . ? -31.599 56.615 -58.762 1.00 42.94 ? 603 HOH C O 1 HETATM 12107 O O . HOH Z 5 . ? -10.348 64.779 9.949 1.00 57.97 ? 604 HOH C O 1 HETATM 12108 O O . HOH Z 5 . ? -34.380 49.753 -70.921 1.00 56.04 ? 605 HOH C O 1 HETATM 12109 O O . HOH Z 5 . ? -20.914 60.600 -65.806 1.00 49.74 ? 606 HOH C O 1 HETATM 12110 O O . HOH Z 5 . ? -28.257 79.850 -67.859 1.00 51.70 ? 607 HOH C O 1 HETATM 12111 O O . HOH Z 5 . ? -46.243 50.443 -49.940 1.00 49.79 ? 608 HOH C O 1 HETATM 12112 O O . HOH Z 5 . ? -26.170 60.725 -58.724 1.00 42.40 ? 609 HOH C O 1 HETATM 12113 O O . HOH Z 5 . ? -45.001 69.817 -57.216 1.00 46.71 ? 610 HOH C O 1 HETATM 12114 O O . HOH Z 5 . ? -9.739 45.512 -9.824 1.00 55.40 ? 611 HOH C O 1 HETATM 12115 O O . HOH Z 5 . ? -12.388 65.628 -23.156 1.00 66.61 ? 612 HOH C O 1 HETATM 12116 O O . HOH Z 5 . ? -37.075 74.697 -70.289 1.00 40.23 ? 613 HOH C O 1 HETATM 12117 O O . HOH Z 5 . ? -33.163 72.558 -37.557 1.00 48.61 ? 614 HOH C O 1 HETATM 12118 O O . HOH Z 5 . ? -24.588 56.856 -68.005 1.00 49.61 ? 615 HOH C O 1 HETATM 12119 O O . HOH Z 5 . ? -18.349 60.976 -66.953 1.00 55.38 ? 616 HOH C O 1 HETATM 12120 O O . HOH Z 5 . ? -16.555 63.130 -68.781 1.00 36.27 ? 617 HOH C O 1 HETATM 12121 O O . HOH Z 5 . ? -34.434 82.306 -57.399 1.00 56.68 ? 618 HOH C O 1 HETATM 12122 O O . HOH Z 5 . ? -16.894 73.359 -39.197 1.00 59.77 ? 619 HOH C O 1 HETATM 12123 O O . HOH Z 5 . ? -33.922 49.729 -58.091 1.00 39.64 ? 620 HOH C O 1 HETATM 12124 O O . HOH Z 5 . ? -31.301 76.296 -73.298 1.00 47.94 ? 621 HOH C O 1 HETATM 12125 O O . HOH Z 5 . ? -48.590 42.783 -62.140 1.00 57.80 ? 622 HOH C O 1 HETATM 12126 O O . HOH Z 5 . ? -39.734 53.853 -40.980 1.00 68.92 ? 623 HOH C O 1 HETATM 12127 O O . HOH Z 5 . ? -48.794 49.528 -52.835 1.00 49.21 ? 624 HOH C O 1 HETATM 12128 O O . HOH Z 5 . ? -18.128 74.206 -52.047 1.00 50.80 ? 625 HOH C O 1 HETATM 12129 O O . HOH Z 5 . ? -40.817 54.511 -51.238 1.00 48.65 ? 626 HOH C O 1 HETATM 12130 O O . HOH Z 5 . ? -49.557 61.810 -65.287 1.00 47.09 ? 627 HOH C O 1 HETATM 12131 O O . HOH Z 5 . ? -39.130 61.216 -80.155 1.00 51.12 ? 628 HOH C O 1 HETATM 12132 O O . HOH Z 5 . ? -52.055 68.282 -71.881 1.00 57.04 ? 629 HOH C O 1 HETATM 12133 O O . HOH Z 5 . ? -33.542 66.398 -82.024 1.00 51.82 ? 630 HOH C O 1 HETATM 12134 O O . HOH Z 5 . ? -22.203 82.410 -48.391 1.00 62.63 ? 631 HOH C O 1 HETATM 12135 O O . HOH Z 5 . ? -27.794 54.599 -77.586 1.00 52.19 ? 632 HOH C O 1 HETATM 12136 O O . HOH Z 5 . ? -45.832 62.540 -81.908 1.00 44.49 ? 633 HOH C O 1 HETATM 12137 O O . HOH Z 5 . ? -49.824 49.407 -63.165 1.00 56.86 ? 634 HOH C O 1 HETATM 12138 O O . HOH Z 5 . ? -12.732 65.773 -42.057 1.00 57.46 ? 635 HOH C O 1 HETATM 12139 O O . HOH Z 5 . ? -40.106 58.836 -81.594 1.00 58.89 ? 636 HOH C O 1 HETATM 12140 O O . HOH Z 5 . ? -47.354 47.120 -64.047 1.00 57.92 ? 637 HOH C O 1 HETATM 12141 O O . HOH Z 5 . ? -47.039 61.515 -47.793 1.00 46.04 ? 638 HOH C O 1 HETATM 12142 O O . HOH Z 5 . ? -14.364 70.058 -25.671 1.00 55.82 ? 639 HOH C O 1 HETATM 12143 O O . HOH Z 5 . ? -25.088 54.968 -73.844 1.00 60.27 ? 640 HOH C O 1 HETATM 12144 O O . HOH Z 5 . ? -16.804 65.023 -60.454 1.00 56.83 ? 641 HOH C O 1 HETATM 12145 O O . HOH Z 5 . ? -38.172 54.948 -34.357 1.00 60.48 ? 642 HOH C O 1 HETATM 12146 O O . HOH Z 5 . ? -47.924 57.292 -64.104 1.00 59.66 ? 643 HOH C O 1 HETATM 12147 O O . HOH Z 5 . ? -30.888 79.735 -68.447 1.00 54.19 ? 644 HOH C O 1 HETATM 12148 O O . HOH Z 5 . ? -14.562 59.545 -32.110 1.00 39.60 ? 645 HOH C O 1 HETATM 12149 O O . HOH Z 5 . ? -47.631 70.035 -58.469 1.00 46.32 ? 646 HOH C O 1 HETATM 12150 O O . HOH Z 5 . ? -41.409 52.797 -49.150 1.00 42.81 ? 647 HOH C O 1 HETATM 12151 O O . HOH Z 5 . ? -25.015 52.347 -30.763 1.00 48.40 ? 648 HOH C O 1 HETATM 12152 O O . HOH Z 5 . ? -28.605 54.783 -33.842 1.00 42.72 ? 649 HOH C O 1 HETATM 12153 O O . HOH Z 5 . ? -36.170 64.400 -26.124 1.00 62.89 ? 650 HOH C O 1 HETATM 12154 O O . HOH Z 5 . ? -49.384 59.791 -63.871 1.00 49.35 ? 651 HOH C O 1 HETATM 12155 O O . HOH Z 5 . ? -15.015 69.891 -61.401 1.00 54.77 ? 652 HOH C O 1 HETATM 12156 O O . HOH Z 5 . ? -31.125 52.073 -74.532 1.00 54.82 ? 653 HOH C O 1 HETATM 12157 O O . HOH Z 5 . ? 7.053 61.139 36.638 1.00 60.82 ? 654 HOH C O 1 HETATM 12158 O O . HOH AA 5 . ? 11.034 68.839 -46.462 1.00 43.95 ? 501 HOH E O 1 HETATM 12159 O O . HOH AA 5 . ? 22.050 75.765 -20.335 1.00 55.63 ? 502 HOH E O 1 HETATM 12160 O O . HOH AA 5 . ? 3.217 64.537 -60.834 1.00 42.74 ? 503 HOH E O 1 HETATM 12161 O O . HOH AA 5 . ? 29.849 71.857 -18.694 1.00 60.44 ? 504 HOH E O 1 HETATM 12162 O O . HOH AA 5 . ? -3.000 60.581 -57.042 1.00 48.48 ? 505 HOH E O 1 HETATM 12163 O O . HOH AA 5 . ? -11.170 47.890 -63.915 1.00 36.00 ? 506 HOH E O 1 HETATM 12164 O O . HOH AA 5 . ? 18.568 62.542 -8.766 1.00 57.78 ? 507 HOH E O 1 HETATM 12165 O O . HOH AA 5 . ? -9.873 67.386 -80.987 1.00 42.18 ? 508 HOH E O 1 HETATM 12166 O O . HOH AA 5 . ? -12.725 50.916 -58.351 1.00 44.64 ? 509 HOH E O 1 HETATM 12167 O O . HOH AA 5 . ? -11.958 54.200 -83.671 1.00 46.96 ? 510 HOH E O 1 HETATM 12168 O O . HOH AA 5 . ? 12.942 45.707 -68.785 1.00 62.78 ? 511 HOH E O 1 HETATM 12169 O O . HOH AA 5 . ? 13.887 64.420 -58.317 1.00 49.78 ? 512 HOH E O 1 HETATM 12170 O O . HOH AA 5 . ? 16.198 51.482 -57.779 1.00 46.62 ? 513 HOH E O 1 HETATM 12171 O O . HOH AA 5 . ? 1.817 64.071 -49.087 1.00 41.17 ? 514 HOH E O 1 HETATM 12172 O O . HOH AA 5 . ? -1.841 59.207 -52.064 1.00 41.97 ? 515 HOH E O 1 HETATM 12173 O O . HOH AA 5 . ? 3.289 38.944 -64.328 1.00 38.80 ? 516 HOH E O 1 HETATM 12174 O O . HOH AA 5 . ? -11.640 40.532 -66.259 1.00 50.19 ? 517 HOH E O 1 HETATM 12175 O O . HOH AA 5 . ? 2.324 67.645 -52.432 1.00 62.14 ? 518 HOH E O 1 HETATM 12176 O O . HOH AA 5 . ? -3.457 60.773 -60.416 1.00 36.38 ? 519 HOH E O 1 HETATM 12177 O O . HOH AA 5 . ? 8.201 66.028 -56.925 1.00 43.86 ? 520 HOH E O 1 HETATM 12178 O O . HOH AA 5 . ? -7.891 48.040 -90.412 1.00 43.81 ? 521 HOH E O 1 HETATM 12179 O O . HOH AA 5 . ? 6.061 70.004 -76.567 1.00 60.17 ? 522 HOH E O 1 HETATM 12180 O O . HOH AA 5 . ? 21.543 66.829 -49.712 1.00 67.92 ? 523 HOH E O 1 HETATM 12181 O O . HOH AA 5 . ? -23.851 56.092 -79.616 1.00 50.97 ? 524 HOH E O 1 HETATM 12182 O O . HOH AA 5 . ? -1.329 68.040 -70.544 1.00 46.84 ? 525 HOH E O 1 HETATM 12183 O O . HOH AA 5 . ? -16.391 42.035 -67.842 1.00 39.83 ? 526 HOH E O 1 HETATM 12184 O O . HOH AA 5 . ? -15.366 38.370 -64.827 1.00 45.49 ? 527 HOH E O 1 HETATM 12185 O O . HOH AA 5 . ? 5.765 51.084 -37.531 1.00 39.49 ? 528 HOH E O 1 HETATM 12186 O O . HOH AA 5 . ? 16.007 54.967 -43.095 1.00 49.43 ? 529 HOH E O 1 HETATM 12187 O O . HOH AA 5 . ? -10.671 49.619 -52.561 1.00 45.00 ? 530 HOH E O 1 HETATM 12188 O O . HOH AA 5 . ? -18.507 52.053 -92.486 1.00 59.50 ? 531 HOH E O 1 HETATM 12189 O O . HOH AA 5 . ? -3.533 66.844 -69.413 1.00 54.96 ? 532 HOH E O 1 HETATM 12190 O O . HOH AA 5 . ? 2.431 59.011 -48.619 1.00 37.34 ? 533 HOH E O 1 HETATM 12191 O O . HOH AA 5 . ? -10.293 43.133 -66.159 1.00 39.87 ? 534 HOH E O 1 HETATM 12192 O O . HOH AA 5 . ? 8.481 59.054 -80.660 1.00 58.17 ? 535 HOH E O 1 HETATM 12193 O O . HOH AA 5 . ? -11.492 58.926 -60.692 1.00 51.23 ? 536 HOH E O 1 HETATM 12194 O O . HOH AA 5 . ? -2.869 49.127 -74.161 1.00 39.17 ? 537 HOH E O 1 HETATM 12195 O O . HOH AA 5 . ? 15.570 60.735 -39.037 1.00 52.06 ? 538 HOH E O 1 HETATM 12196 O O . HOH AA 5 . ? 2.738 30.665 -70.075 1.00 62.27 ? 539 HOH E O 1 HETATM 12197 O O . HOH AA 5 . ? -25.735 55.948 -76.386 1.00 52.42 ? 540 HOH E O 1 HETATM 12198 O O . HOH AA 5 . ? 2.883 56.353 -80.806 1.00 52.03 ? 541 HOH E O 1 HETATM 12199 O O . HOH AA 5 . ? -9.492 32.931 -77.371 1.00 43.32 ? 542 HOH E O 1 HETATM 12200 O O . HOH AA 5 . ? -12.421 39.861 -81.880 1.00 47.58 ? 543 HOH E O 1 HETATM 12201 O O . HOH AA 5 . ? -8.417 39.763 -68.699 1.00 35.15 ? 544 HOH E O 1 HETATM 12202 O O . HOH AA 5 . ? 9.836 67.280 -36.466 1.00 46.60 ? 545 HOH E O 1 HETATM 12203 O O . HOH AA 5 . ? -11.466 65.059 -68.247 1.00 42.73 ? 546 HOH E O 1 HETATM 12204 O O . HOH AA 5 . ? 4.439 57.031 -39.651 1.00 43.34 ? 547 HOH E O 1 HETATM 12205 O O . HOH AA 5 . ? -15.355 64.906 -79.986 1.00 47.37 ? 548 HOH E O 1 HETATM 12206 O O . HOH AA 5 . ? -1.701 32.240 -67.926 1.00 49.80 ? 549 HOH E O 1 HETATM 12207 O O . HOH AA 5 . ? -27.364 66.407 -75.645 1.00 45.13 ? 550 HOH E O 1 HETATM 12208 O O . HOH AA 5 . ? -18.345 65.455 -69.501 1.00 49.84 ? 551 HOH E O 1 HETATM 12209 O O . HOH AA 5 . ? 14.052 68.874 -8.209 1.00 56.52 ? 552 HOH E O 1 HETATM 12210 O O . HOH AA 5 . ? 2.567 39.840 -61.413 1.00 41.38 ? 553 HOH E O 1 HETATM 12211 O O . HOH AA 5 . ? -15.373 36.673 -70.240 1.00 36.30 ? 554 HOH E O 1 HETATM 12212 O O . HOH AA 5 . ? -18.015 54.823 -71.163 1.00 53.85 ? 555 HOH E O 1 HETATM 12213 O O . HOH AA 5 . ? 12.780 53.086 -36.861 1.00 39.53 ? 556 HOH E O 1 HETATM 12214 O O . HOH AA 5 . ? -6.993 39.659 -64.886 1.00 33.55 ? 557 HOH E O 1 HETATM 12215 O O . HOH AA 5 . ? -18.761 41.728 -74.752 1.00 52.51 ? 558 HOH E O 1 HETATM 12216 O O . HOH AA 5 . ? -25.869 58.432 -77.267 1.00 59.06 ? 559 HOH E O 1 HETATM 12217 O O . HOH AA 5 . ? 0.038 56.923 -34.885 1.00 34.54 ? 560 HOH E O 1 HETATM 12218 O O . HOH AA 5 . ? -5.633 47.509 -57.112 1.00 32.76 ? 561 HOH E O 1 HETATM 12219 O O . HOH AA 5 . ? -12.391 74.295 -73.018 1.00 49.15 ? 562 HOH E O 1 HETATM 12220 O O . HOH AA 5 . ? 11.367 52.514 -34.653 1.00 44.90 ? 563 HOH E O 1 HETATM 12221 O O . HOH AA 5 . ? -15.054 40.889 -78.198 1.00 32.58 ? 564 HOH E O 1 HETATM 12222 O O . HOH AA 5 . ? 11.293 49.351 -68.661 1.00 67.74 ? 565 HOH E O 1 HETATM 12223 O O . HOH AA 5 . ? -22.628 55.269 -81.986 1.00 44.35 ? 566 HOH E O 1 HETATM 12224 O O . HOH AA 5 . ? 20.262 55.139 -26.477 1.00 60.69 ? 567 HOH E O 1 HETATM 12225 O O . HOH AA 5 . ? 10.906 49.682 -45.301 1.00 47.73 ? 568 HOH E O 1 HETATM 12226 O O . HOH AA 5 . ? -13.402 55.293 -68.353 1.00 38.24 ? 569 HOH E O 1 HETATM 12227 O O . HOH AA 5 . ? 1.996 55.628 -36.440 1.00 35.26 ? 570 HOH E O 1 HETATM 12228 O O . HOH AA 5 . ? -6.472 37.320 -68.503 1.00 32.17 ? 571 HOH E O 1 HETATM 12229 O O . HOH AA 5 . ? -9.410 60.718 -71.540 1.00 52.32 ? 572 HOH E O 1 HETATM 12230 O O . HOH AA 5 . ? -4.075 58.568 -82.431 1.00 42.89 ? 573 HOH E O 1 HETATM 12231 O O . HOH AA 5 . ? 11.643 48.336 -51.972 1.00 46.89 ? 574 HOH E O 1 HETATM 12232 O O . HOH AA 5 . ? 12.314 53.834 -39.166 1.00 39.02 ? 575 HOH E O 1 HETATM 12233 O O . HOH AA 5 . ? -2.825 46.051 -55.412 1.00 57.41 ? 576 HOH E O 1 HETATM 12234 O O . HOH AA 5 . ? -28.201 62.572 -76.501 1.00 55.20 ? 577 HOH E O 1 HETATM 12235 O O . HOH AA 5 . ? -24.856 50.948 -79.972 1.00 57.79 ? 578 HOH E O 1 HETATM 12236 O O . HOH AA 5 . ? 4.593 58.396 -71.081 1.00 46.51 ? 579 HOH E O 1 HETATM 12237 O O . HOH AA 5 . ? -12.096 47.089 -67.982 1.00 29.59 ? 580 HOH E O 1 HETATM 12238 O O . HOH AA 5 . ? -10.540 52.633 -58.581 1.00 34.75 ? 581 HOH E O 1 HETATM 12239 O O . HOH AA 5 . ? -11.611 61.837 -64.910 1.00 42.91 ? 582 HOH E O 1 HETATM 12240 O O . HOH AA 5 . ? -16.931 36.684 -67.670 1.00 29.33 ? 583 HOH E O 1 HETATM 12241 O O . HOH AA 5 . ? 18.097 51.336 -45.937 1.00 56.74 ? 584 HOH E O 1 HETATM 12242 O O . HOH AA 5 . ? -24.357 52.033 -87.467 1.00 42.15 ? 585 HOH E O 1 HETATM 12243 O O . HOH AA 5 . ? -14.703 67.197 -79.210 1.00 40.71 ? 586 HOH E O 1 HETATM 12244 O O . HOH AA 5 . ? -11.374 49.348 -66.472 1.00 38.97 ? 587 HOH E O 1 HETATM 12245 O O . HOH AA 5 . ? -14.449 63.980 -67.503 1.00 43.30 ? 588 HOH E O 1 HETATM 12246 O O . HOH AA 5 . ? 8.618 62.852 -9.245 1.00 54.67 ? 589 HOH E O 1 HETATM 12247 O O . HOH AA 5 . ? -24.896 48.147 -74.944 1.00 55.70 ? 590 HOH E O 1 HETATM 12248 O O . HOH AA 5 . ? 15.588 62.150 -6.570 1.00 56.21 ? 591 HOH E O 1 HETATM 12249 O O . HOH AA 5 . ? -8.033 37.225 -66.015 1.00 37.78 ? 592 HOH E O 1 HETATM 12250 O O . HOH AA 5 . ? -24.183 42.779 -77.261 1.00 47.89 ? 593 HOH E O 1 HETATM 12251 O O . HOH AA 5 . ? 21.647 57.037 -48.217 1.00 44.14 ? 594 HOH E O 1 HETATM 12252 O O . HOH AA 5 . ? 14.697 54.704 -40.032 1.00 38.22 ? 595 HOH E O 1 HETATM 12253 O O . HOH AA 5 . ? -19.972 45.930 -70.217 1.00 35.74 ? 596 HOH E O 1 HETATM 12254 O O . HOH AA 5 . ? 4.740 67.710 -26.490 1.00 50.35 ? 597 HOH E O 1 HETATM 12255 O O . HOH AA 5 . ? -10.274 43.082 -88.256 1.00 39.79 ? 598 HOH E O 1 HETATM 12256 O O . HOH AA 5 . ? -17.399 45.184 -91.997 1.00 49.68 ? 599 HOH E O 1 HETATM 12257 O O . HOH AA 5 . ? -5.211 35.477 -61.346 1.00 64.98 ? 600 HOH E O 1 HETATM 12258 O O . HOH AA 5 . ? -0.509 67.594 -74.073 1.00 57.28 ? 601 HOH E O 1 HETATM 12259 O O . HOH AA 5 . ? -9.799 59.603 -64.669 1.00 55.94 ? 602 HOH E O 1 HETATM 12260 O O . HOH AA 5 . ? 2.448 66.909 -47.575 1.00 52.02 ? 603 HOH E O 1 HETATM 12261 O O . HOH AA 5 . ? 10.124 47.612 -54.208 1.00 50.04 ? 604 HOH E O 1 HETATM 12262 O O . HOH AA 5 . ? -7.696 59.615 -58.253 1.00 46.91 ? 605 HOH E O 1 HETATM 12263 O O . HOH AA 5 . ? 20.216 55.414 -37.699 1.00 60.49 ? 606 HOH E O 1 HETATM 12264 O O . HOH AA 5 . ? 1.404 61.290 -49.528 1.00 37.64 ? 607 HOH E O 1 HETATM 12265 O O . HOH AA 5 . ? 6.897 60.639 -82.356 1.00 64.08 ? 608 HOH E O 1 HETATM 12266 O O . HOH AA 5 . ? -14.054 54.237 -61.561 1.00 39.50 ? 609 HOH E O 1 HETATM 12267 O O . HOH AA 5 . ? 10.038 46.698 -56.587 1.00 57.67 ? 610 HOH E O 1 HETATM 12268 O O . HOH AA 5 . ? 18.327 63.772 -4.457 1.00 57.55 ? 611 HOH E O 1 HETATM 12269 O O . HOH AA 5 . ? 21.337 55.063 -22.678 1.00 59.41 ? 612 HOH E O 1 HETATM 12270 O O . HOH AA 5 . ? -7.971 42.133 -64.849 1.00 30.04 ? 613 HOH E O 1 HETATM 12271 O O . HOH AA 5 . ? 8.169 45.487 -78.071 1.00 56.10 ? 614 HOH E O 1 HETATM 12272 O O . HOH AA 5 . ? 8.785 65.230 -22.498 1.00 46.44 ? 615 HOH E O 1 HETATM 12273 O O . HOH AA 5 . ? -4.075 31.875 -69.217 1.00 55.01 ? 616 HOH E O 1 HETATM 12274 O O . HOH AA 5 . ? 18.608 48.514 -49.050 1.00 56.49 ? 617 HOH E O 1 HETATM 12275 O O . HOH AA 5 . ? 7.047 68.757 -39.834 1.00 50.36 ? 618 HOH E O 1 HETATM 12276 O O . HOH AA 5 . ? -19.551 52.847 -95.299 1.00 66.84 ? 619 HOH E O 1 HETATM 12277 O O . HOH AA 5 . ? 9.461 57.787 -66.040 1.00 49.13 ? 620 HOH E O 1 HETATM 12278 O O . HOH AA 5 . ? -25.612 66.876 -86.430 1.00 64.54 ? 621 HOH E O 1 HETATM 12279 O O . HOH AA 5 . ? -9.678 45.948 -64.468 1.00 42.35 ? 622 HOH E O 1 HETATM 12280 O O . HOH AA 5 . ? -22.458 46.680 -71.017 1.00 50.50 ? 623 HOH E O 1 HETATM 12281 O O . HOH AA 5 . ? -14.495 41.138 -65.416 1.00 47.92 ? 624 HOH E O 1 HETATM 12282 O O . HOH AA 5 . ? -7.395 60.650 -64.697 1.00 58.57 ? 625 HOH E O 1 HETATM 12283 O O . HOH AA 5 . ? -2.411 46.584 -50.650 1.00 44.61 ? 626 HOH E O 1 HETATM 12284 O O . HOH AA 5 . ? 1.591 47.135 -48.037 1.00 48.86 ? 627 HOH E O 1 HETATM 12285 O O . HOH AA 5 . ? 8.324 44.796 -56.150 1.00 48.05 ? 628 HOH E O 1 HETATM 12286 O O . HOH AA 5 . ? 0.946 66.685 -42.242 1.00 67.71 ? 629 HOH E O 1 HETATM 12287 O O . HOH AA 5 . ? 2.641 67.332 -40.591 1.00 61.35 ? 630 HOH E O 1 HETATM 12288 O O . HOH AA 5 . ? 14.442 62.045 -60.216 1.00 59.47 ? 631 HOH E O 1 HETATM 12289 O O . HOH AA 5 . ? -19.802 50.279 -69.884 1.00 49.26 ? 632 HOH E O 1 HETATM 12290 O O . HOH AA 5 . ? -14.158 45.661 -66.630 1.00 40.65 ? 633 HOH E O 1 HETATM 12291 O O . HOH AA 5 . ? -27.065 65.587 -87.942 1.00 59.05 ? 634 HOH E O 1 HETATM 12292 O O . HOH AA 5 . ? -16.582 44.869 -67.883 1.00 43.87 ? 635 HOH E O 1 HETATM 12293 O O . HOH AA 5 . ? -0.850 69.627 -72.661 1.00 48.26 ? 636 HOH E O 1 HETATM 12294 O O . HOH AA 5 . ? 10.932 71.506 -52.984 1.00 52.09 ? 637 HOH E O 1 HETATM 12295 O O . HOH AA 5 . ? -0.327 33.788 -80.790 1.00 66.07 ? 638 HOH E O 1 HETATM 12296 O O . HOH AA 5 . ? 8.535 43.759 -53.570 1.00 57.87 ? 639 HOH E O 1 HETATM 12297 O O . HOH AA 5 . ? 8.103 45.480 -47.286 1.00 54.76 ? 640 HOH E O 1 HETATM 12298 O O . HOH AA 5 . ? -24.990 44.875 -73.497 1.00 49.92 ? 641 HOH E O 1 HETATM 12299 O O . HOH AA 5 . ? -10.653 64.444 -84.715 1.00 52.21 ? 642 HOH E O 1 HETATM 12300 O O . HOH AA 5 . ? 1.540 56.033 -39.154 1.00 45.10 ? 643 HOH E O 1 HETATM 12301 O O . HOH AA 5 . ? 2.273 53.247 -40.537 1.00 37.54 ? 644 HOH E O 1 HETATM 12302 O O . HOH AA 5 . ? -18.354 48.719 -68.708 1.00 49.61 ? 645 HOH E O 1 HETATM 12303 O O . HOH AA 5 . ? -0.676 65.700 -49.628 1.00 42.92 ? 646 HOH E O 1 HETATM 12304 O O . HOH AA 5 . ? -7.694 35.091 -64.482 1.00 45.99 ? 647 HOH E O 1 HETATM 12305 O O . HOH AA 5 . ? -9.437 30.039 -66.858 1.00 62.61 ? 648 HOH E O 1 HETATM 12306 O O . HOH BA 5 . ? -6.897 37.712 -7.568 1.00 62.64 ? 201 HOH B O 1 HETATM 12307 O O . HOH BA 5 . ? 13.878 46.138 21.109 1.00 67.72 ? 202 HOH B O 1 HETATM 12308 O O . HOH BA 5 . ? -18.952 41.717 -31.501 1.00 45.47 ? 203 HOH B O 1 HETATM 12309 O O . HOH BA 5 . ? 5.972 45.885 0.993 1.00 45.35 ? 204 HOH B O 1 HETATM 12310 O O . HOH BA 5 . ? -12.425 49.667 -55.554 1.00 37.24 ? 205 HOH B O 1 HETATM 12311 O O . HOH BA 5 . ? -16.334 47.910 -52.677 1.00 50.21 ? 206 HOH B O 1 HETATM 12312 O O . HOH BA 5 . ? 4.838 30.927 21.216 1.00 60.19 ? 207 HOH B O 1 HETATM 12313 O O . HOH BA 5 . ? 7.682 41.228 -28.872 1.00 40.12 ? 208 HOH B O 1 HETATM 12314 O O . HOH BA 5 . ? -1.772 46.273 -48.286 1.00 40.68 ? 209 HOH B O 1 HETATM 12315 O O . HOH BA 5 . ? -4.610 45.280 -50.436 1.00 43.50 ? 210 HOH B O 1 HETATM 12316 O O . HOH BA 5 . ? 19.924 45.191 27.406 1.00 51.60 ? 211 HOH B O 1 HETATM 12317 O O . HOH BA 5 . ? 24.700 30.165 24.648 1.00 67.08 ? 212 HOH B O 1 HETATM 12318 O O . HOH BA 5 . ? 6.860 49.480 1.644 1.00 57.10 ? 213 HOH B O 1 HETATM 12319 O O . HOH BA 5 . ? 31.524 37.014 31.008 1.00 51.90 ? 214 HOH B O 1 HETATM 12320 O O . HOH BA 5 . ? 1.618 49.092 -38.391 1.00 32.67 ? 215 HOH B O 1 HETATM 12321 O O . HOH BA 5 . ? -2.598 42.696 -41.544 1.00 47.19 ? 216 HOH B O 1 HETATM 12322 O O . HOH BA 5 . ? 10.985 35.862 25.041 1.00 48.27 ? 217 HOH B O 1 HETATM 12323 O O . HOH BA 5 . ? 0.064 42.608 -37.780 1.00 52.33 ? 218 HOH B O 1 HETATM 12324 O O . HOH BA 5 . ? -16.343 41.334 -36.512 1.00 30.22 ? 219 HOH B O 1 HETATM 12325 O O . HOH BA 5 . ? -14.225 47.606 -57.368 1.00 45.67 ? 220 HOH B O 1 HETATM 12326 O O . HOH BA 5 . ? -13.309 40.444 -41.294 1.00 29.42 ? 221 HOH B O 1 HETATM 12327 O O . HOH BA 5 . ? -14.656 40.658 -21.774 1.00 56.48 ? 222 HOH B O 1 HETATM 12328 O O . HOH BA 5 . ? 8.162 41.808 -21.949 1.00 43.48 ? 223 HOH B O 1 HETATM 12329 O O . HOH BA 5 . ? -2.572 40.951 -38.543 1.00 40.37 ? 224 HOH B O 1 HETATM 12330 O O . HOH BA 5 . ? -5.849 45.276 -58.488 1.00 35.75 ? 225 HOH B O 1 HETATM 12331 O O . HOH BA 5 . ? 0.182 49.460 -45.889 1.00 32.08 ? 226 HOH B O 1 HETATM 12332 O O . HOH BA 5 . ? -6.665 43.208 -45.331 1.00 29.76 ? 227 HOH B O 1 HETATM 12333 O O . HOH BA 5 . ? -4.517 42.908 -34.733 1.00 30.34 ? 228 HOH B O 1 HETATM 12334 O O . HOH BA 5 . ? -0.706 48.997 -49.846 1.00 48.58 ? 229 HOH B O 1 HETATM 12335 O O . HOH BA 5 . ? -6.371 53.852 -46.475 1.00 50.83 ? 230 HOH B O 1 HETATM 12336 O O . HOH BA 5 . ? 0.944 42.195 -41.521 1.00 34.09 ? 231 HOH B O 1 HETATM 12337 O O . HOH BA 5 . ? -11.211 39.073 -56.843 1.00 45.95 ? 232 HOH B O 1 HETATM 12338 O O . HOH BA 5 . ? 21.729 29.567 7.203 1.00 59.46 ? 233 HOH B O 1 HETATM 12339 O O . HOH BA 5 . ? -8.057 45.876 -30.085 1.00 38.85 ? 234 HOH B O 1 HETATM 12340 O O . HOH BA 5 . ? -9.281 42.062 -60.831 1.00 51.84 ? 235 HOH B O 1 HETATM 12341 O O . HOH BA 5 . ? -0.572 50.632 -38.947 1.00 25.37 ? 236 HOH B O 1 HETATM 12342 O O . HOH BA 5 . ? -5.574 52.231 -48.482 1.00 34.32 ? 237 HOH B O 1 HETATM 12343 O O . HOH BA 5 . ? -7.890 38.268 -54.292 1.00 72.23 ? 238 HOH B O 1 HETATM 12344 O O . HOH BA 5 . ? -2.799 43.424 -53.347 1.00 58.58 ? 239 HOH B O 1 HETATM 12345 O O . HOH BA 5 . ? -19.078 39.955 -27.672 1.00 42.17 ? 240 HOH B O 1 HETATM 12346 O O . HOH BA 5 . ? -12.518 43.889 -30.825 1.00 34.35 ? 241 HOH B O 1 HETATM 12347 O O . HOH BA 5 . ? 14.966 48.698 -1.723 1.00 48.35 ? 242 HOH B O 1 HETATM 12348 O O . HOH BA 5 . ? -9.614 40.955 -48.070 1.00 30.11 ? 243 HOH B O 1 HETATM 12349 O O . HOH BA 5 . ? -15.243 36.945 -49.652 1.00 56.19 ? 244 HOH B O 1 HETATM 12350 O O . HOH BA 5 . ? 22.233 35.126 2.680 1.00 51.78 ? 245 HOH B O 1 HETATM 12351 O O . HOH BA 5 . ? 9.776 37.135 32.268 1.00 51.97 ? 246 HOH B O 1 HETATM 12352 O O . HOH BA 5 . ? -2.688 41.645 -44.011 1.00 32.96 ? 247 HOH B O 1 HETATM 12353 O O . HOH BA 5 . ? -13.608 40.559 -44.250 1.00 53.81 ? 248 HOH B O 1 HETATM 12354 O O . HOH BA 5 . ? -10.865 42.181 -44.146 1.00 40.94 ? 249 HOH B O 1 HETATM 12355 O O . HOH BA 5 . ? -11.445 41.269 -58.780 1.00 69.54 ? 250 HOH B O 1 HETATM 12356 O O . HOH BA 5 . ? -12.760 37.826 -50.960 1.00 51.76 ? 251 HOH B O 1 HETATM 12357 O O . HOH BA 5 . ? 0.146 33.958 -8.494 1.00 57.37 ? 252 HOH B O 1 HETATM 12358 O O . HOH BA 5 . ? 3.024 41.764 2.296 1.00 61.01 ? 253 HOH B O 1 HETATM 12359 O O . HOH BA 5 . ? -9.778 34.649 -44.760 1.00 39.81 ? 254 HOH B O 1 HETATM 12360 O O . HOH BA 5 . ? -13.671 35.206 -48.424 1.00 48.93 ? 255 HOH B O 1 HETATM 12361 O O . HOH BA 5 . ? -3.205 43.665 -56.389 1.00 45.45 ? 256 HOH B O 1 HETATM 12362 O O . HOH BA 5 . ? 14.581 49.224 -4.710 1.00 57.24 ? 257 HOH B O 1 HETATM 12363 O O . HOH BA 5 . ? -3.432 44.063 -48.193 1.00 50.47 ? 258 HOH B O 1 HETATM 12364 O O . HOH BA 5 . ? -9.235 42.556 -46.088 1.00 29.63 ? 259 HOH B O 1 HETATM 12365 O O . HOH BA 5 . ? -4.202 42.203 -45.991 1.00 41.37 ? 260 HOH B O 1 HETATM 12366 O O . HOH BA 5 . ? -11.065 41.186 -30.608 1.00 46.65 ? 261 HOH B O 1 HETATM 12367 O O . HOH BA 5 . ? 16.885 48.304 -4.018 1.00 55.39 ? 262 HOH B O 1 HETATM 12368 O O . HOH BA 5 . ? -4.518 40.798 -36.179 1.00 48.21 ? 263 HOH B O 1 HETATM 12369 O O . HOH BA 5 . ? -13.882 50.006 -53.218 1.00 51.70 ? 264 HOH B O 1 HETATM 12370 O O . HOH BA 5 . ? 18.105 45.712 0.676 1.00 43.99 ? 265 HOH B O 1 HETATM 12371 O O . HOH BA 5 . ? 13.893 46.184 -11.614 1.00 54.91 ? 266 HOH B O 1 HETATM 12372 O O . HOH BA 5 . ? -1.723 37.889 -42.056 1.00 43.15 ? 267 HOH B O 1 HETATM 12373 O O . HOH BA 5 . ? -10.317 50.460 -10.415 1.00 40.01 ? 268 HOH B O 1 HETATM 12374 O O . HOH BA 5 . ? -1.056 52.353 -37.012 1.00 37.27 ? 269 HOH B O 1 HETATM 12375 O O . HOH BA 5 . ? -9.050 42.776 -36.676 1.00 32.66 ? 270 HOH B O 1 HETATM 12376 O O . HOH BA 5 . ? -7.223 43.803 -34.866 1.00 31.47 ? 271 HOH B O 1 HETATM 12377 O O . HOH BA 5 . ? 17.768 43.203 0.981 1.00 59.66 ? 272 HOH B O 1 HETATM 12378 O O . HOH BA 5 . ? 9.441 39.769 -20.922 1.00 37.46 ? 273 HOH B O 1 HETATM 12379 O O . HOH BA 5 . ? -8.071 43.915 -62.871 1.00 41.36 ? 274 HOH B O 1 HETATM 12380 O O . HOH BA 5 . ? -0.472 52.406 -40.881 1.00 26.22 ? 275 HOH B O 1 HETATM 12381 O O . HOH BA 5 . ? -10.963 42.368 -34.706 1.00 28.52 ? 276 HOH B O 1 HETATM 12382 O O . HOH CA 5 . ? -17.395 48.811 -29.315 1.00 50.26 ? 201 HOH D O 1 HETATM 12383 O O . HOH CA 5 . ? -19.080 51.032 -50.894 1.00 47.28 ? 202 HOH D O 1 HETATM 12384 O O . HOH CA 5 . ? 20.202 67.050 30.259 1.00 70.84 ? 203 HOH D O 1 HETATM 12385 O O . HOH CA 5 . ? -25.725 57.875 -44.760 1.00 64.95 ? 204 HOH D O 1 HETATM 12386 O O . HOH CA 5 . ? 23.210 59.592 26.369 1.00 71.90 ? 205 HOH D O 1 HETATM 12387 O O . HOH CA 5 . ? -10.169 65.978 -36.365 1.00 43.16 ? 206 HOH D O 1 HETATM 12388 O O . HOH CA 5 . ? -19.385 46.394 -30.510 1.00 43.72 ? 207 HOH D O 1 HETATM 12389 O O . HOH CA 5 . ? -9.306 42.636 -39.226 1.00 31.61 ? 208 HOH D O 1 HETATM 12390 O O . HOH CA 5 . ? 17.079 69.628 30.177 1.00 55.13 ? 209 HOH D O 1 HETATM 12391 O O . HOH CA 5 . ? -22.982 51.981 -41.585 1.00 32.63 ? 210 HOH D O 1 HETATM 12392 O O . HOH CA 5 . ? -30.114 45.349 -50.016 1.00 46.71 ? 211 HOH D O 1 HETATM 12393 O O . HOH CA 5 . ? -14.059 53.066 -30.263 1.00 27.35 ? 212 HOH D O 1 HETATM 12394 O O . HOH CA 5 . ? -3.771 57.582 -7.590 1.00 40.29 ? 213 HOH D O 1 HETATM 12395 O O . HOH CA 5 . ? -11.261 44.592 -33.223 1.00 26.58 ? 214 HOH D O 1 HETATM 12396 O O . HOH CA 5 . ? -7.329 61.124 16.086 1.00 49.43 ? 215 HOH D O 1 HETATM 12397 O O . HOH CA 5 . ? 22.329 67.359 29.133 1.00 49.69 ? 216 HOH D O 1 HETATM 12398 O O . HOH CA 5 . ? 9.788 53.850 -7.285 1.00 46.47 ? 217 HOH D O 1 HETATM 12399 O O . HOH CA 5 . ? -20.213 55.452 -41.457 1.00 42.98 ? 218 HOH D O 1 HETATM 12400 O O . HOH CA 5 . ? -24.958 43.267 -41.676 1.00 58.91 ? 219 HOH D O 1 HETATM 12401 O O . HOH CA 5 . ? -26.510 42.209 -47.522 1.00 28.21 ? 220 HOH D O 1 HETATM 12402 O O . HOH CA 5 . ? 15.998 65.706 11.048 1.00 60.74 ? 221 HOH D O 1 HETATM 12403 O O . HOH CA 5 . ? -0.723 53.750 1.870 1.00 54.11 ? 222 HOH D O 1 HETATM 12404 O O . HOH CA 5 . ? -18.788 49.084 -33.138 1.00 40.03 ? 223 HOH D O 1 HETATM 12405 O O . HOH CA 5 . ? -20.231 43.227 -38.408 1.00 46.60 ? 224 HOH D O 1 HETATM 12406 O O . HOH CA 5 . ? -18.418 57.928 -39.144 1.00 37.86 ? 225 HOH D O 1 HETATM 12407 O O . HOH CA 5 . ? -13.904 47.746 -17.335 1.00 49.36 ? 226 HOH D O 1 HETATM 12408 O O . HOH CA 5 . ? -14.915 43.172 -43.105 1.00 39.64 ? 227 HOH D O 1 HETATM 12409 O O . HOH CA 5 . ? -9.341 50.026 -12.772 1.00 43.10 ? 228 HOH D O 1 HETATM 12410 O O . HOH CA 5 . ? 1.663 67.652 35.083 1.00 52.98 ? 229 HOH D O 1 HETATM 12411 O O . HOH CA 5 . ? -19.945 49.818 -38.566 1.00 32.06 ? 230 HOH D O 1 HETATM 12412 O O . HOH CA 5 . ? -9.801 68.486 -33.885 1.00 51.69 ? 231 HOH D O 1 HETATM 12413 O O . HOH CA 5 . ? -19.752 46.173 -51.304 1.00 37.09 ? 232 HOH D O 1 HETATM 12414 O O . HOH CA 5 . ? -22.693 47.992 -52.874 1.00 44.93 ? 233 HOH D O 1 HETATM 12415 O O . HOH CA 5 . ? 16.765 57.263 17.416 1.00 51.71 ? 234 HOH D O 1 HETATM 12416 O O . HOH CA 5 . ? -18.293 50.994 -30.181 1.00 41.72 ? 235 HOH D O 1 HETATM 12417 O O . HOH CA 5 . ? 4.848 47.080 -5.559 1.00 55.91 ? 236 HOH D O 1 HETATM 12418 O O . HOH CA 5 . ? 24.247 64.363 33.525 1.00 64.88 ? 237 HOH D O 1 HETATM 12419 O O . HOH CA 5 . ? -29.067 41.760 -48.953 1.00 34.36 ? 238 HOH D O 1 HETATM 12420 O O . HOH CA 5 . ? 3.461 65.102 30.424 1.00 63.83 ? 239 HOH D O 1 HETATM 12421 O O . HOH CA 5 . ? 11.401 58.338 -1.020 1.00 41.33 ? 240 HOH D O 1 HETATM 12422 O O . HOH CA 5 . ? -6.621 67.400 5.882 1.00 59.62 ? 241 HOH D O 1 HETATM 12423 O O . HOH CA 5 . ? -29.538 50.195 -47.789 1.00 55.88 ? 242 HOH D O 1 HETATM 12424 O O . HOH CA 5 . ? -25.815 56.638 -37.130 1.00 33.46 ? 243 HOH D O 1 HETATM 12425 O O . HOH CA 5 . ? -20.815 48.291 -34.334 1.00 35.48 ? 244 HOH D O 1 HETATM 12426 O O . HOH CA 5 . ? -6.547 67.518 3.493 1.00 66.90 ? 245 HOH D O 1 HETATM 12427 O O . HOH CA 5 . ? -6.668 55.493 9.072 1.00 60.69 ? 246 HOH D O 1 HETATM 12428 O O . HOH CA 5 . ? 0.819 54.641 6.061 1.00 59.38 ? 247 HOH D O 1 HETATM 12429 O O . HOH CA 5 . ? -24.197 49.895 -52.782 1.00 44.49 ? 248 HOH D O 1 HETATM 12430 O O . HOH CA 5 . ? -3.502 71.849 24.656 1.00 61.61 ? 249 HOH D O 1 HETATM 12431 O O . HOH CA 5 . ? 0.901 52.588 12.380 1.00 48.13 ? 250 HOH D O 1 HETATM 12432 O O . HOH CA 5 . ? 7.909 57.548 -3.013 1.00 48.58 ? 251 HOH D O 1 HETATM 12433 O O . HOH CA 5 . ? 7.792 51.910 4.925 1.00 46.59 ? 252 HOH D O 1 HETATM 12434 O O . HOH CA 5 . ? -20.574 51.331 -40.258 1.00 40.36 ? 253 HOH D O 1 HETATM 12435 O O . HOH CA 5 . ? 7.756 52.704 2.195 1.00 52.14 ? 254 HOH D O 1 HETATM 12436 O O . HOH CA 5 . ? 4.920 74.057 8.958 1.00 59.71 ? 255 HOH D O 1 HETATM 12437 O O . HOH CA 5 . ? -21.311 45.783 -38.299 1.00 37.57 ? 256 HOH D O 1 HETATM 12438 O O . HOH CA 5 . ? 0.756 67.329 -18.163 1.00 46.37 ? 257 HOH D O 1 HETATM 12439 O O . HOH CA 5 . ? -26.995 48.914 -52.609 1.00 55.86 ? 258 HOH D O 1 HETATM 12440 O O . HOH CA 5 . ? -16.723 53.578 -30.138 1.00 51.77 ? 259 HOH D O 1 HETATM 12441 O O . HOH CA 5 . ? -21.313 48.221 -36.896 1.00 45.66 ? 260 HOH D O 1 HETATM 12442 O O . HOH CA 5 . ? -29.601 42.842 -51.181 1.00 46.19 ? 261 HOH D O 1 HETATM 12443 O O . HOH CA 5 . ? -18.416 48.290 -50.829 1.00 51.04 ? 262 HOH D O 1 HETATM 12444 O O . HOH CA 5 . ? 3.532 46.945 -0.756 1.00 48.46 ? 263 HOH D O 1 HETATM 12445 O O . HOH CA 5 . ? 3.307 51.813 12.871 1.00 57.86 ? 264 HOH D O 1 HETATM 12446 O O . HOH CA 5 . ? -13.268 54.443 -32.274 1.00 38.51 ? 265 HOH D O 1 HETATM 12447 O O . HOH CA 5 . ? 2.641 54.512 12.161 1.00 54.14 ? 266 HOH D O 1 HETATM 12448 O O . HOH CA 5 . ? 6.045 50.775 12.332 1.00 60.68 ? 267 HOH D O 1 HETATM 12449 O O . HOH CA 5 . ? -23.104 50.595 -30.463 1.00 57.73 ? 268 HOH D O 1 HETATM 12450 O O . HOH CA 5 . ? 7.189 53.093 11.998 1.00 56.07 ? 269 HOH D O 1 HETATM 12451 O O . HOH CA 5 . ? -8.432 44.630 -32.564 1.00 34.91 ? 270 HOH D O 1 HETATM 12452 O O . HOH CA 5 . ? -27.321 54.377 -36.299 1.00 40.60 ? 271 HOH D O 1 HETATM 12453 O O . HOH DA 5 . ? -3.827 55.647 -42.863 1.00 30.03 ? 201 HOH F O 1 HETATM 12454 O O . HOH DA 5 . ? 1.765 65.614 -26.438 1.00 53.90 ? 202 HOH F O 1 HETATM 12455 O O . HOH DA 5 . ? 46.151 58.198 6.828 1.00 56.40 ? 203 HOH F O 1 HETATM 12456 O O . HOH DA 5 . ? 11.991 53.666 -8.862 1.00 50.57 ? 204 HOH F O 1 HETATM 12457 O O . HOH DA 5 . ? 5.287 63.030 -21.460 1.00 39.50 ? 205 HOH F O 1 HETATM 12458 O O . HOH DA 5 . ? 39.370 66.621 4.797 1.00 68.46 ? 206 HOH F O 1 HETATM 12459 O O . HOH DA 5 . ? 42.824 62.901 10.114 1.00 68.35 ? 207 HOH F O 1 HETATM 12460 O O . HOH DA 5 . ? 38.765 53.289 10.858 1.00 59.09 ? 208 HOH F O 1 HETATM 12461 O O . HOH DA 5 . ? 3.832 44.996 -43.552 1.00 37.48 ? 209 HOH F O 1 HETATM 12462 O O . HOH DA 5 . ? 8.347 43.785 -29.581 1.00 42.10 ? 210 HOH F O 1 HETATM 12463 O O . HOH DA 5 . ? -15.627 52.380 -53.268 1.00 45.82 ? 211 HOH F O 1 HETATM 12464 O O . HOH DA 5 . ? 5.557 51.921 -40.678 1.00 43.50 ? 212 HOH F O 1 HETATM 12465 O O . HOH DA 5 . ? -14.381 61.723 -38.354 1.00 35.28 ? 213 HOH F O 1 HETATM 12466 O O . HOH DA 5 . ? -16.933 66.072 -51.533 1.00 39.14 ? 214 HOH F O 1 HETATM 12467 O O . HOH DA 5 . ? -18.630 64.057 -52.120 1.00 37.59 ? 215 HOH F O 1 HETATM 12468 O O . HOH DA 5 . ? 30.725 68.840 28.687 1.00 64.30 ? 216 HOH F O 1 HETATM 12469 O O . HOH DA 5 . ? 8.238 42.815 -31.957 1.00 51.88 ? 217 HOH F O 1 HETATM 12470 O O . HOH DA 5 . ? -4.228 61.112 -26.908 1.00 51.35 ? 218 HOH F O 1 HETATM 12471 O O . HOH DA 5 . ? 7.472 44.937 -41.933 1.00 48.69 ? 219 HOH F O 1 HETATM 12472 O O . HOH DA 5 . ? 11.491 40.477 -22.457 1.00 42.44 ? 220 HOH F O 1 HETATM 12473 O O . HOH DA 5 . ? -2.775 53.964 -47.640 1.00 30.89 ? 221 HOH F O 1 HETATM 12474 O O . HOH DA 5 . ? -7.124 59.456 -54.396 1.00 40.56 ? 222 HOH F O 1 HETATM 12475 O O . HOH DA 5 . ? 30.660 52.918 22.246 1.00 64.40 ? 223 HOH F O 1 HETATM 12476 O O . HOH DA 5 . ? -19.019 55.205 -52.124 1.00 31.02 ? 224 HOH F O 1 HETATM 12477 O O . HOH DA 5 . ? -13.590 63.130 -42.724 1.00 40.25 ? 225 HOH F O 1 HETATM 12478 O O . HOH DA 5 . ? -8.508 59.467 -44.920 1.00 39.09 ? 226 HOH F O 1 HETATM 12479 O O . HOH DA 5 . ? -17.251 56.987 -42.203 1.00 43.74 ? 227 HOH F O 1 HETATM 12480 O O . HOH DA 5 . ? -1.635 57.473 -36.959 1.00 33.14 ? 228 HOH F O 1 HETATM 12481 O O . HOH DA 5 . ? 4.404 53.568 -42.582 1.00 32.29 ? 229 HOH F O 1 HETATM 12482 O O . HOH DA 5 . ? -9.750 60.440 -32.779 1.00 44.31 ? 230 HOH F O 1 HETATM 12483 O O . HOH DA 5 . ? -5.566 57.265 -55.468 1.00 52.47 ? 231 HOH F O 1 HETATM 12484 O O . HOH DA 5 . ? -10.660 58.093 -33.562 1.00 29.56 ? 232 HOH F O 1 HETATM 12485 O O . HOH DA 5 . ? -8.337 59.296 -49.700 1.00 38.79 ? 233 HOH F O 1 HETATM 12486 O O . HOH DA 5 . ? -8.455 64.685 -41.154 1.00 55.00 ? 234 HOH F O 1 HETATM 12487 O O . HOH DA 5 . ? -0.416 51.608 -34.798 1.00 36.41 ? 235 HOH F O 1 HETATM 12488 O O . HOH DA 5 . ? -6.077 56.115 -47.254 1.00 41.70 ? 236 HOH F O 1 HETATM 12489 O O . HOH DA 5 . ? -18.305 55.751 -55.727 1.00 43.49 ? 237 HOH F O 1 HETATM 12490 O O . HOH DA 5 . ? 39.926 54.055 20.665 1.00 51.92 ? 238 HOH F O 1 HETATM 12491 O O . HOH DA 5 . ? 24.736 57.128 16.738 1.00 48.99 ? 239 HOH F O 1 HETATM 12492 O O . HOH DA 5 . ? 5.042 42.457 -37.236 1.00 46.84 ? 240 HOH F O 1 HETATM 12493 O O . HOH DA 5 . ? 31.571 53.902 -14.014 1.00 54.83 ? 241 HOH F O 1 HETATM 12494 O O . HOH DA 5 . ? -17.837 63.502 -57.737 1.00 46.85 ? 242 HOH F O 1 HETATM 12495 O O . HOH DA 5 . ? 41.311 46.959 1.767 1.00 72.27 ? 243 HOH F O 1 HETATM 12496 O O . HOH DA 5 . ? -2.336 61.133 -38.705 1.00 48.40 ? 244 HOH F O 1 HETATM 12497 O O . HOH DA 5 . ? -1.507 61.212 -50.077 1.00 43.13 ? 245 HOH F O 1 HETATM 12498 O O . HOH DA 5 . ? -4.304 54.759 -49.682 1.00 51.16 ? 246 HOH F O 1 HETATM 12499 O O . HOH DA 5 . ? -19.933 64.930 -56.102 1.00 50.21 ? 247 HOH F O 1 HETATM 12500 O O . HOH DA 5 . ? -14.987 62.834 -45.036 1.00 52.56 ? 248 HOH F O 1 HETATM 12501 O O . HOH DA 5 . ? 20.698 69.271 12.726 1.00 55.30 ? 249 HOH F O 1 HETATM 12502 O O . HOH DA 5 . ? 11.544 60.716 -2.091 1.00 49.27 ? 250 HOH F O 1 HETATM 12503 O O . HOH DA 5 . ? -8.090 58.263 -47.281 1.00 42.29 ? 251 HOH F O 1 HETATM 12504 O O . HOH DA 5 . ? 13.391 54.088 -2.572 1.00 50.42 ? 252 HOH F O 1 HETATM 12505 O O . HOH DA 5 . ? 13.981 51.393 -6.220 1.00 42.01 ? 253 HOH F O 1 HETATM 12506 O O . HOH DA 5 . ? 3.179 51.426 -38.860 1.00 44.72 ? 254 HOH F O 1 HETATM 12507 O O . HOH DA 5 . ? -11.707 62.334 -44.244 1.00 37.63 ? 255 HOH F O 1 HETATM 12508 O O . HOH DA 5 . ? -0.953 59.034 -38.781 1.00 47.16 ? 256 HOH F O 1 HETATM 12509 O O . HOH DA 5 . ? 14.513 55.250 -0.777 1.00 46.42 ? 257 HOH F O 1 HETATM 12510 O O . HOH DA 5 . ? -17.519 53.286 -51.663 1.00 45.67 ? 258 HOH F O 1 HETATM 12511 O O . HOH DA 5 . ? -2.103 54.969 -40.870 1.00 41.13 ? 259 HOH F O 1 HETATM 12512 O O . HOH DA 5 . ? -10.920 56.289 -32.075 1.00 41.20 ? 260 HOH F O 1 HETATM 12513 O O . HOH DA 5 . ? 9.136 52.224 -5.143 1.00 45.21 ? 261 HOH F O 1 HETATM 12514 O O . HOH DA 5 . ? -2.023 54.897 -38.221 1.00 38.31 ? 262 HOH F O 1 HETATM 12515 O O . HOH DA 5 . ? -13.414 58.193 -34.394 1.00 41.78 ? 263 HOH F O 1 HETATM 12516 O O . HOH DA 5 . ? 18.502 63.659 4.146 1.00 49.97 ? 264 HOH F O 1 HETATM 12517 O O . HOH DA 5 . ? 21.190 71.083 10.862 1.00 53.71 ? 265 HOH F O 1 HETATM 12518 O O . HOH DA 5 . ? 30.217 71.159 28.008 1.00 61.86 ? 266 HOH F O 1 HETATM 12519 O O . HOH DA 5 . ? 18.718 61.685 5.888 1.00 52.21 ? 267 HOH F O 1 HETATM 12520 O O . HOH DA 5 . ? -2.566 63.685 -50.067 1.00 38.75 ? 268 HOH F O 1 HETATM 12521 O O . HOH DA 5 . ? 17.607 66.251 2.761 1.00 62.01 ? 269 HOH F O 1 HETATM 12522 O O . HOH DA 5 . ? 23.493 72.637 11.634 1.00 53.75 ? 270 HOH F O 1 HETATM 12523 O O . HOH DA 5 . ? 16.475 65.028 0.803 1.00 55.88 ? 271 HOH F O 1 HETATM 12524 O O . HOH DA 5 . ? 25.799 73.828 11.883 1.00 60.55 ? 272 HOH F O 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 . SER A 5 ? 0.8267 1.0002 0.6690 0.2030 -0.1485 -0.1817 0 SER A N 2 C CA . SER A 5 ? 0.9156 1.0955 0.7637 0.1978 -0.1427 -0.1811 0 SER A CA 3 C C . SER A 5 ? 0.9305 1.1030 0.7801 0.1897 -0.1372 -0.1727 0 SER A C 4 O O . SER A 5 ? 0.8804 1.0498 0.7383 0.1861 -0.1356 -0.1725 0 SER A O 5 C CB . SER A 5 ? 0.9303 1.1234 0.7952 0.1975 -0.1410 -0.1915 0 SER A CB 6 O OG . SER A 5 ? 0.9405 1.1399 0.8101 0.1937 -0.1364 -0.1918 0 SER A OG 7 N N . ASP A 6 ? 0.9623 1.1331 0.8044 0.1868 -0.1343 -0.1663 1 ASP A N 8 C CA . ASP A 6 ? 0.9666 1.1294 0.8068 0.1797 -0.1296 -0.1573 1 ASP A CA 9 C C . ASP A 6 ? 0.9174 1.0843 0.7736 0.1733 -0.1243 -0.1595 1 ASP A C 10 O O . ASP A 6 ? 0.8977 1.0754 0.7650 0.1732 -0.1226 -0.1669 1 ASP A O 11 C CB . ASP A 6 ? 0.9990 1.1615 0.8281 0.1784 -0.1277 -0.1511 1 ASP A CB 12 C CG . ASP A 6 ? 1.0159 1.1714 0.8271 0.1834 -0.1327 -0.1462 1 ASP A CG 13 O OD1 . ASP A 6 ? 1.1347 1.2837 0.9417 0.1874 -0.1376 -0.1466 1 ASP A OD1 14 O OD2 . ASP A 6 ? 0.9410 1.0977 0.7423 0.1833 -0.1317 -0.1419 1 ASP A OD2 15 N N . GLN A 7 ? 0.8954 1.0535 0.7524 0.1681 -0.1218 -0.1531 2 GLN A N 16 C CA . GLN A 7 ? 0.8997 1.0600 0.7710 0.1618 -0.1170 -0.1542 2 GLN A CA 17 C C . GLN A 7 ? 0.8910 1.0434 0.7590 0.1552 -0.1126 -0.1449 2 GLN A C 18 O O . GLN A 7 ? 0.8801 1.0218 0.7374 0.1548 -0.1140 -0.1373 2 GLN A O 19 C CB . GLN A 7 ? 0.9201 1.0786 0.7997 0.1622 -0.1187 -0.1578 2 GLN A CB 20 C CG . GLN A 7 ? 0.9982 1.1681 0.8916 0.1642 -0.1194 -0.1685 2 GLN A CG 21 C CD . GLN A 7 ? 1.1069 1.2758 1.0081 0.1642 -0.1209 -0.1716 2 GLN A CD 22 O OE1 . GLN A 7 ? 1.1461 1.3082 1.0491 0.1598 -0.1187 -0.1666 2 GLN A OE1 23 N NE2 . GLN A 7 ? 1.1358 1.3119 1.0417 0.1692 -0.1246 -0.1801 2 GLN A NE2 24 N N . ILE A 8 ? 0.8430 1.0003 0.7209 0.1500 -0.1076 -0.1455 3 ILE A N 25 C CA . ILE A 8 ? 0.8091 0.9594 0.6874 0.1432 -0.1032 -0.1378 3 ILE A CA 26 C C . ILE A 8 ? 0.8191 0.9717 0.7128 0.1389 -0.1001 -0.1411 3 ILE A C 27 O O . ILE A 8 ? 0.8306 0.9924 0.7358 0.1391 -0.0993 -0.1486 3 ILE A O 28 C CB . ILE A 8 ? 0.7882 0.9403 0.6614 0.1403 -0.0996 -0.1333 3 ILE A CB 29 C CG1 . ILE A 8 ? 0.8213 0.9643 0.6911 0.1342 -0.0963 -0.1240 3 ILE A CG1 30 C CG2 . ILE A 8 ? 0.7540 0.9175 0.6389 0.1391 -0.0966 -0.1398 3 ILE A CG2 31 C CD1 . ILE A 8 ? 0.8423 0.9856 0.7039 0.1315 -0.0933 -0.1181 3 ILE A CD1 32 N N . CYS A 9 ? 0.8260 0.9701 0.7200 0.1350 -0.0988 -0.1356 4 CYS A N 33 C CA . CYS A 9 ? 0.8368 0.9823 0.7444 0.1310 -0.0962 -0.1381 4 CYS A CA 34 C C . CYS A 9 ? 0.8466 0.9872 0.7560 0.1242 -0.0913 -0.1314 4 CYS A C 35 O O . CYS A 9 ? 0.7838 0.9165 0.6830 0.1226 -0.0908 -0.1235 4 CYS A O 36 C CB . CYS A 9 ? 0.8942 1.0351 0.8025 0.1330 -0.0994 -0.1391 4 CYS A CB 37 S SG . CYS A 9 ? 0.9695 1.1159 0.8762 0.1412 -0.1056 -0.1473 4 CYS A SG 38 N N . ILE A 10 ? 0.8270 0.9723 0.7494 0.1202 -0.0879 -0.1345 5 ILE A N 39 C CA . ILE A 10 ? 0.8523 0.9937 0.7783 0.1139 -0.0834 -0.1291 5 ILE A CA 40 C C . ILE A 10 ? 0.8603 0.9981 0.7937 0.1114 -0.0830 -0.1290 5 ILE A C 41 O O . ILE A 10 ? 0.8154 0.9586 0.7582 0.1123 -0.0839 -0.1353 5 ILE A O 42 C CB . ILE A 10 ? 0.8513 1.0002 0.7864 0.1110 -0.0797 -0.1321 5 ILE A CB 43 C CG1 . ILE A 10 ? 0.8144 0.9649 0.7406 0.1118 -0.0789 -0.1294 5 ILE A CG1 44 C CG2 . ILE A 10 ? 0.8739 1.0196 0.8165 0.1046 -0.0755 -0.1286 5 ILE A CG2 45 C CD1 . ILE A 10 ? 0.7667 0.9237 0.6888 0.1177 -0.0823 -0.1348 5 ILE A CD1 46 N N . GLY A 11 ? 0.9541 1.0833 0.8833 0.1079 -0.0815 -0.1217 6 GLY A N 47 C CA . GLY A 11 ? 1.0125 1.1374 0.9467 0.1059 -0.0814 -0.1207 6 GLY A CA 48 C C . GLY A 11 ? 0.9976 1.1146 0.9292 0.1007 -0.0782 -0.1128 6 GLY A C 49 O O . GLY A 11 ? 1.0281 1.1443 0.9565 0.0980 -0.0755 -0.1087 6 GLY A O 50 N N . TYR A 12 ? 0.9811 1.0928 0.9142 0.0994 -0.0788 -0.1107 7 TYR A N 51 C CA . TYR A 12 ? 0.9000 1.0045 0.8320 0.0944 -0.0758 -0.1038 7 TYR A CA 52 C C . TYR A 12 ? 0.8629 0.9586 0.7894 0.0952 -0.0784 -0.1000 7 TYR A C 53 O O . TYR A 12 ? 0.8437 0.9395 0.7692 0.0994 -0.0823 -0.1036 7 TYR A O 54 C CB . TYR A 12 ? 0.8966 1.0057 0.8415 0.0895 -0.0716 -0.1055 7 TYR A CB 55 C CG . TYR A 12 ? 0.9375 1.0513 0.8925 0.0901 -0.0723 -0.1113 7 TYR A CG 56 C CD1 . TYR A 12 ? 0.9275 1.0503 0.8897 0.0922 -0.0732 -0.1188 7 TYR A CD1 57 C CD2 . TYR A 12 ? 0.9936 1.1032 0.9509 0.0884 -0.0724 -0.1094 7 TYR A CD2 58 C CE1 . TYR A 12 ? 0.9812 1.1088 0.9527 0.0923 -0.0738 -0.1240 7 TYR A CE1 59 C CE2 . TYR A 12 ? 0.9657 1.0805 0.9321 0.0888 -0.0730 -0.1147 7 TYR A CE2 60 C CZ . TYR A 12 ? 0.9810 1.1049 0.9545 0.0905 -0.0736 -0.1219 7 TYR A CZ 61 O OH . TYR A 12 ? 1.0789 1.2084 1.0615 0.0905 -0.0742 -0.1270 7 TYR A OH 62 N N . HIS A 13 ? 0.8650 0.9533 0.7879 0.0911 -0.0762 -0.0930 8 HIS A N 63 C CA . HIS A 13 ? 0.8709 0.9494 0.7870 0.0912 -0.0784 -0.0881 8 HIS A CA 64 C C . HIS A 13 ? 0.8240 0.9032 0.7473 0.0919 -0.0796 -0.0915 8 HIS A C 65 O O . HIS A 13 ? 0.7684 0.8545 0.7030 0.0900 -0.0772 -0.0957 8 HIS A O 66 C CB . HIS A 13 ? 0.9300 1.0022 0.8432 0.0858 -0.0750 -0.0805 8 HIS A CB 67 C CG . HIS A 13 ? 1.0565 1.1180 0.9627 0.0854 -0.0771 -0.0750 8 HIS A CG 68 N ND1 . HIS A 13 ? 1.0729 1.1264 0.9664 0.0876 -0.0805 -0.0705 8 HIS A ND1 69 C CD2 . HIS A 13 ? 1.0779 1.1353 0.9882 0.0826 -0.0761 -0.0729 8 HIS A CD2 70 C CE1 . HIS A 13 ? 1.0926 1.1372 0.9829 0.0864 -0.0819 -0.0663 8 HIS A CE1 71 N NE2 . HIS A 13 ? 1.1263 1.1734 1.0267 0.0835 -0.0792 -0.0677 8 HIS A NE2 72 N N . ALA A 14 ? 0.8280 0.9000 0.7444 0.0947 -0.0836 -0.0897 9 ALA A N 73 C CA . ALA A 14 ? 0.8383 0.9098 0.7599 0.0955 -0.0851 -0.0921 9 ALA A CA 74 C C . ALA A 14 ? 0.8863 0.9463 0.7985 0.0964 -0.0882 -0.0867 9 ALA A C 75 O O . ALA A 14 ? 0.9636 1.0165 0.8646 0.0979 -0.0905 -0.0824 9 ALA A O 76 C CB . ALA A 14 ? 0.8033 0.8823 0.7292 0.1006 -0.0883 -0.1001 9 ALA A CB 77 N N . ASN A 15 ? 0.8612 0.9192 0.7777 0.0954 -0.0883 -0.0867 10 ASN A N 78 C CA . ASN A 15 ? 0.8877 0.9347 0.7964 0.0960 -0.0913 -0.0818 10 ASN A CA 79 C C . ASN A 15 ? 1.0058 1.0542 0.9204 0.0975 -0.0930 -0.0854 10 ASN A C 80 O O . ASN A 15 ? 1.0083 1.0663 0.9317 0.0987 -0.0925 -0.0919 10 ASN A O 81 C CB . ASN A 15 ? 0.8426 0.8826 0.7480 0.0903 -0.0878 -0.0740 10 ASN A CB 82 C CG . ASN A 15 ? 0.7849 0.8295 0.7010 0.0848 -0.0824 -0.0737 10 ASN A CG 83 O OD1 . ASN A 15 ? 0.7177 0.7696 0.6434 0.0848 -0.0814 -0.0787 10 ASN A OD1 84 N ND2 . ASN A 15 ? 0.7724 0.8127 0.6866 0.0799 -0.0790 -0.0676 10 ASN A ND2 85 N N . ASN A 16 ? 1.0944 1.1337 1.0042 0.0975 -0.0952 -0.0816 11 ASN A N 86 C CA . ASN A 16 ? 1.2161 1.2574 1.1314 0.0993 -0.0970 -0.0855 11 ASN A CA 87 C C . ASN A 16 ? 1.1962 1.2372 1.1181 0.0938 -0.0928 -0.0825 11 ASN A C 88 O O . ASN A 16 ? 1.3060 1.3450 1.2294 0.0946 -0.0945 -0.0831 11 ASN A O 89 C CB . ASN A 16 ? 1.3283 1.3619 1.2350 0.1054 -0.1040 -0.0862 11 ASN A CB 90 C CG . ASN A 16 ? 1.3664 1.3865 1.2605 0.1052 -0.1065 -0.0789 11 ASN A CG 91 O OD1 . ASN A 16 ? 1.3226 1.3374 1.2150 0.1000 -0.1031 -0.0725 11 ASN A OD1 92 N ND2 . ASN A 16 ? 1.3299 1.3442 1.2149 0.1111 -0.1127 -0.0798 11 ASN A ND2 93 N N . SER A 17 ? 1.0891 1.1325 1.0150 0.0883 -0.0874 -0.0795 12 SER A N 94 C CA . SER A 17 ? 1.0280 1.0738 0.9622 0.0831 -0.0829 -0.0780 12 SER A CA 95 C C . SER A 17 ? 0.9398 0.9961 0.8849 0.0836 -0.0819 -0.0845 12 SER A C 96 O O . SER A 17 ? 0.8977 0.9623 0.8472 0.0855 -0.0821 -0.0899 12 SER A O 97 C CB . SER A 17 ? 1.0458 1.0933 0.9827 0.0777 -0.0776 -0.0745 12 SER A CB 98 O OG . SER A 17 ? 0.9679 1.0220 0.9156 0.0736 -0.0732 -0.0759 12 SER A OG 99 N N . THR A 18 ? 0.9647 1.0209 0.9142 0.0818 -0.0810 -0.0839 13 THR A N 100 C CA . THR A 18 ? 0.9121 0.9785 0.8723 0.0811 -0.0794 -0.0892 13 THR A CA 101 C C . THR A 18 ? 0.8360 0.9060 0.8044 0.0747 -0.0736 -0.0869 13 THR A C 102 O O . THR A 18 ? 0.8014 0.8798 0.7788 0.0732 -0.0717 -0.0906 13 THR A O 103 C CB . THR A 18 ? 0.9382 1.0034 0.8981 0.0839 -0.0827 -0.0910 13 THR A CB 104 O OG1 . THR A 18 ? 0.9536 1.0076 0.9064 0.0831 -0.0839 -0.0850 13 THR A OG1 105 C CG2 . THR A 18 ? 0.9496 1.0172 0.9064 0.0908 -0.0882 -0.0968 13 THR A CG2 106 N N . GLU A 19 ? 0.8207 0.8844 0.7860 0.0709 -0.0709 -0.0809 14 GLU A N 107 C CA . GLU A 19 ? 0.8621 0.9284 0.8344 0.0650 -0.0655 -0.0784 14 GLU A CA 108 C C . GLU A 19 ? 0.7939 0.8708 0.7760 0.0636 -0.0630 -0.0834 14 GLU A C 109 O O . GLU A 19 ? 0.7987 0.8797 0.7807 0.0661 -0.0642 -0.0871 14 GLU A O 110 C CB . GLU A 19 ? 0.9958 1.0561 0.9631 0.0621 -0.0634 -0.0729 14 GLU A CB 111 C CG . GLU A 19 ? 1.1462 1.1959 1.1054 0.0613 -0.0644 -0.0666 14 GLU A CG 112 C CD . GLU A 19 ? 1.2990 1.3471 1.2624 0.0580 -0.0625 -0.0642 14 GLU A CD 113 O OE1 . GLU A 19 ? 1.2459 1.2981 1.2166 0.0537 -0.0582 -0.0635 14 GLU A OE1 114 O OE2 . GLU A 19 ? 1.3263 1.3687 1.2853 0.0598 -0.0655 -0.0629 14 GLU A OE2 115 N N . GLN A 20 ? 0.7955 0.8769 0.7859 0.0599 -0.0599 -0.0836 15 GLN A N 116 C CA . GLN A 20 ? 0.7732 0.8643 0.7735 0.0580 -0.0577 -0.0880 15 GLN A CA 117 C C . GLN A 20 ? 0.7245 0.8156 0.7302 0.0522 -0.0529 -0.0845 15 GLN A C 118 O O . GLN A 20 ? 0.7080 0.7932 0.7116 0.0497 -0.0514 -0.0795 15 GLN A O 119 C CB . GLN A 20 ? 0.8284 0.9261 0.8342 0.0589 -0.0586 -0.0920 15 GLN A CB 120 C CG . GLN A 20 ? 0.9323 1.0351 0.9371 0.0642 -0.0626 -0.0981 15 GLN A CG 121 C CD . GLN A 20 ? 0.9285 1.0395 0.9397 0.0648 -0.0632 -0.1025 15 GLN A CD 122 O OE1 . GLN A 20 ? 0.9127 1.0279 0.9311 0.0605 -0.0599 -0.1019 15 GLN A OE1 123 N NE2 . GLN A 20 ? 1.0518 1.1658 1.0607 0.0701 -0.0673 -0.1074 15 GLN A NE2 124 N N . VAL A 21 ? 0.6593 0.7572 0.6726 0.0502 -0.0508 -0.0876 16 VAL A N 125 C CA . VAL A 21 ? 0.5663 0.6639 0.5843 0.0454 -0.0469 -0.0849 16 VAL A CA 126 C C . VAL A 21 ? 0.5123 0.6187 0.5406 0.0433 -0.0454 -0.0894 16 VAL A C 127 O O . VAL A 21 ? 0.4603 0.5727 0.4907 0.0460 -0.0474 -0.0947 16 VAL A O 128 C CB . VAL A 21 ? 0.6047 0.6987 0.6173 0.0464 -0.0471 -0.0835 16 VAL A CB 129 C CG1 . VAL A 21 ? 0.6231 0.7228 0.6425 0.0448 -0.0453 -0.0867 16 VAL A CG1 130 C CG2 . VAL A 21 ? 0.5417 0.6276 0.5484 0.0445 -0.0457 -0.0771 16 VAL A CG2 131 N N . ASP A 22 ? 0.5244 0.6318 0.5593 0.0384 -0.0420 -0.0874 17 ASP A N 132 C CA . ASP A 22 ? 0.5343 0.6490 0.5789 0.0358 -0.0405 -0.0911 17 ASP A CA 133 C C . ASP A 22 ? 0.5099 0.6238 0.5569 0.0338 -0.0388 -0.0908 17 ASP A C 134 O O . ASP A 22 ? 0.4844 0.5924 0.5269 0.0334 -0.0379 -0.0870 17 ASP A O 135 C CB . ASP A 22 ? 0.5898 0.7069 0.6408 0.0315 -0.0382 -0.0895 17 ASP A CB 136 C CG . ASP A 22 ? 0.7233 0.8440 0.7737 0.0334 -0.0399 -0.0912 17 ASP A CG 137 O OD1 . ASP A 22 ? 0.7729 0.8937 0.8179 0.0383 -0.0431 -0.0938 17 ASP A OD1 138 O OD2 . ASP A 22 ? 0.7394 0.8627 0.7946 0.0301 -0.0380 -0.0900 17 ASP A OD2 139 N N . THR A 23 ? 0.5222 0.6425 0.5770 0.0325 -0.0385 -0.0951 18 THR A N 140 C CA . THR A 23 ? 0.5718 0.6927 0.6303 0.0311 -0.0374 -0.0964 18 THR A CA 141 C C . THR A 23 ? 0.5464 0.6714 0.6151 0.0264 -0.0354 -0.0974 18 THR A C 142 O O . THR A 23 ? 0.5567 0.6855 0.6287 0.0251 -0.0353 -0.0982 18 THR A O 143 C CB . THR A 23 ? 0.6638 0.7887 0.7207 0.0354 -0.0401 -0.1018 18 THR A CB 144 O OG1 . THR A 23 ? 0.7690 0.8889 0.8166 0.0388 -0.0414 -0.0998 18 THR A OG1 145 C CG2 . THR A 23 ? 0.6790 0.8085 0.7436 0.0339 -0.0397 -0.1058 18 THR A CG2 146 N N . ILE A 24 ? 0.5808 0.7055 0.6547 0.0237 -0.0340 -0.0976 19 ILE A N 147 C CA . ILE A 24 ? 0.5895 0.7176 0.6730 0.0190 -0.0324 -0.0985 19 ILE A CA 148 C C . ILE A 24 ? 0.5675 0.7039 0.6569 0.0193 -0.0339 -0.1045 19 ILE A C 149 O O . ILE A 24 ? 0.6020 0.7423 0.6981 0.0157 -0.0328 -0.1050 19 ILE A O 150 C CB . ILE A 24 ? 0.6197 0.7446 0.7071 0.0162 -0.0310 -0.0973 19 ILE A CB 151 C CG1 . ILE A 24 ? 0.7184 0.8429 0.8129 0.0107 -0.0288 -0.0947 19 ILE A CG1 152 C CG2 . ILE A 24 ? 0.6583 0.7870 0.7498 0.0175 -0.0324 -0.1027 19 ILE A CG2 153 C CD1 . ILE A 24 ? 0.7924 0.9117 0.8890 0.0082 -0.0274 -0.0921 19 ILE A CD1 154 N N . MET A 25 ? 0.6562 0.7955 0.7430 0.0237 -0.0363 -0.1089 20 MET A N 155 C CA . MET A 25 ? 0.7001 0.8479 0.7921 0.0246 -0.0380 -0.1151 20 MET A CA 156 C C . MET A 25 ? 0.6763 0.8276 0.7635 0.0288 -0.0401 -0.1173 20 MET A C 157 O O . MET A 25 ? 0.6508 0.8096 0.7426 0.0293 -0.0413 -0.1222 20 MET A O 158 C CB . MET A 25 ? 0.6933 0.8433 0.7874 0.0266 -0.0394 -0.1198 20 MET A CB 159 C CG . MET A 25 ? 0.7223 0.8704 0.8233 0.0222 -0.0378 -0.1191 20 MET A CG 160 S SD . MET A 25 ? 0.7411 0.8948 0.8489 0.0230 -0.0396 -0.1262 20 MET A SD 161 C CE . MET A 25 ? 0.7848 0.9364 0.8823 0.0298 -0.0417 -0.1274 20 MET A CE 162 N N . GLU A 26 ? 0.6824 0.8282 0.7606 0.0318 -0.0408 -0.1137 21 GLU A N 163 C CA . GLU A 26 ? 0.7091 0.8569 0.7820 0.0362 -0.0434 -0.1157 21 GLU A CA 164 C C . GLU A 26 ? 0.6620 0.8043 0.7288 0.0365 -0.0430 -0.1105 21 GLU A C 165 O O . GLU A 26 ? 0.5948 0.7296 0.6571 0.0355 -0.0417 -0.1055 21 GLU A O 166 C CB . GLU A 26 ? 0.7089 0.8553 0.7747 0.0418 -0.0463 -0.1181 21 GLU A CB 167 C CG . GLU A 26 ? 0.8028 0.9551 0.8734 0.0430 -0.0475 -0.1239 21 GLU A CG 168 C CD . GLU A 26 ? 0.8886 1.0394 0.9510 0.0489 -0.0505 -0.1259 21 GLU A CD 169 O OE1 . GLU A 26 ? 0.8662 1.0191 0.9244 0.0532 -0.0533 -0.1283 21 GLU A OE1 170 O OE2 . GLU A 26 ? 0.8548 1.0024 0.9148 0.0494 -0.0502 -0.1250 21 GLU A OE2 171 N N . LYS A 27 ? 0.6278 0.7739 0.6942 0.0381 -0.0443 -0.1123 22 LYS A N 172 C CA . LYS A 27 ? 0.6621 0.8035 0.7225 0.0393 -0.0447 -0.1084 22 LYS A CA 173 C C . LYS A 27 ? 0.6557 0.7952 0.7076 0.0456 -0.0486 -0.1101 22 LYS A C 174 O O . LYS A 27 ? 0.6133 0.7576 0.6652 0.0492 -0.0512 -0.1154 22 LYS A O 175 C CB . LYS A 27 ? 0.7278 0.8752 0.7941 0.0364 -0.0434 -0.1089 22 LYS A CB 176 C CG . LYS A 27 ? 0.7936 0.9426 0.8681 0.0299 -0.0397 -0.1068 22 LYS A CG 177 C CD . LYS A 27 ? 0.8860 1.0392 0.9639 0.0272 -0.0382 -0.1055 22 LYS A CD 178 C CE . LYS A 27 ? 0.8956 1.0536 0.9831 0.0208 -0.0351 -0.1051 22 LYS A CE 179 N NZ . LYS A 27 ? 0.8699 1.0231 0.9580 0.0164 -0.0322 -0.0991 22 LYS A NZ 180 N N . ASN A 28 ? 0.6554 0.7875 0.7000 0.0469 -0.0493 -0.1057 23 ASN A N 181 C CA . ASN A 28 ? 0.6941 0.8235 0.7307 0.0525 -0.0532 -0.1069 23 ASN A CA 182 C C . ASN A 28 ? 0.6890 0.8175 0.7207 0.0568 -0.0559 -0.1096 23 ASN A C 183 O O . ASN A 28 ? 0.7192 0.8517 0.7494 0.0613 -0.0593 -0.1144 23 ASN A O 184 C CB . ASN A 28 ? 0.7320 0.8690 0.7719 0.0543 -0.0549 -0.1112 23 ASN A CB 185 C CG . ASN A 28 ? 0.8498 0.9857 0.8910 0.0515 -0.0531 -0.1077 23 ASN A CG 186 O OD1 . ASN A 28 ? 0.8555 0.9860 0.8968 0.0475 -0.0502 -0.1023 23 ASN A OD1 187 N ND2 . ASN A 28 ? 1.0418 1.1833 1.0841 0.0538 -0.0551 -0.1110 23 ASN A ND2 188 N N . VAL A 29 ? 0.6714 0.7948 0.7006 0.0553 -0.0544 -0.1063 24 VAL A N 189 C CA . VAL A 29 ? 0.6011 0.7227 0.6248 0.0589 -0.0565 -0.1077 24 VAL A CA 190 C C . VAL A 29 ? 0.6138 0.7258 0.6262 0.0617 -0.0586 -0.1032 24 VAL A C 191 O O . VAL A 29 ? 0.7344 0.8398 0.7437 0.0590 -0.0566 -0.0975 24 VAL A O 192 C CB . VAL A 29 ? 0.5737 0.6957 0.6010 0.0557 -0.0537 -0.1070 24 VAL A CB 193 C CG1 . VAL A 29 ? 0.5964 0.7165 0.6170 0.0595 -0.0558 -0.1080 24 VAL A CG1 194 C CG2 . VAL A 29 ? 0.5740 0.7048 0.6124 0.0529 -0.0521 -0.1116 24 VAL A CG2 195 N N . THR A 30 ? 0.6366 0.7480 0.6427 0.0671 -0.0628 -0.1058 25 THR A N 196 C CA . THR A 30 ? 0.6047 0.7066 0.5997 0.0700 -0.0653 -0.1016 25 THR A CA 197 C C . THR A 30 ? 0.6247 0.7227 0.6144 0.0697 -0.0645 -0.0989 25 THR A C 198 O O . THR A 30 ? 0.5905 0.6936 0.5824 0.0708 -0.0646 -0.1026 25 THR A O 199 C CB . THR A 30 ? 0.5729 0.6752 0.5625 0.0764 -0.0706 -0.1055 25 THR A CB 200 O OG1 . THR A 30 ? 0.6136 0.7220 0.6094 0.0767 -0.0712 -0.1093 25 THR A OG1 201 C CG2 . THR A 30 ? 0.5240 0.6151 0.5020 0.0789 -0.0735 -0.1006 25 THR A CG2 202 N N . VAL A 31 ? 0.6321 0.7214 0.6152 0.0681 -0.0637 -0.0925 26 VAL A N 203 C CA . VAL A 31 ? 0.6378 0.7234 0.6155 0.0674 -0.0627 -0.0892 26 VAL A CA 204 C C . VAL A 31 ? 0.6681 0.7440 0.6337 0.0696 -0.0654 -0.0844 26 VAL A C 205 O O . VAL A 31 ? 0.7004 0.7714 0.6620 0.0713 -0.0680 -0.0830 26 VAL A O 206 C CB . VAL A 31 ? 0.6430 0.7287 0.6259 0.0617 -0.0579 -0.0858 26 VAL A CB 207 C CG1 . VAL A 31 ? 0.6452 0.7396 0.6396 0.0594 -0.0555 -0.0905 26 VAL A CG1 208 C CG2 . VAL A 31 ? 0.6598 0.7391 0.6415 0.0585 -0.0564 -0.0803 26 VAL A CG2 209 N N . THR A 32 ? 0.6652 0.7389 0.6253 0.0693 -0.0648 -0.0818 27 THR A N 210 C CA . THR A 32 ? 0.6996 0.7652 0.6477 0.0716 -0.0676 -0.0777 27 THR A CA 211 C C . THR A 32 ? 0.7140 0.7714 0.6583 0.0677 -0.0659 -0.0706 27 THR A C 212 O O . THR A 32 ? 0.6839 0.7331 0.6202 0.0692 -0.0688 -0.0672 27 THR A O 213 C CB . THR A 32 ? 0.7012 0.7701 0.6462 0.0727 -0.0671 -0.0787 27 THR A CB 214 O OG1 . THR A 32 ? 0.7759 0.8462 0.7161 0.0783 -0.0715 -0.0826 27 THR A OG1 215 C CG2 . THR A 32 ? 0.6695 0.7325 0.6068 0.0703 -0.0656 -0.0723 27 THR A CG2 216 N N . HIS A 33 ? 0.7618 0.8212 0.7119 0.0629 -0.0613 -0.0686 28 HIS A N 217 C CA . HIS A 33 ? 0.7698 0.8228 0.7180 0.0586 -0.0590 -0.0624 28 HIS A CA 218 C C . HIS A 33 ? 0.7249 0.7827 0.6840 0.0544 -0.0549 -0.0632 28 HIS A C 219 O O . HIS A 33 ? 0.6596 0.7251 0.6264 0.0539 -0.0531 -0.0674 28 HIS A O 220 C CB . HIS A 33 ? 0.8308 0.8807 0.7723 0.0567 -0.0575 -0.0577 28 HIS A CB 221 C CG . HIS A 33 ? 0.9496 0.9957 0.8803 0.0605 -0.0611 -0.0567 28 HIS A CG 222 N ND1 . HIS A 33 ? 1.0374 1.0880 0.9657 0.0620 -0.0609 -0.0584 28 HIS A ND1 223 C CD2 . HIS A 33 ? 1.0427 1.0808 0.9643 0.0631 -0.0652 -0.0542 28 HIS A CD2 224 C CE1 . HIS A 33 ? 0.9402 0.9859 0.8582 0.0653 -0.0646 -0.0568 28 HIS A CE1 225 N NE2 . HIS A 33 ? 0.9973 1.0350 0.9109 0.0660 -0.0674 -0.0542 28 HIS A NE2 226 N N . ALA A 34 ? 0.7140 0.7671 0.6737 0.0514 -0.0535 -0.0591 29 ALA A N 227 C CA . ALA A 34 ? 0.6866 0.7434 0.6558 0.0473 -0.0498 -0.0593 29 ALA A CA 228 C C . ALA A 34 ? 0.7430 0.7935 0.7100 0.0437 -0.0479 -0.0534 29 ALA A C 229 O O . ALA A 34 ? 0.7688 0.8120 0.7279 0.0446 -0.0501 -0.0498 29 ALA A O 230 C CB . ALA A 34 ? 0.6480 0.7090 0.6237 0.0485 -0.0508 -0.0634 29 ALA A CB 231 N N . GLN A 35 ? 0.7661 0.8194 0.7402 0.0398 -0.0441 -0.0526 30 GLN A N 232 C CA . GLN A 35 ? 0.7880 0.8364 0.7613 0.0361 -0.0420 -0.0474 30 GLN A CA 233 C C . GLN A 35 ? 0.7280 0.7792 0.7102 0.0332 -0.0396 -0.0480 30 GLN A C 234 O O . GLN A 35 ? 0.5882 0.6454 0.5781 0.0317 -0.0373 -0.0506 30 GLN A O 235 C CB . GLN A 35 ? 0.8549 0.9028 0.8259 0.0337 -0.0396 -0.0445 30 GLN A CB 236 C CG . GLN A 35 ? 0.9957 1.0358 0.9591 0.0321 -0.0399 -0.0386 30 GLN A CG 237 C CD . GLN A 35 ? 1.1080 1.1485 1.0718 0.0284 -0.0365 -0.0354 30 GLN A CD 238 O OE1 . GLN A 35 ? 1.2987 1.3424 1.2608 0.0286 -0.0356 -0.0360 30 GLN A OE1 239 N NE2 . GLN A 35 ? 1.2930 1.3306 1.2588 0.0251 -0.0346 -0.0320 30 GLN A NE2 240 N N . ASP A 36 ? 0.6821 0.7289 0.6631 0.0326 -0.0403 -0.0455 31 ASP A N 241 C CA . ASP A 36 ? 0.6111 0.6600 0.5994 0.0299 -0.0382 -0.0454 31 ASP A CA 242 C C . ASP A 36 ? 0.5612 0.6077 0.5506 0.0257 -0.0349 -0.0410 31 ASP A C 243 O O . ASP A 36 ? 0.5969 0.6374 0.5801 0.0250 -0.0353 -0.0369 31 ASP A O 244 C CB . ASP A 36 ? 0.6246 0.6704 0.6110 0.0315 -0.0407 -0.0450 31 ASP A CB 245 C CG . ASP A 36 ? 0.5955 0.6461 0.5900 0.0299 -0.0391 -0.0468 31 ASP A CG 246 O OD1 . ASP A 36 ? 0.5851 0.6385 0.5857 0.0264 -0.0357 -0.0459 31 ASP A OD1 247 O OD2 . ASP A 36 ? 0.6204 0.6728 0.6156 0.0323 -0.0413 -0.0494 31 ASP A OD2 248 N N . ILE A 37 ? 0.4617 0.5128 0.4590 0.0231 -0.0319 -0.0419 32 ILE A N 249 C CA . ILE A 37 ? 0.4727 0.5222 0.4718 0.0193 -0.0289 -0.0383 32 ILE A CA 250 C C . ILE A 37 ? 0.5013 0.5499 0.5046 0.0170 -0.0276 -0.0365 32 ILE A C 251 O O . ILE A 37 ? 0.5132 0.5615 0.5195 0.0139 -0.0250 -0.0342 32 ILE A O 252 C CB . ILE A 37 ? 0.4427 0.4968 0.4470 0.0178 -0.0265 -0.0401 32 ILE A CB 253 C CG1 . ILE A 37 ? 0.4625 0.5225 0.4753 0.0176 -0.0260 -0.0442 32 ILE A CG1 254 C CG2 . ILE A 37 ? 0.4728 0.5276 0.4721 0.0199 -0.0275 -0.0412 32 ILE A CG2 255 C CD1 . ILE A 37 ? 0.4431 0.5071 0.4618 0.0160 -0.0239 -0.0459 32 ILE A CD1 256 N N . LEU A 38 ? 0.5227 0.5712 0.5259 0.0186 -0.0295 -0.0377 33 LEU A N 257 C CA . LEU A 38 ? 0.5414 0.5893 0.5478 0.0168 -0.0286 -0.0361 33 LEU A CA 258 C C . LEU A 38 ? 0.5686 0.6098 0.5685 0.0175 -0.0304 -0.0328 33 LEU A C 259 O O . LEU A 38 ? 0.5313 0.5699 0.5259 0.0206 -0.0337 -0.0338 33 LEU A O 260 C CB . LEU A 38 ? 0.5294 0.5828 0.5407 0.0182 -0.0296 -0.0399 33 LEU A CB 261 C CG . LEU A 38 ? 0.5440 0.5981 0.5588 0.0164 -0.0286 -0.0387 33 LEU A CG 262 C CD1 . LEU A 38 ? 0.5726 0.6275 0.5927 0.0124 -0.0251 -0.0364 33 LEU A CD1 263 C CD2 . LEU A 38 ? 0.5300 0.5905 0.5491 0.0179 -0.0296 -0.0428 33 LEU A CD2 264 N N . GLU A 39 ? 0.5672 0.6053 0.5673 0.0145 -0.0285 -0.0290 34 GLU A N 265 C CA . GLU A 39 ? 0.5885 0.6201 0.5832 0.0146 -0.0301 -0.0258 34 GLU A CA 266 C C . GLU A 39 ? 0.5539 0.5866 0.5510 0.0157 -0.0314 -0.0271 34 GLU A C 267 O O . GLU A 39 ? 0.4792 0.5162 0.4826 0.0139 -0.0293 -0.0276 34 GLU A O 268 C CB . GLU A 39 ? 0.5981 0.6267 0.5928 0.0110 -0.0276 -0.0216 34 GLU A CB 269 C CG . GLU A 39 ? 0.6614 0.6830 0.6503 0.0108 -0.0293 -0.0181 34 GLU A CG 270 C CD . GLU A 39 ? 0.7054 0.7219 0.6861 0.0134 -0.0327 -0.0178 34 GLU A CD 271 O OE1 . GLU A 39 ? 0.7251 0.7385 0.7028 0.0160 -0.0360 -0.0187 34 GLU A OE1 272 O OE2 . GLU A 39 ? 0.7430 0.7589 0.7204 0.0129 -0.0321 -0.0167 34 GLU A OE2 273 N N . LYS A 40 ? 0.5730 0.6023 0.5650 0.0188 -0.0350 -0.0279 35 LYS A N 274 C CA . LYS A 40 ? 0.6499 0.6810 0.6437 0.0208 -0.0369 -0.0301 35 LYS A CA 275 C C . LYS A 40 ? 0.5953 0.6196 0.5845 0.0212 -0.0390 -0.0275 35 LYS A C 276 O O . LYS A 40 ? 0.6186 0.6444 0.6093 0.0226 -0.0404 -0.0290 35 LYS A O 277 C CB . LYS A 40 ? 0.7341 0.7680 0.7265 0.0250 -0.0401 -0.0346 35 LYS A CB 278 C CG . LYS A 40 ? 0.7770 0.8197 0.7759 0.0251 -0.0385 -0.0386 35 LYS A CG 279 C CD . LYS A 40 ? 0.8357 0.8805 0.8322 0.0292 -0.0416 -0.0428 35 LYS A CD 280 C CE . LYS A 40 ? 0.8799 0.9259 0.8758 0.0291 -0.0407 -0.0436 35 LYS A CE 281 N NZ . LYS A 40 ? 0.9079 0.9466 0.8954 0.0305 -0.0428 -0.0412 35 LYS A NZ 282 N N . THR A 41 ? 0.5555 0.5728 0.5391 0.0199 -0.0394 -0.0237 36 THR A N 283 C CA . THR A 41 ? 0.5663 0.5762 0.5450 0.0205 -0.0420 -0.0213 36 THR A CA 284 C C . THR A 41 ? 0.5411 0.5480 0.5205 0.0165 -0.0395 -0.0171 36 THR A C 285 O O . THR A 41 ? 0.5293 0.5375 0.5103 0.0135 -0.0363 -0.0151 36 THR A O 286 C CB . THR A 41 ? 0.6544 0.6569 0.6246 0.0226 -0.0457 -0.0202 36 THR A CB 287 O OG1 . THR A 41 ? 0.6722 0.6706 0.6389 0.0195 -0.0440 -0.0160 36 THR A OG1 288 C CG2 . THR A 41 ? 0.7050 0.7108 0.6741 0.0262 -0.0475 -0.0241 36 THR A CG2 289 N N . HIS A 42 ? 0.5314 0.5341 0.5093 0.0168 -0.0414 -0.0159 37 HIS A N 290 C CA . HIS A 42 ? 0.5310 0.5297 0.5085 0.0135 -0.0400 -0.0120 37 HIS A CA 291 C C . HIS A 42 ? 0.5457 0.5361 0.5175 0.0148 -0.0440 -0.0105 37 HIS A C 292 O O . HIS A 42 ? 0.5358 0.5245 0.5051 0.0187 -0.0479 -0.0131 37 HIS A O 293 C CB . HIS A 42 ? 0.5124 0.5167 0.4970 0.0120 -0.0373 -0.0127 37 HIS A CB 294 C CG . HIS A 42 ? 0.5002 0.5072 0.4866 0.0150 -0.0397 -0.0159 37 HIS A CG 295 N ND1 . HIS A 42 ? 0.5187 0.5214 0.5031 0.0160 -0.0422 -0.0154 37 HIS A ND1 296 C CD2 . HIS A 42 ? 0.5434 0.5573 0.5334 0.0173 -0.0400 -0.0200 37 HIS A CD2 297 C CE1 . HIS A 42 ? 0.5566 0.5640 0.5435 0.0189 -0.0439 -0.0191 37 HIS A CE1 298 N NE2 . HIS A 42 ? 0.5435 0.5577 0.5336 0.0197 -0.0425 -0.0219 37 HIS A NE2 299 N N . ASN A 43 ? 0.5130 0.4985 0.4832 0.0117 -0.0432 -0.0066 38 ASN A N 300 C CA . ASN A 43 ? 0.5296 0.5058 0.4936 0.0120 -0.0469 -0.0043 38 ASN A CA 301 C C . ASN A 43 ? 0.5469 0.5219 0.5128 0.0133 -0.0489 -0.0054 38 ASN A C 302 O O . ASN A 43 ? 0.6141 0.5814 0.5759 0.0131 -0.0519 -0.0035 38 ASN A O 303 C CB . ASN A 43 ? 0.5520 0.5237 0.5133 0.0076 -0.0450 0.0004 38 ASN A CB 304 C CG . ASN A 43 ? 0.4814 0.4557 0.4478 0.0043 -0.0418 0.0020 38 ASN A CG 305 O OD1 . ASN A 43 ? 0.4605 0.4394 0.4321 0.0052 -0.0410 -0.0001 38 ASN A OD1 306 N ND2 . ASN A 43 ? 0.4900 0.4614 0.4546 0.0004 -0.0400 0.0059 38 ASN A ND2 307 N N . GLY A 44 ? 0.4659 0.4486 0.4382 0.0141 -0.0472 -0.0083 39 GLY A N 308 C CA . GLY A 44 ? 0.4954 0.4785 0.4696 0.0158 -0.0491 -0.0100 39 GLY A CA 309 C C . GLY A 44 ? 0.5134 0.4934 0.4886 0.0129 -0.0482 -0.0071 39 GLY A C 310 O O . GLY A 44 ? 0.5976 0.5776 0.5741 0.0144 -0.0501 -0.0086 39 GLY A O 311 N N . LYS A 45 ? 0.5483 0.5268 0.5234 0.0087 -0.0451 -0.0033 40 LYS A N 312 C CA . LYS A 45 ? 0.5789 0.5538 0.5544 0.0057 -0.0445 -0.0004 40 LYS A CA 313 C C . LYS A 45 ? 0.5835 0.5636 0.5641 0.0019 -0.0394 0.0015 40 LYS A C 314 O O . LYS A 45 ? 0.5476 0.5330 0.5308 0.0011 -0.0364 0.0010 40 LYS A O 315 C CB . LYS A 45 ? 0.6892 0.6547 0.6580 0.0043 -0.0469 0.0028 40 LYS A CB 316 C CG . LYS A 45 ? 0.7880 0.7468 0.7518 0.0082 -0.0526 0.0011 40 LYS A CG 317 C CD . LYS A 45 ? 0.9419 0.8900 0.8987 0.0065 -0.0556 0.0048 40 LYS A CD 318 C CE . LYS A 45 ? 1.0004 0.9466 0.9525 0.0057 -0.0551 0.0066 40 LYS A CE 319 N NZ . LYS A 45 ? 1.0112 0.9468 0.9560 0.0039 -0.0581 0.0105 40 LYS A NZ 320 N N . LEU A 46 ? 0.5373 0.5162 0.5197 -0.0001 -0.0388 0.0031 41 LEU A N 321 C CA . LEU A 46 ? 0.5000 0.4825 0.4865 -0.0037 -0.0346 0.0051 41 LEU A CA 322 C C . LEU A 46 ? 0.4997 0.4770 0.4826 -0.0071 -0.0341 0.0088 41 LEU A C 323 O O . LEU A 46 ? 0.5006 0.4714 0.4802 -0.0079 -0.0366 0.0105 41 LEU A O 324 C CB . LEU A 46 ? 0.5407 0.5254 0.5312 -0.0041 -0.0342 0.0049 41 LEU A CB 325 C CG . LEU A 46 ? 0.6529 0.6440 0.6478 -0.0015 -0.0340 0.0018 41 LEU A CG 326 C CD1 . LEU A 46 ? 0.6710 0.6635 0.6691 -0.0026 -0.0332 0.0025 41 LEU A CD1 327 C CD2 . LEU A 46 ? 0.6610 0.6594 0.6600 -0.0017 -0.0307 0.0006 41 LEU A CD2 328 N N . CYS A 47 ? 0.4711 0.4520 0.4556 -0.0094 -0.0306 0.0100 42 CYS A N 329 C CA . CYS A 47 ? 0.4930 0.4706 0.4741 -0.0127 -0.0296 0.0132 42 CYS A CA 330 C C . CYS A 47 ? 0.4993 0.4812 0.4846 -0.0161 -0.0257 0.0147 42 CYS A C 331 O O . CYS A 47 ? 0.5066 0.4943 0.4975 -0.0158 -0.0234 0.0132 42 CYS A O 332 C CB . CYS A 47 ? 0.5312 0.5097 0.5094 -0.0120 -0.0293 0.0129 42 CYS A CB 333 S SG . CYS A 47 ? 0.5445 0.5185 0.5175 -0.0075 -0.0339 0.0107 42 CYS A SG 334 N N . ASP A 48 ? 0.5090 0.4881 0.4913 -0.0193 -0.0251 0.0177 43 ASP A N 335 C CA . ASP A 48 ? 0.5211 0.5046 0.5066 -0.0225 -0.0214 0.0190 43 ASP A CA 336 C C . ASP A 48 ? 0.4903 0.4799 0.4781 -0.0217 -0.0189 0.0173 43 ASP A C 337 O O . ASP A 48 ? 0.5219 0.5110 0.5071 -0.0196 -0.0200 0.0161 43 ASP A O 338 C CB . ASP A 48 ? 0.5594 0.5395 0.5405 -0.0263 -0.0212 0.0224 43 ASP A CB 339 C CG . ASP A 48 ? 0.6155 0.5886 0.5937 -0.0278 -0.0239 0.0245 43 ASP A CG 340 O OD1 . ASP A 48 ? 0.6855 0.6569 0.6656 -0.0258 -0.0259 0.0231 43 ASP A OD1 341 O OD2 . ASP A 48 ? 0.5647 0.5342 0.5388 -0.0310 -0.0242 0.0275 43 ASP A OD2 342 N N . LEU A 49 ? 0.4491 0.4441 0.4417 -0.0233 -0.0157 0.0172 44 LEU A N 343 C CA . LEU A 49 ? 0.5060 0.5068 0.5015 -0.0226 -0.0134 0.0154 44 LEU A CA 344 C C . LEU A 49 ? 0.4817 0.4848 0.4765 -0.0256 -0.0111 0.0171 44 LEU A C 345 O O . LEU A 49 ? 0.4218 0.4270 0.4197 -0.0277 -0.0094 0.0179 44 LEU A O 346 C CB . LEU A 49 ? 0.5019 0.5074 0.5042 -0.0217 -0.0117 0.0136 44 LEU A CB 347 C CG . LEU A 49 ? 0.5450 0.5542 0.5506 -0.0192 -0.0114 0.0108 44 LEU A CG 348 C CD1 . LEU A 49 ? 0.5286 0.5427 0.5406 -0.0199 -0.0089 0.0101 44 LEU A CD1 349 C CD2 . LEU A 49 ? 0.5480 0.5584 0.5514 -0.0181 -0.0114 0.0095 44 LEU A CD2 350 N N . ASN A 50 ? 0.5111 0.5143 0.5019 -0.0258 -0.0110 0.0174 45 ASN A N 351 C CA . ASN A 50 ? 0.5123 0.5184 0.5017 -0.0287 -0.0088 0.0189 45 ASN A CA 352 C C . ASN A 50 ? 0.5321 0.5355 0.5197 -0.0322 -0.0088 0.0220 45 ASN A C 353 O O . ASN A 50 ? 0.5881 0.5956 0.5785 -0.0346 -0.0065 0.0225 45 ASN A O 354 C CB . ASN A 50 ? 0.5180 0.5317 0.5135 -0.0286 -0.0058 0.0168 45 ASN A CB 355 C CG . ASN A 50 ? 0.5515 0.5679 0.5491 -0.0255 -0.0058 0.0137 45 ASN A CG 356 O OD1 . ASN A 50 ? 0.6742 0.6899 0.6680 -0.0242 -0.0068 0.0132 45 ASN A OD1 357 N ND2 . ASN A 50 ? 0.5740 0.5933 0.5776 -0.0243 -0.0050 0.0117 45 ASN A ND2 358 N N . GLY A 51 ? 0.5632 0.5594 0.5463 -0.0323 -0.0117 0.0238 46 GLY A N 359 C CA . GLY A 51 ? 0.6119 0.6046 0.5928 -0.0358 -0.0122 0.0268 46 GLY A CA 360 C C . GLY A 51 ? 0.6134 0.6054 0.5985 -0.0363 -0.0124 0.0267 46 GLY A C 361 O O . GLY A 51 ? 0.6772 0.6652 0.6603 -0.0389 -0.0134 0.0290 46 GLY A O 362 N N . VAL A 52 ? 0.6141 0.6097 0.6049 -0.0339 -0.0116 0.0240 47 VAL A N 363 C CA . VAL A 52 ? 0.5383 0.5330 0.5326 -0.0341 -0.0121 0.0240 47 VAL A CA 364 C C . VAL A 52 ? 0.5484 0.5400 0.5432 -0.0307 -0.0147 0.0223 47 VAL A C 365 O O . VAL A 52 ? 0.5742 0.5681 0.5708 -0.0278 -0.0147 0.0201 47 VAL A O 366 C CB . VAL A 52 ? 0.5419 0.5431 0.5421 -0.0357 -0.0090 0.0234 47 VAL A CB 367 C CG1 . VAL A 52 ? 0.5051 0.5125 0.5066 -0.0365 -0.0061 0.0227 47 VAL A CG1 368 C CG2 . VAL A 52 ? 0.5266 0.5296 0.5320 -0.0336 -0.0090 0.0216 47 VAL A CG2 369 N N . LYS A 53 ? 0.5301 0.5171 0.5239 -0.0313 -0.0169 0.0233 48 LYS A N 370 C CA . LYS A 53 ? 0.5698 0.5535 0.5635 -0.0283 -0.0199 0.0218 48 LYS A CA 371 C C . LYS A 53 ? 0.5251 0.5142 0.5248 -0.0263 -0.0185 0.0195 48 LYS A C 372 O O . LYS A 53 ? 0.4980 0.4914 0.5018 -0.0278 -0.0161 0.0197 48 LYS A O 373 C CB . LYS A 53 ? 0.6290 0.6063 0.6201 -0.0298 -0.0226 0.0235 48 LYS A CB 374 C CG . LYS A 53 ? 0.7191 0.6917 0.7085 -0.0265 -0.0265 0.0219 48 LYS A CG 375 C CD . LYS A 53 ? 0.8173 0.7832 0.8045 -0.0280 -0.0295 0.0234 48 LYS A CD 376 C CE . LYS A 53 ? 0.8765 0.8417 0.8657 -0.0247 -0.0322 0.0208 48 LYS A CE 377 N NZ . LYS A 53 ? 0.8937 0.8505 0.8784 -0.0233 -0.0370 0.0208 48 LYS A NZ 378 N N . PRO A 54 ? 0.4220 0.4113 0.4221 -0.0228 -0.0202 0.0174 49 PRO A N 379 C CA . PRO A 54 ? 0.4269 0.4206 0.4320 -0.0213 -0.0193 0.0157 49 PRO A CA 380 C C . PRO A 54 ? 0.4390 0.4308 0.4450 -0.0215 -0.0208 0.0159 49 PRO A C 381 O O . PRO A 54 ? 0.4948 0.4811 0.4975 -0.0223 -0.0232 0.0170 49 PRO A O 382 C CB . PRO A 54 ? 0.4113 0.4056 0.4158 -0.0178 -0.0209 0.0133 49 PRO A CB 383 C CG . PRO A 54 ? 0.4246 0.4128 0.4234 -0.0170 -0.0240 0.0137 49 PRO A CG 384 C CD . PRO A 54 ? 0.4562 0.4420 0.4523 -0.0203 -0.0228 0.0163 49 PRO A CD 385 N N . LEU A 55 ? 0.4287 0.4253 0.4394 -0.0207 -0.0194 0.0149 50 LEU A N 386 C CA . LEU A 55 ? 0.4229 0.4190 0.4350 -0.0202 -0.0208 0.0146 50 LEU A CA 387 C C . LEU A 55 ? 0.4336 0.4303 0.4455 -0.0167 -0.0230 0.0123 50 LEU A C 388 O O . LEU A 55 ? 0.4848 0.4864 0.4992 -0.0152 -0.0216 0.0111 50 LEU A O 389 C CB . LEU A 55 ? 0.4094 0.4107 0.4266 -0.0212 -0.0181 0.0148 50 LEU A CB 390 C CG . LEU A 55 ? 0.4132 0.4152 0.4323 -0.0204 -0.0194 0.0143 50 LEU A CG 391 C CD1 . LEU A 55 ? 0.4483 0.4448 0.4648 -0.0219 -0.0216 0.0152 50 LEU A CD1 392 C CD2 . LEU A 55 ? 0.3875 0.3943 0.4110 -0.0213 -0.0167 0.0147 50 LEU A CD2 393 N N . ILE A 56 ? 0.4407 0.4324 0.4493 -0.0153 -0.0265 0.0117 51 ILE A N 394 C CA . ILE A 56 ? 0.4513 0.4436 0.4591 -0.0117 -0.0290 0.0092 51 ILE A CA 395 C C . ILE A 56 ? 0.4697 0.4633 0.4795 -0.0104 -0.0304 0.0081 51 ILE A C 396 O O . ILE A 56 ? 0.4782 0.4668 0.4862 -0.0109 -0.0329 0.0085 51 ILE A O 397 C CB . ILE A 56 ? 0.4639 0.4496 0.4664 -0.0104 -0.0326 0.0088 51 ILE A CB 398 C CG1 . ILE A 56 ? 0.5410 0.5264 0.5416 -0.0114 -0.0310 0.0098 51 ILE A CG1 399 C CG2 . ILE A 56 ? 0.5053 0.4923 0.5073 -0.0062 -0.0354 0.0056 51 ILE A CG2 400 C CD1 . ILE A 56 ? 0.6112 0.5904 0.6063 -0.0099 -0.0343 0.0095 51 ILE A CD1 401 N N . LEU A 57 ? 0.4428 0.4430 0.4561 -0.0088 -0.0291 0.0066 52 LEU A N 402 C CA . LEU A 57 ? 0.4309 0.4337 0.4465 -0.0080 -0.0296 0.0058 52 LEU A CA 403 C C . LEU A 57 ? 0.4750 0.4777 0.4893 -0.0044 -0.0333 0.0030 52 LEU A C 404 O O . LEU A 57 ? 0.5738 0.5771 0.5891 -0.0036 -0.0346 0.0022 52 LEU A O 405 C CB . LEU A 57 ? 0.4380 0.4479 0.4579 -0.0085 -0.0263 0.0062 52 LEU A CB 406 C CG . LEU A 57 ? 0.4220 0.4319 0.4438 -0.0118 -0.0233 0.0087 52 LEU A CG 407 C CD1 . LEU A 57 ? 0.4746 0.4909 0.5004 -0.0119 -0.0205 0.0090 52 LEU A CD1 408 C CD2 . LEU A 57 ? 0.4178 0.4243 0.4394 -0.0133 -0.0243 0.0097 52 LEU A CD2 409 N N . LYS A 58 ? 0.4967 0.4986 0.5087 -0.0021 -0.0351 0.0012 53 LYS A N 410 C CA . LYS A 58 ? 0.5681 0.5692 0.5784 0.0015 -0.0392 -0.0018 53 LYS A CA 411 C C . LYS A 58 ? 0.5727 0.5821 0.5863 0.0037 -0.0387 -0.0040 53 LYS A C 412 O O . LYS A 58 ? 0.6250 0.6410 0.6407 0.0041 -0.0363 -0.0045 53 LYS A O 413 C CB . LYS A 58 ? 0.6410 0.6344 0.6488 0.0012 -0.0427 -0.0015 53 LYS A CB 414 C CG . LYS A 58 ? 0.8025 0.7878 0.8069 -0.0014 -0.0432 0.0011 53 LYS A CG 415 C CD . LYS A 58 ? 0.9050 0.8818 0.9052 0.0000 -0.0484 0.0002 53 LYS A CD 416 C CE . LYS A 58 ? 1.0716 1.0398 1.0684 -0.0034 -0.0491 0.0034 53 LYS A CE 417 N NZ . LYS A 58 ? 1.1826 1.1430 1.1770 -0.0028 -0.0539 0.0029 53 LYS A NZ 418 N N . ASP A 59 ? 0.5665 0.5759 0.5806 0.0051 -0.0409 -0.0053 54 ASP A N 419 C CA . ASP A 59 ? 0.5367 0.5544 0.5534 0.0073 -0.0405 -0.0074 54 ASP A CA 420 C C . ASP A 59 ? 0.4988 0.5211 0.5190 0.0049 -0.0369 -0.0052 54 ASP A C 421 O O . ASP A 59 ? 0.4824 0.5110 0.5045 0.0064 -0.0367 -0.0064 54 ASP A O 422 C CB . ASP A 59 ? 0.5851 0.6015 0.6005 0.0108 -0.0451 -0.0107 54 ASP A CB 423 C CG . ASP A 59 ? 0.7027 0.7113 0.7171 0.0093 -0.0473 -0.0095 54 ASP A CG 424 O OD1 . ASP A 59 ? 0.7175 0.7217 0.7318 0.0056 -0.0452 -0.0061 54 ASP A OD1 425 O OD2 . ASP A 59 ? 0.7945 0.8012 0.8080 0.0120 -0.0513 -0.0121 54 ASP A OD2 426 N N . CYS A 60 ? 0.4745 0.4936 0.4953 0.0014 -0.0344 -0.0019 55 CYS A N 427 C CA . CYS A 60 ? 0.5071 0.5301 0.5311 -0.0007 -0.0311 0.0001 55 CYS A CA 428 C C . CYS A 60 ? 0.4747 0.5009 0.5005 -0.0026 -0.0273 0.0019 55 CYS A C 429 O O . CYS A 60 ? 0.5135 0.5372 0.5381 -0.0036 -0.0266 0.0025 55 CYS A O 430 C CB . CYS A 60 ? 0.5176 0.5356 0.5417 -0.0031 -0.0311 0.0020 55 CYS A CB 431 S SG . CYS A 60 ? 0.7450 0.7594 0.7676 -0.0010 -0.0356 -0.0002 55 CYS A SG 432 N N . SER A 61 ? 0.4081 0.4400 0.4367 -0.0030 -0.0251 0.0027 56 SER A N 433 C CA . SER A 61 ? 0.4232 0.4575 0.4539 -0.0052 -0.0217 0.0047 56 SER A CA 434 C C . SER A 61 ? 0.3943 0.4250 0.4259 -0.0078 -0.0202 0.0071 56 SER A C 435 O O . SER A 61 ? 0.3845 0.4123 0.4156 -0.0081 -0.0216 0.0072 56 SER A O 436 C CB . SER A 61 ? 0.3943 0.4360 0.4275 -0.0046 -0.0201 0.0050 56 SER A CB 437 O OG . SER A 61 ? 0.3805 0.4226 0.4148 -0.0049 -0.0201 0.0059 56 SER A OG 438 N N . VAL A 62 ? 0.3905 0.4217 0.4237 -0.0098 -0.0175 0.0087 57 VAL A N 439 C CA . VAL A 62 ? 0.3616 0.3906 0.3962 -0.0121 -0.0160 0.0106 57 VAL A CA 440 C C . VAL A 62 ? 0.3703 0.4017 0.4067 -0.0120 -0.0159 0.0111 57 VAL A C 441 O O . VAL A 62 ? 0.3684 0.3974 0.4050 -0.0131 -0.0162 0.0117 57 VAL A O 442 C CB . VAL A 62 ? 0.3406 0.3710 0.3771 -0.0137 -0.0133 0.0118 57 VAL A CB 443 C CG1 . VAL A 62 ? 0.3200 0.3494 0.3583 -0.0157 -0.0118 0.0133 57 VAL A CG1 444 C CG2 . VAL A 62 ? 0.3364 0.3642 0.3709 -0.0139 -0.0135 0.0112 57 VAL A CG2 445 N N . ALA A 63 ? 0.3720 0.4083 0.4096 -0.0107 -0.0156 0.0109 58 ALA A N 446 C CA . ALA A 63 ? 0.3863 0.4251 0.4254 -0.0103 -0.0156 0.0114 58 ALA A CA 447 C C . ALA A 63 ? 0.3744 0.4113 0.4122 -0.0091 -0.0182 0.0100 58 ALA A C 448 O O . ALA A 63 ? 0.3198 0.3559 0.3586 -0.0097 -0.0184 0.0105 58 ALA A O 449 C CB . ALA A 63 ? 0.3801 0.4247 0.4202 -0.0092 -0.0148 0.0117 58 ALA A CB 450 N N . GLY A 64 ? 0.3469 0.3830 0.3825 -0.0073 -0.0205 0.0080 59 GLY A N 451 C CA . GLY A 64 ? 0.3386 0.3729 0.3730 -0.0058 -0.0235 0.0062 59 GLY A CA 452 C C . GLY A 64 ? 0.3439 0.3719 0.3776 -0.0078 -0.0243 0.0069 59 GLY A C 453 O O . GLY A 64 ? 0.3381 0.3646 0.3721 -0.0080 -0.0257 0.0066 59 GLY A O 454 N N . TRP A 65 ? 0.3732 0.3975 0.4056 -0.0094 -0.0235 0.0078 60 TRP A N 455 C CA . TRP A 65 ? 0.3618 0.3804 0.3932 -0.0119 -0.0238 0.0089 60 TRP A CA 456 C C . TRP A 65 ? 0.3881 0.4081 0.4222 -0.0141 -0.0217 0.0104 60 TRP A C 457 O O . TRP A 65 ? 0.4142 0.4319 0.4485 -0.0152 -0.0229 0.0105 60 TRP A O 458 C CB . TRP A 65 ? 0.3656 0.3815 0.3951 -0.0129 -0.0230 0.0096 60 TRP A CB 459 C CG . TRP A 65 ? 0.4061 0.4178 0.4347 -0.0158 -0.0223 0.0112 60 TRP A CG 460 C CD1 . TRP A 65 ? 0.4247 0.4309 0.4511 -0.0171 -0.0245 0.0114 60 TRP A CD1 461 C CD2 . TRP A 65 ? 0.3962 0.4090 0.4261 -0.0181 -0.0194 0.0128 60 TRP A CD2 462 N NE1 . TRP A 65 ? 0.4557 0.4599 0.4818 -0.0202 -0.0229 0.0132 60 TRP A NE1 463 C CE2 . TRP A 65 ? 0.4425 0.4510 0.4708 -0.0207 -0.0197 0.0139 60 TRP A CE2 464 C CE3 . TRP A 65 ? 0.4351 0.4520 0.4673 -0.0182 -0.0167 0.0133 60 TRP A CE3 465 C CZ2 . TRP A 65 ? 0.4597 0.4690 0.4889 -0.0232 -0.0172 0.0153 60 TRP A CZ2 466 C CZ3 . TRP A 65 ? 0.4494 0.4662 0.4825 -0.0205 -0.0145 0.0145 60 TRP A CZ3 467 C CH2 . TRP A 65 ? 0.4419 0.4555 0.4735 -0.0228 -0.0147 0.0153 60 TRP A CH2 468 N N . LEU A 66 ? 0.3911 0.4150 0.4274 -0.0145 -0.0190 0.0115 61 LEU A N 469 C CA . LEU A 66 ? 0.3868 0.4122 0.4257 -0.0162 -0.0172 0.0127 61 LEU A CA 470 C C . LEU A 66 ? 0.3989 0.4264 0.4393 -0.0153 -0.0183 0.0121 61 LEU A C 471 O O . LEU A 66 ? 0.4480 0.4746 0.4897 -0.0168 -0.0182 0.0124 61 LEU A O 472 C CB . LEU A 66 ? 0.3944 0.4235 0.4355 -0.0162 -0.0146 0.0137 61 LEU A CB 473 C CG . LEU A 66 ? 0.4097 0.4379 0.4511 -0.0179 -0.0125 0.0147 61 LEU A CG 474 C CD1 . LEU A 66 ? 0.4073 0.4391 0.4514 -0.0176 -0.0106 0.0155 61 LEU A CD1 475 C CD2 . LEU A 66 ? 0.4240 0.4501 0.4658 -0.0203 -0.0120 0.0151 61 LEU A CD2 476 N N . LEU A 67 ? 0.3729 0.4039 0.4134 -0.0128 -0.0190 0.0113 62 LEU A N 477 C CA . LEU A 67 ? 0.3603 0.3941 0.4022 -0.0116 -0.0200 0.0106 62 LEU A CA 478 C C . LEU A 67 ? 0.3754 0.4062 0.4161 -0.0110 -0.0231 0.0088 62 LEU A C 479 O O . LEU A 67 ? 0.3634 0.3955 0.4053 -0.0104 -0.0242 0.0081 62 LEU A O 480 C CB . LEU A 67 ? 0.3564 0.3955 0.3986 -0.0092 -0.0198 0.0104 62 LEU A CB 481 C CG . LEU A 67 ? 0.3707 0.4127 0.4146 -0.0100 -0.0170 0.0124 62 LEU A CG 482 C CD1 . LEU A 67 ? 0.4043 0.4510 0.4477 -0.0082 -0.0167 0.0125 62 LEU A CD1 483 C CD2 . LEU A 67 ? 0.3931 0.4363 0.4392 -0.0105 -0.0163 0.0132 62 LEU A CD2 484 N N . GLY A 68 ? 0.3807 0.4072 0.4188 -0.0109 -0.0248 0.0080 63 GLY A N 485 C CA . GLY A 68 ? 0.3898 0.4124 0.4264 -0.0103 -0.0282 0.0063 63 GLY A CA 486 C C . GLY A 68 ? 0.3816 0.4068 0.4175 -0.0067 -0.0308 0.0038 63 GLY A C 487 O O . GLY A 68 ? 0.4172 0.4419 0.4536 -0.0057 -0.0332 0.0022 63 GLY A O 488 N N . ASN A 69 ? 0.4042 0.4329 0.4394 -0.0048 -0.0302 0.0033 64 ASN A N 489 C CA . ASN A 69 ? 0.4023 0.4337 0.4363 -0.0013 -0.0328 0.0006 64 ASN A CA 490 C C . ASN A 69 ? 0.3995 0.4247 0.4318 -0.0006 -0.0368 -0.0013 64 ASN A C 491 O O . ASN A 69 ? 0.3408 0.3598 0.3712 -0.0021 -0.0376 -0.0007 64 ASN A O 492 C CB . ASN A 69 ? 0.4016 0.4355 0.4344 -0.0001 -0.0319 0.0003 64 ASN A CB 493 C CG . ASN A 69 ? 0.4010 0.4392 0.4329 0.0036 -0.0344 -0.0028 64 ASN A CG 494 O OD1 . ASN A 69 ? 0.3505 0.3865 0.3815 0.0054 -0.0378 -0.0052 64 ASN A OD1 495 N ND2 . ASN A 69 ? 0.4008 0.4452 0.4329 0.0047 -0.0327 -0.0030 64 ASN A ND2 496 N N . PRO A 70 ? 0.4341 0.4610 0.4669 0.0017 -0.0395 -0.0038 65 PRO A N 497 C CA . PRO A 70 ? 0.4691 0.4890 0.5006 0.0018 -0.0435 -0.0054 65 PRO A CA 498 C C . PRO A 70 ? 0.5116 0.5273 0.5401 0.0036 -0.0463 -0.0071 65 PRO A C 499 O O . PRO A 70 ? 0.5730 0.5811 0.5998 0.0029 -0.0493 -0.0075 65 PRO A O 500 C CB . PRO A 70 ? 0.4255 0.4487 0.4585 0.0042 -0.0459 -0.0080 65 PRO A CB 501 C CG . PRO A 70 ? 0.4409 0.4733 0.4752 0.0061 -0.0436 -0.0081 65 PRO A CG 502 C CD . PRO A 70 ? 0.4306 0.4648 0.4652 0.0038 -0.0392 -0.0049 65 PRO A CD 503 N N . MET A 71 ? 0.5367 0.5570 0.5644 0.0057 -0.0454 -0.0079 66 MET A N 504 C CA . MET A 71 ? 0.6584 0.6745 0.6831 0.0071 -0.0476 -0.0092 66 MET A CA 505 C C . MET A 71 ? 0.6221 0.6326 0.6453 0.0039 -0.0458 -0.0062 66 MET A C 506 O O . MET A 71 ? 0.6323 0.6390 0.6529 0.0048 -0.0475 -0.0069 66 MET A O 507 C CB . MET A 71 ? 0.7001 0.7235 0.7247 0.0106 -0.0476 -0.0116 66 MET A CB 508 C CG . MET A 71 ? 0.8104 0.8331 0.8335 0.0148 -0.0525 -0.0159 66 MET A CG 509 S SD . MET A 71 ? 0.9189 0.9469 0.9442 0.0171 -0.0542 -0.0184 66 MET A SD 510 C CE . MET A 71 ? 0.9105 0.9514 0.9367 0.0205 -0.0526 -0.0206 66 MET A CE 511 N N . CYS A 72 ? 0.6914 0.7014 0.7160 0.0002 -0.0425 -0.0031 67 CYS A N 512 C CA . CYS A 72 ? 0.6902 0.6955 0.7133 -0.0027 -0.0408 -0.0005 67 CYS A CA 513 C C . CYS A 72 ? 0.9257 0.9240 0.9483 -0.0057 -0.0421 0.0008 67 CYS A C 514 O O . CYS A 72 ? 0.7752 0.7705 0.7972 -0.0091 -0.0401 0.0035 67 CYS A O 515 C CB . CYS A 72 ? 0.6249 0.6357 0.6504 -0.0046 -0.0360 0.0017 67 CYS A CB 516 S SG . CYS A 72 ? 0.5241 0.5434 0.5506 -0.0019 -0.0341 0.0005 67 CYS A SG 517 N N . ASP A 73 ? 1.2879 1.2840 1.3107 -0.0045 -0.0456 -0.0010 68 ASP A N 518 C CA . ASP A 73 ? 1.6423 1.6342 1.6660 -0.0074 -0.0465 0.0000 68 ASP A CA 519 C C . ASP A 73 ? 1.6313 1.6150 1.6524 -0.0110 -0.0470 0.0024 68 ASP A C 520 O O . ASP A 73 ? 1.5369 1.5150 1.5576 -0.0131 -0.0493 0.0027 68 ASP A O 521 C CB . ASP A 73 ? 1.7988 1.7889 1.8228 -0.0049 -0.0510 -0.0030 68 ASP A CB 522 C CG . ASP A 73 ? 1.8342 1.8276 1.8617 -0.0062 -0.0501 -0.0030 68 ASP A CG 523 O OD1 . ASP A 73 ? 1.5957 1.5969 1.6257 -0.0042 -0.0484 -0.0040 68 ASP A OD1 524 O OD2 . ASP A 73 ? 1.9206 1.9089 1.9485 -0.0092 -0.0513 -0.0021 68 ASP A OD2 525 N N . GLU A 74 ? 1.6050 1.5883 1.6244 -0.0120 -0.0448 0.0041 69 GLU A N 526 C CA . GLU A 74 ? 1.5891 1.5648 1.6049 -0.0146 -0.0459 0.0061 69 GLU A CA 527 C C . GLU A 74 ? 1.4938 1.4707 1.5107 -0.0191 -0.0418 0.0093 69 GLU A C 528 O O . GLU A 74 ? 1.6202 1.5936 1.6343 -0.0209 -0.0411 0.0112 69 GLU A O 529 C CB . GLU A 74 ? 1.5220 1.4964 1.5346 -0.0118 -0.0470 0.0052 69 GLU A CB 530 C CG . GLU A 74 ? 1.4489 1.4277 1.4624 -0.0069 -0.0490 0.0015 69 GLU A CG 531 C CD . GLU A 74 ? 1.5084 1.4868 1.5192 -0.0038 -0.0504 0.0000 69 GLU A CD 532 O OE1 . GLU A 74 ? 1.4498 1.4235 1.4575 -0.0051 -0.0505 0.0016 69 GLU A OE1 533 O OE2 . GLU A 74 ? 1.5352 1.5188 1.5471 0.0000 -0.0515 -0.0030 69 GLU A OE2 534 N N . PHE A 75 ? 1.2072 1.1890 1.2279 -0.0207 -0.0394 0.0098 70 PHE A N 535 C CA . PHE A 75 ? 1.1541 1.1385 1.1761 -0.0242 -0.0352 0.0123 70 PHE A CA 536 C C . PHE A 75 ? 1.1996 1.1783 1.2190 -0.0285 -0.0353 0.0148 70 PHE A C 537 O O . PHE A 75 ? 1.3303 1.3079 1.3510 -0.0317 -0.0354 0.0157 70 PHE A O 538 C CB . PHE A 75 ? 1.0553 1.0463 1.0819 -0.0252 -0.0324 0.0123 70 PHE A CB 539 C CG . PHE A 75 ? 1.0304 1.0244 1.0579 -0.0279 -0.0283 0.0144 70 PHE A CG 540 C CD1 . PHE A 75 ? 0.9900 0.9878 1.0178 -0.0262 -0.0260 0.0144 70 PHE A CD1 541 C CD2 . PHE A 75 ? 0.9404 0.9335 0.9684 -0.0321 -0.0271 0.0161 70 PHE A CD2 542 C CE1 . PHE A 75 ? 0.8491 0.8496 0.8778 -0.0283 -0.0227 0.0159 70 PHE A CE1 543 C CE2 . PHE A 75 ? 0.8620 0.8585 0.8908 -0.0342 -0.0236 0.0176 70 PHE A CE2 544 C CZ . PHE A 75 ? 0.8663 0.8662 0.8955 -0.0321 -0.0215 0.0174 70 PHE A CZ 545 N N . ILE A 76 ? 1.2008 1.1763 1.2166 -0.0285 -0.0354 0.0158 71 ILE A N 546 C CA . ILE A 76 ? 1.1411 1.1125 1.1539 -0.0324 -0.0346 0.0186 71 ILE A CA 547 C C . ILE A 76 ? 1.1319 1.1098 1.1470 -0.0342 -0.0298 0.0198 71 ILE A C 548 O O . ILE A 76 ? 1.1154 1.0988 1.1326 -0.0318 -0.0277 0.0187 71 ILE A O 549 C CB . ILE A 76 ? 1.0920 1.0569 1.0995 -0.0310 -0.0372 0.0189 71 ILE A CB 550 C CG1 . ILE A 76 ? 1.1245 1.0819 1.1296 -0.0295 -0.0425 0.0177 71 ILE A CG1 551 C CG2 . ILE A 76 ? 1.0290 0.9909 1.0331 -0.0348 -0.0358 0.0220 71 ILE A CG2 552 C CD1 . ILE A 76 ? 1.0875 1.0389 1.0917 -0.0337 -0.0444 0.0196 71 ILE A CD1 553 N N . ARG A 77 ? 1.0832 1.0607 1.0979 -0.0386 -0.0282 0.0220 72 ARG A N 554 C CA . ARG A 77 ? 1.0411 1.0238 1.0570 -0.0403 -0.0242 0.0231 72 ARG A CA 555 C C . ARG A 77 ? 0.9929 0.9733 1.0046 -0.0396 -0.0241 0.0240 72 ARG A C 556 O O . ARG A 77 ? 0.8872 0.8613 0.8943 -0.0414 -0.0260 0.0257 72 ARG A O 557 C CB . ARG A 77 ? 1.1335 1.1171 1.1500 -0.0453 -0.0226 0.0250 72 ARG A CB 558 C CG . ARG A 77 ? 1.2609 1.2464 1.2813 -0.0466 -0.0230 0.0243 72 ARG A CG 559 C CD . ARG A 77 ? 1.4056 1.3888 1.4247 -0.0520 -0.0230 0.0265 72 ARG A CD 560 N NE . ARG A 77 ? 1.4906 1.4806 1.5145 -0.0544 -0.0204 0.0261 72 ARG A NE 561 C CZ . ARG A 77 ? 1.6717 1.6682 1.6973 -0.0563 -0.0167 0.0266 72 ARG A CZ 562 N NH1 . ARG A 77 ? 1.6816 1.6787 1.7046 -0.0563 -0.0150 0.0276 72 ARG A NH1 563 N NH2 . ARG A 77 ? 1.7157 1.7183 1.7458 -0.0580 -0.0149 0.0258 72 ARG A NH2 564 N N . VAL A 78 ? 0.8984 0.8834 0.9116 -0.0370 -0.0221 0.0228 73 VAL A N 565 C CA . VAL A 78 ? 0.8460 0.8323 0.8572 -0.0374 -0.0202 0.0236 73 VAL A CA 566 C C . VAL A 78 ? 0.7199 0.7135 0.7355 -0.0389 -0.0163 0.0235 73 VAL A C 567 O O . VAL A 78 ? 0.7620 0.7600 0.7815 -0.0367 -0.0152 0.0220 73 VAL A O 568 C CB . VAL A 78 ? 0.7059 0.6927 0.7165 -0.0333 -0.0207 0.0219 73 VAL A CB 569 N N . PRO A 79 ? 0.5694 0.5643 0.5843 -0.0425 -0.0144 0.0251 74 PRO A N 570 C CA . PRO A 79 ? 0.5116 0.5139 0.5310 -0.0436 -0.0111 0.0246 74 PRO A CA 571 C C . PRO A 79 ? 0.5198 0.5265 0.5402 -0.0421 -0.0088 0.0237 74 PRO A C 572 O O . PRO A 79 ? 0.4770 0.4896 0.5013 -0.0421 -0.0064 0.0228 74 PRO A O 573 C CB . PRO A 79 ? 0.5791 0.5815 0.5972 -0.0483 -0.0103 0.0265 74 PRO A CB 574 C CG . PRO A 79 ? 0.5723 0.5679 0.5843 -0.0494 -0.0122 0.0285 74 PRO A CG 575 C CD . PRO A 79 ? 0.5651 0.5551 0.5755 -0.0460 -0.0155 0.0275 74 PRO A CD 576 N N . GLU A 80 ? 0.5239 0.5277 0.5407 -0.0407 -0.0096 0.0239 75 GLU A N 577 C CA . GLU A 80 ? 0.5250 0.5325 0.5429 -0.0387 -0.0078 0.0227 75 GLU A CA 578 C C . GLU A 80 ? 0.4657 0.4693 0.4806 -0.0359 -0.0098 0.0221 75 GLU A C 579 O O . GLU A 80 ? 0.4412 0.4392 0.4521 -0.0359 -0.0124 0.0229 75 GLU A O 580 C CB . GLU A 80 ? 0.6043 0.6149 0.6211 -0.0411 -0.0056 0.0234 75 GLU A CB 581 C CG . GLU A 80 ? 0.6810 0.6872 0.6918 -0.0427 -0.0066 0.0253 75 GLU A CG 582 C CD . GLU A 80 ? 0.8596 0.8702 0.8693 -0.0440 -0.0043 0.0254 75 GLU A CD 583 O OE1 . GLU A 80 ? 0.7607 0.7686 0.7655 -0.0466 -0.0047 0.0276 75 GLU A OE1 584 O OE2 . GLU A 80 ? 0.8426 0.8591 0.8561 -0.0425 -0.0022 0.0234 75 GLU A OE2 585 N N . TRP A 81 ? 0.4086 0.4156 0.4256 -0.0335 -0.0087 0.0205 76 TRP A N 586 C CA . TRP A 81 ? 0.4002 0.4048 0.4149 -0.0308 -0.0103 0.0195 76 TRP A CA 587 C C . TRP A 81 ? 0.4050 0.4140 0.4220 -0.0294 -0.0083 0.0181 76 TRP A C 588 O O . TRP A 81 ? 0.4151 0.4287 0.4361 -0.0299 -0.0061 0.0175 76 TRP A O 589 C CB . TRP A 81 ? 0.3713 0.3742 0.3869 -0.0283 -0.0124 0.0185 76 TRP A CB 590 C CG . TRP A 81 ? 0.3623 0.3698 0.3830 -0.0273 -0.0111 0.0175 76 TRP A CG 591 C CD1 . TRP A 81 ? 0.3767 0.3879 0.4003 -0.0253 -0.0100 0.0161 76 TRP A CD1 592 C CD2 . TRP A 81 ? 0.3440 0.3527 0.3675 -0.0281 -0.0109 0.0178 76 TRP A CD2 593 N NE1 . TRP A 81 ? 0.3746 0.3887 0.4021 -0.0250 -0.0092 0.0159 76 TRP A NE1 594 C CE2 . TRP A 81 ? 0.3431 0.3560 0.3706 -0.0265 -0.0097 0.0168 76 TRP A CE2 595 C CE3 . TRP A 81 ? 0.3576 0.3642 0.3804 -0.0302 -0.0116 0.0189 76 TRP A CE3 596 C CZ2 . TRP A 81 ? 0.3481 0.3631 0.3787 -0.0265 -0.0094 0.0168 76 TRP A CZ2 597 C CZ3 . TRP A 81 ? 0.3665 0.3757 0.3929 -0.0303 -0.0112 0.0186 76 TRP A CZ3 598 C CH2 . TRP A 81 ? 0.3636 0.3769 0.3937 -0.0284 -0.0101 0.0176 76 TRP A CH2 599 N N . SER A 82 ? 0.3758 0.3833 0.3903 -0.0275 -0.0094 0.0173 77 SER A N 600 C CA . SER A 82 ? 0.3757 0.3869 0.3920 -0.0264 -0.0078 0.0158 77 SER A CA 601 C C . SER A 82 ? 0.4018 0.4149 0.4211 -0.0238 -0.0081 0.0140 77 SER A C 602 O O . SER A 82 ? 0.4109 0.4277 0.4335 -0.0232 -0.0066 0.0128 77 SER A O 603 C CB . SER A 82 ? 0.3789 0.3876 0.3903 -0.0262 -0.0088 0.0160 77 SER A CB 604 O OG . SER A 82 ? 0.3439 0.3477 0.3516 -0.0246 -0.0117 0.0160 77 SER A OG 605 N N . TYR A 83 ? 0.4083 0.4189 0.4264 -0.0223 -0.0103 0.0137 78 TYR A N 606 C CA . TYR A 83 ? 0.3678 0.3809 0.3889 -0.0202 -0.0105 0.0122 78 TYR A CA 607 C C . TYR A 83 ? 0.3492 0.3604 0.3696 -0.0192 -0.0125 0.0123 78 TYR A C 608 O O . TYR A 83 ? 0.4052 0.4121 0.4223 -0.0200 -0.0142 0.0133 78 TYR A O 609 C CB . TYR A 83 ? 0.3756 0.3893 0.3956 -0.0182 -0.0112 0.0105 78 TYR A CB 610 C CG . TYR A 83 ? 0.3376 0.3472 0.3524 -0.0169 -0.0138 0.0102 78 TYR A CG 611 C CD1 . TYR A 83 ? 0.3468 0.3531 0.3575 -0.0181 -0.0143 0.0113 78 TYR A CD1 612 C CD2 . TYR A 83 ? 0.3508 0.3602 0.3649 -0.0145 -0.0159 0.0085 78 TYR A CD2 613 C CE1 . TYR A 83 ? 0.3553 0.3572 0.3609 -0.0167 -0.0170 0.0111 78 TYR A CE1 614 C CE2 . TYR A 83 ? 0.3716 0.3771 0.3811 -0.0128 -0.0187 0.0079 78 TYR A CE2 615 C CZ . TYR A 83 ? 0.3749 0.3761 0.3800 -0.0139 -0.0193 0.0093 78 TYR A CZ 616 O OH . TYR A 83 ? 0.3896 0.3863 0.3897 -0.0121 -0.0225 0.0088 78 TYR A OH 617 N N . ILE A 84 ? 0.3316 0.3458 0.3549 -0.0178 -0.0125 0.0113 79 ILE A N 618 C CA . ILE A 84 ? 0.3270 0.3403 0.3496 -0.0164 -0.0146 0.0108 79 ILE A CA 619 C C . ILE A 84 ? 0.3311 0.3452 0.3525 -0.0137 -0.0163 0.0088 79 ILE A C 620 O O . ILE A 84 ? 0.3542 0.3720 0.3777 -0.0131 -0.0151 0.0078 79 ILE A O 621 C CB . ILE A 84 ? 0.3216 0.3385 0.3483 -0.0166 -0.0134 0.0112 79 ILE A CB 622 C CG1 . ILE A 84 ? 0.3396 0.3561 0.3676 -0.0189 -0.0118 0.0128 79 ILE A CG1 623 C CG2 . ILE A 84 ? 0.3458 0.3625 0.3718 -0.0148 -0.0156 0.0104 79 ILE A CG2 624 C CD1 . ILE A 84 ? 0.3301 0.3495 0.3615 -0.0190 -0.0111 0.0132 79 ILE A CD1 625 N N . VAL A 85 ? 0.3325 0.3434 0.3509 -0.0121 -0.0193 0.0081 80 VAL A N 626 C CA . VAL A 85 ? 0.3554 0.3676 0.3728 -0.0093 -0.0213 0.0057 80 VAL A CA 627 C C . VAL A 85 ? 0.3770 0.3914 0.3958 -0.0078 -0.0225 0.0048 80 VAL A C 628 O O . VAL A 85 ? 0.3519 0.3628 0.3692 -0.0079 -0.0242 0.0053 80 VAL A O 629 C CB . VAL A 85 ? 0.3966 0.4030 0.4089 -0.0080 -0.0244 0.0051 80 VAL A CB 630 C CG1 . VAL A 85 ? 0.4268 0.4349 0.4381 -0.0045 -0.0269 0.0022 80 VAL A CG1 631 C CG2 . VAL A 85 ? 0.4063 0.4108 0.4167 -0.0093 -0.0233 0.0061 80 VAL A CG2 632 N N . GLU A 86 ? 0.3975 0.4179 0.4190 -0.0065 -0.0216 0.0034 81 GLU A N 633 C CA . GLU A 86 ? 0.4270 0.4512 0.4498 -0.0048 -0.0227 0.0021 81 GLU A CA 634 C C . GLU A 86 ? 0.4311 0.4583 0.4530 -0.0018 -0.0246 -0.0008 81 GLU A C 635 O O . GLU A 86 ? 0.4338 0.4624 0.4557 -0.0016 -0.0239 -0.0016 81 GLU A O 636 C CB . GLU A 86 ? 0.4522 0.4822 0.4791 -0.0060 -0.0198 0.0031 81 GLU A CB 637 C CG . GLU A 86 ? 0.4484 0.4785 0.4768 -0.0071 -0.0192 0.0047 81 GLU A CG 638 C CD . GLU A 86 ? 0.4544 0.4898 0.4865 -0.0082 -0.0166 0.0059 81 GLU A CD 639 O OE1 . GLU A 86 ? 0.5109 0.5503 0.5448 -0.0084 -0.0150 0.0057 81 GLU A OE1 640 O OE2 . GLU A 86 ? 0.4456 0.4814 0.4787 -0.0086 -0.0163 0.0070 81 GLU A OE2 641 N N . ARG A 87 ? 0.4547 0.4828 0.4757 0.0005 -0.0272 -0.0027 82 ARG A N 642 C CA . ARG A 87 ? 0.4427 0.4754 0.4635 0.0035 -0.0288 -0.0059 82 ARG A CA 643 C C . ARG A 87 ? 0.4479 0.4892 0.4726 0.0028 -0.0260 -0.0060 82 ARG A C 644 O O . ARG A 87 ? 0.4572 0.5004 0.4843 0.0006 -0.0234 -0.0037 82 ARG A O 645 C CB . ARG A 87 ? 0.4714 0.5034 0.4905 0.0064 -0.0324 -0.0082 82 ARG A CB 646 C CG . ARG A 87 ? 0.5062 0.5296 0.5211 0.0075 -0.0359 -0.0086 82 ARG A CG 647 C CD . ARG A 87 ? 0.5217 0.5439 0.5352 0.0106 -0.0398 -0.0111 82 ARG A CD 648 N NE . ARG A 87 ? 0.6177 0.6301 0.6271 0.0109 -0.0432 -0.0106 82 ARG A NE 649 C CZ . ARG A 87 ? 0.6652 0.6736 0.6726 0.0132 -0.0474 -0.0124 82 ARG A CZ 650 N NH1 . ARG A 87 ? 0.6009 0.6149 0.6102 0.0158 -0.0487 -0.0152 82 ARG A NH1 651 N NH2 . ARG A 87 ? 0.6750 0.6737 0.6786 0.0129 -0.0504 -0.0115 82 ARG A NH2 652 N N . ALA A 88 ? 0.4381 0.4845 0.4632 0.0046 -0.0265 -0.0087 83 ALA A N 653 C CA . ALA A 88 ? 0.4535 0.5085 0.4822 0.0037 -0.0239 -0.0087 83 ALA A CA 654 C C . ALA A 88 ? 0.4344 0.4936 0.4646 0.0036 -0.0234 -0.0080 83 ALA A C 655 O O . ALA A 88 ? 0.4438 0.5064 0.4767 0.0012 -0.0205 -0.0058 83 ALA A O 656 C CB . ALA A 88 ? 0.4198 0.4806 0.4487 0.0060 -0.0250 -0.0123 83 ALA A CB 657 N N . ASN A 89 ? 0.4616 0.5201 0.4899 0.0063 -0.0264 -0.0100 84 ASN A N 658 C CA . ASN A 89 ? 0.5250 0.5876 0.5543 0.0069 -0.0263 -0.0099 84 ASN A CA 659 C C . ASN A 89 ? 0.4845 0.5408 0.5116 0.0081 -0.0291 -0.0101 84 ASN A C 660 O O . ASN A 89 ? 0.5349 0.5914 0.5604 0.0114 -0.0325 -0.0131 84 ASN A O 661 C CB . ASN A 89 ? 0.6378 0.7096 0.6679 0.0095 -0.0273 -0.0132 84 ASN A CB 662 C CG . ASN A 89 ? 0.7365 0.8157 0.7692 0.0076 -0.0242 -0.0126 84 ASN A CG 663 O OD1 . ASN A 89 ? 0.9062 0.9885 0.9412 0.0049 -0.0212 -0.0098 84 ASN A OD1 664 N ND2 . ASN A 89 ? 0.8131 0.8946 0.8456 0.0088 -0.0249 -0.0152 84 ASN A ND2 665 N N . PRO A 90 ? 0.4584 0.5090 0.4857 0.0055 -0.0279 -0.0069 85 PRO A N 666 C CA . PRO A 90 ? 0.4413 0.4863 0.4670 0.0062 -0.0302 -0.0069 85 PRO A CA 667 C C . PRO A 90 ? 0.5056 0.5566 0.5323 0.0083 -0.0313 -0.0086 85 PRO A C 668 O O . PRO A 90 ? 0.5266 0.5848 0.5556 0.0076 -0.0288 -0.0078 85 PRO A O 669 C CB . PRO A 90 ? 0.4343 0.4755 0.4611 0.0027 -0.0277 -0.0032 85 PRO A CB 670 C CG . PRO A 90 ? 0.4371 0.4801 0.4655 0.0005 -0.0245 -0.0015 85 PRO A CG 671 C CD . PRO A 90 ? 0.4341 0.4845 0.4636 0.0020 -0.0241 -0.0035 85 PRO A CD 672 N N . ALA A 91 ? 0.4534 0.5014 0.4783 0.0108 -0.0351 -0.0109 86 ALA A N 673 C CA . ALA A 91 ? 0.4779 0.5310 0.5034 0.0134 -0.0367 -0.0132 86 ALA A CA 674 C C . ALA A 91 ? 0.5207 0.5727 0.5474 0.0116 -0.0356 -0.0109 86 ALA A C 675 O O . ALA A 91 ? 0.5432 0.6019 0.5713 0.0127 -0.0352 -0.0115 86 ALA A O 676 C CB . ALA A 91 ? 0.5110 0.5601 0.5339 0.0170 -0.0417 -0.0169 86 ALA A CB 677 N N . ASN A 92 ? 0.4887 0.5331 0.5151 0.0089 -0.0350 -0.0082 87 ASN A N 678 C CA . ASN A 92 ? 0.4672 0.5105 0.4949 0.0072 -0.0340 -0.0062 87 ASN A CA 679 C C . ASN A 92 ? 0.4825 0.5266 0.5123 0.0037 -0.0299 -0.0025 87 ASN A C 680 O O . ASN A 92 ? 0.4633 0.5024 0.4927 0.0013 -0.0286 -0.0006 87 ASN A O 681 C CB . ASN A 92 ? 0.4524 0.4873 0.4785 0.0069 -0.0369 -0.0065 87 ASN A CB 682 C CG . ASN A 92 ? 0.4631 0.4965 0.4872 0.0106 -0.0415 -0.0103 87 ASN A CG 683 O OD1 . ASN A 92 ? 0.5640 0.5902 0.5856 0.0109 -0.0441 -0.0110 87 ASN A OD1 684 N ND2 . ASN A 92 ? 0.4042 0.4441 0.4293 0.0135 -0.0428 -0.0129 87 ASN A ND2 685 N N . ASP A 93 ? 0.4488 0.4993 0.4805 0.0036 -0.0280 -0.0017 88 ASP A N 686 C CA . ASP A 93 ? 0.4378 0.4898 0.4715 0.0008 -0.0243 0.0015 88 ASP A CA 687 C C . ASP A 93 ? 0.4145 0.4690 0.4498 0.0005 -0.0237 0.0027 88 ASP A C 688 O O . ASP A 93 ? 0.4030 0.4531 0.4382 0.0001 -0.0248 0.0028 88 ASP A O 689 C CB . ASP A 93 ? 0.4524 0.5102 0.4868 0.0008 -0.0224 0.0015 88 ASP A CB 690 C CG . ASP A 93 ? 0.4925 0.5516 0.5289 -0.0019 -0.0190 0.0047 88 ASP A CG 691 O OD1 . ASP A 93 ? 0.5149 0.5689 0.5519 -0.0040 -0.0178 0.0065 88 ASP A OD1 692 O OD2 . ASP A 93 ? 0.5467 0.6122 0.5842 -0.0019 -0.0176 0.0055 88 ASP A OD2 693 N N . LEU A 94 ? 0.3703 0.4315 0.4066 0.0008 -0.0220 0.0036 89 LEU A N 694 C CA . LEU A 94 ? 0.4198 0.4832 0.4571 0.0009 -0.0218 0.0046 89 LEU A CA 695 C C . LEU A 94 ? 0.4337 0.5018 0.4701 0.0041 -0.0243 0.0016 89 LEU A C 696 O O . LEU A 94 ? 0.4382 0.5136 0.4745 0.0053 -0.0237 0.0012 89 LEU A O 697 C CB . LEU A 94 ? 0.4559 0.5234 0.4947 -0.0006 -0.0188 0.0075 89 LEU A CB 698 C CG . LEU A 94 ? 0.5077 0.5707 0.5477 -0.0035 -0.0166 0.0101 89 LEU A CG 699 C CD1 . LEU A 94 ? 0.5266 0.5937 0.5679 -0.0049 -0.0141 0.0128 89 LEU A CD1 700 C CD2 . LEU A 94 ? 0.5161 0.5738 0.5569 -0.0047 -0.0168 0.0110 89 LEU A CD2 701 N N . CYS A 95 ? 0.4222 0.4863 0.4580 0.0054 -0.0272 -0.0003 90 CYS A N 702 C CA . CYS A 95 ? 0.4010 0.4687 0.4360 0.0088 -0.0302 -0.0037 90 CYS A CA 703 C C . CYS A 95 ? 0.4034 0.4787 0.4392 0.0097 -0.0292 -0.0031 90 CYS A C 704 O O . CYS A 95 ? 0.3934 0.4762 0.4287 0.0120 -0.0297 -0.0049 90 CYS A O 705 C CB . CYS A 95 ? 0.4174 0.4783 0.4519 0.0094 -0.0335 -0.0055 90 CYS A CB 706 S SG . CYS A 95 ? 0.5112 0.5671 0.5474 0.0068 -0.0326 -0.0031 90 CYS A SG 707 N N . TYR A 96 ? 0.3867 0.4608 0.4237 0.0079 -0.0275 -0.0004 91 TYR A N 708 C CA . TYR A 96 ? 0.3902 0.4711 0.4278 0.0082 -0.0261 0.0010 91 TYR A CA 709 C C . TYR A 96 ? 0.3520 0.4347 0.3899 0.0058 -0.0227 0.0042 91 TYR A C 710 O O . TYR A 96 ? 0.3502 0.4278 0.3890 0.0034 -0.0211 0.0064 91 TYR A O 711 C CB . TYR A 96 ? 0.3935 0.4723 0.4323 0.0077 -0.0262 0.0021 91 TYR A CB 712 C CG . TYR A 96 ? 0.4142 0.5004 0.4528 0.0093 -0.0259 0.0026 91 TYR A CG 713 C CD1 . TYR A 96 ? 0.4268 0.5164 0.4650 0.0122 -0.0285 -0.0003 91 TYR A CD1 714 C CD2 . TYR A 96 ? 0.4346 0.5244 0.4733 0.0078 -0.0231 0.0060 91 TYR A CD2 715 C CE1 . TYR A 96 ? 0.3863 0.4833 0.4241 0.0138 -0.0282 0.0000 91 TYR A CE1 716 C CE2 . TYR A 96 ? 0.4320 0.5285 0.4700 0.0091 -0.0228 0.0068 91 TYR A CE2 717 C CZ . TYR A 96 ? 0.4266 0.5270 0.4641 0.0121 -0.0253 0.0038 91 TYR A CZ 718 O OH . TYR A 96 ? 0.4095 0.5171 0.4462 0.0134 -0.0249 0.0048 91 TYR A OH 719 N N . PRO A 97 ? 0.3536 0.4439 0.3909 0.0066 -0.0217 0.0044 92 PRO A N 720 C CA . PRO A 97 ? 0.3339 0.4258 0.3717 0.0041 -0.0189 0.0072 92 PRO A CA 721 C C . PRO A 97 ? 0.3539 0.4439 0.3927 0.0016 -0.0166 0.0112 92 PRO A C 722 O O . PRO A 97 ? 0.3568 0.4473 0.3958 0.0022 -0.0169 0.0122 92 PRO A O 723 C CB . PRO A 97 ? 0.3470 0.4486 0.3838 0.0055 -0.0186 0.0062 92 PRO A CB 724 C CG . PRO A 97 ? 0.3426 0.4482 0.3787 0.0082 -0.0205 0.0046 92 PRO A CG 725 C CD . PRO A 97 ? 0.3261 0.4246 0.3624 0.0095 -0.0231 0.0022 92 PRO A CD 726 N N . GLY A 98 ? 0.3744 0.4622 0.4141 -0.0008 -0.0145 0.0135 93 GLY A N 727 C CA . GLY A 98 ? 0.4053 0.4906 0.4460 -0.0031 -0.0126 0.0172 93 GLY A CA 728 C C . GLY A 98 ? 0.4143 0.4948 0.4563 -0.0056 -0.0110 0.0185 93 GLY A C 729 O O . GLY A 98 ? 0.4115 0.4940 0.4534 -0.0062 -0.0103 0.0180 93 GLY A O 730 N N . ASN A 99 ? 0.4059 0.4807 0.4491 -0.0069 -0.0105 0.0201 94 ASN A N 731 C CA . ASN A 99 ? 0.3721 0.4425 0.4167 -0.0091 -0.0091 0.0212 94 ASN A CA 732 C C . ASN A 99 ? 0.3877 0.4518 0.4332 -0.0095 -0.0095 0.0208 94 ASN A C 733 O O . ASN A 99 ? 0.3791 0.4424 0.4248 -0.0087 -0.0103 0.0207 94 ASN A O 734 C CB . ASN A 99 ? 0.4212 0.4922 0.4668 -0.0110 -0.0074 0.0246 94 ASN A CB 735 C CG . ASN A 99 ? 0.4257 0.5033 0.4704 -0.0114 -0.0066 0.0257 94 ASN A CG 736 O OD1 . ASN A 99 ? 0.3903 0.4720 0.4340 -0.0110 -0.0066 0.0273 94 ASN A OD1 737 N ND2 . ASN A 99 ? 0.4215 0.5003 0.4664 -0.0123 -0.0060 0.0247 94 ASN A ND2 738 N N . LEU A 100 ? 0.3962 0.4566 0.4426 -0.0110 -0.0087 0.0207 95 LEU A N 739 C CA . LEU A 100 ? 0.3623 0.4176 0.4099 -0.0120 -0.0084 0.0209 95 LEU A CA 740 C C . LEU A 100 ? 0.3639 0.4179 0.4132 -0.0137 -0.0068 0.0229 95 LEU A C 741 O O . LEU A 100 ? 0.3846 0.4386 0.4341 -0.0146 -0.0060 0.0228 95 LEU A O 742 C CB . LEU A 100 ? 0.3653 0.4173 0.4122 -0.0121 -0.0090 0.0189 95 LEU A CB 743 C CG . LEU A 100 ? 0.4069 0.4550 0.4541 -0.0125 -0.0096 0.0182 95 LEU A CG 744 C CD1 . LEU A 100 ? 0.4102 0.4548 0.4563 -0.0132 -0.0098 0.0170 95 LEU A CD1 745 C CD2 . LEU A 100 ? 0.4439 0.4906 0.4932 -0.0136 -0.0085 0.0197 95 LEU A CD2 746 N N . ASN A 101 ? 0.3316 0.3843 0.3823 -0.0140 -0.0065 0.0244 96 ASN A N 747 C CA . ASN A 101 ? 0.3219 0.3728 0.3743 -0.0154 -0.0054 0.0262 96 ASN A CA 748 C C . ASN A 101 ? 0.3070 0.3545 0.3605 -0.0165 -0.0048 0.0251 96 ASN A C 749 O O . ASN A 101 ? 0.3000 0.3456 0.3535 -0.0164 -0.0051 0.0235 96 ASN A O 750 C CB . ASN A 101 ? 0.3451 0.3949 0.3988 -0.0151 -0.0057 0.0277 96 ASN A CB 751 C CG . ASN A 101 ? 0.3528 0.4009 0.4079 -0.0162 -0.0051 0.0299 96 ASN A CG 752 O OD1 . ASN A 101 ? 0.4004 0.4504 0.4548 -0.0170 -0.0047 0.0318 96 ASN A OD1 753 N ND2 . ASN A 101 ? 0.3432 0.3881 0.4001 -0.0163 -0.0052 0.0298 96 ASN A ND2 754 N N . ASP A 102 ? 0.3409 0.3877 0.3956 -0.0178 -0.0039 0.0260 97 ASP A N 755 C CA . ASP A 102 ? 0.3322 0.3762 0.3881 -0.0187 -0.0034 0.0249 97 ASP A CA 756 C C . ASP A 102 ? 0.3190 0.3628 0.3733 -0.0183 -0.0036 0.0227 97 ASP A C 757 O O . ASP A 102 ? 0.3209 0.3622 0.3754 -0.0186 -0.0035 0.0215 97 ASP A O 758 C CB . ASP A 102 ? 0.3941 0.4352 0.4520 -0.0187 -0.0034 0.0248 97 ASP A CB 759 C CG . ASP A 102 ? 0.4695 0.5094 0.5294 -0.0192 -0.0033 0.0268 97 ASP A CG 760 O OD1 . ASP A 102 ? 0.5912 0.6314 0.6513 -0.0203 -0.0030 0.0280 97 ASP A OD1 761 O OD2 . ASP A 102 ? 0.4680 0.5064 0.5291 -0.0186 -0.0038 0.0271 97 ASP A OD2 762 N N . TYR A 103 ? 0.3169 0.3634 0.3693 -0.0176 -0.0041 0.0221 98 TYR A N 763 C CA . TYR A 103 ? 0.3166 0.3623 0.3670 -0.0168 -0.0050 0.0200 98 TYR A CA 764 C C . TYR A 103 ? 0.3076 0.3513 0.3581 -0.0175 -0.0045 0.0189 98 TYR A C 765 O O . TYR A 103 ? 0.2964 0.3376 0.3458 -0.0175 -0.0049 0.0178 98 TYR A O 766 C CB . TYR A 103 ? 0.3375 0.3870 0.3862 -0.0157 -0.0057 0.0193 98 TYR A CB 767 C CG . TYR A 103 ? 0.3208 0.3694 0.3673 -0.0144 -0.0072 0.0170 98 TYR A CG 768 C CD1 . TYR A 103 ? 0.3260 0.3709 0.3714 -0.0142 -0.0081 0.0163 98 TYR A CD1 769 C CD2 . TYR A 103 ? 0.3145 0.3663 0.3597 -0.0134 -0.0078 0.0156 98 TYR A CD2 770 C CE1 . TYR A 103 ? 0.3295 0.3729 0.3726 -0.0131 -0.0098 0.0145 98 TYR A CE1 771 C CE2 . TYR A 103 ? 0.3291 0.3796 0.3720 -0.0118 -0.0097 0.0134 98 TYR A CE2 772 C CZ . TYR A 103 ? 0.3218 0.3677 0.3636 -0.0118 -0.0107 0.0130 98 TYR A CZ 773 O OH . TYR A 103 ? 0.3425 0.3864 0.3818 -0.0104 -0.0128 0.0110 98 TYR A OH 774 N N . GLU A 104 ? 0.3227 0.3674 0.3746 -0.0184 -0.0036 0.0194 99 GLU A N 775 C CA . GLU A 104 ? 0.3045 0.3479 0.3564 -0.0189 -0.0033 0.0180 99 GLU A CA 776 C C . GLU A 104 ? 0.3163 0.3564 0.3693 -0.0196 -0.0028 0.0178 99 GLU A C 777 O O . GLU A 104 ? 0.3315 0.3699 0.3834 -0.0195 -0.0029 0.0164 99 GLU A O 778 C CB . GLU A 104 ? 0.3353 0.3809 0.3887 -0.0198 -0.0026 0.0183 99 GLU A CB 779 C CG . GLU A 104 ? 0.3618 0.4120 0.4140 -0.0192 -0.0029 0.0180 99 GLU A CG 780 C CD . GLU A 104 ? 0.3884 0.4414 0.4411 -0.0194 -0.0027 0.0202 99 GLU A CD 781 O OE1 . GLU A 104 ? 0.4933 0.5444 0.5474 -0.0202 -0.0023 0.0221 99 GLU A OE1 782 O OE2 . GLU A 104 ? 0.4250 0.4823 0.4764 -0.0186 -0.0031 0.0198 99 GLU A OE2 783 N N . GLU A 105 ? 0.2941 0.3334 0.3492 -0.0200 -0.0024 0.0191 100 GLU A N 784 C CA . GLU A 105 ? 0.2832 0.3203 0.3397 -0.0204 -0.0020 0.0186 100 GLU A CA 785 C C . GLU A 105 ? 0.2852 0.3213 0.3400 -0.0201 -0.0024 0.0179 100 GLU A C 786 O O . GLU A 105 ? 0.2774 0.3123 0.3319 -0.0205 -0.0021 0.0168 100 GLU A O 787 C CB . GLU A 105 ? 0.2963 0.3329 0.3555 -0.0206 -0.0018 0.0200 100 GLU A CB 788 C CG . GLU A 105 ? 0.3274 0.3636 0.3886 -0.0215 -0.0015 0.0206 100 GLU A CG 789 C CD . GLU A 105 ? 0.3369 0.3718 0.3995 -0.0218 -0.0011 0.0189 100 GLU A CD 790 O OE1 . GLU A 105 ? 0.2983 0.3322 0.3616 -0.0215 -0.0011 0.0177 100 GLU A OE1 791 O OE2 . GLU A 105 ? 0.3246 0.3599 0.3878 -0.0225 -0.0009 0.0187 100 GLU A OE2 792 N N . LEU A 106 ? 0.2720 0.3090 0.3256 -0.0195 -0.0031 0.0185 101 LEU A N 793 C CA . LEU A 106 ? 0.2990 0.3348 0.3509 -0.0194 -0.0038 0.0178 101 LEU A CA 794 C C . LEU A 106 ? 0.3293 0.3636 0.3785 -0.0195 -0.0042 0.0166 101 LEU A C 795 O O . LEU A 106 ? 0.3387 0.3712 0.3870 -0.0203 -0.0042 0.0161 101 LEU A O 796 C CB . LEU A 106 ? 0.2979 0.3349 0.3490 -0.0185 -0.0048 0.0183 101 LEU A CB 797 C CG . LEU A 106 ? 0.2902 0.3259 0.3397 -0.0185 -0.0057 0.0176 101 LEU A CG 798 C CD1 . LEU A 106 ? 0.3053 0.3404 0.3565 -0.0196 -0.0050 0.0175 101 LEU A CD1 799 C CD2 . LEU A 106 ? 0.2917 0.3291 0.3410 -0.0174 -0.0069 0.0178 101 LEU A CD2 800 N N . LYS A 107 ? 0.3093 0.3444 0.3571 -0.0187 -0.0048 0.0161 102 LYS A N 801 C CA . LYS A 107 ? 0.3495 0.3829 0.3947 -0.0185 -0.0056 0.0149 102 LYS A CA 802 C C . LYS A 107 ? 0.3458 0.3779 0.3912 -0.0194 -0.0046 0.0144 102 LYS A C 803 O O . LYS A 107 ? 0.3585 0.3884 0.4016 -0.0197 -0.0051 0.0139 102 LYS A O 804 C CB . LYS A 107 ? 0.4008 0.4362 0.4450 -0.0173 -0.0063 0.0141 102 LYS A CB 805 C CG . LYS A 107 ? 0.4471 0.4837 0.4901 -0.0160 -0.0077 0.0140 102 LYS A CG 806 C CD . LYS A 107 ? 0.4973 0.5358 0.5387 -0.0145 -0.0089 0.0125 102 LYS A CD 807 C CE . LYS A 107 ? 0.4851 0.5282 0.5285 -0.0146 -0.0078 0.0129 102 LYS A CE 808 N NZ . LYS A 107 ? 0.6546 0.6999 0.6963 -0.0130 -0.0090 0.0108 102 LYS A NZ 809 N N . HIS A 108 ? 0.3432 0.3766 0.3914 -0.0198 -0.0035 0.0147 103 HIS A N 810 C CA . HIS A 108 ? 0.3333 0.3661 0.3823 -0.0204 -0.0026 0.0139 103 HIS A CA 811 C C . HIS A 108 ? 0.3547 0.3865 0.4038 -0.0212 -0.0021 0.0139 103 HIS A C 812 O O . HIS A 108 ? 0.3617 0.3927 0.4094 -0.0217 -0.0019 0.0132 103 HIS A O 813 C CB . HIS A 108 ? 0.3425 0.3766 0.3948 -0.0207 -0.0018 0.0141 103 HIS A CB 814 C CG . HIS A 108 ? 0.3456 0.3794 0.3986 -0.0209 -0.0013 0.0127 103 HIS A CG 815 N ND1 . HIS A 108 ? 0.3742 0.4077 0.4291 -0.0213 -0.0006 0.0122 103 HIS A ND1 816 C CD2 . HIS A 108 ? 0.3759 0.4099 0.4277 -0.0206 -0.0015 0.0115 103 HIS A CD2 817 C CE1 . HIS A 108 ? 0.3826 0.4162 0.4375 -0.0213 -0.0004 0.0107 103 HIS A CE1 818 N NE2 . HIS A 108 ? 0.4132 0.4470 0.4662 -0.0209 -0.0010 0.0103 103 HIS A NE2 819 N N . LEU A 109 ? 0.3783 0.4106 0.4289 -0.0214 -0.0020 0.0148 104 LEU A N 820 C CA . LEU A 109 ? 0.3666 0.3989 0.4176 -0.0223 -0.0015 0.0147 104 LEU A CA 821 C C . LEU A 109 ? 0.3651 0.3957 0.4126 -0.0230 -0.0022 0.0147 104 LEU A C 822 O O . LEU A 109 ? 0.3657 0.3960 0.4122 -0.0241 -0.0016 0.0144 104 LEU A O 823 C CB . LEU A 109 ? 0.3954 0.4288 0.4485 -0.0220 -0.0016 0.0155 104 LEU A CB 824 C CG . LEU A 109 ? 0.4268 0.4614 0.4821 -0.0225 -0.0010 0.0151 104 LEU A CG 825 C CD1 . LEU A 109 ? 0.4086 0.4437 0.4637 -0.0227 -0.0016 0.0156 104 LEU A CD1 826 C CD2 . LEU A 109 ? 0.4315 0.4667 0.4865 -0.0235 -0.0001 0.0140 104 LEU A CD2 827 N N . LEU A 110 ? 0.3641 0.3935 0.4096 -0.0224 -0.0035 0.0151 105 LEU A N 828 C CA . LEU A 110 ? 0.3568 0.3837 0.3989 -0.0230 -0.0046 0.0152 105 LEU A CA 829 C C . LEU A 110 ? 0.3792 0.4040 0.4181 -0.0228 -0.0052 0.0146 105 LEU A C 830 O O . LEU A 110 ? 0.3802 0.4021 0.4158 -0.0233 -0.0064 0.0149 105 LEU A O 831 C CB . LEU A 110 ? 0.3504 0.3766 0.3916 -0.0221 -0.0062 0.0154 105 LEU A CB 832 C CG . LEU A 110 ? 0.3510 0.3791 0.3948 -0.0221 -0.0060 0.0159 105 LEU A CG 833 C CD1 . LEU A 110 ? 0.3419 0.3701 0.3850 -0.0208 -0.0076 0.0158 105 LEU A CD1 834 C CD2 . LEU A 110 ? 0.3466 0.3739 0.3903 -0.0239 -0.0057 0.0161 105 LEU A CD2 835 N N . SER A 111 ? 0.3511 0.3770 0.3907 -0.0221 -0.0046 0.0139 106 SER A N 836 C CA . SER A 111 ? 0.4049 0.4292 0.4416 -0.0214 -0.0054 0.0132 106 SER A CA 837 C C . SER A 111 ? 0.3828 0.4049 0.4165 -0.0228 -0.0054 0.0135 106 SER A C 838 O O . SER A 111 ? 0.3902 0.4091 0.4199 -0.0226 -0.0070 0.0136 106 SER A O 839 C CB . SER A 111 ? 0.4850 0.5114 0.5236 -0.0206 -0.0046 0.0121 106 SER A CB 840 O OG . SER A 111 ? 0.4584 0.4861 0.4991 -0.0215 -0.0031 0.0119 106 SER A OG 841 N N . ARG A 112 ? 0.3539 0.3776 0.3893 -0.0241 -0.0038 0.0137 107 ARG A N 842 C CA . ARG A 112 ? 0.3973 0.4200 0.4302 -0.0258 -0.0034 0.0142 107 ARG A CA 843 C C . ARG A 112 ? 0.3675 0.3920 0.4023 -0.0276 -0.0023 0.0149 107 ARG A C 844 O O . ARG A 112 ? 0.3982 0.4260 0.4369 -0.0274 -0.0010 0.0142 107 ARG A O 845 C CB . ARG A 112 ? 0.4630 0.4873 0.4957 -0.0257 -0.0024 0.0132 107 ARG A CB 846 C CG . ARG A 112 ? 0.5472 0.5715 0.5773 -0.0276 -0.0018 0.0139 107 ARG A CG 847 C CD . ARG A 112 ? 0.6038 0.6311 0.6348 -0.0273 -0.0004 0.0125 107 ARG A CD 848 N NE . ARG A 112 ? 0.7362 0.7615 0.7636 -0.0263 -0.0014 0.0121 107 ARG A NE 849 C CZ . ARG A 112 ? 0.9003 0.9278 0.9284 -0.0254 -0.0008 0.0105 107 ARG A CZ 850 N NH1 . ARG A 112 ? 0.8287 0.8601 0.8610 -0.0252 0.0006 0.0090 107 ARG A NH1 851 N NH2 . ARG A 112 ? 0.9613 0.9868 0.9858 -0.0244 -0.0019 0.0101 107 ARG A NH2 852 N N . ILE A 113 ? 0.3846 0.4071 0.4168 -0.0293 -0.0029 0.0161 108 ILE A N 853 C CA . ILE A 113 ? 0.3977 0.4219 0.4317 -0.0311 -0.0022 0.0166 108 ILE A CA 854 C C . ILE A 113 ? 0.4141 0.4376 0.4450 -0.0339 -0.0018 0.0177 108 ILE A C 855 O O . ILE A 113 ? 0.4274 0.4468 0.4541 -0.0346 -0.0032 0.0188 108 ILE A O 856 C CB . ILE A 113 ? 0.3993 0.4218 0.4340 -0.0307 -0.0037 0.0171 108 ILE A CB 857 C CG1 . ILE A 113 ? 0.4225 0.4471 0.4607 -0.0284 -0.0035 0.0162 108 ILE A CG1 858 C CG2 . ILE A 113 ? 0.4141 0.4381 0.4503 -0.0327 -0.0032 0.0176 108 ILE A CG2 859 C CD1 . ILE A 113 ? 0.4125 0.4412 0.4550 -0.0283 -0.0019 0.0156 108 ILE A CD1 860 N N . ASN A 114 ? 0.5050 0.5329 0.5382 -0.0354 0.0000 0.0174 109 ASN A N 861 C CA . ASN A 114 ? 0.5247 0.5536 0.5555 -0.0383 0.0008 0.0183 109 ASN A CA 862 C C . ASN A 114 ? 0.5234 0.5509 0.5535 -0.0409 0.0002 0.0198 109 ASN A C 863 O O . ASN A 114 ? 0.5091 0.5342 0.5353 -0.0435 -0.0001 0.0215 109 ASN A O 864 C CB . ASN A 114 ? 0.5576 0.5929 0.5914 -0.0386 0.0031 0.0168 109 ASN A CB 865 C CG . ASN A 114 ? 0.6504 0.6883 0.6819 -0.0418 0.0044 0.0177 109 ASN A CG 866 O OD1 . ASN A 114 ? 0.8251 0.8675 0.8590 -0.0436 0.0056 0.0173 109 ASN A OD1 867 N ND2 . ASN A 114 ? 0.6728 0.7080 0.6994 -0.0427 0.0040 0.0189 109 ASN A ND2 868 N N . HIS A 115 ? 0.5103 0.5393 0.5441 -0.0404 0.0001 0.0191 110 HIS A N 869 C CA . HIS A 115 ? 0.5057 0.5331 0.5393 -0.0426 -0.0008 0.0202 110 HIS A CA 870 C C . HIS A 115 ? 0.4862 0.5125 0.5223 -0.0403 -0.0022 0.0195 110 HIS A C 871 O O . HIS A 115 ? 0.4369 0.4667 0.4769 -0.0383 -0.0014 0.0181 110 HIS A O 872 C CB . HIS A 115 ? 0.5742 0.6070 0.6101 -0.0454 0.0009 0.0200 110 HIS A CB 873 C CG . HIS A 115 ? 0.6118 0.6431 0.6478 -0.0479 0.0000 0.0210 110 HIS A CG 874 N ND1 . HIS A 115 ? 0.6332 0.6598 0.6651 -0.0508 -0.0013 0.0231 110 HIS A ND1 875 C CD2 . HIS A 115 ? 0.6330 0.6667 0.6729 -0.0478 -0.0002 0.0200 110 HIS A CD2 876 C CE1 . HIS A 115 ? 0.6154 0.6415 0.6487 -0.0526 -0.0022 0.0233 110 HIS A CE1 877 N NE2 . HIS A 115 ? 0.6787 0.7094 0.7169 -0.0507 -0.0015 0.0214 110 HIS A NE2 878 N N . PHE A 116 ? 0.4409 0.4625 0.4749 -0.0406 -0.0044 0.0203 111 PHE A N 879 C CA . PHE A 116 ? 0.4536 0.4742 0.4895 -0.0383 -0.0059 0.0196 111 PHE A CA 880 C C . PHE A 116 ? 0.4903 0.5085 0.5256 -0.0404 -0.0075 0.0202 111 PHE A C 881 O O . PHE A 116 ? 0.5439 0.5571 0.5754 -0.0419 -0.0091 0.0214 111 PHE A O 882 C CB . PHE A 116 ? 0.4286 0.4456 0.4622 -0.0355 -0.0076 0.0193 111 PHE A CB 883 C CG . PHE A 116 ? 0.4025 0.4204 0.4384 -0.0326 -0.0086 0.0183 111 PHE A CG 884 C CD1 . PHE A 116 ? 0.4043 0.4265 0.4438 -0.0310 -0.0071 0.0175 111 PHE A CD1 885 C CD2 . PHE A 116 ? 0.4224 0.4368 0.4567 -0.0315 -0.0112 0.0181 111 PHE A CD2 886 C CE1 . PHE A 116 ? 0.3793 0.4025 0.4204 -0.0286 -0.0079 0.0169 111 PHE A CE1 887 C CE2 . PHE A 116 ? 0.3878 0.4037 0.4238 -0.0289 -0.0120 0.0171 111 PHE A CE2 888 C CZ . PHE A 116 ? 0.4009 0.4213 0.4402 -0.0276 -0.0103 0.0167 111 PHE A CZ 889 N N . GLU A 117 ? 0.5097 0.5309 0.5486 -0.0402 -0.0074 0.0194 112 GLU A N 890 C CA . GLU A 117 ? 0.5038 0.5230 0.5427 -0.0421 -0.0090 0.0197 112 GLU A CA 891 C C . GLU A 117 ? 0.4461 0.4669 0.4881 -0.0399 -0.0101 0.0183 112 GLU A C 892 O O . GLU A 117 ? 0.5094 0.5354 0.5551 -0.0391 -0.0086 0.0174 112 GLU A O 893 C CB . GLU A 117 ? 0.5371 0.5594 0.5771 -0.0461 -0.0074 0.0203 112 GLU A CB 894 C CG . GLU A 117 ? 0.5981 0.6177 0.6376 -0.0490 -0.0091 0.0209 112 GLU A CG 895 C CD . GLU A 117 ? 0.6676 0.6917 0.7089 -0.0532 -0.0072 0.0213 112 GLU A CD 896 O OE1 . GLU A 117 ? 0.6153 0.6445 0.6576 -0.0540 -0.0046 0.0211 112 GLU A OE1 897 O OE2 . GLU A 117 ? 0.7960 0.8189 0.8380 -0.0558 -0.0084 0.0216 112 GLU A OE2 898 N N . LYS A 118 ? 0.4047 0.4214 0.4452 -0.0389 -0.0128 0.0182 113 LYS A N 899 C CA . LYS A 118 ? 0.4294 0.4475 0.4724 -0.0369 -0.0141 0.0168 113 LYS A CA 900 C C . LYS A 118 ? 0.4043 0.4245 0.4499 -0.0395 -0.0141 0.0165 113 LYS A C 901 O O . LYS A 118 ? 0.4932 0.5102 0.5372 -0.0426 -0.0151 0.0173 113 LYS A O 902 C CB . LYS A 118 ? 0.4662 0.4794 0.5065 -0.0348 -0.0173 0.0163 113 LYS A CB 903 C CG . LYS A 118 ? 0.5274 0.5430 0.5702 -0.0321 -0.0186 0.0147 113 LYS A CG 904 C CD . LYS A 118 ? 0.5489 0.5622 0.5898 -0.0288 -0.0211 0.0137 113 LYS A CD 905 C CE . LYS A 118 ? 0.5599 0.5676 0.5987 -0.0297 -0.0243 0.0133 113 LYS A CE 906 N NZ . LYS A 118 ? 0.5725 0.5795 0.6105 -0.0261 -0.0271 0.0115 113 LYS A NZ 907 N N . ILE A 119 ? 0.3931 0.4185 0.4425 -0.0382 -0.0132 0.0153 114 ILE A N 908 C CA . ILE A 119 ? 0.4142 0.4425 0.4667 -0.0402 -0.0133 0.0145 114 ILE A CA 909 C C . ILE A 119 ? 0.4015 0.4321 0.4566 -0.0372 -0.0146 0.0129 114 ILE A C 910 O O . ILE A 119 ? 0.4059 0.4379 0.4613 -0.0338 -0.0144 0.0125 114 ILE A O 911 C CB . ILE A 119 ? 0.4592 0.4933 0.5145 -0.0421 -0.0104 0.0143 114 ILE A CB 912 C CG1 . ILE A 119 ? 0.4814 0.5194 0.5387 -0.0389 -0.0089 0.0136 114 ILE A CG1 913 C CG2 . ILE A 119 ? 0.4945 0.5274 0.5474 -0.0454 -0.0090 0.0158 114 ILE A CG2 914 C CD1 . ILE A 119 ? 0.4955 0.5400 0.5567 -0.0398 -0.0069 0.0125 114 ILE A CD1 915 N N . LEU A 120 ? 0.4014 0.4324 0.4582 -0.0386 -0.0160 0.0120 115 LEU A N 916 C CA . LEU A 120 ? 0.4310 0.4647 0.4903 -0.0359 -0.0173 0.0103 115 LEU A CA 917 C C . LEU A 120 ? 0.4273 0.4675 0.4904 -0.0354 -0.0153 0.0094 115 LEU A C 918 O O . LEU A 120 ? 0.4240 0.4669 0.4889 -0.0384 -0.0139 0.0094 115 LEU A O 919 C CB . LEU A 120 ? 0.4308 0.4622 0.4906 -0.0376 -0.0198 0.0093 115 LEU A CB 920 C CG . LEU A 120 ? 0.4306 0.4643 0.4926 -0.0347 -0.0218 0.0073 115 LEU A CG 921 C CD1 . LEU A 120 ? 0.4006 0.4331 0.4606 -0.0304 -0.0232 0.0069 115 LEU A CD1 922 C CD2 . LEU A 120 ? 0.4391 0.4697 0.5016 -0.0371 -0.0244 0.0064 115 LEU A CD2 923 N N . ILE A 121 ? 0.4135 0.4564 0.4776 -0.0317 -0.0151 0.0090 116 ILE A N 924 C CA . ILE A 121 ? 0.4432 0.4917 0.5107 -0.0307 -0.0136 0.0081 116 ILE A CA 925 C C . ILE A 121 ? 0.4625 0.5142 0.5325 -0.0285 -0.0151 0.0065 116 ILE A C 926 O O . ILE A 121 ? 0.5555 0.6119 0.6288 -0.0285 -0.0144 0.0053 116 ILE A O 927 C CB . ILE A 121 ? 0.4397 0.4892 0.5069 -0.0287 -0.0119 0.0090 116 ILE A CB 928 C CG1 . ILE A 121 ? 0.4318 0.4794 0.4969 -0.0254 -0.0128 0.0097 116 ILE A CG1 929 C CG2 . ILE A 121 ? 0.4796 0.5272 0.5451 -0.0311 -0.0102 0.0102 116 ILE A CG2 930 C CD1 . ILE A 121 ? 0.4443 0.4937 0.5100 -0.0232 -0.0115 0.0104 116 ILE A CD1 931 N N . ILE A 122 ? 0.4124 0.4621 0.4808 -0.0262 -0.0172 0.0063 117 ILE A N 932 C CA . ILE A 122 ? 0.4292 0.4819 0.4995 -0.0238 -0.0187 0.0047 117 ILE A CA 933 C C . ILE A 122 ? 0.4633 0.5129 0.5322 -0.0237 -0.0215 0.0038 117 ILE A C 934 O O . ILE A 122 ? 0.4324 0.4801 0.4988 -0.0213 -0.0227 0.0041 117 ILE A O 935 C CB . ILE A 122 ? 0.4625 0.5171 0.5322 -0.0199 -0.0185 0.0053 117 ILE A CB 936 C CG1 . ILE A 122 ? 0.4406 0.4976 0.5117 -0.0197 -0.0163 0.0061 117 ILE A CG1 937 C CG2 . ILE A 122 ? 0.4929 0.5509 0.5642 -0.0174 -0.0204 0.0037 117 ILE A CG2 938 C CD1 . ILE A 122 ? 0.4517 0.5096 0.5218 -0.0164 -0.0162 0.0073 117 ILE A CD1 939 N N . PRO A 123 ? 0.4504 0.4996 0.5210 -0.0265 -0.0226 0.0026 118 PRO A N 940 C CA . PRO A 123 ? 0.4500 0.4954 0.5194 -0.0265 -0.0256 0.0016 118 PRO A CA 941 C C . PRO A 123 ? 0.4404 0.4880 0.5099 -0.0222 -0.0276 0.0000 118 PRO A C 942 O O . PRO A 123 ? 0.4977 0.5504 0.5694 -0.0202 -0.0271 -0.0007 118 PRO A O 943 C CB . PRO A 123 ? 0.4526 0.4982 0.5247 -0.0303 -0.0262 0.0005 118 PRO A CB 944 C CG . PRO A 123 ? 0.4674 0.5168 0.5415 -0.0327 -0.0232 0.0012 118 PRO A CG 945 C CD . PRO A 123 ? 0.4319 0.4844 0.5059 -0.0295 -0.0213 0.0019 118 PRO A CD 946 N N . LYS A 124 ? 0.4933 0.5375 0.5604 -0.0207 -0.0300 -0.0005 119 LYS A N 947 C CA . LYS A 124 ? 0.5681 0.6148 0.6351 -0.0167 -0.0321 -0.0023 119 LYS A CA 948 C C . LYS A 124 ? 0.5791 0.6297 0.6495 -0.0162 -0.0335 -0.0046 119 LYS A C 949 O O . LYS A 124 ? 0.5837 0.6389 0.6548 -0.0129 -0.0338 -0.0055 119 LYS A O 950 C CB . LYS A 124 ? 0.6033 0.6454 0.6678 -0.0158 -0.0351 -0.0034 119 LYS A CB 951 C CG . LYS A 124 ? 0.7145 0.7552 0.7756 -0.0136 -0.0348 -0.0024 119 LYS A CG 952 C CD . LYS A 124 ? 0.7870 0.8263 0.8464 -0.0107 -0.0383 -0.0046 119 LYS A CD 953 C CE . LYS A 124 ? 0.8576 0.8958 0.9136 -0.0088 -0.0379 -0.0037 119 LYS A CE 954 N NZ . LYS A 124 ? 1.0127 1.0534 1.0675 -0.0047 -0.0405 -0.0061 119 LYS A NZ 955 N N . SER A 125 ? 0.6536 0.7024 0.7261 -0.0198 -0.0342 -0.0055 120 SER A N 956 C CA . SER A 125 ? 0.6339 0.6863 0.7101 -0.0197 -0.0358 -0.0080 120 SER A CA 957 C C . SER A 125 ? 0.6210 0.6800 0.7000 -0.0187 -0.0337 -0.0082 120 SER A C 958 O O . SER A 125 ? 0.7301 0.7932 0.8119 -0.0175 -0.0350 -0.0104 120 SER A O 959 C CB . SER A 125 ? 0.6788 0.7281 0.7568 -0.0246 -0.0365 -0.0084 120 SER A CB 960 O OG . SER A 125 ? 0.7117 0.7613 0.7901 -0.0281 -0.0334 -0.0063 120 SER A OG 961 N N . SER A 126 ? 0.5797 0.6397 0.6579 -0.0189 -0.0308 -0.0060 121 SER A N 962 C CA . SER A 126 ? 0.5777 0.6431 0.6583 -0.0179 -0.0291 -0.0061 121 SER A CA 963 C C . SER A 126 ? 0.6525 0.7214 0.7323 -0.0129 -0.0298 -0.0063 121 SER A C 964 O O . SER A 126 ? 0.6179 0.6915 0.6998 -0.0114 -0.0293 -0.0070 121 SER A O 965 C CB . SER A 126 ? 0.5378 0.6027 0.6179 -0.0197 -0.0261 -0.0039 121 SER A CB 966 O OG . SER A 126 ? 0.6121 0.6754 0.6891 -0.0173 -0.0253 -0.0020 121 SER A OG 967 N N . TRP A 127 ? 0.6621 0.7292 0.7388 -0.0105 -0.0310 -0.0059 122 TRP A N 968 C CA . TRP A 127 ? 0.7164 0.7871 0.7919 -0.0061 -0.0318 -0.0060 122 TRP A CA 969 C C . TRP A 127 ? 0.8226 0.8964 0.8997 -0.0041 -0.0347 -0.0091 122 TRP A C 970 O O . TRP A 127 ? 0.9433 1.0159 1.0188 -0.0026 -0.0369 -0.0103 122 TRP A O 971 C CB . TRP A 127 ? 0.6725 0.7412 0.7440 -0.0043 -0.0317 -0.0043 122 TRP A CB 972 C CG . TRP A 127 ? 0.5942 0.6601 0.6642 -0.0060 -0.0291 -0.0016 122 TRP A CG 973 C CD1 . TRP A 127 ? 0.5691 0.6301 0.6374 -0.0084 -0.0286 -0.0007 122 TRP A CD1 974 C CD2 . TRP A 127 ? 0.5165 0.5840 0.5864 -0.0054 -0.0269 0.0004 122 TRP A CD2 975 N NE1 . TRP A 127 ? 0.4976 0.5577 0.5651 -0.0093 -0.0261 0.0015 122 TRP A NE1 976 C CE2 . TRP A 127 ? 0.4796 0.5433 0.5481 -0.0075 -0.0251 0.0023 122 TRP A CE2 977 C CE3 . TRP A 127 ? 0.5016 0.5729 0.5725 -0.0032 -0.0266 0.0008 122 TRP A CE3 978 C CZ2 . TRP A 127 ? 0.5091 0.5729 0.5774 -0.0076 -0.0229 0.0044 122 TRP A CZ2 979 C CZ3 . TRP A 127 ? 0.5292 0.6000 0.5997 -0.0033 -0.0245 0.0031 122 TRP A CZ3 980 C CH2 . TRP A 127 ? 0.5075 0.5747 0.5769 -0.0055 -0.0227 0.0048 122 TRP A CH2 981 N N . THR A 128 ? 0.7535 0.8313 0.8339 -0.0039 -0.0349 -0.0106 123 THR A N 982 C CA . THR A 128 ? 0.7540 0.8348 0.8366 -0.0024 -0.0378 -0.0139 123 THR A CA 983 C C . THR A 128 ? 0.6711 0.7559 0.7518 0.0025 -0.0392 -0.0145 123 THR A C 984 O O . THR A 128 ? 0.6750 0.7610 0.7558 0.0043 -0.0419 -0.0170 123 THR A O 985 C CB . THR A 128 ? 0.7611 0.8452 0.8481 -0.0040 -0.0377 -0.0159 123 THR A CB 986 O OG1 . THR A 128 ? 0.7605 0.8479 0.8480 -0.0026 -0.0358 -0.0145 123 THR A OG1 987 C CG2 . THR A 128 ? 0.8311 0.9117 0.9200 -0.0093 -0.0368 -0.0158 123 THR A CG2 988 N N . ASN A 129 ? 0.5953 0.6818 0.6740 0.0045 -0.0375 -0.0119 124 ASN A N 989 C CA . ASN A 129 ? 0.6017 0.6923 0.6782 0.0089 -0.0385 -0.0118 124 ASN A CA 990 C C . ASN A 129 ? 0.6002 0.6898 0.6723 0.0106 -0.0382 -0.0098 124 ASN A C 991 O O . ASN A 129 ? 0.6251 0.7185 0.6950 0.0139 -0.0386 -0.0090 124 ASN A O 992 C CB . ASN A 129 ? 0.6874 0.7811 0.7645 0.0104 -0.0374 -0.0104 124 ASN A CB 993 C CG . ASN A 129 ? 0.7100 0.8062 0.7916 0.0095 -0.0380 -0.0130 124 ASN A CG 994 O OD1 . ASN A 129 ? 0.7156 0.8133 0.7995 0.0093 -0.0400 -0.0162 124 ASN A OD1 995 N ND2 . ASN A 129 ? 0.7440 0.8406 0.8271 0.0087 -0.0363 -0.0119 124 ASN A ND2 996 N N . HIS A 130 ? 0.5665 0.6515 0.6373 0.0082 -0.0375 -0.0089 125 HIS A N 997 C CA . HIS A 130 ? 0.5059 0.5904 0.5730 0.0096 -0.0372 -0.0074 125 HIS A CA 998 C C . HIS A 130 ? 0.4888 0.5700 0.5554 0.0088 -0.0390 -0.0094 125 HIS A C 999 O O . HIS A 130 ? 0.5629 0.6405 0.6317 0.0060 -0.0396 -0.0106 125 HIS A O 1000 C CB . HIS A 130 ? 0.4879 0.5699 0.5533 0.0080 -0.0342 -0.0037 125 HIS A CB 1001 C CG . HIS A 130 ? 0.4393 0.5237 0.5050 0.0090 -0.0328 -0.0016 125 HIS A CG 1002 N ND1 . HIS A 130 ? 0.4465 0.5305 0.5153 0.0075 -0.0321 -0.0020 125 HIS A ND1 1003 C CD2 . HIS A 130 ? 0.4255 0.5125 0.4888 0.0113 -0.0321 0.0006 125 HIS A CD2 1004 C CE1 . HIS A 130 ? 0.4535 0.5394 0.5218 0.0091 -0.0312 0.0000 125 HIS A CE1 1005 N NE2 . HIS A 130 ? 0.4512 0.5386 0.5160 0.0113 -0.0313 0.0017 125 HIS A NE2 1006 N N . GLU A 131 ? 0.4903 0.5730 0.5540 0.0112 -0.0398 -0.0096 126 GLU A N 1007 C CA . GLU A 131 ? 0.6192 0.6987 0.6821 0.0110 -0.0419 -0.0117 126 GLU A CA 1008 C C . GLU A 131 ? 0.5921 0.6660 0.6536 0.0081 -0.0400 -0.0094 126 GLU A C 1009 O O . GLU A 131 ? 0.5691 0.6439 0.6286 0.0082 -0.0376 -0.0066 126 GLU A O 1010 C CB . GLU A 131 ? 0.6659 0.7500 0.7260 0.0149 -0.0433 -0.0128 126 GLU A CB 1011 C CG . GLU A 131 ? 0.7276 0.8127 0.7881 0.0172 -0.0471 -0.0170 126 GLU A CG 1012 C CD . GLU A 131 ? 0.7642 0.8433 0.8273 0.0146 -0.0492 -0.0192 126 GLU A CD 1013 O OE1 . GLU A 131 ? 0.7790 0.8521 0.8413 0.0124 -0.0492 -0.0187 126 GLU A OE1 1014 O OE2 . GLU A 131 ? 0.7832 0.8638 0.8490 0.0150 -0.0510 -0.0216 126 GLU A OE2 1015 N N . THR A 132 ? 0.6143 0.6827 0.6768 0.0055 -0.0411 -0.0104 127 THR A N 1016 C CA . THR A 132 ? 0.6149 0.6779 0.6760 0.0027 -0.0395 -0.0084 127 THR A CA 1017 C C . THR A 132 ? 0.5876 0.6468 0.6465 0.0034 -0.0418 -0.0099 127 THR A C 1018 O O . THR A 132 ? 0.6548 0.7094 0.7123 0.0014 -0.0410 -0.0086 127 THR A O 1019 C CB . THR A 132 ? 0.6614 0.7201 0.7247 -0.0014 -0.0386 -0.0077 127 THR A CB 1020 O OG1 . THR A 132 ? 0.6392 0.6953 0.7041 -0.0024 -0.0416 -0.0104 127 THR A OG1 1021 C CG2 . THR A 132 ? 0.6977 0.7601 0.7634 -0.0020 -0.0365 -0.0066 127 THR A CG2 1022 N N . SER A 133 ? 0.5838 0.6453 0.6424 0.0065 -0.0449 -0.0130 128 SER A N 1023 C CA . SER A 133 ? 0.6565 0.7141 0.7135 0.0074 -0.0479 -0.0152 128 SER A CA 1024 C C . SER A 133 ? 0.6521 0.7147 0.7066 0.0116 -0.0488 -0.0165 128 SER A C 1025 O O . SER A 133 ? 0.6782 0.7384 0.7313 0.0131 -0.0514 -0.0187 128 SER A O 1026 C CB . SER A 133 ? 0.7200 0.7751 0.7792 0.0073 -0.0516 -0.0185 128 SER A CB 1027 O OG . SER A 133 ? 0.7605 0.8220 0.8206 0.0109 -0.0533 -0.0211 128 SER A OG 1028 N N . LEU A 134 ? 0.6348 0.7046 0.6888 0.0136 -0.0467 -0.0153 129 LEU A N 1029 C CA . LEU A 134 ? 0.6152 0.6914 0.6669 0.0174 -0.0471 -0.0162 129 LEU A CA 1030 C C . LEU A 134 ? 0.5489 0.6269 0.5984 0.0168 -0.0440 -0.0131 129 LEU A C 1031 O O . LEU A 134 ? 0.5077 0.5914 0.5552 0.0195 -0.0441 -0.0137 129 LEU A O 1032 C CB . LEU A 134 ? 0.6742 0.7579 0.7265 0.0200 -0.0473 -0.0170 129 LEU A CB 1033 C CG . LEU A 134 ? 0.7592 0.8458 0.8124 0.0233 -0.0514 -0.0216 129 LEU A CG 1034 C CD1 . LEU A 134 ? 0.7615 0.8410 0.8168 0.0219 -0.0546 -0.0244 129 LEU A CD1 1035 C CD2 . LEU A 134 ? 0.7420 0.8345 0.7964 0.0248 -0.0510 -0.0215 129 LEU A CD2 1036 N N . GLY A 135 ? 0.4559 0.5294 0.5057 0.0134 -0.0413 -0.0099 130 GLY A N 1037 C CA . GLY A 135 ? 0.4814 0.5558 0.5294 0.0126 -0.0384 -0.0071 130 GLY A CA 1038 C C . GLY A 135 ? 0.4589 0.5292 0.5053 0.0121 -0.0392 -0.0078 130 GLY A C 1039 O O . GLY A 135 ? 0.4372 0.5017 0.4838 0.0092 -0.0379 -0.0062 130 GLY A O 1040 N N . VAL A 136 ? 0.4350 0.5086 0.4800 0.0152 -0.0414 -0.0107 131 VAL A N 1041 C CA . VAL A 136 ? 0.4611 0.5310 0.5046 0.0156 -0.0430 -0.0123 131 VAL A CA 1042 C C . VAL A 136 ? 0.4603 0.5377 0.5021 0.0187 -0.0431 -0.0135 131 VAL A C 1043 O O . VAL A 136 ? 0.4623 0.5470 0.5041 0.0207 -0.0428 -0.0139 131 VAL A O 1044 C CB . VAL A 136 ? 0.4930 0.5576 0.5371 0.0165 -0.0474 -0.0159 131 VAL A CB 1045 C CG1 . VAL A 136 ? 0.4982 0.5553 0.5440 0.0127 -0.0472 -0.0144 131 VAL A CG1 1046 C CG2 . VAL A 136 ? 0.4465 0.5165 0.4912 0.0202 -0.0503 -0.0195 131 VAL A CG2 1047 N N . SER A 137 ? 0.4512 0.5273 0.4914 0.0192 -0.0435 -0.0143 132 SER A N 1048 C CA . SER A 137 ? 0.4434 0.5273 0.4822 0.0217 -0.0432 -0.0154 132 SER A CA 1049 C C . SER A 137 ? 0.4829 0.5646 0.5204 0.0235 -0.0459 -0.0186 132 SER A C 1050 O O . SER A 137 ? 0.5514 0.6247 0.5887 0.0217 -0.0466 -0.0182 132 SER A O 1051 C CB . SER A 137 ? 0.4800 0.5661 0.5184 0.0192 -0.0388 -0.0113 132 SER A CB 1052 O OG . SER A 137 ? 0.5507 0.6444 0.5877 0.0210 -0.0382 -0.0120 132 SER A OG 1053 N N . ALA A 138 ? 0.4564 0.5458 0.4930 0.0272 -0.0475 -0.0219 133 ALA A N 1054 C CA . ALA A 138 ? 0.4644 0.5535 0.4997 0.0296 -0.0500 -0.0252 133 ALA A CA 1055 C C . ALA A 138 ? 0.4791 0.5666 0.5136 0.0272 -0.0471 -0.0226 133 ALA A C 1056 O O . ALA A 138 ? 0.4416 0.5259 0.4750 0.0283 -0.0491 -0.0246 133 ALA A O 1057 C CB . ALA A 138 ? 0.4487 0.5484 0.4834 0.0340 -0.0516 -0.0291 133 ALA A CB 1058 N N . ALA A 139 ? 0.5157 0.6051 0.5506 0.0241 -0.0428 -0.0181 134 ALA A N 1059 C CA . ALA A 139 ? 0.5174 0.6050 0.5519 0.0216 -0.0400 -0.0156 134 ALA A CA 1060 C C . ALA A 139 ? 0.5633 0.6397 0.5977 0.0190 -0.0404 -0.0142 134 ALA A C 1061 O O . ALA A 139 ? 0.5661 0.6400 0.5998 0.0177 -0.0393 -0.0132 134 ALA A O 1062 C CB . ALA A 139 ? 0.5250 0.6172 0.5600 0.0191 -0.0357 -0.0113 134 ALA A CB 1063 N N . CYS A 140 ? 0.5394 0.6097 0.5745 0.0182 -0.0420 -0.0142 135 CYS A N 1064 C CA . CYS A 140 ? 0.4888 0.5492 0.5238 0.0154 -0.0423 -0.0128 135 CYS A CA 1065 C C . CYS A 140 ? 0.4685 0.5227 0.5032 0.0167 -0.0469 -0.0158 135 CYS A C 1066 O O . CYS A 140 ? 0.3967 0.4467 0.4327 0.0151 -0.0475 -0.0151 135 CYS A O 1067 C CB . CYS A 140 ? 0.4719 0.5304 0.5086 0.0119 -0.0392 -0.0090 135 CYS A CB 1068 S SG . CYS A 140 ? 0.5436 0.6074 0.5809 0.0099 -0.0343 -0.0051 135 CYS A SG 1069 N N . PRO A 141 ? 0.4414 0.4951 0.4746 0.0198 -0.0503 -0.0193 136 PRO A N 1070 C CA . PRO A 141 ? 0.4247 0.4724 0.4576 0.0213 -0.0551 -0.0224 136 PRO A CA 1071 C C . PRO A 141 ? 0.4695 0.5063 0.5016 0.0181 -0.0559 -0.0206 136 PRO A C 1072 O O . PRO A 141 ? 0.4375 0.4714 0.4684 0.0161 -0.0539 -0.0183 136 PRO A O 1073 C CB . PRO A 141 ? 0.4666 0.5175 0.4980 0.0258 -0.0584 -0.0268 136 PRO A CB 1074 C CG . PRO A 141 ? 0.4805 0.5356 0.5111 0.0254 -0.0553 -0.0253 136 PRO A CG 1075 C CD . PRO A 141 ? 0.4796 0.5386 0.5115 0.0221 -0.0501 -0.0209 136 PRO A CD 1076 N N . TYR A 142 ? 0.5226 0.5535 0.5553 0.0176 -0.0590 -0.0217 137 TYR A N 1077 C CA . TYR A 142 ? 0.6481 0.6682 0.6794 0.0150 -0.0608 -0.0205 137 TYR A CA 1078 C C . TYR A 142 ? 0.7806 0.7956 0.8115 0.0173 -0.0666 -0.0243 137 TYR A C 1079 O O . TYR A 142 ? 0.7714 0.7872 0.8043 0.0177 -0.0683 -0.0258 137 TYR A O 1080 C CB . TYR A 142 ? 0.7098 0.7271 0.7427 0.0103 -0.0579 -0.0168 137 TYR A CB 1081 C CG . TYR A 142 ? 0.8663 0.8733 0.8980 0.0068 -0.0595 -0.0152 137 TYR A CG 1082 C CD1 . TYR A 142 ? 0.9489 0.9499 0.9776 0.0062 -0.0602 -0.0143 137 TYR A CD1 1083 C CD2 . TYR A 142 ? 1.0475 1.0508 1.0810 0.0040 -0.0602 -0.0145 137 TYR A CD2 1084 C CE1 . TYR A 142 ? 1.0363 1.0277 1.0634 0.0029 -0.0617 -0.0125 137 TYR A CE1 1085 C CE2 . TYR A 142 ? 1.1996 1.1937 1.2319 0.0004 -0.0616 -0.0128 137 TYR A CE2 1086 C CZ . TYR A 142 ? 1.2578 1.2458 1.2866 -0.0001 -0.0623 -0.0116 137 TYR A CZ 1087 O OH . TYR A 142 ? 1.4973 1.4761 1.5246 -0.0040 -0.0637 -0.0095 137 TYR A OH 1088 N N . GLN A 143 ? 0.8991 0.9089 0.9273 0.0192 -0.0700 -0.0261 138 GLN A N 1089 C CA . GLN A 143 ? 0.8598 0.8646 0.8872 0.0224 -0.0762 -0.0303 138 GLN A CA 1090 C C . GLN A 143 ? 0.8547 0.8694 0.8835 0.0276 -0.0777 -0.0348 138 GLN A C 1091 O O . GLN A 143 ? 0.7362 0.7509 0.7663 0.0295 -0.0811 -0.0379 138 GLN A O 1092 C CB . GLN A 143 ? 0.8688 0.8653 0.8972 0.0193 -0.0784 -0.0295 138 GLN A CB 1093 C CG . GLN A 143 ? 0.9478 0.9339 0.9740 0.0148 -0.0780 -0.0256 138 GLN A CG 1094 C CD . GLN A 143 ? 1.0194 0.9996 1.0470 0.0099 -0.0778 -0.0231 138 GLN A CD 1095 O OE1 . GLN A 143 ? 1.0292 1.0144 1.0599 0.0088 -0.0759 -0.0229 138 GLN A OE1 1096 N NE2 . GLN A 143 ? 1.1196 1.0892 1.1448 0.0067 -0.0796 -0.0209 138 GLN A NE2 1097 N N . GLY A 144 ? 0.8547 0.8785 0.8832 0.0295 -0.0747 -0.0350 139 GLY A N 1098 C CA . GLY A 144 ? 0.8744 0.9094 0.9038 0.0343 -0.0755 -0.0391 139 GLY A CA 1099 C C . GLY A 144 ? 0.9460 0.9890 0.9780 0.0344 -0.0735 -0.0389 139 GLY A C 1100 O O . GLY A 144 ? 0.7852 0.8390 0.8176 0.0375 -0.0726 -0.0410 139 GLY A O 1101 N N . THR A 145 ? 0.9898 1.0275 1.0232 0.0308 -0.0728 -0.0365 140 THR A N 1102 C CA . THR A 145 ? 0.8190 0.8623 0.8550 0.0301 -0.0709 -0.0358 140 THR A CA 1103 C C . THR A 145 ? 0.6535 0.7015 0.6902 0.0267 -0.0647 -0.0308 140 THR A C 1104 O O . THR A 145 ? 0.5994 0.6430 0.6353 0.0232 -0.0619 -0.0271 140 THR A O 1105 C CB . THR A 145 ? 0.8996 0.9352 0.9372 0.0284 -0.0740 -0.0364 140 THR A CB 1106 O OG1 . THR A 145 ? 0.8158 0.8558 0.8558 0.0266 -0.0712 -0.0346 140 THR A OG1 1107 C CG2 . THR A 145 ? 0.9902 1.0140 1.0268 0.0240 -0.0743 -0.0335 140 THR A CG2 1108 N N . PRO A 146 ? 0.6107 0.6678 0.6487 0.0278 -0.0626 -0.0307 141 PRO A N 1109 C CA . PRO A 146 ? 0.5500 0.6112 0.5884 0.0250 -0.0572 -0.0261 141 PRO A CA 1110 C C . PRO A 146 ? 0.4730 0.5274 0.5126 0.0203 -0.0550 -0.0223 141 PRO A C 1111 O O . PRO A 146 ? 0.4676 0.5173 0.5085 0.0193 -0.0571 -0.0231 141 PRO A O 1112 C CB . PRO A 146 ? 0.5416 0.6126 0.5810 0.0273 -0.0564 -0.0270 141 PRO A CB 1113 C CG . PRO A 146 ? 0.5473 0.6227 0.5861 0.0322 -0.0606 -0.0323 141 PRO A CG 1114 C CD . PRO A 146 ? 0.5991 0.6642 0.6378 0.0322 -0.0650 -0.0347 141 PRO A CD 1115 N N . SER A 147 ? 0.4173 0.4709 0.4564 0.0175 -0.0511 -0.0185 142 SER A N 1116 C CA . SER A 147 ? 0.4264 0.4740 0.4665 0.0130 -0.0489 -0.0151 142 SER A CA 1117 C C . SER A 147 ? 0.3844 0.4358 0.4248 0.0111 -0.0442 -0.0114 142 SER A C 1118 O O . SER A 147 ? 0.3908 0.4499 0.4312 0.0129 -0.0426 -0.0111 142 SER A O 1119 C CB . SER A 147 ? 0.4705 0.5086 0.5092 0.0110 -0.0505 -0.0148 142 SER A CB 1120 O OG . SER A 147 ? 0.5061 0.5389 0.5460 0.0068 -0.0489 -0.0120 142 SER A OG 1121 N N . PHE A 148 ? 0.3499 0.3961 0.3905 0.0075 -0.0420 -0.0085 143 PHE A N 1122 C CA . PHE A 148 ? 0.3692 0.4182 0.4103 0.0057 -0.0379 -0.0052 143 PHE A CA 1123 C C . PHE A 148 ? 0.3807 0.4233 0.4216 0.0021 -0.0361 -0.0027 143 PHE A C 1124 O O . PHE A 148 ? 0.4206 0.4568 0.4611 0.0005 -0.0379 -0.0032 143 PHE A O 1125 C CB . PHE A 148 ? 0.3676 0.4205 0.4109 0.0054 -0.0367 -0.0043 143 PHE A CB 1126 C CG . PHE A 148 ? 0.3915 0.4487 0.4353 0.0045 -0.0329 -0.0012 143 PHE A CG 1127 C CD1 . PHE A 148 ? 0.4067 0.4700 0.4495 0.0064 -0.0319 -0.0008 143 PHE A CD1 1128 C CD2 . PHE A 148 ? 0.4234 0.4783 0.4688 0.0017 -0.0307 0.0012 143 PHE A CD2 1129 C CE1 . PHE A 148 ? 0.4076 0.4739 0.4507 0.0053 -0.0288 0.0021 143 PHE A CE1 1130 C CE2 . PHE A 148 ? 0.4262 0.4843 0.4721 0.0011 -0.0278 0.0038 143 PHE A CE2 1131 C CZ . PHE A 148 ? 0.4199 0.4832 0.4645 0.0028 -0.0269 0.0044 143 PHE A CZ 1132 N N . PHE A 149 ? 0.3798 0.4245 0.4210 0.0006 -0.0326 0.0000 144 PHE A N 1133 C CA . PHE A 149 ? 0.3987 0.4387 0.4400 -0.0026 -0.0306 0.0022 144 PHE A CA 1134 C C . PHE A 149 ? 0.4269 0.4630 0.4697 -0.0049 -0.0312 0.0024 144 PHE A C 1135 O O . PHE A 149 ? 0.3967 0.4355 0.4415 -0.0048 -0.0310 0.0023 144 PHE A O 1136 C CB . PHE A 149 ? 0.4009 0.4444 0.4434 -0.0036 -0.0270 0.0048 144 PHE A CB 1137 C CG . PHE A 149 ? 0.3589 0.4067 0.4004 -0.0021 -0.0259 0.0051 144 PHE A CG 1138 C CD1 . PHE A 149 ? 0.3559 0.4016 0.3958 -0.0026 -0.0255 0.0052 144 PHE A CD1 1139 C CD2 . PHE A 149 ? 0.3567 0.4110 0.3987 -0.0005 -0.0251 0.0055 144 PHE A CD2 1140 C CE1 . PHE A 149 ? 0.3613 0.4116 0.4007 -0.0014 -0.0244 0.0054 144 PHE A CE1 1141 C CE2 . PHE A 149 ? 0.3365 0.3952 0.3776 0.0003 -0.0239 0.0060 144 PHE A CE2 1142 C CZ . PHE A 149 ? 0.3499 0.4067 0.3899 -0.0001 -0.0235 0.0058 144 PHE A CZ 1143 N N . ARG A 150 ? 0.4620 0.4919 0.5037 -0.0072 -0.0318 0.0028 145 ARG A N 1144 C CA . ARG A 150 ? 0.5040 0.5299 0.5468 -0.0098 -0.0327 0.0029 145 ARG A CA 1145 C C . ARG A 150 ? 0.4402 0.4670 0.4851 -0.0128 -0.0296 0.0051 145 ARG A C 1146 O O . ARG A 150 ? 0.3880 0.4135 0.4345 -0.0148 -0.0301 0.0049 145 ARG A O 1147 C CB . ARG A 150 ? 0.5796 0.5982 0.6199 -0.0111 -0.0350 0.0026 145 ARG A CB 1148 C CG . ARG A 150 ? 0.7135 0.7310 0.7522 -0.0078 -0.0389 -0.0001 145 ARG A CG 1149 C CD . ARG A 150 ? 0.8301 0.8408 0.8656 -0.0080 -0.0413 -0.0005 145 ARG A CD 1150 N NE . ARG A 150 ? 0.9330 0.9370 0.9682 -0.0112 -0.0428 0.0002 145 ARG A NE 1151 C CZ . ARG A 150 ? 1.0749 1.0767 1.1111 -0.0112 -0.0459 -0.0014 145 ARG A CZ 1152 N NH1 . ARG A 150 ? 1.0469 1.0528 1.0844 -0.0075 -0.0479 -0.0043 145 ARG A NH1 1153 N NH2 . ARG A 150 ? 1.0287 1.0245 1.0647 -0.0148 -0.0469 -0.0003 145 ARG A NH2 1154 N N . ASN A 151 ? 0.3906 0.4199 0.4358 -0.0131 -0.0267 0.0068 146 ASN A N 1155 C CA . ASN A 151 ? 0.3899 0.4201 0.4371 -0.0156 -0.0240 0.0084 146 ASN A CA 1156 C C . ASN A 151 ? 0.3933 0.4290 0.4432 -0.0144 -0.0226 0.0087 146 ASN A C 1157 O O . ASN A 151 ? 0.3815 0.4184 0.4334 -0.0161 -0.0207 0.0096 146 ASN A O 1158 C CB . ASN A 151 ? 0.4116 0.4405 0.4577 -0.0169 -0.0218 0.0101 146 ASN A CB 1159 C CG . ASN A 151 ? 0.4355 0.4586 0.4787 -0.0183 -0.0232 0.0101 146 ASN A CG 1160 O OD1 . ASN A 151 ? 0.4571 0.4790 0.4983 -0.0179 -0.0227 0.0106 146 ASN A OD1 1161 N ND2 . ASN A 151 ? 0.3925 0.4122 0.4355 -0.0200 -0.0250 0.0096 146 ASN A ND2 1162 N N . VAL A 152 ? 0.3875 0.4267 0.4372 -0.0115 -0.0236 0.0078 147 VAL A N 1163 C CA . VAL A 152 ? 0.3967 0.4408 0.4482 -0.0101 -0.0227 0.0082 147 VAL A CA 1164 C C . VAL A 152 ? 0.3886 0.4349 0.4402 -0.0077 -0.0253 0.0062 147 VAL A C 1165 O O . VAL A 152 ? 0.4189 0.4633 0.4690 -0.0069 -0.0275 0.0045 147 VAL A O 1166 C CB . VAL A 152 ? 0.4298 0.4767 0.4805 -0.0088 -0.0209 0.0098 147 VAL A CB 1167 C CG1 . VAL A 152 ? 0.4130 0.4580 0.4642 -0.0109 -0.0185 0.0116 147 VAL A CG1 1168 C CG2 . VAL A 152 ? 0.4515 0.4992 0.4998 -0.0069 -0.0220 0.0091 147 VAL A CG2 1169 N N . VAL A 153 ? 0.3826 0.4331 0.4359 -0.0065 -0.0250 0.0061 148 VAL A N 1170 C CA . VAL A 153 ? 0.4088 0.4620 0.4626 -0.0043 -0.0274 0.0040 148 VAL A CA 1171 C C . VAL A 153 ? 0.4038 0.4626 0.4572 -0.0015 -0.0271 0.0045 148 VAL A C 1172 O O . VAL A 153 ? 0.4430 0.5039 0.4974 -0.0016 -0.0254 0.0062 148 VAL A O 1173 C CB . VAL A 153 ? 0.4825 0.5358 0.5392 -0.0055 -0.0281 0.0030 148 VAL A CB 1174 C CG1 . VAL A 153 ? 0.4861 0.5416 0.5432 -0.0032 -0.0310 0.0003 148 VAL A CG1 1175 C CG2 . VAL A 153 ? 0.5076 0.5557 0.5648 -0.0089 -0.0282 0.0028 148 VAL A CG2 1176 N N . TRP A 154 ? 0.3887 0.4502 0.4406 0.0010 -0.0289 0.0029 149 TRP A N 1177 C CA . TRP A 154 ? 0.3741 0.4414 0.4250 0.0036 -0.0286 0.0035 149 TRP A CA 1178 C C . TRP A 154 ? 0.4134 0.4838 0.4659 0.0052 -0.0303 0.0018 149 TRP A C 1179 O O . TRP A 154 ? 0.3979 0.4697 0.4501 0.0072 -0.0329 -0.0008 149 TRP A O 1180 C CB . TRP A 154 ? 0.3943 0.4639 0.4428 0.0057 -0.0298 0.0022 149 TRP A CB 1181 C CG . TRP A 154 ? 0.3679 0.4445 0.4150 0.0083 -0.0295 0.0027 149 TRP A CG 1182 C CD1 . TRP A 154 ? 0.3888 0.4691 0.4360 0.0088 -0.0283 0.0047 149 TRP A CD1 1183 C CD2 . TRP A 154 ? 0.3726 0.4533 0.4176 0.0104 -0.0304 0.0014 149 TRP A CD2 1184 N NE1 . TRP A 154 ? 0.3773 0.4638 0.4225 0.0109 -0.0283 0.0050 149 TRP A NE1 1185 C CE2 . TRP A 154 ? 0.3616 0.4488 0.4055 0.0119 -0.0294 0.0029 149 TRP A CE2 1186 C CE3 . TRP A 154 ? 0.3784 0.4580 0.4222 0.0112 -0.0318 -0.0007 149 TRP A CE3 1187 C CZ2 . TRP A 154 ? 0.3777 0.4712 0.4196 0.0140 -0.0296 0.0022 149 TRP A CZ2 1188 C CZ3 . TRP A 154 ? 0.3944 0.4802 0.4365 0.0136 -0.0323 -0.0019 149 TRP A CZ3 1189 C CH2 . TRP A 154 ? 0.3745 0.4676 0.4157 0.0149 -0.0312 -0.0004 149 TRP A CH2 1190 N N . LEU A 155 ? 0.4157 0.4870 0.4698 0.0046 -0.0290 0.0033 150 LEU A N 1191 C CA . LEU A 155 ? 0.3926 0.4670 0.4483 0.0062 -0.0305 0.0018 150 LEU A CA 1192 C C . LEU A 155 ? 0.4105 0.4911 0.4643 0.0096 -0.0314 0.0015 150 LEU A C 1193 O O . LEU A 155 ? 0.4351 0.5183 0.4869 0.0104 -0.0299 0.0039 150 LEU A O 1194 C CB . LEU A 155 ? 0.3808 0.4550 0.4386 0.0049 -0.0289 0.0034 150 LEU A CB 1195 C CG . LEU A 155 ? 0.4020 0.4717 0.4619 0.0016 -0.0280 0.0034 150 LEU A CG 1196 C CD1 . LEU A 155 ? 0.3860 0.4565 0.4477 0.0011 -0.0264 0.0048 150 LEU A CD1 1197 C CD2 . LEU A 155 ? 0.4416 0.5096 0.5034 0.0006 -0.0300 0.0005 150 LEU A CD2 1198 N N . ILE A 156 ? 0.4050 0.4880 0.4596 0.0116 -0.0340 -0.0014 151 ILE A N 1199 C CA . ILE A 156 ? 0.4676 0.5572 0.5206 0.0152 -0.0353 -0.0024 151 ILE A CA 1200 C C . ILE A 156 ? 0.4970 0.5896 0.5519 0.0166 -0.0365 -0.0035 151 ILE A C 1201 O O . ILE A 156 ? 0.4640 0.5537 0.5218 0.0150 -0.0370 -0.0047 151 ILE A O 1202 C CB . ILE A 156 ? 0.4681 0.5586 0.5202 0.0170 -0.0379 -0.0058 151 ILE A CB 1203 C CG1 . ILE A 156 ? 0.5007 0.5896 0.5507 0.0162 -0.0367 -0.0046 151 ILE A CG1 1204 C CG2 . ILE A 156 ? 0.4837 0.5816 0.5345 0.0209 -0.0397 -0.0077 151 ILE A CG2 1205 C CD1 . ILE A 156 ? 0.4878 0.5815 0.5353 0.0169 -0.0345 -0.0017 151 ILE A CD1 1206 N N . LYS A 157 ? 0.5501 0.6488 0.6032 0.0196 -0.0369 -0.0031 152 LYS A N 1207 C CA . LYS A 157 ? 0.5437 0.6457 0.5983 0.0215 -0.0383 -0.0044 152 LYS A CA 1208 C C . LYS A 157 ? 0.5624 0.6643 0.6196 0.0223 -0.0413 -0.0090 152 LYS A C 1209 O O . LYS A 157 ? 0.5724 0.6731 0.6292 0.0225 -0.0428 -0.0113 152 LYS A O 1210 C CB . LYS A 157 ? 0.5294 0.6382 0.5810 0.0247 -0.0385 -0.0033 152 LYS A CB 1211 C CG . LYS A 157 ? 0.5549 0.6686 0.6050 0.0276 -0.0407 -0.0064 152 LYS A CG 1212 C CD . LYS A 157 ? 0.5421 0.6633 0.5889 0.0305 -0.0406 -0.0050 152 LYS A CD 1213 C CE . LYS A 157 ? 0.5904 0.7176 0.6359 0.0338 -0.0430 -0.0086 152 LYS A CE 1214 N NZ . LYS A 157 ? 0.5978 0.7330 0.6394 0.0362 -0.0423 -0.0067 152 LYS A NZ 1215 N N . LYS A 158 ? 0.5586 0.6611 0.6185 0.0224 -0.0422 -0.0104 153 LYS A N 1216 C CA . LYS A 158 ? 0.6419 0.7439 0.7047 0.0226 -0.0451 -0.0147 153 LYS A CA 1217 C C . LYS A 158 ? 0.7032 0.8113 0.7666 0.0260 -0.0469 -0.0165 153 LYS A C 1218 O O . LYS A 158 ? 0.6192 0.7296 0.6822 0.0268 -0.0457 -0.0144 153 LYS A O 1219 C CB . LYS A 158 ? 0.6824 0.7792 0.7489 0.0188 -0.0446 -0.0151 153 LYS A CB 1220 C CG . LYS A 158 ? 0.7321 0.8271 0.8015 0.0181 -0.0475 -0.0192 153 LYS A CG 1221 C CD . LYS A 158 ? 0.7931 0.8839 0.8660 0.0140 -0.0467 -0.0192 153 LYS A CD 1222 C CE . LYS A 158 ? 0.8795 0.9693 0.9557 0.0132 -0.0499 -0.0233 153 LYS A CE 1223 N NZ . LYS A 158 ? 0.9290 1.0141 1.0082 0.0084 -0.0490 -0.0231 153 LYS A NZ 1224 N N . ASN A 159 ? 0.8631 0.9736 0.9273 0.0282 -0.0500 -0.0206 154 ASN A N 1225 C CA . ASN A 159 ? 0.8340 0.9516 0.8977 0.0322 -0.0519 -0.0226 154 ASN A CA 1226 C C . ASN A 159 ? 0.8562 0.9778 0.9153 0.0341 -0.0500 -0.0191 154 ASN A C 1227 O O . ASN A 159 ? 0.9854 1.1063 1.0421 0.0338 -0.0492 -0.0181 154 ASN A O 1228 C CB . ASN A 159 ? 0.7976 0.9159 0.8648 0.0318 -0.0524 -0.0236 154 ASN A CB 1229 C CG . ASN A 159 ? 0.7650 0.8782 0.8366 0.0286 -0.0536 -0.0264 154 ASN A CG 1230 O OD1 . ASN A 159 ? 0.7970 0.9072 0.8710 0.0255 -0.0520 -0.0251 154 ASN A OD1 1231 N ND2 . ASN A 159 ? 0.6814 0.7937 0.7540 0.0290 -0.0564 -0.0300 154 ASN A ND2 1232 N N . ASP A 160 ? 0.8029 0.9287 0.8605 0.0359 -0.0493 -0.0169 155 ASP A N 1233 C CA . ASP A 160 ? 0.7749 0.9034 0.8279 0.0367 -0.0472 -0.0129 155 ASP A CA 1234 C C . ASP A 160 ? 0.7300 0.8553 0.7827 0.0347 -0.0446 -0.0083 155 ASP A C 1235 O O . ASP A 160 ? 0.6974 0.8258 0.7472 0.0361 -0.0437 -0.0052 155 ASP A O 1236 C CB . ASP A 160 ? 0.8563 0.9933 0.9063 0.0410 -0.0487 -0.0137 155 ASP A CB 1237 C CG . ASP A 160 ? 0.9549 1.0954 1.0001 0.0415 -0.0467 -0.0099 155 ASP A CG 1238 O OD1 . ASP A 160 ? 1.0277 1.1743 1.0697 0.0440 -0.0468 -0.0083 155 ASP A OD1 1239 O OD2 . ASP A 160 ? 0.9813 1.1189 1.0257 0.0392 -0.0450 -0.0084 155 ASP A OD2 1240 N N . ALA A 161 ? 0.7456 0.8644 0.8011 0.0312 -0.0434 -0.0080 156 ALA A N 1241 C CA . ALA A 161 ? 0.7240 0.8396 0.7799 0.0294 -0.0412 -0.0044 156 ALA A CA 1242 C C . ALA A 161 ? 0.6068 0.7159 0.6637 0.0255 -0.0390 -0.0026 156 ALA A C 1243 O O . ALA A 161 ? 0.5282 0.6342 0.5866 0.0237 -0.0393 -0.0046 156 ALA A O 1244 C CB . ALA A 161 ? 0.6763 0.7924 0.7353 0.0301 -0.0424 -0.0061 156 ALA A CB 1245 N N . TYR A 162 ? 0.5843 0.6913 0.6401 0.0244 -0.0369 0.0012 157 TYR A N 1246 C CA . TYR A 162 ? 0.5503 0.6515 0.6070 0.0209 -0.0347 0.0031 157 TYR A CA 1247 C C . TYR A 162 ? 0.5124 0.6122 0.5705 0.0207 -0.0340 0.0048 157 TYR A C 1248 O O . TYR A 162 ? 0.5524 0.6520 0.6081 0.0213 -0.0330 0.0083 157 TYR A O 1249 C CB . TYR A 162 ? 0.5325 0.6327 0.5858 0.0200 -0.0329 0.0062 157 TYR A CB 1250 C CG . TYR A 162 ? 0.5001 0.5947 0.5545 0.0165 -0.0309 0.0073 157 TYR A CG 1251 C CD1 . TYR A 162 ? 0.5154 0.6062 0.5712 0.0147 -0.0294 0.0092 157 TYR A CD1 1252 C CD2 . TYR A 162 ? 0.4947 0.5880 0.5483 0.0154 -0.0308 0.0063 157 TYR A CD2 1253 C CE1 . TYR A 162 ? 0.5258 0.6120 0.5824 0.0117 -0.0276 0.0102 157 TYR A CE1 1254 C CE2 . TYR A 162 ? 0.4916 0.5799 0.5458 0.0125 -0.0291 0.0074 157 TYR A CE2 1255 C CZ . TYR A 162 ? 0.4941 0.5790 0.5498 0.0106 -0.0274 0.0093 157 TYR A CZ 1256 O OH . TYR A 162 ? 0.5627 0.6431 0.6189 0.0078 -0.0258 0.0102 157 TYR A OH 1257 N N . PRO A 163 ? 0.5034 0.6023 0.5654 0.0199 -0.0346 0.0022 158 PRO A N 1258 C CA . PRO A 163 ? 0.5170 0.6149 0.5807 0.0199 -0.0341 0.0032 158 PRO A CA 1259 C C . PRO A 163 ? 0.5237 0.6168 0.5875 0.0171 -0.0318 0.0057 158 PRO A C 1260 O O . PRO A 163 ? 0.5149 0.6053 0.5786 0.0147 -0.0307 0.0058 158 PRO A O 1261 C CB . PRO A 163 ? 0.4951 0.5940 0.5633 0.0192 -0.0353 -0.0007 158 PRO A CB 1262 C CG . PRO A 163 ? 0.4854 0.5839 0.5545 0.0178 -0.0359 -0.0032 158 PRO A CG 1263 C CD . PRO A 163 ? 0.5097 0.6091 0.5747 0.0192 -0.0362 -0.0019 158 PRO A CD 1264 N N . THR A 164 ? 0.5325 0.6244 0.5965 0.0177 -0.0313 0.0075 159 THR A N 1265 C CA . THR A 164 ? 0.5616 0.6492 0.6254 0.0156 -0.0294 0.0101 159 THR A CA 1266 C C . THR A 164 ? 0.5708 0.6563 0.6382 0.0128 -0.0284 0.0080 159 THR A C 1267 O O . THR A 164 ? 0.6326 0.7197 0.7033 0.0129 -0.0291 0.0054 159 THR A O 1268 C CB . THR A 164 ? 0.5741 0.6609 0.6373 0.0174 -0.0298 0.0123 159 THR A CB 1269 O OG1 . THR A 164 ? 0.6272 0.7157 0.6864 0.0197 -0.0306 0.0150 159 THR A OG1 1270 C CG2 . THR A 164 ? 0.5718 0.6540 0.6355 0.0153 -0.0281 0.0144 159 THR A CG2 1271 N N . ILE A 165 ? 0.5409 0.6231 0.6076 0.0102 -0.0267 0.0091 160 ILE A N 1272 C CA . ILE A 165 ? 0.5266 0.6066 0.5960 0.0071 -0.0256 0.0075 160 ILE A CA 1273 C C . ILE A 165 ? 0.4769 0.5551 0.5479 0.0065 -0.0244 0.0084 160 ILE A C 1274 O O . ILE A 165 ? 0.4794 0.5557 0.5484 0.0073 -0.0239 0.0112 160 ILE A O 1275 C CB . ILE A 165 ? 0.5324 0.6095 0.5999 0.0049 -0.0244 0.0083 160 ILE A CB 1276 C CG1 . ILE A 165 ? 0.5240 0.6029 0.5907 0.0055 -0.0260 0.0064 160 ILE A CG1 1277 C CG2 . ILE A 165 ? 0.5418 0.6162 0.6115 0.0017 -0.0230 0.0076 160 ILE A CG2 1278 C CD1 . ILE A 165 ? 0.5554 0.6324 0.6193 0.0048 -0.0255 0.0075 160 ILE A CD1 1279 N N . LYS A 166 ? 0.5170 0.5963 0.5917 0.0052 -0.0242 0.0060 161 LYS A N 1280 C CA . LYS A 166 ? 0.5614 0.6394 0.6380 0.0044 -0.0231 0.0061 161 LYS A CA 1281 C C . LYS A 166 ? 0.5639 0.6422 0.6433 0.0012 -0.0220 0.0040 161 LYS A C 1282 O O . LYS A 166 ? 0.6251 0.7068 0.7074 0.0009 -0.0226 0.0013 161 LYS A O 1283 C CB . LYS A 166 ? 0.6163 0.6968 0.6950 0.0070 -0.0244 0.0051 161 LYS A CB 1284 C CG . LYS A 166 ? 0.7016 0.7815 0.7774 0.0103 -0.0258 0.0075 161 LYS A CG 1285 C CD . LYS A 166 ? 0.8227 0.9045 0.9002 0.0132 -0.0274 0.0064 161 LYS A CD 1286 C CE . LYS A 166 ? 0.8734 0.9554 0.9476 0.0165 -0.0292 0.0087 161 LYS A CE 1287 N NZ . LYS A 166 ? 0.8872 0.9680 0.9615 0.0192 -0.0307 0.0095 161 LYS A NZ 1288 N N . ILE A 167 ? 0.5729 0.6480 0.6513 -0.0012 -0.0202 0.0052 162 ILE A N 1289 C CA . ILE A 167 ? 0.5498 0.6251 0.6303 -0.0045 -0.0191 0.0036 162 ILE A CA 1290 C C . ILE A 167 ? 0.5234 0.5966 0.6040 -0.0059 -0.0173 0.0045 162 ILE A C 1291 O O . ILE A 167 ? 0.4872 0.5578 0.5660 -0.0047 -0.0169 0.0067 162 ILE A O 1292 C CB . ILE A 167 ? 0.6108 0.6840 0.6895 -0.0066 -0.0191 0.0037 162 ILE A CB 1293 C CG1 . ILE A 167 ? 0.6013 0.6706 0.6763 -0.0065 -0.0184 0.0063 162 ILE A CG1 1294 C CG2 . ILE A 167 ? 0.6142 0.6897 0.6930 -0.0052 -0.0212 0.0021 162 ILE A CG2 1295 C CD1 . ILE A 167 ? 0.6301 0.6966 0.7035 -0.0089 -0.0182 0.0063 162 ILE A CD1 1296 N N . SER A 168 ? 0.4739 0.5486 0.5569 -0.0086 -0.0161 0.0029 163 SER A N 1297 C CA . SER A 168 ? 0.4984 0.5715 0.5814 -0.0100 -0.0144 0.0035 163 SER A CA 1298 C C . SER A 168 ? 0.4558 0.5288 0.5391 -0.0138 -0.0131 0.0028 163 SER A C 1299 O O . SER A 168 ? 0.4421 0.5170 0.5266 -0.0153 -0.0137 0.0014 163 SER A O 1300 C CB . SER A 168 ? 0.5199 0.5956 0.6057 -0.0083 -0.0144 0.0022 163 SER A CB 1301 O OG . SER A 168 ? 0.5787 0.6594 0.6680 -0.0092 -0.0144 -0.0006 163 SER A OG 1302 N N . TYR A 169 ? 0.4358 0.5060 0.5175 -0.0154 -0.0117 0.0042 164 TYR A N 1303 C CA . TYR A 169 ? 0.4019 0.4716 0.4833 -0.0192 -0.0104 0.0039 164 TYR A CA 1304 C C . TYR A 169 ? 0.4032 0.4742 0.4857 -0.0199 -0.0087 0.0035 164 TYR A C 1305 O O . TYR A 169 ? 0.4225 0.4912 0.5039 -0.0185 -0.0083 0.0047 164 TYR A O 1306 C CB . TYR A 169 ? 0.3920 0.4566 0.4696 -0.0204 -0.0104 0.0058 164 TYR A CB 1307 C CG . TYR A 169 ? 0.3869 0.4504 0.4636 -0.0241 -0.0092 0.0060 164 TYR A CG 1308 C CD1 . TYR A 169 ? 0.3919 0.4562 0.4694 -0.0269 -0.0097 0.0051 164 TYR A CD1 1309 C CD2 . TYR A 169 ? 0.3852 0.4472 0.4607 -0.0250 -0.0077 0.0069 164 TYR A CD2 1310 C CE1 . TYR A 169 ? 0.4283 0.4916 0.5047 -0.0307 -0.0085 0.0055 164 TYR A CE1 1311 C CE2 . TYR A 169 ? 0.4014 0.4628 0.4760 -0.0284 -0.0065 0.0071 164 TYR A CE2 1312 C CZ . TYR A 169 ? 0.4261 0.4881 0.5010 -0.0313 -0.0068 0.0066 164 TYR A CZ 1313 O OH . TYR A 169 ? 0.5573 0.6182 0.6307 -0.0348 -0.0057 0.0073 164 TYR A OH 1314 N N . ASN A 170 ? 0.4324 0.5074 0.5173 -0.0223 -0.0077 0.0017 165 ASN A N 1315 C CA . ASN A 170 ? 0.4409 0.5185 0.5273 -0.0231 -0.0061 0.0007 165 ASN A CA 1316 C C . ASN A 170 ? 0.4293 0.5045 0.5130 -0.0266 -0.0046 0.0021 165 ASN A C 1317 O O . ASN A 170 ? 0.4666 0.5417 0.5497 -0.0297 -0.0045 0.0023 165 ASN A O 1318 C CB . ASN A 170 ? 0.4203 0.5050 0.5109 -0.0237 -0.0059 -0.0022 165 ASN A CB 1319 C CG . ASN A 170 ? 0.4825 0.5713 0.5750 -0.0241 -0.0044 -0.0038 165 ASN A CG 1320 O OD1 . ASN A 170 ? 0.5531 0.6408 0.6439 -0.0263 -0.0028 -0.0029 165 ASN A OD1 1321 N ND2 . ASN A 170 ? 0.5843 0.6781 0.6805 -0.0216 -0.0050 -0.0065 165 ASN A ND2 1322 N N . ASN A 171 ? 0.3972 0.4705 0.4796 -0.0263 -0.0036 0.0029 166 ASN A N 1323 C CA . ASN A 171 ? 0.3824 0.4539 0.4622 -0.0295 -0.0023 0.0040 166 ASN A CA 1324 C C . ASN A 171 ? 0.4000 0.4772 0.4819 -0.0323 -0.0007 0.0024 166 ASN A C 1325 O O . ASN A 171 ? 0.4316 0.5117 0.5145 -0.0320 0.0005 0.0013 166 ASN A O 1326 C CB . ASN A 171 ? 0.3682 0.4358 0.4458 -0.0282 -0.0018 0.0054 166 ASN A CB 1327 C CG . ASN A 171 ? 0.3948 0.4603 0.4694 -0.0312 -0.0006 0.0065 166 ASN A CG 1328 O OD1 . ASN A 171 ? 0.3852 0.4512 0.4588 -0.0343 -0.0002 0.0069 166 ASN A OD1 1329 N ND2 . ASN A 171 ? 0.3766 0.4398 0.4497 -0.0302 0.0000 0.0072 166 ASN A ND2 1330 N N . THR A 172 ? 0.4246 0.5035 0.5069 -0.0353 -0.0007 0.0022 167 THR A N 1331 C CA . THR A 172 ? 0.4503 0.5352 0.5343 -0.0388 0.0009 0.0009 167 THR A CA 1332 C C . THR A 172 ? 0.4824 0.5649 0.5627 -0.0423 0.0023 0.0028 167 THR A C 1333 O O . THR A 172 ? 0.5019 0.5891 0.5829 -0.0455 0.0038 0.0022 167 THR A O 1334 C CB . THR A 172 ? 0.4527 0.5408 0.5388 -0.0412 0.0004 0.0000 167 THR A CB 1335 O OG1 . THR A 172 ? 0.5119 0.5937 0.5949 -0.0427 -0.0008 0.0020 167 THR A OG1 1336 C CG2 . THR A 172 ? 0.4609 0.5523 0.5507 -0.0378 -0.0008 -0.0022 167 THR A CG2 1337 N N . ASN A 173 ? 0.4927 0.5684 0.5692 -0.0415 0.0017 0.0050 168 ASN A N 1338 C CA . ASN A 173 ? 0.4581 0.5312 0.5309 -0.0442 0.0028 0.0068 168 ASN A CA 1339 C C . ASN A 173 ? 0.4487 0.5253 0.5222 -0.0430 0.0044 0.0056 168 ASN A C 1340 O O . ASN A 173 ? 0.4995 0.5795 0.5762 -0.0400 0.0044 0.0036 168 ASN A O 1341 C CB . ASN A 173 ? 0.4120 0.4768 0.4806 -0.0435 0.0014 0.0092 168 ASN A CB 1342 C CG . ASN A 173 ? 0.4061 0.4675 0.4743 -0.0437 -0.0005 0.0097 168 ASN A CG 1343 O OD1 . ASN A 173 ? 0.5436 0.6037 0.6106 -0.0471 -0.0009 0.0106 168 ASN A OD1 1344 N ND2 . ASN A 173 ? 0.4234 0.4835 0.4926 -0.0402 -0.0019 0.0092 168 ASN A ND2 1345 N N . GLN A 174 ? 0.4936 0.5693 0.5640 -0.0452 0.0056 0.0069 169 GLN A N 1346 C CA . GLN A 174 ? 0.5540 0.6332 0.6248 -0.0444 0.0071 0.0057 169 GLN A CA 1347 C C . GLN A 174 ? 0.5426 0.6161 0.6110 -0.0417 0.0065 0.0067 169 GLN A C 1348 O O . GLN A 174 ? 0.5499 0.6254 0.6187 -0.0404 0.0074 0.0056 169 GLN A O 1349 C CB . GLN A 174 ? 0.6672 0.7494 0.7357 -0.0487 0.0089 0.0065 169 GLN A CB 1350 C CG . GLN A 174 ? 0.8026 0.8938 0.8745 -0.0509 0.0103 0.0044 169 GLN A CG 1351 C CD . GLN A 174 ? 0.9753 1.0670 1.0495 -0.0522 0.0093 0.0043 169 GLN A CD 1352 O OE1 . GLN A 174 ? 0.9451 1.0329 1.0168 -0.0555 0.0087 0.0065 169 GLN A OE1 1353 N NE2 . GLN A 174 ? 1.0348 1.1310 1.1135 -0.0493 0.0088 0.0015 169 GLN A NE2 1354 N N . GLU A 175 ? 0.5734 0.6403 0.6395 -0.0410 0.0049 0.0086 170 GLU A N 1355 C CA . GLU A 175 ? 0.5429 0.6044 0.6065 -0.0388 0.0043 0.0097 170 GLU A CA 1356 C C . GLU A 175 ? 0.4828 0.5422 0.5482 -0.0355 0.0029 0.0094 170 GLU A C 1357 O O . GLU A 175 ? 0.4397 0.4997 0.5068 -0.0351 0.0019 0.0092 170 GLU A O 1358 C CB . GLU A 175 ? 0.6302 0.6859 0.6891 -0.0408 0.0035 0.0120 170 GLU A CB 1359 C CG . GLU A 175 ? 0.7242 0.7808 0.7803 -0.0435 0.0049 0.0127 170 GLU A CG 1360 C CD . GLU A 175 ? 0.9351 0.9889 0.9880 -0.0472 0.0044 0.0147 170 GLU A CD 1361 O OE1 . GLU A 175 ? 1.1721 1.2290 1.2267 -0.0497 0.0047 0.0145 170 GLU A OE1 1362 O OE2 . GLU A 175 ? 1.0760 1.1244 1.1246 -0.0477 0.0036 0.0165 170 GLU A OE2 1363 N N . ASP A 176 ? 0.4284 0.4855 0.4934 -0.0331 0.0027 0.0095 171 ASP A N 1364 C CA . ASP A 176 ? 0.4040 0.4581 0.4695 -0.0303 0.0013 0.0101 171 ASP A CA 1365 C C . ASP A 176 ? 0.3795 0.4299 0.4428 -0.0308 0.0000 0.0116 171 ASP A C 1366 O O . ASP A 176 ? 0.4274 0.4750 0.4875 -0.0327 -0.0001 0.0127 171 ASP A O 1367 C CB . ASP A 176 ? 0.4058 0.4570 0.4700 -0.0288 0.0014 0.0106 171 ASP A CB 1368 C CG . ASP A 176 ? 0.4582 0.5122 0.5252 -0.0274 0.0021 0.0089 171 ASP A CG 1369 O OD1 . ASP A 176 ? 0.4460 0.5042 0.5162 -0.0269 0.0023 0.0072 171 ASP A OD1 1370 O OD2 . ASP A 176 ? 0.4630 0.5152 0.5292 -0.0266 0.0023 0.0090 171 ASP A OD2 1371 N N . LEU A 177 ? 0.3763 0.4262 0.4408 -0.0288 -0.0011 0.0117 172 LEU A N 1372 C CA . LEU A 177 ? 0.3800 0.4268 0.4425 -0.0286 -0.0025 0.0127 172 LEU A CA 1373 C C . LEU A 177 ? 0.3627 0.4070 0.4242 -0.0260 -0.0033 0.0137 172 LEU A C 1374 O O . LEU A 177 ? 0.3360 0.3816 0.3996 -0.0240 -0.0034 0.0136 172 LEU A O 1375 C CB . LEU A 177 ? 0.4232 0.4729 0.4882 -0.0285 -0.0032 0.0119 172 LEU A CB 1376 C CG . LEU A 177 ? 0.4895 0.5384 0.5537 -0.0303 -0.0042 0.0119 172 LEU A CG 1377 C CD1 . LEU A 177 ? 0.4926 0.5405 0.5549 -0.0338 -0.0035 0.0124 172 LEU A CD1 1378 C CD2 . LEU A 177 ? 0.4713 0.5245 0.5390 -0.0300 -0.0045 0.0105 172 LEU A CD2 1379 N N . LEU A 178 ? 0.3368 0.3777 0.3952 -0.0261 -0.0041 0.0146 173 LEU A N 1380 C CA . LEU A 178 ? 0.3389 0.3783 0.3963 -0.0239 -0.0049 0.0153 173 LEU A CA 1381 C C . LEU A 178 ? 0.3238 0.3636 0.3813 -0.0230 -0.0065 0.0153 173 LEU A C 1382 O O . LEU A 178 ? 0.3899 0.4283 0.4459 -0.0239 -0.0075 0.0150 173 LEU A O 1383 C CB . LEU A 178 ? 0.3265 0.3628 0.3807 -0.0242 -0.0052 0.0159 173 LEU A CB 1384 C CG . LEU A 178 ? 0.3334 0.3688 0.3862 -0.0223 -0.0063 0.0164 173 LEU A CG 1385 C CD1 . LEU A 178 ? 0.3687 0.4057 0.4233 -0.0208 -0.0056 0.0169 173 LEU A CD1 1386 C CD2 . LEU A 178 ? 0.3350 0.3677 0.3848 -0.0225 -0.0066 0.0164 173 LEU A CD2 1387 N N . ILE A 179 ? 0.3173 0.3591 0.3766 -0.0211 -0.0067 0.0155 174 ILE A N 1388 C CA . ILE A 179 ? 0.2905 0.3334 0.3499 -0.0198 -0.0081 0.0153 174 ILE A CA 1389 C C . ILE A 179 ? 0.3066 0.3495 0.3647 -0.0178 -0.0087 0.0163 174 ILE A C 1390 O O . ILE A 179 ? 0.3279 0.3709 0.3865 -0.0171 -0.0078 0.0173 174 ILE A O 1391 C CB . ILE A 179 ? 0.2916 0.3375 0.3541 -0.0191 -0.0081 0.0147 174 ILE A CB 1392 C CG1 . ILE A 179 ? 0.3074 0.3545 0.3715 -0.0213 -0.0073 0.0135 174 ILE A CG1 1393 C CG2 . ILE A 179 ? 0.3001 0.3475 0.3627 -0.0177 -0.0097 0.0143 174 ILE A CG2 1394 C CD1 . ILE A 179 ? 0.3195 0.3702 0.3868 -0.0208 -0.0074 0.0123 174 ILE A CD1 1395 N N . LEU A 180 ? 0.2901 0.3331 0.3468 -0.0168 -0.0102 0.0160 175 LEU A N 1396 C CA . LEU A 180 ? 0.3118 0.3559 0.3671 -0.0149 -0.0108 0.0167 175 LEU A CA 1397 C C . LEU A 180 ? 0.3135 0.3601 0.3692 -0.0132 -0.0122 0.0163 175 LEU A C 1398 O O . LEU A 180 ? 0.3551 0.4016 0.4112 -0.0135 -0.0133 0.0149 175 LEU A O 1399 C CB . LEU A 180 ? 0.3160 0.3583 0.3687 -0.0149 -0.0115 0.0163 175 LEU A CB 1400 C CG . LEU A 180 ? 0.3256 0.3654 0.3774 -0.0163 -0.0103 0.0166 175 LEU A CG 1401 C CD1 . LEU A 180 ? 0.3342 0.3710 0.3847 -0.0179 -0.0110 0.0157 175 LEU A CD1 1402 C CD2 . LEU A 180 ? 0.3231 0.3633 0.3732 -0.0154 -0.0103 0.0170 175 LEU A CD2 1403 N N . TRP A 181 ? 0.3013 0.3502 0.3565 -0.0115 -0.0122 0.0174 176 TRP A N 1404 C CA . TRP A 181 ? 0.3002 0.3522 0.3553 -0.0096 -0.0135 0.0172 176 TRP A CA 1405 C C . TRP A 181 ? 0.3100 0.3641 0.3634 -0.0084 -0.0133 0.0186 176 TRP A C 1406 O O . TRP A 181 ? 0.3370 0.3901 0.3898 -0.0092 -0.0121 0.0197 176 TRP A O 1407 C CB . TRP A 181 ? 0.3045 0.3579 0.3619 -0.0091 -0.0134 0.0175 176 TRP A CB 1408 C CG . TRP A 181 ? 0.3092 0.3621 0.3671 -0.0091 -0.0122 0.0195 176 TRP A CG 1409 C CD1 . TRP A 181 ? 0.3312 0.3856 0.3884 -0.0078 -0.0122 0.0215 176 TRP A CD1 1410 C CD2 . TRP A 181 ? 0.2992 0.3499 0.3586 -0.0106 -0.0109 0.0198 176 TRP A CD2 1411 N NE1 . TRP A 181 ? 0.3095 0.3621 0.3676 -0.0085 -0.0112 0.0230 176 TRP A NE1 1412 C CE2 . TRP A 181 ? 0.3092 0.3597 0.3689 -0.0100 -0.0104 0.0217 176 TRP A CE2 1413 C CE3 . TRP A 181 ? 0.3224 0.3713 0.3828 -0.0123 -0.0102 0.0185 176 TRP A CE3 1414 C CZ2 . TRP A 181 ? 0.3009 0.3492 0.3620 -0.0109 -0.0095 0.0221 176 TRP A CZ2 1415 C CZ3 . TRP A 181 ? 0.2980 0.3456 0.3598 -0.0132 -0.0090 0.0189 176 TRP A CZ3 1416 C CH2 . TRP A 181 ? 0.2974 0.3446 0.3597 -0.0123 -0.0087 0.0205 176 TRP A CH2 1417 N N . GLY A 182 ? 0.3141 0.3716 0.3667 -0.0065 -0.0144 0.0187 177 GLY A N 1418 C CA . GLY A 182 ? 0.3205 0.3810 0.3713 -0.0055 -0.0141 0.0200 177 GLY A CA 1419 C C . GLY A 182 ? 0.3468 0.4112 0.3970 -0.0036 -0.0149 0.0208 177 GLY A C 1420 O O . GLY A 182 ? 0.3295 0.3945 0.3808 -0.0027 -0.0159 0.0200 177 GLY A O 1421 N N . VAL A 183 ? 0.3501 0.4177 0.3985 -0.0031 -0.0144 0.0225 178 VAL A N 1422 C CA . VAL A 183 ? 0.3580 0.4301 0.4051 -0.0014 -0.0150 0.0236 178 VAL A CA 1423 C C . VAL A 183 ? 0.3644 0.4414 0.4094 -0.0002 -0.0156 0.0225 178 VAL A C 1424 O O . VAL A 183 ? 0.3414 0.4186 0.3856 -0.0011 -0.0147 0.0225 178 VAL A O 1425 C CB . VAL A 183 ? 0.3866 0.4586 0.4334 -0.0022 -0.0138 0.0274 178 VAL A CB 1426 C CG1 . VAL A 183 ? 0.3629 0.4345 0.4089 -0.0041 -0.0123 0.0291 178 VAL A CG1 1427 C CG2 . VAL A 183 ? 0.3723 0.4491 0.4172 -0.0003 -0.0146 0.0287 178 VAL A CG2 1428 N N . HIS A 184 ? 0.3484 0.4294 0.3925 0.0020 -0.0170 0.0213 179 HIS A N 1429 C CA . HIS A 184 ? 0.4016 0.4884 0.4438 0.0037 -0.0178 0.0199 179 HIS A CA 1430 C C . HIS A 184 ? 0.4011 0.4934 0.4412 0.0041 -0.0170 0.0228 179 HIS A C 1431 O O . HIS A 184 ? 0.4459 0.5394 0.4856 0.0050 -0.0174 0.0242 179 HIS A O 1432 C CB . HIS A 184 ? 0.4099 0.4985 0.4523 0.0061 -0.0203 0.0165 179 HIS A CB 1433 C CG . HIS A 184 ? 0.4522 0.5474 0.4925 0.0084 -0.0214 0.0146 179 HIS A CG 1434 N ND1 . HIS A 184 ? 0.5304 0.6308 0.5700 0.0111 -0.0230 0.0132 179 HIS A ND1 1435 C CD2 . HIS A 184 ? 0.4515 0.5496 0.4907 0.0086 -0.0211 0.0136 179 HIS A CD2 1436 C CE1 . HIS A 184 ? 0.5001 0.6063 0.5380 0.0128 -0.0237 0.0114 179 HIS A CE1 1437 N NE2 . HIS A 184 ? 0.5108 0.6159 0.5485 0.0113 -0.0226 0.0116 179 HIS A NE2 1438 N N . HIS A 185 ? 0.3652 0.4608 0.4039 0.0033 -0.0158 0.0237 180 HIS A N 1439 C CA . HIS A 185 ? 0.3931 0.4948 0.4296 0.0033 -0.0150 0.0264 180 HIS A CA 1440 C C . HIS A 185 ? 0.4049 0.5143 0.4397 0.0061 -0.0164 0.0237 180 HIS A C 1441 O O . HIS A 185 ? 0.3627 0.4747 0.3974 0.0068 -0.0168 0.0209 180 HIS A O 1442 C CB . HIS A 185 ? 0.3997 0.5020 0.4358 0.0008 -0.0130 0.0284 180 HIS A CB 1443 C CG . HIS A 185 ? 0.4026 0.4977 0.4405 -0.0017 -0.0118 0.0307 180 HIS A CG 1444 N ND1 . HIS A 185 ? 0.4107 0.5026 0.4487 -0.0027 -0.0113 0.0340 180 HIS A ND1 1445 C CD2 . HIS A 185 ? 0.4422 0.5327 0.4817 -0.0033 -0.0110 0.0299 180 HIS A CD2 1446 C CE1 . HIS A 185 ? 0.4096 0.4955 0.4496 -0.0047 -0.0105 0.0350 180 HIS A CE1 1447 N NE2 . HIS A 185 ? 0.4240 0.5091 0.4648 -0.0052 -0.0102 0.0326 180 HIS A NE2 1448 N N . SER A 186 ? 0.4099 0.5228 0.4436 0.0080 -0.0173 0.0242 181 SER A N 1449 C CA . SER A 186 ? 0.4401 0.5606 0.4723 0.0111 -0.0189 0.0213 181 SER A CA 1450 C C . SER A 186 ? 0.4169 0.5454 0.4465 0.0106 -0.0175 0.0234 181 SER A C 1451 O O . SER A 186 ? 0.4428 0.5701 0.4718 0.0078 -0.0155 0.0275 181 SER A O 1452 C CB . SER A 186 ? 0.4633 0.5844 0.4954 0.0133 -0.0206 0.0208 181 SER A CB 1453 O OG . SER A 186 ? 0.4985 0.6185 0.5295 0.0122 -0.0195 0.0253 181 SER A OG 1454 N N . ASN A 187 ? 0.4356 0.5724 0.4637 0.0132 -0.0187 0.0207 182 ASN A N 1455 C CA . ASN A 187 ? 0.4933 0.6396 0.5190 0.0129 -0.0173 0.0219 182 ASN A CA 1456 C C . ASN A 187 ? 0.5266 0.6799 0.5492 0.0134 -0.0168 0.0251 182 ASN A C 1457 O O . ASN A 187 ? 0.5110 0.6703 0.5316 0.0116 -0.0149 0.0280 182 ASN A O 1458 C CB . ASN A 187 ? 0.5038 0.6560 0.5296 0.0157 -0.0189 0.0166 182 ASN A CB 1459 C CG . ASN A 187 ? 0.4759 0.6218 0.5041 0.0149 -0.0193 0.0139 182 ASN A CG 1460 O OD1 . ASN A 187 ? 0.5276 0.6690 0.5565 0.0118 -0.0174 0.0164 182 ASN A OD1 1461 N ND2 . ASN A 187 ? 0.4454 0.5905 0.4745 0.0177 -0.0220 0.0090 182 ASN A ND2 1462 N N . ASN A 188 ? 0.5545 0.7069 0.5768 0.0156 -0.0184 0.0247 183 ASN A N 1463 C CA . ASN A 188 ? 0.5130 0.6714 0.5322 0.0165 -0.0183 0.0276 183 ASN A CA 1464 C C . ASN A 188 ? 0.5395 0.6942 0.5592 0.0188 -0.0204 0.0268 183 ASN A C 1465 O O . ASN A 188 ? 0.4898 0.6385 0.5125 0.0199 -0.0219 0.0233 183 ASN A O 1466 C CB . ASN A 188 ? 0.5100 0.6807 0.5268 0.0188 -0.0187 0.0252 183 ASN A CB 1467 C CG . ASN A 188 ? 0.5341 0.7069 0.5527 0.0227 -0.0214 0.0185 183 ASN A CG 1468 O OD1 . ASN A 188 ? 0.5214 0.6918 0.5410 0.0253 -0.0237 0.0160 183 ASN A OD1 1469 N ND2 . ASN A 188 ? 0.5322 0.7094 0.5513 0.0231 -0.0214 0.0154 183 ASN A ND2 1470 N N . ALA A 189 ? 0.5680 0.7266 0.5848 0.0196 -0.0204 0.0299 184 ALA A N 1471 C CA . ALA A 189 ? 0.6284 0.7841 0.6455 0.0218 -0.0222 0.0296 184 ALA A CA 1472 C C . ALA A 189 ? 0.5505 0.7082 0.5695 0.0256 -0.0250 0.0235 184 ALA A C 1473 O O . ALA A 189 ? 0.5267 0.6786 0.5481 0.0265 -0.0265 0.0218 184 ALA A O 1474 C CB . ALA A 189 ? 0.6732 0.8342 0.6861 0.0223 -0.0220 0.0338 184 ALA A CB 1475 N N . ALA A 190 ? 0.5428 0.7088 0.5610 0.0277 -0.0257 0.0200 185 ALA A N 1476 C CA . ALA A 190 ? 0.5575 0.7255 0.5773 0.0314 -0.0286 0.0140 185 ALA A CA 1477 C C . ALA A 190 ? 0.5701 0.7296 0.5940 0.0306 -0.0296 0.0107 185 ALA A C 1478 O O . ALA A 190 ? 0.6607 0.8167 0.6869 0.0323 -0.0318 0.0076 185 ALA A O 1479 C CB . ALA A 190 ? 0.5782 0.7572 0.5962 0.0339 -0.0293 0.0107 185 ALA A CB 1480 N N . GLU A 191 ? 0.5781 0.7345 0.6027 0.0281 -0.0281 0.0113 186 GLU A N 1481 C CA . GLU A 191 ? 0.5640 0.7121 0.5921 0.0271 -0.0289 0.0085 186 GLU A CA 1482 C C . GLU A 191 ? 0.5042 0.6431 0.5343 0.0252 -0.0285 0.0107 186 GLU A C 1483 O O . GLU A 191 ? 0.4609 0.5946 0.4937 0.0256 -0.0302 0.0077 186 GLU A O 1484 C CB . GLU A 191 ? 0.5731 0.7203 0.6011 0.0248 -0.0271 0.0093 186 GLU A CB 1485 C CG . GLU A 191 ? 0.6570 0.7953 0.6879 0.0234 -0.0276 0.0072 186 GLU A CG 1486 C CD . GLU A 191 ? 0.7311 0.8695 0.7617 0.0217 -0.0262 0.0074 186 GLU A CD 1487 O OE1 . GLU A 191 ? 0.8571 1.0025 0.8867 0.0237 -0.0271 0.0044 186 GLU A OE1 1488 O OE2 . GLU A 191 ? 0.7058 0.8380 0.7374 0.0186 -0.0243 0.0101 186 GLU A OE2 1489 N N . GLN A 192 ? 0.4742 0.6120 0.5030 0.0232 -0.0265 0.0157 187 GLN A N 1490 C CA . GLN A 192 ? 0.4678 0.5978 0.4983 0.0216 -0.0261 0.0180 187 GLN A CA 1491 C C . GLN A 192 ? 0.5042 0.6342 0.5360 0.0242 -0.0284 0.0155 187 GLN A C 1492 O O . GLN A 192 ? 0.5405 0.6644 0.5754 0.0236 -0.0292 0.0137 187 GLN A O 1493 C CB . GLN A 192 ? 0.4657 0.5954 0.4939 0.0197 -0.0240 0.0238 187 GLN A CB 1494 C CG . GLN A 192 ? 0.4904 0.6123 0.5203 0.0182 -0.0237 0.0261 187 GLN A CG 1495 C CD . GLN A 192 ? 0.4892 0.6033 0.5224 0.0158 -0.0229 0.0252 187 GLN A CD 1496 O OE1 . GLN A 192 ? 0.4824 0.5960 0.5158 0.0142 -0.0219 0.0247 187 GLN A OE1 1497 N NE2 . GLN A 192 ? 0.4893 0.5978 0.5249 0.0156 -0.0235 0.0249 187 GLN A NE2 1498 N N . THR A 193 ? 0.5417 0.6789 0.5712 0.0271 -0.0296 0.0150 188 THR A N 1499 C CA . THR A 193 ? 0.5697 0.7075 0.6006 0.0297 -0.0321 0.0122 188 THR A CA 1500 C C . THR A 193 ? 0.5556 0.6931 0.5893 0.0312 -0.0343 0.0064 188 THR A C 1501 O O . THR A 193 ? 0.5111 0.6450 0.5477 0.0317 -0.0360 0.0038 188 THR A O 1502 C CB . THR A 193 ? 0.5488 0.6944 0.5765 0.0326 -0.0329 0.0133 188 THR A CB 1503 O OG1 . THR A 193 ? 0.6147 0.7686 0.6397 0.0342 -0.0330 0.0121 188 THR A OG1 1504 C CG2 . THR A 193 ? 0.5765 0.7206 0.6017 0.0310 -0.0311 0.0192 188 THR A CG2 1505 N N . ASN A 194 ? 0.5914 0.7326 0.6241 0.0318 -0.0345 0.0044 189 ASN A N 1506 C CA . ASN A 194 ? 0.6017 0.7419 0.6367 0.0333 -0.0370 -0.0010 189 ASN A CA 1507 C C . ASN A 194 ? 0.6507 0.7813 0.6891 0.0307 -0.0372 -0.0019 189 ASN A C 1508 O O . ASN A 194 ? 0.5786 0.7068 0.6195 0.0316 -0.0396 -0.0058 189 ASN A O 1509 C CB . ASN A 194 ? 0.7175 0.8621 0.7509 0.0339 -0.0369 -0.0025 189 ASN A CB 1510 C CG . ASN A 194 ? 0.7950 0.9450 0.8287 0.0376 -0.0401 -0.0079 189 ASN A CG 1511 O OD1 . ASN A 194 ? 0.9702 1.1294 1.0014 0.0404 -0.0405 -0.0086 189 ASN A OD1 1512 N ND2 . ASN A 194 ? 0.7500 0.8943 0.7865 0.0379 -0.0425 -0.0120 189 ASN A ND2 1513 N N . LEU A 195 ? 0.6352 0.7607 0.6737 0.0274 -0.0346 0.0017 190 LEU A N 1514 C CA . LEU A 195 ? 0.5818 0.6986 0.6231 0.0246 -0.0343 0.0013 190 LEU A CA 1515 C C . LEU A 195 ? 0.5343 0.6467 0.5777 0.0232 -0.0337 0.0030 190 LEU A C 1516 O O . LEU A 195 ? 0.5375 0.6446 0.5837 0.0219 -0.0345 0.0011 190 LEU A O 1517 C CB . LEU A 195 ? 0.6151 0.7288 0.6556 0.0219 -0.0319 0.0038 190 LEU A CB 1518 C CG . LEU A 195 ? 0.6129 0.7300 0.6519 0.0229 -0.0324 0.0017 190 LEU A CG 1519 C CD1 . LEU A 195 ? 0.5794 0.6937 0.6177 0.0201 -0.0298 0.0046 190 LEU A CD1 1520 C CD2 . LEU A 195 ? 0.6281 0.7422 0.6688 0.0240 -0.0353 -0.0030 190 LEU A CD2 1521 N N . TYR A 196 ? 0.5119 0.6261 0.5537 0.0232 -0.0322 0.0066 191 TYR A N 1522 C CA . TYR A 196 ? 0.5106 0.6201 0.5542 0.0216 -0.0314 0.0087 191 TYR A CA 1523 C C . TYR A 196 ? 0.5418 0.6548 0.5848 0.0239 -0.0323 0.0096 191 TYR A C 1524 O O . TYR A 196 ? 0.4961 0.6058 0.5408 0.0232 -0.0320 0.0108 191 TYR A O 1525 C CB . TYR A 196 ? 0.5043 0.6099 0.5472 0.0188 -0.0287 0.0129 191 TYR A CB 1526 C CG . TYR A 196 ? 0.5167 0.6194 0.5598 0.0167 -0.0276 0.0125 191 TYR A CG 1527 C CD1 . TYR A 196 ? 0.5607 0.6582 0.6065 0.0152 -0.0281 0.0101 191 TYR A CD1 1528 C CD2 . TYR A 196 ? 0.5156 0.6208 0.5562 0.0161 -0.0261 0.0146 191 TYR A CD2 1529 C CE1 . TYR A 196 ? 0.5756 0.6702 0.6213 0.0134 -0.0273 0.0098 191 TYR A CE1 1530 C CE2 . TYR A 196 ? 0.5165 0.6192 0.5574 0.0144 -0.0253 0.0140 191 TYR A CE2 1531 C CZ . TYR A 196 ? 0.5346 0.6317 0.5779 0.0132 -0.0260 0.0116 191 TYR A CZ 1532 O OH . TYR A 196 ? 0.4604 0.5548 0.5036 0.0118 -0.0254 0.0110 191 TYR A OH 1533 N N . LYS A 197 ? 0.5809 0.7009 0.6214 0.0267 -0.0334 0.0089 192 LYS A N 1534 C CA . LYS A 197 ? 0.6369 0.7608 0.6761 0.0292 -0.0345 0.0097 192 LYS A CA 1535 C C . LYS A 197 ? 0.6131 0.7359 0.6498 0.0282 -0.0327 0.0150 192 LYS A C 1536 O O . LYS A 197 ? 0.6511 0.7790 0.6841 0.0295 -0.0325 0.0175 192 LYS A O 1537 C CB . LYS A 197 ? 0.7395 0.8611 0.7824 0.0299 -0.0363 0.0066 192 LYS A CB 1538 C CG . LYS A 197 ? 0.8556 0.9811 0.8976 0.0328 -0.0378 0.0068 192 LYS A CG 1539 C CD . LYS A 197 ? 0.9535 1.0868 0.9937 0.0363 -0.0397 0.0042 192 LYS A CD 1540 C CE . LYS A 197 ? 1.0304 1.1669 1.0707 0.0392 -0.0417 0.0032 192 LYS A CE 1541 N NZ . LYS A 197 ? 1.1338 1.2780 1.1695 0.0421 -0.0422 0.0045 192 LYS A NZ 1542 N N . ASN A 198 ? 0.5826 0.6988 0.6213 0.0258 -0.0315 0.0168 193 ASN A N 1543 C CA . ASN A 198 ? 0.5762 0.6900 0.6131 0.0249 -0.0304 0.0216 193 ASN A CA 1544 C C . ASN A 198 ? 0.5826 0.6972 0.6164 0.0230 -0.0283 0.0253 193 ASN A C 1545 O O . ASN A 198 ? 0.6138 0.7265 0.6487 0.0209 -0.0271 0.0245 193 ASN A O 1546 C CB . ASN A 198 ? 0.5719 0.6785 0.6122 0.0230 -0.0298 0.0218 193 ASN A CB 1547 C CG . ASN A 198 ? 0.6496 0.7560 0.6934 0.0244 -0.0316 0.0179 193 ASN A CG 1548 O OD1 . ASN A 198 ? 0.7693 0.8799 0.8125 0.0272 -0.0334 0.0167 193 ASN A OD1 1549 N ND2 . ASN A 198 ? 0.5910 0.6930 0.6386 0.0223 -0.0311 0.0157 193 ASN A ND2 1550 N N . PRO A 199 ? 0.5942 0.7121 0.6241 0.0236 -0.0280 0.0291 194 PRO A N 1551 C CA . PRO A 199 ? 0.5842 0.7039 0.6113 0.0215 -0.0261 0.0325 194 PRO A CA 1552 C C . PRO A 199 ? 0.5936 0.7064 0.6212 0.0181 -0.0242 0.0362 194 PRO A C 1553 O O . PRO A 199 ? 0.6879 0.8008 0.7151 0.0158 -0.0225 0.0373 194 PRO A O 1554 C CB . PRO A 199 ? 0.6536 0.7793 0.6762 0.0233 -0.0266 0.0356 194 PRO A CB 1555 C CG . PRO A 199 ? 0.6401 0.7632 0.6633 0.0254 -0.0284 0.0356 194 PRO A CG 1556 C CD . PRO A 199 ? 0.5880 0.7094 0.6157 0.0265 -0.0297 0.0301 194 PRO A CD 1557 N N . THR A 200 ? 0.5731 0.6804 0.6017 0.0180 -0.0248 0.0379 195 THR A N 1558 C CA . THR A 200 ? 0.5986 0.6991 0.6280 0.0153 -0.0235 0.0412 195 THR A CA 1559 C C . THR A 200 ? 0.5574 0.6520 0.5913 0.0146 -0.0236 0.0382 195 THR A C 1560 O O . THR A 200 ? 0.6213 0.7141 0.6571 0.0163 -0.0251 0.0367 195 THR A O 1561 C CB . THR A 200 ? 0.6183 0.7169 0.6450 0.0159 -0.0244 0.0456 195 THR A CB 1562 O OG1 . THR A 200 ? 0.6695 0.7737 0.6916 0.0159 -0.0240 0.0489 195 THR A OG1 1563 C CG2 . THR A 200 ? 0.6713 0.7620 0.6990 0.0135 -0.0238 0.0487 195 THR A CG2 1564 N N . THR A 201 ? 0.5104 0.6024 0.5461 0.0122 -0.0221 0.0374 196 THR A N 1565 C CA . THR A 201 ? 0.4686 0.5563 0.5085 0.0115 -0.0221 0.0341 196 THR A CA 1566 C C . THR A 201 ? 0.4400 0.5218 0.4813 0.0087 -0.0206 0.0358 196 THR A C 1567 O O . THR A 201 ? 0.4908 0.5718 0.5302 0.0070 -0.0195 0.0392 196 THR A O 1568 C CB . THR A 201 ? 0.4816 0.5720 0.5227 0.0117 -0.0222 0.0299 196 THR A CB 1569 O OG1 . THR A 201 ? 0.4894 0.5813 0.5289 0.0101 -0.0208 0.0308 196 THR A OG1 1570 C CG2 . THR A 201 ? 0.5238 0.6200 0.5639 0.0147 -0.0240 0.0276 196 THR A CG2 1571 N N . TYR A 202 ? 0.4028 0.4810 0.4476 0.0081 -0.0206 0.0332 197 TYR A N 1572 C CA . TYR A 202 ? 0.4139 0.4867 0.4605 0.0059 -0.0194 0.0341 197 TYR A CA 1573 C C . TYR A 202 ? 0.4105 0.4816 0.4605 0.0051 -0.0192 0.0303 197 TYR A C 1574 O O . TYR A 202 ? 0.4337 0.5071 0.4849 0.0064 -0.0202 0.0273 197 TYR A O 1575 C CB . TYR A 202 ? 0.4378 0.5069 0.4848 0.0064 -0.0202 0.0363 197 TYR A CB 1576 C CG . TYR A 202 ? 0.4453 0.5146 0.4946 0.0086 -0.0218 0.0337 197 TYR A CG 1577 C CD1 . TYR A 202 ? 0.4806 0.5536 0.5285 0.0113 -0.0235 0.0335 197 TYR A CD1 1578 C CD2 . TYR A 202 ? 0.4796 0.5461 0.5326 0.0080 -0.0217 0.0312 197 TYR A CD2 1579 C CE1 . TYR A 202 ? 0.4930 0.5667 0.5432 0.0133 -0.0250 0.0307 197 TYR A CE1 1580 C CE2 . TYR A 202 ? 0.4868 0.5543 0.5422 0.0099 -0.0231 0.0285 197 TYR A CE2 1581 C CZ . TYR A 202 ? 0.5290 0.6002 0.5832 0.0125 -0.0248 0.0282 197 TYR A CZ 1582 O OH . TYR A 202 ? 0.5154 0.5882 0.5721 0.0144 -0.0262 0.0253 197 TYR A OH 1583 N N . ILE A 203 ? 0.4203 0.4875 0.4717 0.0030 -0.0179 0.0306 198 ILE A N 1584 C CA . ILE A 203 ? 0.4127 0.4776 0.4672 0.0020 -0.0175 0.0277 198 ILE A CA 1585 C C . ILE A 203 ? 0.4274 0.4881 0.4837 0.0010 -0.0170 0.0287 198 ILE A C 1586 O O . ILE A 203 ? 0.4907 0.5491 0.5460 -0.0001 -0.0161 0.0311 198 ILE A O 1587 C CB . ILE A 203 ? 0.3959 0.4604 0.4504 0.0001 -0.0164 0.0263 198 ILE A CB 1588 C CG1 . ILE A 203 ? 0.4289 0.4974 0.4817 0.0013 -0.0172 0.0248 198 ILE A CG1 1589 C CG2 . ILE A 203 ? 0.3621 0.4242 0.4193 -0.0011 -0.0159 0.0239 198 ILE A CG2 1590 C CD1 . ILE A 203 ? 0.4534 0.5219 0.5049 0.0000 -0.0163 0.0246 198 ILE A CD1 1591 N N . SER A 204 ? 0.4447 0.5048 0.5039 0.0016 -0.0176 0.0265 199 SER A N 1592 C CA . SER A 204 ? 0.4721 0.5287 0.5334 0.0010 -0.0172 0.0266 199 SER A CA 1593 C C . SER A 204 ? 0.4269 0.4831 0.4907 -0.0006 -0.0162 0.0238 199 SER A C 1594 O O . SER A 204 ? 0.4383 0.4968 0.5033 -0.0005 -0.0165 0.0213 199 SER A O 1595 C CB . SER A 204 ? 0.4740 0.5305 0.5365 0.0033 -0.0190 0.0265 199 SER A CB 1596 O OG . SER A 204 ? 0.5563 0.6123 0.6161 0.0046 -0.0200 0.0297 199 SER A OG 1597 N N . VAL A 205 ? 0.3907 0.4440 0.4555 -0.0021 -0.0151 0.0242 200 VAL A N 1598 C CA . VAL A 205 ? 0.3794 0.4324 0.4462 -0.0038 -0.0140 0.0218 200 VAL A CA 1599 C C . VAL A 205 ? 0.4048 0.4556 0.4738 -0.0037 -0.0139 0.0214 200 VAL A C 1600 O O . VAL A 205 ? 0.3938 0.4417 0.4621 -0.0038 -0.0139 0.0235 200 VAL A O 1601 C CB . VAL A 205 ? 0.3724 0.4243 0.4375 -0.0058 -0.0127 0.0222 200 VAL A CB 1602 C CG1 . VAL A 205 ? 0.3768 0.4288 0.4434 -0.0076 -0.0117 0.0198 200 VAL A CG1 1603 C CG2 . VAL A 205 ? 0.3718 0.4258 0.4344 -0.0053 -0.0131 0.0228 200 VAL A CG2 1604 N N . GLY A 206 ? 0.3791 0.4317 0.4509 -0.0036 -0.0140 0.0186 201 GLY A N 1605 C CA . GLY A 206 ? 0.3894 0.4409 0.4638 -0.0032 -0.0140 0.0174 201 GLY A CA 1606 C C . GLY A 206 ? 0.3792 0.4327 0.4558 -0.0049 -0.0127 0.0146 201 GLY A C 1607 O O . GLY A 206 ? 0.4337 0.4902 0.5108 -0.0058 -0.0124 0.0130 201 GLY A O 1608 N N . THR A 207 ? 0.3712 0.4231 0.4489 -0.0056 -0.0120 0.0142 202 THR A N 1609 C CA . THR A 207 ? 0.3959 0.4503 0.4758 -0.0070 -0.0108 0.0114 202 THR A CA 1610 C C . THR A 207 ? 0.4135 0.4676 0.4960 -0.0052 -0.0116 0.0099 202 THR A C 1611 O O . THR A 207 ? 0.5162 0.5688 0.5992 -0.0028 -0.0134 0.0106 202 THR A O 1612 C CB . THR A 207 ? 0.3830 0.4360 0.4612 -0.0096 -0.0090 0.0120 202 THR A CB 1613 O OG1 . THR A 207 ? 0.3659 0.4153 0.4434 -0.0095 -0.0089 0.0133 202 THR A OG1 1614 C CG2 . THR A 207 ? 0.3807 0.4331 0.4560 -0.0108 -0.0087 0.0134 202 THR A CG2 1615 N N . SER A 208 ? 0.3995 0.4547 0.4835 -0.0063 -0.0105 0.0081 203 SER A N 1616 C CA . SER A 208 ? 0.4012 0.4556 0.4876 -0.0044 -0.0115 0.0066 203 SER A CA 1617 C C . SER A 208 ? 0.4303 0.4791 0.5154 -0.0041 -0.0121 0.0090 203 SER A C 1618 O O . SER A 208 ? 0.4786 0.5252 0.5652 -0.0021 -0.0138 0.0085 203 SER A O 1619 C CB . SER A 208 ? 0.3859 0.4445 0.4747 -0.0053 -0.0103 0.0033 203 SER A CB 1620 O OG . SER A 208 ? 0.4336 0.4911 0.5208 -0.0076 -0.0085 0.0040 203 SER A OG 1621 N N . THR A 209 ? 0.4268 0.4733 0.5091 -0.0062 -0.0108 0.0114 204 THR A N 1622 C CA . THR A 209 ? 0.4242 0.4659 0.5053 -0.0065 -0.0111 0.0138 204 THR A CA 1623 C C . THR A 209 ? 0.4572 0.4966 0.5353 -0.0068 -0.0113 0.0173 204 THR A C 1624 O O . THR A 209 ? 0.5527 0.5884 0.6300 -0.0065 -0.0122 0.0196 204 THR A O 1625 C CB . THR A 209 ? 0.4549 0.4963 0.5354 -0.0085 -0.0093 0.0133 204 THR A CB 1626 O OG1 . THR A 209 ? 0.5560 0.5995 0.6344 -0.0105 -0.0078 0.0135 204 THR A OG1 1627 C CG2 . THR A 209 ? 0.4306 0.4740 0.5140 -0.0080 -0.0092 0.0099 204 THR A CG2 1628 N N . LEU A 210 ? 0.4553 0.4972 0.5317 -0.0075 -0.0107 0.0177 205 LEU A N 1629 C CA . LEU A 210 ? 0.4102 0.4510 0.4838 -0.0077 -0.0109 0.0205 205 LEU A CA 1630 C C . LEU A 210 ? 0.4058 0.4466 0.4791 -0.0056 -0.0127 0.0217 205 LEU A C 1631 O O . LEU A 210 ? 0.3833 0.4265 0.4582 -0.0042 -0.0135 0.0199 205 LEU A O 1632 C CB . LEU A 210 ? 0.4198 0.4632 0.4918 -0.0091 -0.0098 0.0200 205 LEU A CB 1633 C CG . LEU A 210 ? 0.4186 0.4619 0.4875 -0.0093 -0.0098 0.0224 205 LEU A CG 1634 C CD1 . LEU A 210 ? 0.4198 0.4607 0.4873 -0.0106 -0.0090 0.0242 205 LEU A CD1 1635 C CD2 . LEU A 210 ? 0.4332 0.4789 0.5009 -0.0100 -0.0094 0.0212 205 LEU A CD2 1636 N N . ASN A 211 ? 0.4158 0.4545 0.4870 -0.0055 -0.0132 0.0249 206 ASN A N 1637 C CA . ASN A 211 ? 0.3914 0.4299 0.4617 -0.0036 -0.0150 0.0265 206 ASN A CA 1638 C C . ASN A 211 ? 0.3880 0.4264 0.4549 -0.0044 -0.0146 0.0298 206 ASN A C 1639 O O . ASN A 211 ? 0.4120 0.4475 0.4777 -0.0049 -0.0150 0.0326 206 ASN A O 1640 C CB . ASN A 211 ? 0.4066 0.4412 0.4783 -0.0022 -0.0167 0.0271 206 ASN A CB 1641 C CG . ASN A 211 ? 0.3965 0.4304 0.4672 0.0000 -0.0189 0.0288 206 ASN A CG 1642 O OD1 . ASN A 211 ? 0.3873 0.4244 0.4569 0.0010 -0.0191 0.0285 206 ASN A OD1 1643 N ND2 . ASN A 211 ? 0.4432 0.4725 0.5140 0.0010 -0.0207 0.0305 206 ASN A ND2 1644 N N . GLN A 212 ? 0.3466 0.3885 0.4120 -0.0046 -0.0140 0.0293 207 GLN A N 1645 C CA . GLN A 212 ? 0.3756 0.4186 0.4380 -0.0056 -0.0133 0.0317 207 GLN A CA 1646 C C . GLN A 212 ? 0.3899 0.4356 0.4503 -0.0039 -0.0145 0.0329 207 GLN A C 1647 O O . GLN A 212 ? 0.3894 0.4373 0.4507 -0.0023 -0.0153 0.0309 207 GLN A O 1648 C CB . GLN A 212 ? 0.3833 0.4282 0.4453 -0.0071 -0.0119 0.0299 207 GLN A CB 1649 C CG . GLN A 212 ? 0.3985 0.4455 0.4577 -0.0077 -0.0113 0.0314 207 GLN A CG 1650 C CD . GLN A 212 ? 0.4101 0.4581 0.4691 -0.0088 -0.0103 0.0292 207 GLN A CD 1651 O OE1 . GLN A 212 ? 0.4533 0.5038 0.5117 -0.0082 -0.0107 0.0278 207 GLN A OE1 1652 N NE2 . GLN A 212 ? 0.4636 0.5095 0.5233 -0.0104 -0.0092 0.0289 207 GLN A NE2 1653 N N . ARG A 213 ? 0.4159 0.4619 0.4735 -0.0043 -0.0144 0.0360 208 ARG A N 1654 C CA . ARG A 213 ? 0.4556 0.5053 0.5109 -0.0028 -0.0152 0.0369 208 ARG A CA 1655 C C . ARG A 213 ? 0.4576 0.5104 0.5102 -0.0040 -0.0141 0.0383 208 ARG A C 1656 O O . ARG A 213 ? 0.4619 0.5134 0.5134 -0.0056 -0.0134 0.0410 208 ARG A O 1657 C CB . ARG A 213 ? 0.5210 0.5689 0.5752 -0.0015 -0.0168 0.0397 208 ARG A CB 1658 C CG . ARG A 213 ? 0.5901 0.6419 0.6420 0.0005 -0.0179 0.0404 208 ARG A CG 1659 C CD . ARG A 213 ? 0.6866 0.7360 0.7363 0.0012 -0.0193 0.0443 208 ARG A CD 1660 N NE . ARG A 213 ? 0.7472 0.8007 0.7938 0.0028 -0.0201 0.0457 208 ARG A NE 1661 C CZ . ARG A 213 ? 0.7110 0.7669 0.7580 0.0055 -0.0215 0.0438 208 ARG A CZ 1662 N NH1 . ARG A 213 ? 0.6514 0.7061 0.7018 0.0066 -0.0223 0.0404 208 ARG A NH1 1663 N NH2 . ARG A 213 ? 0.7654 0.8255 0.8094 0.0069 -0.0222 0.0451 208 ARG A NH2 1664 N N . LEU A 214 ? 0.3969 0.4538 0.4487 -0.0031 -0.0141 0.0364 209 LEU A N 1665 C CA . LEU A 214 ? 0.3848 0.4454 0.4342 -0.0038 -0.0133 0.0370 209 LEU A CA 1666 C C . LEU A 214 ? 0.4293 0.4944 0.4762 -0.0019 -0.0143 0.0381 209 LEU A C 1667 O O . LEU A 214 ? 0.4137 0.4799 0.4611 0.0000 -0.0157 0.0366 209 LEU A O 1668 C CB . LEU A 214 ? 0.3751 0.4369 0.4253 -0.0041 -0.0129 0.0337 209 LEU A CB 1669 C CG . LEU A 214 ? 0.3684 0.4263 0.4209 -0.0057 -0.0120 0.0321 209 LEU A CG 1670 C CD1 . LEU A 214 ? 0.3551 0.4138 0.4081 -0.0058 -0.0120 0.0289 209 LEU A CD1 1671 C CD2 . LEU A 214 ? 0.3829 0.4392 0.4350 -0.0077 -0.0107 0.0341 209 LEU A CD2 1672 N N . VAL A 215 ? 0.4749 0.5429 0.5192 -0.0027 -0.0137 0.0405 210 VAL A N 1673 C CA . VAL A 215 ? 0.5213 0.5945 0.5627 -0.0012 -0.0144 0.0419 210 VAL A CA 1674 C C . VAL A 215 ? 0.4755 0.5542 0.5152 -0.0017 -0.0135 0.0412 210 VAL A C 1675 O O . VAL A 215 ? 0.5028 0.5813 0.5423 -0.0038 -0.0121 0.0424 210 VAL A O 1676 C CB . VAL A 215 ? 0.5717 0.6436 0.6110 -0.0019 -0.0145 0.0467 210 VAL A CB 1677 C CG1 . VAL A 215 ? 0.5456 0.6234 0.5814 -0.0003 -0.0152 0.0483 210 VAL A CG1 1678 C CG2 . VAL A 215 ? 0.6059 0.6720 0.6470 -0.0010 -0.0158 0.0472 210 VAL A CG2 1679 N N . PRO A 216 ? 0.4891 0.5729 0.5278 0.0004 -0.0144 0.0389 211 PRO A N 1680 C CA . PRO A 216 ? 0.4820 0.5717 0.5190 0.0005 -0.0139 0.0377 211 PRO A CA 1681 C C . PRO A 216 ? 0.4418 0.5359 0.4760 -0.0005 -0.0128 0.0414 211 PRO A C 1682 O O . PRO A 216 ? 0.4352 0.5293 0.4676 -0.0004 -0.0132 0.0447 211 PRO A O 1683 C CB . PRO A 216 ? 0.4848 0.5788 0.5214 0.0036 -0.0156 0.0346 211 PRO A CB 1684 C CG . PRO A 216 ? 0.4845 0.5737 0.5235 0.0045 -0.0168 0.0333 211 PRO A CG 1685 C CD . PRO A 216 ? 0.4888 0.5736 0.5279 0.0031 -0.0162 0.0369 211 PRO A CD 1686 N N . LYS A 217 ? 0.4291 0.5268 0.4628 -0.0018 -0.0117 0.0408 212 LYS A N 1687 C CA . LYS A 217 ? 0.4426 0.5458 0.4738 -0.0034 -0.0103 0.0439 212 LYS A CA 1688 C C . LYS A 217 ? 0.4778 0.5898 0.5072 -0.0013 -0.0108 0.0415 212 LYS A C 1689 O O . LYS A 217 ? 0.5317 0.6461 0.5620 -0.0007 -0.0109 0.0378 212 LYS A O 1690 C CB . LYS A 217 ? 0.4405 0.5418 0.4728 -0.0065 -0.0086 0.0448 212 LYS A CB 1691 C CG . LYS A 217 ? 0.4658 0.5590 0.4996 -0.0088 -0.0082 0.0478 212 LYS A CG 1692 C CD . LYS A 217 ? 0.5241 0.6157 0.5593 -0.0117 -0.0066 0.0483 212 LYS A CD 1693 C CE . LYS A 217 ? 0.5740 0.6580 0.6124 -0.0121 -0.0068 0.0464 212 LYS A CE 1694 N NZ . LYS A 217 ? 0.5743 0.6579 0.6140 -0.0144 -0.0054 0.0458 212 LYS A NZ 1695 N N . ILE A 218 ? 0.5371 0.6537 0.5639 0.0002 -0.0115 0.0430 213 ILE A N 1696 C CA . ILE A 218 ? 0.5629 0.6881 0.5882 0.0030 -0.0125 0.0400 213 ILE A CA 1697 C C . ILE A 218 ? 0.5044 0.6374 0.5272 0.0015 -0.0109 0.0422 213 ILE A C 1698 O O . ILE A 218 ? 0.4855 0.6207 0.5057 0.0003 -0.0102 0.0465 213 ILE A O 1699 C CB . ILE A 218 ? 0.5876 0.7141 0.6114 0.0058 -0.0142 0.0401 213 ILE A CB 1700 C CG1 . ILE A 218 ? 0.5972 0.7165 0.6240 0.0073 -0.0158 0.0373 213 ILE A CG1 1701 C CG2 . ILE A 218 ? 0.6032 0.7396 0.6251 0.0088 -0.0152 0.0373 213 ILE A CG2 1702 C CD1 . ILE A 218 ? 0.6087 0.7287 0.6347 0.0099 -0.0175 0.0373 213 ILE A CD1 1703 N N . ALA A 219 ? 0.4932 0.6305 0.5168 0.0014 -0.0104 0.0392 214 ALA A N 1704 C CA . ALA A 219 ? 0.5101 0.6550 0.5320 -0.0007 -0.0085 0.0411 214 ALA A CA 1705 C C . ALA A 219 ? 0.4975 0.6494 0.5200 0.0009 -0.0088 0.0362 214 ALA A C 1706 O O . ALA A 219 ? 0.5286 0.6774 0.5530 0.0032 -0.0104 0.0317 214 ALA A O 1707 C CB . ALA A 219 ? 0.5079 0.6467 0.5310 -0.0049 -0.0067 0.0447 214 ALA A CB 1708 N N . THR A 220 ? 0.5229 0.6839 0.5438 -0.0005 -0.0072 0.0372 215 THR A N 1709 C CA . THR A 220 ? 0.5119 0.6808 0.5334 0.0010 -0.0074 0.0324 215 THR A CA 1710 C C . THR A 220 ? 0.4782 0.6432 0.5022 -0.0010 -0.0065 0.0314 215 THR A C 1711 O O . THR A 220 ? 0.5269 0.6903 0.5511 -0.0049 -0.0044 0.0352 215 THR A O 1712 C CB . THR A 220 ? 0.5300 0.7122 0.5488 0.0006 -0.0062 0.0335 215 THR A CB 1713 O OG1 . THR A 220 ? 0.5827 0.7691 0.5987 0.0028 -0.0071 0.0345 215 THR A OG1 1714 C CG2 . THR A 220 ? 0.5120 0.7031 0.5314 0.0031 -0.0068 0.0279 215 THR A CG2 1715 N N . ARG A 221 ? 0.4302 0.5936 0.4559 0.0015 -0.0082 0.0260 216 ARG A N 1716 C CA . ARG A 221 ? 0.4057 0.5654 0.4336 0.0002 -0.0078 0.0242 216 ARG A CA 1717 C C . ARG A 221 ? 0.4105 0.5772 0.4386 0.0033 -0.0092 0.0185 216 ARG A C 1718 O O . ARG A 221 ? 0.4354 0.6080 0.4624 0.0068 -0.0110 0.0154 216 ARG A O 1719 C CB . ARG A 221 ? 0.4325 0.5797 0.4624 0.0002 -0.0088 0.0238 216 ARG A CB 1720 C CG . ARG A 221 ? 0.4399 0.5794 0.4702 -0.0027 -0.0075 0.0289 216 ARG A CG 1721 C CD . ARG A 221 ? 0.4322 0.5610 0.4643 -0.0020 -0.0087 0.0279 216 ARG A CD 1722 N NE . ARG A 221 ? 0.4447 0.5736 0.4761 0.0010 -0.0108 0.0260 216 ARG A NE 1723 C CZ . ARG A 221 ? 0.4484 0.5747 0.4793 0.0012 -0.0111 0.0285 216 ARG A CZ 1724 N NH1 . ARG A 221 ? 0.4469 0.5689 0.4779 -0.0013 -0.0097 0.0330 216 ARG A NH1 1725 N NH2 . ARG A 221 ? 0.4600 0.5873 0.4905 0.0042 -0.0131 0.0261 216 ARG A NH2 1726 N N . SER A 222 ? 0.4371 0.6033 0.4667 0.0023 -0.0087 0.0168 217 SER A N 1727 C CA . SER A 222 ? 0.4462 0.6183 0.4762 0.0055 -0.0105 0.0109 217 SER A CA 1728 C C . SER A 222 ? 0.4262 0.5904 0.4569 0.0088 -0.0136 0.0069 217 SER A C 1729 O O . SER A 222 ? 0.4157 0.5699 0.4471 0.0079 -0.0139 0.0087 217 SER A O 1730 C CB . SER A 222 ? 0.4537 0.6276 0.4850 0.0033 -0.0090 0.0105 217 SER A CB 1731 O OG . SER A 222 ? 0.4898 0.6713 0.5205 0.0000 -0.0062 0.0143 217 SER A OG 1732 N N . GLN A 223 ? 0.4500 0.6187 0.4806 0.0127 -0.0162 0.0014 218 GLN A N 1733 C CA . GLN A 223 ? 0.4885 0.6495 0.5196 0.0157 -0.0195 -0.0024 218 GLN A CA 1734 C C . GLN A 223 ? 0.4905 0.6436 0.5229 0.0146 -0.0197 -0.0032 218 GLN A C 1735 O O . GLN A 223 ? 0.5069 0.6645 0.5396 0.0141 -0.0189 -0.0043 218 GLN A O 1736 C CB . GLN A 223 ? 0.6034 0.7717 0.6339 0.0205 -0.0226 -0.0084 218 GLN A CB 1737 C CG . GLN A 223 ? 0.7501 0.9276 0.7792 0.0227 -0.0231 -0.0091 218 GLN A CG 1738 C CD . GLN A 223 ? 0.9035 1.0824 0.9325 0.0279 -0.0274 -0.0152 218 GLN A CD 1739 O OE1 . GLN A 223 ? 0.9131 1.0901 0.9427 0.0301 -0.0298 -0.0196 218 GLN A OE1 1740 N NE2 . GLN A 223 ? 0.9804 1.1619 1.0086 0.0298 -0.0285 -0.0155 218 GLN A NE2 1741 N N . VAL A 224 ? 0.4296 0.5714 0.4626 0.0144 -0.0209 -0.0028 219 VAL A N 1742 C CA . VAL A 224 ? 0.3974 0.5311 0.4311 0.0140 -0.0219 -0.0043 219 VAL A CA 1743 C C . VAL A 224 ? 0.4476 0.5739 0.4812 0.0165 -0.0252 -0.0070 219 VAL A C 1744 O O . VAL A 224 ? 0.4581 0.5810 0.4918 0.0162 -0.0255 -0.0055 219 VAL A O 1745 C CB . VAL A 224 ? 0.4221 0.5488 0.4569 0.0098 -0.0191 0.0001 219 VAL A CB 1746 C CG1 . VAL A 224 ? 0.4123 0.5312 0.4476 0.0096 -0.0201 -0.0014 219 VAL A CG1 1747 C CG2 . VAL A 224 ? 0.4109 0.5444 0.4460 0.0070 -0.0159 0.0031 219 VAL A CG2 1748 N N . ASN A 225 ? 0.4813 0.6052 0.5146 0.0188 -0.0280 -0.0111 220 ASN A N 1749 C CA . ASN A 225 ? 0.4536 0.5712 0.4865 0.0215 -0.0319 -0.0144 220 ASN A CA 1750 C C . ASN A 225 ? 0.4011 0.5231 0.4339 0.0238 -0.0334 -0.0157 220 ASN A C 1751 O O . ASN A 225 ? 0.3958 0.5115 0.4289 0.0241 -0.0351 -0.0158 220 ASN A O 1752 C CB . ASN A 225 ? 0.5302 0.6355 0.5636 0.0190 -0.0319 -0.0121 220 ASN A CB 1753 C CG . ASN A 225 ? 0.6324 0.7332 0.6659 0.0165 -0.0301 -0.0104 220 ASN A CG 1754 O OD1 . ASN A 225 ? 0.6888 0.7831 0.7230 0.0133 -0.0281 -0.0069 220 ASN A OD1 1755 N ND2 . ASN A 225 ? 0.6223 0.7270 0.6552 0.0181 -0.0309 -0.0131 220 ASN A ND2 1756 N N . GLY A 226 ? 0.4155 0.5490 0.4478 0.0254 -0.0327 -0.0167 221 GLY A N 1757 C CA . GLY A 226 ? 0.4612 0.6006 0.4930 0.0281 -0.0342 -0.0184 221 GLY A CA 1758 C C . GLY A 226 ? 0.5386 0.6787 0.5705 0.0259 -0.0318 -0.0140 221 GLY A C 1759 O O . GLY A 226 ? 0.6034 0.7483 0.6349 0.0281 -0.0330 -0.0152 221 GLY A O 1760 N N . GLN A 227 ? 0.5627 0.6979 0.5951 0.0218 -0.0286 -0.0091 222 GLN A N 1761 C CA . GLN A 227 ? 0.4711 0.6046 0.5037 0.0198 -0.0268 -0.0049 222 GLN A CA 1762 C C . GLN A 227 ? 0.4011 0.5390 0.4333 0.0166 -0.0230 -0.0001 222 GLN A C 1763 O O . GLN A 227 ? 0.3568 0.4938 0.3893 0.0143 -0.0212 0.0012 222 GLN A O 1764 C CB . GLN A 227 ? 0.4630 0.5847 0.4969 0.0177 -0.0269 -0.0032 222 GLN A CB 1765 C CG . GLN A 227 ? 0.4919 0.6076 0.5263 0.0199 -0.0305 -0.0071 222 GLN A CG 1766 C CD . GLN A 227 ? 0.4802 0.5996 0.5144 0.0231 -0.0331 -0.0099 222 GLN A CD 1767 O OE1 . GLN A 227 ? 0.5916 0.7118 0.6256 0.0262 -0.0364 -0.0144 222 GLN A OE1 1768 N NE2 . GLN A 227 ? 0.4439 0.5659 0.4781 0.0225 -0.0318 -0.0074 222 GLN A NE2 1769 N N . ARG A 228 ? 0.3826 0.5247 0.4139 0.0165 -0.0220 0.0023 223 ARG A N 1770 C CA . ARG A 228 ? 0.4217 0.5668 0.4524 0.0132 -0.0187 0.0074 223 ARG A CA 1771 C C . ARG A 228 ? 0.3880 0.5241 0.4195 0.0106 -0.0176 0.0115 223 ARG A C 1772 O O . ARG A 228 ? 0.3544 0.4895 0.3858 0.0075 -0.0151 0.0158 223 ARG A O 1773 C CB . ARG A 228 ? 0.4962 0.6522 0.5247 0.0145 -0.0183 0.0081 223 ARG A CB 1774 C CG . ARG A 228 ? 0.5281 0.6946 0.5560 0.0170 -0.0192 0.0040 223 ARG A CG 1775 C CD . ARG A 228 ? 0.5875 0.7659 0.6131 0.0188 -0.0191 0.0040 223 ARG A CD 1776 N NE . ARG A 228 ? 0.6946 0.8811 0.7193 0.0163 -0.0163 0.0064 223 ARG A NE 1777 C CZ . ARG A 228 ? 0.6360 0.8313 0.6607 0.0173 -0.0163 0.0031 223 ARG A CZ 1778 N NH1 . ARG A 228 ? 0.6846 0.8830 0.7098 0.0216 -0.0193 -0.0030 223 ARG A NH1 1779 N NH2 . ARG A 228 ? 0.6653 0.8667 0.6895 0.0140 -0.0134 0.0061 223 ARG A NH2 1780 N N . GLY A 229 ? 0.3882 0.5179 0.4207 0.0120 -0.0195 0.0099 224 GLY A N 1781 C CA . GLY A 229 ? 0.4177 0.5387 0.4515 0.0098 -0.0187 0.0129 224 GLY A CA 1782 C C . GLY A 229 ? 0.4107 0.5244 0.4460 0.0072 -0.0175 0.0137 224 GLY A C 1783 O O . GLY A 229 ? 0.4906 0.6046 0.5259 0.0073 -0.0178 0.0115 224 GLY A O 1784 N N . ARG A 230 ? 0.3597 0.4668 0.3960 0.0050 -0.0164 0.0166 225 ARG A N 1785 C CA . ARG A 230 ? 0.3588 0.4591 0.3965 0.0026 -0.0153 0.0174 225 ARG A CA 1786 C C . ARG A 230 ? 0.3645 0.4575 0.4038 0.0020 -0.0157 0.0179 225 ARG A C 1787 O O . ARG A 230 ? 0.3505 0.4437 0.3899 0.0025 -0.0160 0.0192 225 ARG A O 1788 C CB . ARG A 230 ? 0.3681 0.4695 0.4058 -0.0001 -0.0128 0.0211 225 ARG A CB 1789 C CG . ARG A 230 ? 0.3889 0.4982 0.4254 -0.0001 -0.0120 0.0209 225 ARG A CG 1790 C CD . ARG A 230 ? 0.4219 0.5308 0.4588 0.0002 -0.0125 0.0177 225 ARG A CD 1791 N NE . ARG A 230 ? 0.3992 0.5165 0.4353 0.0001 -0.0116 0.0172 225 ARG A NE 1792 C CZ . ARG A 230 ? 0.4017 0.5270 0.4365 0.0027 -0.0128 0.0144 225 ARG A CZ 1793 N NH1 . ARG A 230 ? 0.3932 0.5191 0.4274 0.0058 -0.0152 0.0117 225 ARG A NH1 1794 N NH2 . ARG A 230 ? 0.4533 0.5866 0.4876 0.0021 -0.0117 0.0142 225 ARG A NH2 1795 N N . MET A 231 ? 0.3661 0.4528 0.4066 0.0006 -0.0156 0.0171 226 MET A N 1796 C CA . MET A 231 ? 0.3557 0.4358 0.3979 -0.0006 -0.0154 0.0179 226 MET A CA 1797 C C . MET A 231 ? 0.3482 0.4239 0.3915 -0.0031 -0.0136 0.0198 226 MET A C 1798 O O . MET A 231 ? 0.3400 0.4144 0.3831 -0.0037 -0.0134 0.0187 226 MET A O 1799 C CB . MET A 231 ? 0.3840 0.4607 0.4266 0.0003 -0.0175 0.0148 226 MET A CB 1800 C CG . MET A 231 ? 0.4360 0.5162 0.4782 0.0027 -0.0193 0.0133 226 MET A CG 1801 S SD . MET A 231 ? 0.5261 0.6020 0.5691 0.0036 -0.0220 0.0098 226 MET A SD 1802 C CE . MET A 231 ? 0.4708 0.5521 0.5135 0.0065 -0.0240 0.0082 226 MET A CE 1803 N N . ASP A 232 ? 0.3464 0.4200 0.3907 -0.0044 -0.0125 0.0225 227 ASP A N 1804 C CA . ASP A 232 ? 0.3421 0.4116 0.3878 -0.0067 -0.0109 0.0243 227 ASP A CA 1805 C C . ASP A 232 ? 0.3347 0.3989 0.3821 -0.0072 -0.0112 0.0234 227 ASP A C 1806 O O . ASP A 232 ? 0.3284 0.3922 0.3766 -0.0065 -0.0118 0.0236 227 ASP A O 1807 C CB . ASP A 232 ? 0.3969 0.4675 0.4426 -0.0077 -0.0097 0.0278 227 ASP A CB 1808 C CG . ASP A 232 ? 0.3985 0.4744 0.4427 -0.0082 -0.0089 0.0291 227 ASP A CG 1809 O OD1 . ASP A 232 ? 0.5276 0.6061 0.5711 -0.0078 -0.0090 0.0272 227 ASP A OD1 1810 O OD2 . ASP A 232 ? 0.4207 0.4982 0.4643 -0.0089 -0.0082 0.0322 227 ASP A OD2 1811 N N . PHE A 233 ? 0.3283 0.3890 0.3761 -0.0084 -0.0108 0.0223 228 PHE A N 1812 C CA . PHE A 233 ? 0.3491 0.4055 0.3983 -0.0091 -0.0110 0.0213 228 PHE A CA 1813 C C . PHE A 233 ? 0.3498 0.4035 0.4007 -0.0108 -0.0095 0.0228 228 PHE A C 1814 O O . PHE A 233 ? 0.3582 0.4120 0.4089 -0.0116 -0.0085 0.0240 228 PHE A O 1815 C CB . PHE A 233 ? 0.3278 0.3820 0.3761 -0.0092 -0.0118 0.0190 228 PHE A CB 1816 C CG . PHE A 233 ? 0.3409 0.3967 0.3881 -0.0075 -0.0139 0.0170 228 PHE A CG 1817 C CD1 . PHE A 233 ? 0.3514 0.4104 0.3969 -0.0060 -0.0148 0.0159 228 PHE A CD1 1818 C CD2 . PHE A 233 ? 0.3490 0.4037 0.3972 -0.0073 -0.0149 0.0161 228 PHE A CD2 1819 C CE1 . PHE A 233 ? 0.3586 0.4191 0.4031 -0.0040 -0.0170 0.0137 228 PHE A CE1 1820 C CE2 . PHE A 233 ? 0.3540 0.4100 0.4013 -0.0056 -0.0170 0.0142 228 PHE A CE2 1821 C CZ . PHE A 233 ? 0.3607 0.4195 0.4062 -0.0039 -0.0181 0.0129 228 PHE A CZ 1822 N N . PHE A 234 ? 0.3123 0.3636 0.3649 -0.0112 -0.0095 0.0225 229 PHE A N 1823 C CA . PHE A 234 ? 0.3231 0.3720 0.3775 -0.0123 -0.0084 0.0234 229 PHE A CA 1824 C C . PHE A 234 ? 0.3253 0.3718 0.3808 -0.0133 -0.0083 0.0218 229 PHE A C 1825 O O . PHE A 234 ? 0.3221 0.3688 0.3773 -0.0130 -0.0092 0.0203 229 PHE A O 1826 C CB . PHE A 234 ? 0.3249 0.3745 0.3804 -0.0116 -0.0086 0.0251 229 PHE A CB 1827 C CG . PHE A 234 ? 0.3106 0.3624 0.3648 -0.0112 -0.0085 0.0274 229 PHE A CG 1828 C CD1 . PHE A 234 ? 0.3136 0.3690 0.3661 -0.0099 -0.0093 0.0275 229 PHE A CD1 1829 C CD2 . PHE A 234 ? 0.3295 0.3798 0.3842 -0.0123 -0.0076 0.0294 229 PHE A CD2 1830 C CE1 . PHE A 234 ? 0.3209 0.3791 0.3719 -0.0098 -0.0090 0.0299 229 PHE A CE1 1831 C CE2 . PHE A 234 ? 0.3314 0.3839 0.3847 -0.0125 -0.0074 0.0318 229 PHE A CE2 1832 C CZ . PHE A 234 ? 0.3013 0.3581 0.3526 -0.0113 -0.0080 0.0321 229 PHE A CZ 1833 N N . TRP A 235 ? 0.3073 0.3518 0.3643 -0.0144 -0.0072 0.0218 230 TRP A N 1834 C CA . TRP A 235 ? 0.2897 0.3328 0.3477 -0.0154 -0.0069 0.0203 230 TRP A CA 1835 C C . TRP A 235 ? 0.3175 0.3600 0.3780 -0.0158 -0.0062 0.0203 230 TRP A C 1836 O O . TRP A 235 ? 0.4159 0.4580 0.4772 -0.0153 -0.0060 0.0215 230 TRP A O 1837 C CB . TRP A 235 ? 0.2888 0.3302 0.3450 -0.0165 -0.0066 0.0196 230 TRP A CB 1838 C CG . TRP A 235 ? 0.2706 0.3112 0.3266 -0.0169 -0.0057 0.0203 230 TRP A CG 1839 C CD1 . TRP A 235 ? 0.2667 0.3083 0.3217 -0.0164 -0.0058 0.0212 230 TRP A CD1 1840 C CD2 . TRP A 235 ? 0.2688 0.3080 0.3260 -0.0179 -0.0047 0.0200 230 TRP A CD2 1841 N NE1 . TRP A 235 ? 0.2760 0.3167 0.3315 -0.0172 -0.0048 0.0215 230 TRP A NE1 1842 C CE2 . TRP A 235 ? 0.2632 0.3021 0.3200 -0.0180 -0.0043 0.0207 230 TRP A CE2 1843 C CE3 . TRP A 235 ? 0.2796 0.3181 0.3380 -0.0187 -0.0041 0.0189 230 TRP A CE3 1844 C CZ2 . TRP A 235 ? 0.2646 0.3023 0.3224 -0.0187 -0.0034 0.0203 230 TRP A CZ2 1845 C CZ3 . TRP A 235 ? 0.2949 0.3324 0.3541 -0.0193 -0.0032 0.0185 230 TRP A CZ3 1846 C CH2 . TRP A 235 ? 0.2874 0.3244 0.3464 -0.0193 -0.0030 0.0192 230 TRP A CH2 1847 N N . THR A 236 ? 0.3115 0.3541 0.3731 -0.0166 -0.0059 0.0188 231 THR A N 1848 C CA . THR A 236 ? 0.3242 0.3668 0.3882 -0.0169 -0.0052 0.0181 231 THR A CA 1849 C C . THR A 236 ? 0.3360 0.3789 0.4002 -0.0185 -0.0045 0.0165 231 THR A C 1850 O O . THR A 236 ? 0.3342 0.3771 0.3969 -0.0195 -0.0047 0.0162 231 THR A O 1851 C CB . THR A 236 ? 0.3552 0.3993 0.4214 -0.0155 -0.0059 0.0180 231 THR A CB 1852 O OG1 . THR A 236 ? 0.3276 0.3715 0.3962 -0.0152 -0.0056 0.0172 231 THR A OG1 1853 C CG2 . THR A 236 ? 0.3778 0.4241 0.4447 -0.0157 -0.0064 0.0166 231 THR A CG2 1854 N N . ILE A 237 ? 0.3393 0.3826 0.4052 -0.0188 -0.0036 0.0156 232 ILE A N 1855 C CA . ILE A 237 ? 0.3638 0.4085 0.4301 -0.0205 -0.0028 0.0141 232 ILE A CA 1856 C C . ILE A 237 ? 0.3818 0.4297 0.4512 -0.0199 -0.0029 0.0127 232 ILE A C 1857 O O . ILE A 237 ? 0.4306 0.4791 0.5022 -0.0185 -0.0030 0.0121 232 ILE A O 1858 C CB . ILE A 237 ? 0.3634 0.4075 0.4297 -0.0210 -0.0018 0.0136 232 ILE A CB 1859 C CG1 . ILE A 237 ? 0.3734 0.4147 0.4369 -0.0213 -0.0017 0.0147 232 ILE A CG1 1860 C CG2 . ILE A 237 ? 0.3758 0.4220 0.4422 -0.0228 -0.0007 0.0122 232 ILE A CG2 1861 C CD1 . ILE A 237 ? 0.3760 0.4161 0.4365 -0.0224 -0.0021 0.0152 232 ILE A CD1 1862 N N . LEU A 238 ? 0.3742 0.4240 0.4437 -0.0209 -0.0030 0.0121 233 LEU A N 1863 C CA . LEU A 238 ? 0.3819 0.4354 0.4544 -0.0204 -0.0032 0.0104 233 LEU A CA 1864 C C . LEU A 238 ? 0.3718 0.4283 0.4455 -0.0221 -0.0019 0.0088 233 LEU A C 1865 O O . LEU A 238 ? 0.3688 0.4254 0.4408 -0.0246 -0.0012 0.0089 233 LEU A O 1866 C CB . LEU A 238 ? 0.3782 0.4329 0.4507 -0.0206 -0.0041 0.0104 233 LEU A CB 1867 C CG . LEU A 238 ? 0.3701 0.4291 0.4459 -0.0199 -0.0045 0.0085 233 LEU A CG 1868 C CD1 . LEU A 238 ? 0.4326 0.4915 0.5101 -0.0169 -0.0055 0.0085 233 LEU A CD1 1869 C CD2 . LEU A 238 ? 0.3825 0.4424 0.4581 -0.0205 -0.0054 0.0084 233 LEU A CD2 1870 N N . LYS A 239 ? 0.4118 0.4706 0.4881 -0.0209 -0.0017 0.0072 234 LYS A N 1871 C CA . LYS A 239 ? 0.4801 0.5426 0.5576 -0.0223 -0.0003 0.0053 234 LYS A CA 1872 C C . LYS A 239 ? 0.4333 0.5007 0.5122 -0.0241 0.0001 0.0039 234 LYS A C 1873 O O . LYS A 239 ? 0.3566 0.4252 0.4370 -0.0232 -0.0008 0.0035 234 LYS A O 1874 C CB . LYS A 239 ? 0.5391 0.6034 0.6196 -0.0200 -0.0006 0.0033 234 LYS A CB 1875 C CG . LYS A 239 ? 0.6523 0.7121 0.7320 -0.0184 -0.0011 0.0044 234 LYS A CG 1876 C CD . LYS A 239 ? 0.7809 0.8388 0.8578 -0.0203 0.0000 0.0053 234 LYS A CD 1877 C CE . LYS A 239 ? 0.9226 0.9787 1.0004 -0.0189 -0.0001 0.0047 234 LYS A CE 1878 N NZ . LYS A 239 ? 1.0158 1.0701 1.0906 -0.0205 0.0008 0.0055 234 LYS A NZ 1879 N N . PRO A 240 ? 0.4352 0.5059 0.5139 -0.0265 0.0016 0.0030 235 PRO A N 1880 C CA . PRO A 240 ? 0.4900 0.5658 0.5701 -0.0288 0.0023 0.0017 235 PRO A CA 1881 C C . PRO A 240 ? 0.5535 0.6342 0.6377 -0.0272 0.0016 -0.0004 235 PRO A C 1882 O O . PRO A 240 ? 0.6511 0.7332 0.7358 -0.0287 0.0012 -0.0004 235 PRO A O 1883 C CB . PRO A 240 ? 0.4640 0.5434 0.5436 -0.0310 0.0041 0.0008 235 PRO A CB 1884 C CG . PRO A 240 ? 0.4546 0.5286 0.5307 -0.0310 0.0043 0.0027 235 PRO A CG 1885 C CD . PRO A 240 ? 0.4369 0.5068 0.5137 -0.0275 0.0028 0.0031 235 PRO A CD 1886 N N . ASN A 241 ? 0.5223 0.6053 0.6094 -0.0242 0.0009 -0.0025 236 ASN A N 1887 C CA . ASN A 241 ? 0.6007 0.6880 0.6910 -0.0233 0.0000 -0.0043 236 ASN A CA 1888 C C . ASN A 241 ? 0.4982 0.5822 0.5890 -0.0200 -0.0021 -0.0036 236 ASN A C 1889 O O . ASN A 241 ? 0.5218 0.6093 0.6156 -0.0180 -0.0032 -0.0056 236 ASN A O 1890 C CB . ASN A 241 ? 0.6564 0.7520 0.7507 -0.0231 0.0006 -0.0079 236 ASN A CB 1891 C CG . ASN A 241 ? 0.8302 0.9311 0.9249 -0.0271 0.0021 -0.0085 236 ASN A CG 1892 O OD1 . ASN A 241 ? 0.9852 1.0889 1.0818 -0.0275 0.0014 -0.0094 236 ASN A OD1 1893 N ND2 . ASN A 241 ? 0.8575 0.9591 0.9499 -0.0305 0.0040 -0.0076 236 ASN A ND2 1894 N N . ASP A 242 ? 0.4297 0.5072 0.5176 -0.0192 -0.0027 -0.0009 237 ASP A N 1895 C CA . ASP A 242 ? 0.3933 0.4675 0.4812 -0.0162 -0.0045 0.0001 237 ASP A CA 1896 C C . ASP A 242 ? 0.3769 0.4501 0.4634 -0.0169 -0.0052 0.0014 237 ASP A C 1897 O O . ASP A 242 ? 0.4063 0.4800 0.4916 -0.0198 -0.0044 0.0017 237 ASP A O 1898 C CB . ASP A 242 ? 0.4142 0.4827 0.4998 -0.0153 -0.0047 0.0022 237 ASP A CB 1899 C CG . ASP A 242 ? 0.4166 0.4821 0.5024 -0.0121 -0.0065 0.0033 237 ASP A CG 1900 O OD1 . ASP A 242 ? 0.4000 0.4678 0.4881 -0.0099 -0.0079 0.0019 237 ASP A OD1 1901 O OD2 . ASP A 242 ? 0.4432 0.5039 0.5269 -0.0118 -0.0067 0.0055 237 ASP A OD2 1902 N N . ALA A 243 ? 0.3515 0.4231 0.4380 -0.0143 -0.0069 0.0021 238 ALA A N 1903 C CA . ALA A 243 ? 0.3692 0.4399 0.4544 -0.0144 -0.0078 0.0032 238 ALA A CA 1904 C C . ALA A 243 ? 0.3923 0.4583 0.4750 -0.0123 -0.0089 0.0058 238 ALA A C 1905 O O . ALA A 243 ? 0.3759 0.4401 0.4588 -0.0103 -0.0094 0.0063 238 ALA A O 1906 C CB . ALA A 243 ? 0.3665 0.4418 0.4546 -0.0131 -0.0089 0.0010 238 ALA A CB 1907 N N . ILE A 244 ? 0.3724 0.4367 0.4527 -0.0128 -0.0094 0.0071 239 ILE A N 1908 C CA . ILE A 244 ? 0.3629 0.4240 0.4407 -0.0112 -0.0102 0.0095 239 ILE A CA 1909 C C . ILE A 244 ? 0.3693 0.4322 0.4475 -0.0093 -0.0118 0.0092 239 ILE A C 1910 O O . ILE A 244 ? 0.3744 0.4399 0.4535 -0.0102 -0.0122 0.0077 239 ILE A O 1911 C CB . ILE A 244 ? 0.3695 0.4276 0.4441 -0.0131 -0.0095 0.0111 239 ILE A CB 1912 C CG1 . ILE A 244 ? 0.3746 0.4301 0.4466 -0.0115 -0.0103 0.0134 239 ILE A CG1 1913 C CG2 . ILE A 244 ? 0.3437 0.4027 0.4179 -0.0149 -0.0098 0.0101 239 ILE A CG2 1914 C CD1 . ILE A 244 ? 0.3599 0.4125 0.4293 -0.0129 -0.0094 0.0148 239 ILE A CD1 1915 N N . HIS A 245 ? 0.3841 0.4458 0.4614 -0.0068 -0.0129 0.0108 240 HIS A N 1916 C CA . HIS A 245 ? 0.3995 0.4633 0.4770 -0.0045 -0.0147 0.0105 240 HIS A CA 1917 C C . HIS A 245 ? 0.3768 0.4388 0.4509 -0.0035 -0.0153 0.0131 240 HIS A C 1918 O O . HIS A 245 ? 0.3662 0.4255 0.4386 -0.0029 -0.0152 0.0154 240 HIS A O 1919 C CB . HIS A 245 ? 0.3974 0.4622 0.4769 -0.0019 -0.0159 0.0098 240 HIS A CB 1920 C CG . HIS A 245 ? 0.3829 0.4501 0.4658 -0.0025 -0.0153 0.0071 240 HIS A CG 1921 N ND1 . HIS A 245 ? 0.4072 0.4793 0.4931 -0.0025 -0.0156 0.0041 240 HIS A ND1 1922 C CD2 . HIS A 245 ? 0.3858 0.4519 0.4699 -0.0033 -0.0143 0.0067 240 HIS A CD2 1923 C CE1 . HIS A 245 ? 0.3854 0.4596 0.4740 -0.0032 -0.0148 0.0020 240 HIS A CE1 1924 N NE2 . HIS A 245 ? 0.3841 0.4547 0.4715 -0.0036 -0.0140 0.0035 240 HIS A NE2 1925 N N . PHE A 246 ? 0.3548 0.4186 0.4280 -0.0034 -0.0160 0.0124 241 PHE A N 1926 C CA . PHE A 246 ? 0.3737 0.4369 0.4438 -0.0025 -0.0166 0.0143 241 PHE A CA 1927 C C . PHE A 246 ? 0.4142 0.4801 0.4843 0.0001 -0.0184 0.0140 241 PHE A C 1928 O O . PHE A 246 ? 0.4632 0.5319 0.5357 0.0006 -0.0192 0.0116 241 PHE A O 1929 C CB . PHE A 246 ? 0.3697 0.4330 0.4387 -0.0041 -0.0165 0.0133 241 PHE A CB 1930 C CG . PHE A 246 ? 0.3697 0.4300 0.4377 -0.0064 -0.0151 0.0139 241 PHE A CG 1931 C CD1 . PHE A 246 ? 0.3712 0.4296 0.4367 -0.0063 -0.0145 0.0161 241 PHE A CD1 1932 C CD2 . PHE A 246 ? 0.3866 0.4464 0.4561 -0.0088 -0.0142 0.0124 241 PHE A CD2 1933 C CE1 . PHE A 246 ? 0.3869 0.4428 0.4515 -0.0083 -0.0133 0.0165 241 PHE A CE1 1934 C CE2 . PHE A 246 ? 0.4145 0.4716 0.4828 -0.0108 -0.0130 0.0130 241 PHE A CE2 1935 C CZ . PHE A 246 ? 0.4313 0.4863 0.4971 -0.0104 -0.0126 0.0150 241 PHE A CZ 1936 N N . GLU A 247 ? 0.4282 0.4937 0.4955 0.0017 -0.0190 0.0165 242 GLU A N 1937 C CA . GLU A 247 ? 0.4558 0.5241 0.5222 0.0044 -0.0207 0.0167 242 GLU A CA 1938 C C . GLU A 247 ? 0.4380 0.5068 0.5007 0.0050 -0.0208 0.0190 242 GLU A C 1939 O O . GLU A 247 ? 0.4214 0.4879 0.4822 0.0042 -0.0198 0.0217 242 GLU A O 1940 C CB . GLU A 247 ? 0.5279 0.5958 0.5951 0.0065 -0.0217 0.0175 242 GLU A CB 1941 C CG . GLU A 247 ? 0.5988 0.6694 0.6645 0.0095 -0.0237 0.0180 242 GLU A CG 1942 C CD . GLU A 247 ? 0.6392 0.7087 0.7053 0.0119 -0.0251 0.0189 242 GLU A CD 1943 O OE1 . GLU A 247 ? 0.6689 0.7379 0.7382 0.0119 -0.0252 0.0171 242 GLU A OE1 1944 O OE2 . GLU A 247 ? 0.6702 0.7396 0.7334 0.0137 -0.0262 0.0216 242 GLU A OE2 1945 N N . SER A 248 ? 0.4008 0.4729 0.4626 0.0064 -0.0220 0.0178 243 SER A N 1946 C CA . SER A 248 ? 0.4270 0.5008 0.4853 0.0072 -0.0221 0.0195 243 SER A CA 1947 C C . SER A 248 ? 0.4612 0.5394 0.5187 0.0097 -0.0240 0.0182 243 SER A C 1948 O O . SER A 248 ? 0.5128 0.5926 0.5727 0.0101 -0.0250 0.0151 243 SER A O 1949 C CB . SER A 248 ? 0.4062 0.4792 0.4637 0.0053 -0.0211 0.0189 243 SER A CB 1950 O OG . SER A 248 ? 0.3469 0.4224 0.4012 0.0062 -0.0213 0.0203 243 SER A OG 1951 N N . ASN A 249 ? 0.4411 0.5217 0.4954 0.0113 -0.0243 0.0204 244 ASN A N 1952 C CA . ASN A 249 ? 0.4922 0.5777 0.5452 0.0138 -0.0260 0.0190 244 ASN A CA 1953 C C . ASN A 249 ? 0.5203 0.6084 0.5707 0.0138 -0.0258 0.0190 244 ASN A C 1954 O O . ASN A 249 ? 0.5697 0.6625 0.6179 0.0160 -0.0269 0.0189 244 ASN A O 1955 C CB . ASN A 249 ? 0.4880 0.5754 0.5390 0.0162 -0.0271 0.0211 244 ASN A CB 1956 C CG . ASN A 249 ? 0.5201 0.6069 0.5677 0.0157 -0.0261 0.0255 244 ASN A CG 1957 O OD1 . ASN A 249 ? 0.5973 0.6814 0.6445 0.0133 -0.0244 0.0270 244 ASN A OD1 1958 N ND2 . ASN A 249 ? 0.5125 0.6019 0.5572 0.0178 -0.0271 0.0276 244 ASN A ND2 1959 N N . GLY A 250 ? 0.5035 0.5892 0.5541 0.0115 -0.0244 0.0190 245 GLY A N 1960 C CA . GLY A 250 ? 0.5157 0.6041 0.5641 0.0117 -0.0244 0.0184 245 GLY A CA 1961 C C . GLY A 250 ? 0.4670 0.5525 0.5149 0.0092 -0.0226 0.0197 245 GLY A C 1962 O O . GLY A 250 ? 0.4635 0.5453 0.5119 0.0074 -0.0212 0.0219 245 GLY A O 1963 N N . ASN A 251 ? 0.4459 0.5334 0.4927 0.0094 -0.0229 0.0180 246 ASN A N 1964 C CA . ASN A 251 ? 0.4455 0.5313 0.4914 0.0075 -0.0214 0.0190 246 ASN A CA 1965 C C . ASN A 251 ? 0.4133 0.4931 0.4613 0.0050 -0.0204 0.0187 246 ASN A C 1966 O O . ASN A 251 ? 0.3628 0.4406 0.4103 0.0033 -0.0189 0.0201 246 ASN A O 1967 C CB . ASN A 251 ? 0.4187 0.5064 0.4622 0.0070 -0.0199 0.0229 246 ASN A CB 1968 C CG . ASN A 251 ? 0.4143 0.5085 0.4553 0.0093 -0.0207 0.0238 246 ASN A CG 1969 O OD1 . ASN A 251 ? 0.3909 0.4862 0.4319 0.0109 -0.0217 0.0240 246 ASN A OD1 1970 N ND2 . ASN A 251 ? 0.3994 0.4983 0.4382 0.0095 -0.0202 0.0239 246 ASN A ND2 1971 N N . PHE A 252 ? 0.3815 0.4589 0.4320 0.0047 -0.0212 0.0166 247 PHE A N 1972 C CA . PHE A 252 ? 0.3743 0.4466 0.4268 0.0023 -0.0202 0.0165 247 PHE A CA 1973 C C . PHE A 252 ? 0.3949 0.4652 0.4476 0.0014 -0.0209 0.0139 247 PHE A C 1974 O O . PHE A 252 ? 0.3497 0.4211 0.4027 0.0025 -0.0228 0.0114 247 PHE A O 1975 C CB . PHE A 252 ? 0.3736 0.4453 0.4286 0.0024 -0.0206 0.0158 247 PHE A CB 1976 C CG . PHE A 252 ? 0.3518 0.4195 0.4092 0.0001 -0.0196 0.0153 247 PHE A CG 1977 C CD1 . PHE A 252 ? 0.3574 0.4220 0.4147 -0.0017 -0.0179 0.0168 247 PHE A CD1 1978 C CD2 . PHE A 252 ? 0.3372 0.4050 0.3973 -0.0001 -0.0204 0.0132 247 PHE A CD2 1979 C CE1 . PHE A 252 ? 0.3405 0.4022 0.3998 -0.0038 -0.0170 0.0162 247 PHE A CE1 1980 C CE2 . PHE A 252 ? 0.3338 0.3990 0.3962 -0.0024 -0.0193 0.0127 247 PHE A CE2 1981 C CZ . PHE A 252 ? 0.3314 0.3936 0.3933 -0.0041 -0.0176 0.0142 247 PHE A CZ 1982 N N . ILE A 253 ? 0.3794 0.4464 0.4318 -0.0004 -0.0196 0.0146 248 ILE A N 1983 C CA . ILE A 253 ? 0.3676 0.4316 0.4199 -0.0016 -0.0203 0.0127 248 ILE A CA 1984 C C . ILE A 253 ? 0.3463 0.4064 0.4007 -0.0040 -0.0193 0.0128 248 ILE A C 1985 O O . ILE A 253 ? 0.3021 0.3602 0.3566 -0.0054 -0.0175 0.0144 248 ILE A O 1986 C CB . ILE A 253 ? 0.3711 0.4347 0.4212 -0.0017 -0.0198 0.0131 248 ILE A CB 1987 C CG1 . ILE A 253 ? 0.3522 0.4210 0.4004 0.0003 -0.0201 0.0136 248 ILE A CG1 1988 C CG2 . ILE A 253 ? 0.4036 0.4643 0.4532 -0.0022 -0.0212 0.0108 248 ILE A CG2 1989 C CD1 . ILE A 253 ? 0.3524 0.4246 0.4001 0.0028 -0.0225 0.0110 248 ILE A CD1 1990 N N . ALA A 254 ? 0.3444 0.4037 0.4004 -0.0045 -0.0204 0.0110 249 ALA A N 1991 C CA . ALA A 254 ? 0.3247 0.3821 0.3831 -0.0067 -0.0195 0.0109 249 ALA A CA 1992 C C . ALA A 254 ? 0.3417 0.3950 0.3999 -0.0093 -0.0190 0.0106 249 ALA A C 1993 O O . ALA A 254 ? 0.3614 0.4126 0.4180 -0.0095 -0.0202 0.0096 249 ALA A O 1994 C CB . ALA A 254 ? 0.3252 0.3845 0.3858 -0.0063 -0.0208 0.0091 249 ALA A CB 1995 N N . PRO A 255 ? 0.3395 0.3916 0.3992 -0.0113 -0.0173 0.0113 250 PRO A N 1996 C CA . PRO A 255 ? 0.3390 0.3876 0.3983 -0.0139 -0.0169 0.0110 250 PRO A CA 1997 C C . PRO A 255 ? 0.3612 0.4089 0.4211 -0.0150 -0.0186 0.0093 250 PRO A C 1998 O O . PRO A 255 ? 0.3781 0.4286 0.4401 -0.0143 -0.0195 0.0081 250 PRO A O 1999 C CB . PRO A 255 ? 0.3457 0.3947 0.4069 -0.0155 -0.0149 0.0117 250 PRO A CB 2000 C CG . PRO A 255 ? 0.3393 0.3909 0.4015 -0.0135 -0.0143 0.0126 250 PRO A CG 2001 C CD . PRO A 255 ? 0.3386 0.3925 0.4004 -0.0111 -0.0159 0.0122 250 PRO A CD 2002 N N . GLU A 256 ? 0.4060 0.4498 0.4644 -0.0169 -0.0193 0.0091 251 GLU A N 2003 C CA . GLU A 256 ? 0.3968 0.4385 0.4557 -0.0190 -0.0207 0.0078 251 GLU A CA 2004 C C . GLU A 256 ? 0.3687 0.4075 0.4271 -0.0224 -0.0192 0.0089 251 GLU A C 2005 O O . GLU A 256 ? 0.3294 0.3694 0.3899 -0.0248 -0.0183 0.0088 251 GLU A O 2006 C CB . GLU A 256 ? 0.4566 0.4959 0.5137 -0.0177 -0.0236 0.0066 251 GLU A CB 2007 C CG . GLU A 256 ? 0.5517 0.5884 0.6095 -0.0197 -0.0257 0.0052 251 GLU A CG 2008 C CD . GLU A 256 ? 0.5939 0.6275 0.6496 -0.0179 -0.0290 0.0036 251 GLU A CD 2009 O OE1 . GLU A 256 ? 0.6156 0.6510 0.6699 -0.0146 -0.0297 0.0031 251 GLU A OE1 2010 O OE2 . GLU A 256 ? 0.6928 0.7227 0.7486 -0.0198 -0.0310 0.0028 251 GLU A OE2 2011 N N . TYR A 257 ? 0.3634 0.3989 0.4189 -0.0225 -0.0190 0.0099 252 TYR A N 2012 C CA . TYR A 257 ? 0.3749 0.4079 0.4294 -0.0254 -0.0176 0.0111 252 TYR A CA 2013 C C . TYR A 257 ? 0.4119 0.4466 0.4664 -0.0246 -0.0152 0.0122 252 TYR A C 2014 O O . TYR A 257 ? 0.4293 0.4659 0.4839 -0.0220 -0.0150 0.0123 252 TYR A O 2015 C CB . TYR A 257 ? 0.3832 0.4106 0.4341 -0.0260 -0.0192 0.0113 252 TYR A CB 2016 C CG . TYR A 257 ? 0.4080 0.4320 0.4583 -0.0273 -0.0219 0.0104 252 TYR A CG 2017 C CD1 . TYR A 257 ? 0.4176 0.4382 0.4672 -0.0311 -0.0220 0.0113 252 TYR A CD1 2018 C CD2 . TYR A 257 ? 0.4339 0.4577 0.4841 -0.0247 -0.0246 0.0088 252 TYR A CD2 2019 C CE1 . TYR A 257 ? 0.4357 0.4524 0.4847 -0.0326 -0.0247 0.0107 252 TYR A CE1 2020 C CE2 . TYR A 257 ? 0.4789 0.4988 0.5286 -0.0259 -0.0275 0.0078 252 TYR A CE2 2021 C CZ . TYR A 257 ? 0.4815 0.4976 0.5307 -0.0300 -0.0275 0.0088 252 TYR A CZ 2022 O OH . TYR A 257 ? 0.5913 0.6028 0.6400 -0.0315 -0.0305 0.0081 252 TYR A OH 2023 N N . ALA A 258 ? 0.3480 0.3820 0.4023 -0.0271 -0.0135 0.0129 253 ALA A N 2024 C CA . ALA A 258 ? 0.3442 0.3797 0.3989 -0.0266 -0.0114 0.0137 253 ALA A CA 2025 C C . ALA A 258 ? 0.3503 0.3833 0.4031 -0.0292 -0.0104 0.0144 253 ALA A C 2026 O O . ALA A 258 ? 0.3508 0.3807 0.4019 -0.0312 -0.0116 0.0146 253 ALA A O 2027 C CB . ALA A 258 ? 0.3446 0.3846 0.4029 -0.0264 -0.0100 0.0132 253 ALA A CB 2028 N N . TYR A 259 ? 0.3445 0.3784 0.3973 -0.0292 -0.0086 0.0149 254 TYR A N 2029 C CA . TYR A 259 ? 0.3720 0.4034 0.4223 -0.0313 -0.0080 0.0156 254 TYR A CA 2030 C C . TYR A 259 ? 0.3558 0.3905 0.4079 -0.0327 -0.0057 0.0155 254 TYR A C 2031 O O . TYR A 259 ? 0.3468 0.3839 0.4007 -0.0310 -0.0046 0.0151 254 TYR A O 2032 C CB . TYR A 259 ? 0.3780 0.4066 0.4256 -0.0296 -0.0084 0.0161 254 TYR A CB 2033 C CG . TYR A 259 ? 0.3693 0.3950 0.4148 -0.0279 -0.0108 0.0159 254 TYR A CG 2034 C CD1 . TYR A 259 ? 0.3856 0.4134 0.4323 -0.0251 -0.0113 0.0154 254 TYR A CD1 2035 C CD2 . TYR A 259 ? 0.3843 0.4056 0.4267 -0.0289 -0.0126 0.0161 254 TYR A CD2 2036 C CE1 . TYR A 259 ? 0.3552 0.3812 0.4001 -0.0233 -0.0134 0.0148 254 TYR A CE1 2037 C CE2 . TYR A 259 ? 0.3885 0.4073 0.4292 -0.0269 -0.0151 0.0154 254 TYR A CE2 2038 C CZ . TYR A 259 ? 0.3849 0.4066 0.4269 -0.0240 -0.0154 0.0146 254 TYR A CZ 2039 O OH . TYR A 259 ? 0.4452 0.4652 0.4855 -0.0220 -0.0179 0.0136 254 TYR A OH 2040 N N . LYS A 260 ? 0.3707 0.4056 0.4221 -0.0358 -0.0051 0.0158 255 LYS A N 2041 C CA . LYS A 260 ? 0.3959 0.4343 0.4484 -0.0372 -0.0029 0.0155 255 LYS A CA 2042 C C . LYS A 260 ? 0.4021 0.4382 0.4518 -0.0365 -0.0024 0.0161 255 LYS A C 2043 O O . LYS A 260 ? 0.4443 0.4758 0.4904 -0.0369 -0.0036 0.0171 255 LYS A O 2044 C CB . LYS A 260 ? 0.4292 0.4688 0.4811 -0.0411 -0.0022 0.0159 255 LYS A CB 2045 C CG . LYS A 260 ? 0.4989 0.5410 0.5537 -0.0421 -0.0028 0.0152 255 LYS A CG 2046 C CD . LYS A 260 ? 0.5435 0.5900 0.5996 -0.0457 -0.0013 0.0149 255 LYS A CD 2047 C CE . LYS A 260 ? 0.6088 0.6519 0.6611 -0.0495 -0.0015 0.0167 255 LYS A CE 2048 N NZ . LYS A 260 ? 0.7235 0.7725 0.7772 -0.0529 0.0006 0.0165 255 LYS A NZ 2049 N N . ILE A 261 ? 0.3913 0.4303 0.4429 -0.0353 -0.0009 0.0153 256 ILE A N 2050 C CA . ILE A 261 ? 0.4657 0.5027 0.5152 -0.0341 -0.0007 0.0156 256 ILE A CA 2051 C C . ILE A 261 ? 0.4730 0.5138 0.5238 -0.0347 0.0011 0.0147 256 ILE A C 2052 O O . ILE A 261 ? 0.5436 0.5888 0.5980 -0.0343 0.0020 0.0134 256 ILE A O 2053 C CB . ILE A 261 ? 0.5219 0.5579 0.5725 -0.0311 -0.0015 0.0154 256 ILE A CB 2054 C CG1 . ILE A 261 ? 0.6187 0.6533 0.6680 -0.0299 -0.0012 0.0154 256 ILE A CG1 2055 C CG2 . ILE A 261 ? 0.6221 0.6618 0.6770 -0.0297 -0.0009 0.0144 256 ILE A CG2 2056 C CD1 . ILE A 261 ? 0.6472 0.6810 0.6974 -0.0275 -0.0019 0.0155 256 ILE A CD1 2057 N N . VAL A 262 ? 0.4447 0.4841 0.4924 -0.0358 0.0016 0.0152 257 VAL A N 2058 C CA . VAL A 262 ? 0.4655 0.5086 0.5141 -0.0359 0.0032 0.0141 257 VAL A CA 2059 C C . VAL A 262 ? 0.4746 0.5151 0.5213 -0.0343 0.0029 0.0140 257 VAL A C 2060 O O . VAL A 262 ? 0.4513 0.4878 0.4941 -0.0348 0.0020 0.0152 257 VAL A O 2061 C CB . VAL A 262 ? 0.4915 0.5370 0.5382 -0.0392 0.0044 0.0145 257 VAL A CB 2062 C CG1 . VAL A 262 ? 0.4914 0.5411 0.5387 -0.0390 0.0060 0.0131 257 VAL A CG1 2063 C CG2 . VAL A 262 ? 0.4608 0.5102 0.5102 -0.0409 0.0049 0.0140 257 VAL A CG2 2064 N N . LYS A 263 ? 0.5720 0.6147 0.6214 -0.0324 0.0036 0.0125 258 LYS A N 2065 C CA . LYS A 263 ? 0.6099 0.6503 0.6586 -0.0306 0.0031 0.0123 258 LYS A CA 2066 C C . LYS A 263 ? 0.6842 0.7252 0.7307 -0.0308 0.0038 0.0116 258 LYS A C 2067 O O . LYS A 263 ? 0.9172 0.9549 0.9599 -0.0310 0.0031 0.0126 258 LYS A O 2068 C CB . LYS A 263 ? 0.6673 0.7086 0.7200 -0.0283 0.0030 0.0113 258 LYS A CB 2069 C CG . LYS A 263 ? 0.6063 0.6442 0.6582 -0.0269 0.0018 0.0122 258 LYS A CG 2070 C CD . LYS A 263 ? 0.5423 0.5783 0.5917 -0.0266 0.0016 0.0121 258 LYS A CD 2071 C CE . LYS A 263 ? 0.5076 0.5422 0.5582 -0.0249 0.0009 0.0122 258 LYS A CE 2072 N NZ . LYS A 263 ? 0.5378 0.5705 0.5855 -0.0245 0.0003 0.0121 258 LYS A NZ 2073 N N . LYS A 264 ? 0.5928 0.6380 0.6417 -0.0305 0.0050 0.0099 259 LYS A N 2074 C CA . LYS A 264 ? 0.6880 0.7343 0.7346 -0.0307 0.0056 0.0091 259 LYS A CA 2075 C C . LYS A 264 ? 0.6460 0.6897 0.6912 -0.0291 0.0050 0.0086 259 LYS A C 2076 O O . LYS A 264 ? 0.7762 0.8216 0.8198 -0.0291 0.0055 0.0077 259 LYS A O 2077 C CB . LYS A 264 ? 0.7564 0.8018 0.7983 -0.0333 0.0058 0.0108 259 LYS A CB 2078 C CG . LYS A 264 ? 0.8726 0.9222 0.9130 -0.0345 0.0072 0.0100 259 LYS A CG 2079 C CD . LYS A 264 ? 0.9805 1.0322 1.0191 -0.0377 0.0081 0.0114 259 LYS A CD 2080 C CE . LYS A 264 ? 1.0595 1.1157 1.1028 -0.0380 0.0088 0.0102 259 LYS A CE 2081 N NZ . LYS A 264 ? 1.0689 1.1271 1.1106 -0.0415 0.0096 0.0117 259 LYS A NZ 2082 N N . GLY A 265 ? 0.6176 0.6578 0.6629 -0.0279 0.0038 0.0093 260 GLY A N 2083 C CA . GLY A 265 ? 0.5576 0.5956 0.6009 -0.0268 0.0031 0.0089 260 GLY A CA 2084 C C . GLY A 265 ? 0.5801 0.6150 0.6236 -0.0256 0.0019 0.0096 260 GLY A C 2085 O O . GLY A 265 ? 0.4486 0.4821 0.4921 -0.0259 0.0013 0.0109 260 GLY A O 2086 N N . ASP A 266 ? 0.6211 0.6555 0.6651 -0.0243 0.0015 0.0087 261 ASP A N 2087 C CA . ASP A 266 ? 0.6319 0.6646 0.6767 -0.0232 0.0005 0.0090 261 ASP A CA 2088 C C . ASP A 266 ? 0.5545 0.5851 0.5956 -0.0226 -0.0005 0.0089 261 ASP A C 2089 O O . ASP A 266 ? 0.5696 0.6003 0.6085 -0.0224 -0.0004 0.0081 261 ASP A O 2090 C CB . ASP A 266 ? 0.7099 0.7440 0.7590 -0.0224 0.0009 0.0079 261 ASP A CB 2091 C CG . ASP A 266 ? 0.8697 0.9050 0.9225 -0.0225 0.0013 0.0082 261 ASP A CG 2092 O OD1 . ASP A 266 ? 0.7000 0.7344 0.7532 -0.0225 0.0009 0.0096 261 ASP A OD1 2093 O OD2 . ASP A 266 ? 0.9101 0.9472 0.9653 -0.0223 0.0019 0.0068 261 ASP A OD2 2094 N N . SER A 267 ? 0.4746 0.5039 0.5152 -0.0219 -0.0015 0.0095 262 SER A N 2095 C CA . SER A 267 ? 0.4408 0.4686 0.4784 -0.0209 -0.0028 0.0090 262 SER A CA 2096 C C . SER A 267 ? 0.4095 0.4383 0.4492 -0.0199 -0.0033 0.0089 262 SER A C 2097 O O . SER A 267 ? 0.4217 0.4523 0.4652 -0.0201 -0.0024 0.0088 262 SER A O 2098 C CB . SER A 267 ? 0.4577 0.4824 0.4909 -0.0213 -0.0040 0.0102 262 SER A CB 2099 O OG . SER A 267 ? 0.5417 0.5646 0.5714 -0.0202 -0.0054 0.0095 262 SER A OG 2100 N N . THR A 268 ? 0.3721 0.3996 0.4092 -0.0189 -0.0048 0.0088 263 THR A N 2101 C CA . THR A 268 ? 0.3527 0.3820 0.3915 -0.0181 -0.0052 0.0088 263 THR A CA 2102 C C . THR A 268 ? 0.3348 0.3625 0.3704 -0.0170 -0.0071 0.0088 263 THR A C 2103 O O . THR A 268 ? 0.3009 0.3255 0.3332 -0.0171 -0.0081 0.0091 263 THR A O 2104 C CB . THR A 268 ? 0.3780 0.4100 0.4189 -0.0175 -0.0050 0.0073 263 THR A CB 2105 O OG1 . THR A 268 ? 0.3561 0.3906 0.3993 -0.0174 -0.0049 0.0077 263 THR A OG1 2106 C CG2 . THR A 268 ? 0.4088 0.4401 0.4464 -0.0161 -0.0064 0.0057 263 THR A CG2 2107 N N . ILE A 269 ? 0.3289 0.3589 0.3657 -0.0161 -0.0076 0.0084 264 ILE A N 2108 C CA . ILE A 269 ? 0.3523 0.3814 0.3863 -0.0146 -0.0097 0.0079 264 ILE A CA 2109 C C . ILE A 269 ? 0.3628 0.3927 0.3951 -0.0128 -0.0110 0.0058 264 ILE A C 2110 O O . ILE A 269 ? 0.4028 0.4364 0.4375 -0.0126 -0.0103 0.0049 264 ILE A O 2111 C CB . ILE A 269 ? 0.3608 0.3929 0.3969 -0.0142 -0.0096 0.0083 264 ILE A CB 2112 C CG1 . ILE A 269 ? 0.3594 0.3913 0.3976 -0.0157 -0.0083 0.0102 264 ILE A CG1 2113 C CG2 . ILE A 269 ? 0.3748 0.4061 0.4081 -0.0124 -0.0120 0.0074 264 ILE A CG2 2114 C CD1 . ILE A 269 ? 0.3636 0.3917 0.3998 -0.0164 -0.0089 0.0110 264 ILE A CD1 2115 N N . MET A 270 ? 0.3584 0.3847 0.3866 -0.0116 -0.0132 0.0052 265 MET A N 2116 C CA . MET A 270 ? 0.3582 0.3850 0.3844 -0.0095 -0.0149 0.0030 265 MET A CA 2117 C C . MET A 270 ? 0.3797 0.4079 0.4052 -0.0075 -0.0170 0.0017 265 MET A C 2118 O O . MET A 270 ? 0.4382 0.4635 0.4620 -0.0072 -0.0184 0.0024 265 MET A O 2119 C CB . MET A 270 ? 0.3550 0.3768 0.3768 -0.0092 -0.0164 0.0029 265 MET A CB 2120 C CG . MET A 270 ? 0.3423 0.3638 0.3614 -0.0065 -0.0189 0.0005 265 MET A CG 2121 S SD . MET A 270 ? 0.4002 0.4166 0.4143 -0.0061 -0.0203 0.0006 265 MET A SD 2122 C CE . MET A 270 ? 0.3680 0.3877 0.3853 -0.0080 -0.0170 0.0008 265 MET A CE 2123 N N . LYS A 271 ? 0.3926 0.4254 0.4192 -0.0059 -0.0174 -0.0004 266 LYS A N 2124 C CA . LYS A 271 ? 0.4241 0.4593 0.4499 -0.0034 -0.0196 -0.0024 266 LYS A CA 2125 C C . LYS A 271 ? 0.4432 0.4758 0.4652 -0.0008 -0.0226 -0.0047 266 LYS A C 2126 O O . LYS A 271 ? 0.4125 0.4469 0.4348 -0.0003 -0.0223 -0.0061 266 LYS A O 2127 C CB . LYS A 271 ? 0.4416 0.4846 0.4712 -0.0034 -0.0181 -0.0034 266 LYS A CB 2128 C CG . LYS A 271 ? 0.4672 0.5129 0.5003 -0.0059 -0.0154 -0.0009 266 LYS A CG 2129 C CD . LYS A 271 ? 0.5510 0.5945 0.5833 -0.0059 -0.0160 0.0004 266 LYS A CD 2130 C CE . LYS A 271 ? 0.6263 0.6752 0.6614 -0.0065 -0.0147 0.0013 266 LYS A CE 2131 N NZ . LYS A 271 ? 0.6380 0.6868 0.6717 -0.0048 -0.0166 0.0009 266 LYS A NZ 2132 N N . SER A 272 ? 0.4548 0.4826 0.4734 0.0007 -0.0255 -0.0050 267 SER A N 2133 C CA . SER A 272 ? 0.4535 0.4776 0.4679 0.0034 -0.0289 -0.0070 267 SER A CA 2134 C C . SER A 272 ? 0.4997 0.5212 0.5119 0.0056 -0.0323 -0.0082 267 SER A C 2135 O O . SER A 272 ? 0.5399 0.5594 0.5525 0.0044 -0.0321 -0.0065 267 SER A O 2136 C CB . SER A 272 ? 0.4804 0.4974 0.4913 0.0020 -0.0293 -0.0051 267 SER A CB 2137 O OG . SER A 272 ? 0.5026 0.5160 0.5093 0.0047 -0.0326 -0.0069 267 SER A OG 2138 N N . GLU A 273 ? 0.5175 0.5386 0.5273 0.0091 -0.0357 -0.0112 268 GLU A N 2139 C CA . GLU A 273 ? 0.6151 0.6328 0.6224 0.0117 -0.0397 -0.0128 268 GLU A CA 2140 C C . GLU A 273 ? 0.6501 0.6576 0.6523 0.0119 -0.0428 -0.0115 268 GLU A C 2141 O O . GLU A 273 ? 0.7987 0.8013 0.7986 0.0134 -0.0462 -0.0121 268 GLU A O 2142 C CB . GLU A 273 ? 0.6225 0.6463 0.6304 0.0157 -0.0419 -0.0172 268 GLU A CB 2143 C CG . GLU A 273 ? 0.6054 0.6400 0.6184 0.0151 -0.0386 -0.0182 268 GLU A CG 2144 C CD . GLU A 273 ? 0.6393 0.6768 0.6552 0.0129 -0.0363 -0.0161 268 GLU A CD 2145 O OE1 . GLU A 273 ? 0.6230 0.6593 0.6381 0.0145 -0.0386 -0.0170 268 GLU A OE1 2146 O OE2 . GLU A 273 ? 0.6389 0.6797 0.6579 0.0098 -0.0324 -0.0138 268 GLU A OE2 2147 N N . MET A 274 ? 0.6533 0.6574 0.6535 0.0103 -0.0417 -0.0097 269 MET A N 2148 C CA . MET A 274 ? 0.6530 0.6476 0.6477 0.0102 -0.0445 -0.0083 269 MET A CA 2149 C C . MET A 274 ? 0.6972 0.6856 0.6908 0.0071 -0.0443 -0.0048 269 MET A C 2150 O O . MET A 274 ? 0.6300 0.6216 0.6271 0.0047 -0.0414 -0.0033 269 MET A O 2151 C CB . MET A 274 ? 0.6761 0.6702 0.6693 0.0093 -0.0431 -0.0074 269 MET A CB 2152 C CG . MET A 274 ? 0.7744 0.7735 0.7681 0.0127 -0.0442 -0.0112 269 MET A CG 2153 S SD . MET A 274 ? 0.8866 0.8821 0.8763 0.0127 -0.0444 -0.0106 269 MET A SD 2154 C CE . MET A 274 ? 0.7321 0.7285 0.7241 0.0075 -0.0392 -0.0065 269 MET A CE 2155 N N . GLU A 275 ? 0.7988 0.7782 0.7873 0.0072 -0.0477 -0.0036 270 GLU A N 2156 C CA . GLU A 275 ? 0.8007 0.7739 0.7877 0.0038 -0.0477 -0.0002 270 GLU A CA 2157 C C . GLU A 275 ? 0.6530 0.6219 0.6367 0.0008 -0.0462 0.0030 270 GLU A C 2158 O O . GLU A 275 ? 0.5848 0.5540 0.5663 0.0018 -0.0462 0.0025 270 GLU A O 2159 C CB . GLU A 275 ? 0.9355 0.9011 0.9191 0.0057 -0.0529 -0.0010 270 GLU A CB 2160 C CG . GLU A 275 ? 1.0888 1.0524 1.0742 0.0035 -0.0529 0.0004 270 GLU A CG 2161 C CD . GLU A 275 ? 1.2481 1.2169 1.2371 0.0064 -0.0541 -0.0028 270 GLU A CD 2162 O OE1 . GLU A 275 ? 1.3676 1.3383 1.3560 0.0107 -0.0570 -0.0065 270 GLU A OE1 2163 O OE2 . GLU A 275 ? 1.1863 1.1575 1.1786 0.0046 -0.0523 -0.0019 270 GLU A OE2 2164 N N . TYR A 276 ? 0.5875 0.5528 0.5707 -0.0029 -0.0451 0.0063 271 TYR A N 2165 C CA . TYR A 276 ? 0.5529 0.5148 0.5330 -0.0062 -0.0435 0.0096 271 TYR A CA 2166 C C . TYR A 276 ? 0.5654 0.5202 0.5391 -0.0047 -0.0472 0.0099 271 TYR A C 2167 O O . TYR A 276 ? 0.6235 0.5726 0.5943 -0.0022 -0.0517 0.0087 271 TYR A O 2168 C CB . TYR A 276 ? 0.5270 0.4853 0.5071 -0.0101 -0.0429 0.0126 271 TYR A CB 2169 C CG . TYR A 276 ? 0.5711 0.5279 0.5490 -0.0142 -0.0404 0.0161 271 TYR A CG 2170 C CD1 . TYR A 276 ? 0.5555 0.5186 0.5355 -0.0151 -0.0365 0.0162 271 TYR A CD1 2171 C CD2 . TYR A 276 ? 0.5793 0.5289 0.5533 -0.0172 -0.0421 0.0192 271 TYR A CD2 2172 C CE1 . TYR A 276 ? 0.5314 0.4940 0.5095 -0.0187 -0.0342 0.0191 271 TYR A CE1 2173 C CE2 . TYR A 276 ? 0.5525 0.5017 0.5244 -0.0212 -0.0396 0.0224 271 TYR A CE2 2174 C CZ . TYR A 276 ? 0.5231 0.4790 0.4970 -0.0217 -0.0357 0.0222 271 TYR A CZ 2175 O OH . TYR A 276 ? 0.5638 0.5200 0.5358 -0.0254 -0.0334 0.0250 271 TYR A OH 2176 N N . GLY A 277 ? 0.5381 0.4933 0.5095 -0.0058 -0.0455 0.0112 272 GLY A N 2177 C CA . GLY A 277 ? 0.5311 0.4798 0.4960 -0.0042 -0.0489 0.0116 272 GLY A CA 2178 C C . GLY A 277 ? 0.5680 0.5114 0.5281 -0.0081 -0.0483 0.0159 272 GLY A C 2179 O O . GLY A 277 ? 0.6975 0.6367 0.6521 -0.0073 -0.0502 0.0167 272 GLY A O 2180 N N . HIS A 278 ? 0.5675 0.5111 0.5292 -0.0124 -0.0458 0.0187 273 HIS A N 2181 C CA . HIS A 278 ? 0.6754 0.6137 0.6322 -0.0166 -0.0456 0.0230 273 HIS A CA 2182 C C . HIS A 278 ? 0.6755 0.6159 0.6292 -0.0168 -0.0438 0.0238 273 HIS A C 2183 O O . HIS A 278 ? 0.7021 0.6362 0.6493 -0.0177 -0.0460 0.0263 273 HIS A O 2184 C CB . HIS A 278 ? 0.6467 0.5737 0.5976 -0.0165 -0.0510 0.0246 273 HIS A CB 2185 C CG . HIS A 278 ? 0.7111 0.6359 0.6649 -0.0156 -0.0533 0.0233 273 HIS A CG 2186 N ND1 . HIS A 278 ? 0.6850 0.6093 0.6411 -0.0196 -0.0518 0.0254 273 HIS A ND1 2187 C CD2 . HIS A 278 ? 0.6986 0.6224 0.6537 -0.0111 -0.0567 0.0196 273 HIS A CD2 2188 C CE1 . HIS A 278 ? 0.6508 0.5736 0.6094 -0.0176 -0.0544 0.0231 273 HIS A CE1 2189 N NE2 . HIS A 278 ? 0.6638 0.5863 0.6217 -0.0124 -0.0574 0.0196 273 HIS A NE2 2190 N N . CYS A 279 ? 0.7063 0.6557 0.6650 -0.0161 -0.0400 0.0218 274 CYS A N 2191 C CA . CYS A 279 ? 0.6621 0.6154 0.6193 -0.0158 -0.0380 0.0216 274 CYS A CA 2192 C C . CYS A 279 ? 0.5917 0.5534 0.5544 -0.0184 -0.0328 0.0217 274 CYS A C 2193 O O . CYS A 279 ? 0.5443 0.5090 0.5119 -0.0199 -0.0309 0.0217 274 CYS A O 2194 C CB . CYS A 279 ? 0.6836 0.6395 0.6419 -0.0108 -0.0396 0.0175 274 CYS A CB 2195 S SG . CYS A 279 ? 0.7101 0.6721 0.6764 -0.0083 -0.0389 0.0136 274 CYS A SG 2196 N N . ASN A 280 ? 0.5594 0.5250 0.5211 -0.0188 -0.0306 0.0218 275 ASN A N 2197 C CA . ASN A 280 ? 0.5496 0.5234 0.5164 -0.0206 -0.0261 0.0213 275 ASN A CA 2198 C C . ASN A 280 ? 0.5176 0.4969 0.4865 -0.0175 -0.0251 0.0180 275 ASN A C 2199 O O . ASN A 280 ? 0.4884 0.4651 0.4531 -0.0150 -0.0275 0.0172 275 ASN A O 2200 C CB . ASN A 280 ? 0.5605 0.5346 0.5246 -0.0248 -0.0240 0.0246 275 ASN A CB 2201 C CG . ASN A 280 ? 0.6299 0.6126 0.5995 -0.0265 -0.0196 0.0238 275 ASN A CG 2202 O OD1 . ASN A 280 ? 0.6867 0.6731 0.6624 -0.0265 -0.0179 0.0224 275 ASN A OD1 2203 N ND2 . ASN A 280 ? 0.6273 0.6133 0.5947 -0.0276 -0.0178 0.0244 275 ASN A ND2 2204 N N . THR A 281 ? 0.4978 0.4843 0.4732 -0.0177 -0.0219 0.0162 276 THR A N 2205 C CA . THR A 281 ? 0.4743 0.4663 0.4525 -0.0152 -0.0208 0.0130 276 THR A CA 2206 C C . THR A 281 ? 0.4709 0.4700 0.4551 -0.0167 -0.0170 0.0121 276 THR A C 2207 O O . THR A 281 ? 0.4912 0.4916 0.4783 -0.0192 -0.0151 0.0135 276 THR A O 2208 C CB . THR A 281 ? 0.4860 0.4784 0.4667 -0.0118 -0.0227 0.0100 276 THR A CB 2209 O OG1 . THR A 281 ? 0.5121 0.5092 0.4948 -0.0096 -0.0221 0.0071 276 THR A OG1 2210 C CG2 . THR A 281 ? 0.5040 0.4991 0.4908 -0.0123 -0.0214 0.0094 276 THR A CG2 2211 N N . LYS A 282 ? 0.4774 0.4810 0.4634 -0.0151 -0.0160 0.0097 277 LYS A N 2212 C CA . LYS A 282 ? 0.5253 0.5355 0.5176 -0.0158 -0.0129 0.0081 277 LYS A CA 2213 C C . LYS A 282 ? 0.4820 0.4950 0.4801 -0.0140 -0.0128 0.0055 277 LYS A C 2214 O O . LYS A 282 ? 0.4208 0.4380 0.4244 -0.0147 -0.0106 0.0045 277 LYS A O 2215 C CB . LYS A 282 ? 0.6259 0.6398 0.6174 -0.0151 -0.0119 0.0065 277 LYS A CB 2216 C CG . LYS A 282 ? 0.7952 0.8076 0.7804 -0.0166 -0.0119 0.0088 277 LYS A CG 2217 C CD . LYS A 282 ? 0.9395 0.9574 0.9254 -0.0159 -0.0105 0.0067 277 LYS A CD 2218 C CE . LYS A 282 ? 1.0552 1.0720 1.0339 -0.0166 -0.0109 0.0086 277 LYS A CE 2219 N NZ . LYS A 282 ? 1.0894 1.1087 1.0676 -0.0201 -0.0086 0.0109 277 LYS A NZ 2220 N N . CYS A 283 ? 0.4384 0.4491 0.4350 -0.0115 -0.0153 0.0042 278 CYS A N 2221 C CA . CYS A 283 ? 0.4353 0.4493 0.4368 -0.0097 -0.0154 0.0016 278 CYS A CA 2222 C C . CYS A 283 ? 0.4244 0.4355 0.4248 -0.0081 -0.0179 0.0013 278 CYS A C 2223 O O . CYS A 283 ? 0.4375 0.4454 0.4335 -0.0061 -0.0206 0.0007 278 CYS A O 2224 C CB . CYS A 283 ? 0.4400 0.4570 0.4419 -0.0077 -0.0157 -0.0012 278 CYS A CB 2225 S SG . CYS A 283 ? 0.4523 0.4738 0.4601 -0.0059 -0.0158 -0.0045 278 CYS A SG 2226 N N . GLN A 284 ? 0.3873 0.3993 0.3914 -0.0090 -0.0171 0.0018 279 GLN A N 2227 C CA . GLN A 284 ? 0.3656 0.3755 0.3688 -0.0075 -0.0194 0.0015 279 GLN A CA 2228 C C . GLN A 284 ? 0.3711 0.3861 0.3790 -0.0059 -0.0191 -0.0011 279 GLN A C 2229 O O . GLN A 284 ? 0.3832 0.4026 0.3962 -0.0071 -0.0167 -0.0013 279 GLN A O 2230 C CB . GLN A 284 ? 0.3504 0.3582 0.3543 -0.0094 -0.0189 0.0038 279 GLN A CB 2231 C CG . GLN A 284 ? 0.3767 0.3816 0.3790 -0.0078 -0.0217 0.0035 279 GLN A CG 2232 C CD . GLN A 284 ? 0.4144 0.4131 0.4103 -0.0063 -0.0252 0.0037 279 GLN A CD 2233 O OE1 . GLN A 284 ? 0.5299 0.5241 0.5218 -0.0080 -0.0255 0.0062 279 GLN A OE1 2234 N NE2 . GLN A 284 ? 0.4053 0.4039 0.4000 -0.0030 -0.0279 0.0012 279 GLN A NE2 2235 N N . THR A 285 ? 0.3644 0.3789 0.3705 -0.0032 -0.0218 -0.0030 280 THR A N 2236 C CA . THR A 285 ? 0.3776 0.3974 0.3879 -0.0018 -0.0218 -0.0054 280 THR A CA 2237 C C . THR A 285 ? 0.3978 0.4158 0.4069 -0.0005 -0.0239 -0.0054 280 THR A C 2238 O O . THR A 285 ? 0.4525 0.4646 0.4571 -0.0001 -0.0262 -0.0042 280 THR A O 2239 C CB . THR A 285 ? 0.3851 0.4080 0.3954 0.0005 -0.0229 -0.0086 280 THR A CB 2240 O OG1 . THR A 285 ? 0.4097 0.4300 0.4159 0.0035 -0.0265 -0.0102 280 THR A OG1 2241 C CG2 . THR A 285 ? 0.4067 0.4287 0.4153 0.0001 -0.0223 -0.0086 280 THR A CG2 2242 N N . PRO A 286 ? 0.3611 0.3842 0.3741 0.0000 -0.0235 -0.0069 281 PRO A N 2243 C CA . PRO A 286 ? 0.3870 0.4090 0.3990 0.0013 -0.0255 -0.0071 281 PRO A CA 2244 C C . PRO A 286 ? 0.3871 0.4065 0.3949 0.0048 -0.0295 -0.0094 281 PRO A C 2245 O O . PRO A 286 ? 0.4321 0.4496 0.4385 0.0062 -0.0318 -0.0098 281 PRO A O 2246 C CB . PRO A 286 ? 0.3720 0.4013 0.3892 0.0010 -0.0237 -0.0082 281 PRO A CB 2247 C CG . PRO A 286 ? 0.3682 0.4009 0.3894 -0.0014 -0.0204 -0.0074 281 PRO A CG 2248 C CD . PRO A 286 ? 0.3762 0.4062 0.3947 -0.0008 -0.0210 -0.0080 281 PRO A CD 2249 N N . ILE A 287 ? 0.3762 0.3959 0.3823 0.0065 -0.0306 -0.0113 282 ILE A N 2250 C CA . ILE A 287 ? 0.3724 0.3893 0.3741 0.0102 -0.0348 -0.0137 282 ILE A CA 2251 C C . ILE A 287 ? 0.4188 0.4277 0.4145 0.0103 -0.0367 -0.0121 282 ILE A C 2252 O O . ILE A 287 ? 0.4724 0.4776 0.4637 0.0134 -0.0405 -0.0137 282 ILE A O 2253 C CB . ILE A 287 ? 0.3752 0.3988 0.3790 0.0128 -0.0354 -0.0178 282 ILE A CB 2254 C CG1 . ILE A 287 ? 0.3912 0.4173 0.3964 0.0117 -0.0332 -0.0181 282 ILE A CG1 2255 C CG2 . ILE A 287 ? 0.3769 0.4083 0.3859 0.0128 -0.0340 -0.0195 282 ILE A CG2 2256 C CD1 . ILE A 287 ? 0.3835 0.4156 0.3902 0.0145 -0.0344 -0.0224 282 ILE A CD1 2257 N N . GLY A 288 ? 0.4117 0.4183 0.4071 0.0071 -0.0342 -0.0089 283 GLY A N 2258 C CA . GLY A 288 ? 0.4091 0.4090 0.3987 0.0066 -0.0355 -0.0068 283 GLY A CA 2259 C C . GLY A 288 ? 0.3975 0.3988 0.3880 0.0038 -0.0321 -0.0050 283 GLY A C 2260 O O . GLY A 288 ? 0.4213 0.4288 0.4169 0.0029 -0.0292 -0.0061 283 GLY A O 2261 N N . ALA A 289 ? 0.4217 0.4173 0.4075 0.0022 -0.0325 -0.0022 284 ALA A N 2262 C CA . ALA A 289 ? 0.4078 0.4046 0.3936 -0.0003 -0.0296 -0.0004 284 ALA A CA 2263 C C . ALA A 289 ? 0.4311 0.4295 0.4150 0.0014 -0.0301 -0.0022 284 ALA A C 2264 O O . ALA A 289 ? 0.4841 0.4799 0.4641 0.0043 -0.0333 -0.0037 284 ALA A O 2265 C CB . ALA A 289 ? 0.4087 0.3994 0.3900 -0.0030 -0.0298 0.0034 284 ALA A CB 2266 N N . ILE A 290 ? 0.4732 0.4760 0.4599 -0.0001 -0.0270 -0.0023 285 ILE A N 2267 C CA . ILE A 290 ? 0.4950 0.5004 0.4808 0.0014 -0.0271 -0.0044 285 ILE A CA 2268 C C . ILE A 290 ? 0.5266 0.5296 0.5081 -0.0005 -0.0261 -0.0017 285 ILE A C 2269 O O . ILE A 290 ? 0.5002 0.5037 0.4831 -0.0036 -0.0236 0.0005 285 ILE A O 2270 C CB . ILE A 290 ? 0.5142 0.5271 0.5070 0.0010 -0.0242 -0.0069 285 ILE A CB 2271 C CG1 . ILE A 290 ? 0.4892 0.5056 0.4859 0.0030 -0.0252 -0.0098 285 ILE A CG1 2272 C CG2 . ILE A 290 ? 0.5565 0.5722 0.5486 0.0019 -0.0238 -0.0086 285 ILE A CG2 2273 C CD1 . ILE A 290 ? 0.4696 0.4927 0.4736 0.0019 -0.0223 -0.0115 285 ILE A CD1 2274 N N . ASN A 291 ? 0.5537 0.5543 0.5296 0.0013 -0.0283 -0.0021 286 ASN A N 2275 C CA . ASN A 291 ? 0.6155 0.6142 0.5865 -0.0004 -0.0275 0.0004 286 ASN A CA 2276 C C . ASN A 291 ? 0.6148 0.6173 0.5851 0.0016 -0.0276 -0.0021 286 ASN A C 2277 O O . ASN A 291 ? 0.5758 0.5756 0.5415 0.0046 -0.0308 -0.0033 286 ASN A O 2278 C CB . ASN A 291 ? 0.6797 0.6701 0.6427 -0.0007 -0.0305 0.0037 286 ASN A CB 2279 C CG . ASN A 291 ? 0.7269 0.7160 0.6842 -0.0023 -0.0300 0.0062 286 ASN A CG 2280 O OD1 . ASN A 291 ? 0.7910 0.7849 0.7507 -0.0046 -0.0266 0.0067 286 ASN A OD1 2281 N ND2 . ASN A 291 ? 0.8676 0.8504 0.8171 -0.0009 -0.0334 0.0076 286 ASN A ND2 2282 N N . SER A 292 ? 0.6190 0.6276 0.5939 0.0004 -0.0245 -0.0033 287 SER A N 2283 C CA . SER A 292 ? 0.5985 0.6119 0.5748 0.0026 -0.0244 -0.0067 287 SER A CA 2284 C C . SER A 292 ? 0.6053 0.6243 0.5850 0.0009 -0.0212 -0.0074 287 SER A C 2285 O O . SER A 292 ? 0.4927 0.5138 0.4769 -0.0015 -0.0186 -0.0064 287 SER A O 2286 C CB . SER A 292 ? 0.6046 0.6215 0.5866 0.0047 -0.0250 -0.0105 287 SER A CB 2287 O OG . SER A 292 ? 0.5655 0.5868 0.5488 0.0069 -0.0253 -0.0140 287 SER A OG 2288 N N . SER A 293 ? 0.6572 0.6788 0.6349 0.0028 -0.0217 -0.0094 288 SER A N 2289 C CA . SER A 293 ? 0.6635 0.6911 0.6446 0.0021 -0.0192 -0.0111 288 SER A CA 2290 C C . SER A 293 ? 0.6012 0.6337 0.5886 0.0041 -0.0192 -0.0157 288 SER A C 2291 O O . SER A 293 ? 0.5703 0.6079 0.5620 0.0038 -0.0174 -0.0178 288 SER A O 2292 C CB . SER A 293 ? 0.7629 0.7905 0.7373 0.0026 -0.0198 -0.0103 288 SER A CB 2293 O OG . SER A 293 ? 0.8749 0.8988 0.8444 0.0000 -0.0192 -0.0058 288 SER A OG 2294 N N . MET A 294 ? 0.5362 0.5676 0.5244 0.0061 -0.0213 -0.0174 289 MET A N 2295 C CA . MET A 294 ? 0.5507 0.5871 0.5450 0.0077 -0.0214 -0.0217 289 MET A CA 2296 C C . MET A 294 ? 0.5454 0.5855 0.5480 0.0055 -0.0187 -0.0224 289 MET A C 2297 O O . MET A 294 ? 0.5673 0.6054 0.5713 0.0032 -0.0174 -0.0198 289 MET A O 2298 C CB . MET A 294 ? 0.5812 0.6162 0.5746 0.0102 -0.0241 -0.0234 289 MET A CB 2299 C CG . MET A 294 ? 0.6607 0.6926 0.6465 0.0132 -0.0273 -0.0237 289 MET A CG 2300 S SD . MET A 294 ? 0.7756 0.8107 0.7586 0.0146 -0.0272 -0.0256 289 MET A SD 2301 C CE . MET A 294 ? 0.8459 0.8763 0.8196 0.0183 -0.0315 -0.0255 289 MET A CE 2302 N N . PRO A 295 ? 0.5263 0.5714 0.5343 0.0061 -0.0181 -0.0261 290 PRO A N 2303 C CA . PRO A 295 ? 0.4735 0.5216 0.4892 0.0040 -0.0159 -0.0268 290 PRO A CA 2304 C C . PRO A 295 ? 0.4705 0.5192 0.4911 0.0034 -0.0159 -0.0273 290 PRO A C 2305 O O . PRO A 295 ? 0.4828 0.5326 0.5088 0.0012 -0.0142 -0.0267 290 PRO A O 2306 C CB . PRO A 295 ? 0.4886 0.5414 0.5076 0.0052 -0.0158 -0.0308 290 PRO A CB 2307 C CG . PRO A 295 ? 0.5052 0.5584 0.5201 0.0082 -0.0183 -0.0330 290 PRO A CG 2308 C CD . PRO A 295 ? 0.5098 0.5578 0.5165 0.0088 -0.0195 -0.0296 290 PRO A CD 2309 N N . PHE A 296 ? 0.4374 0.4856 0.4559 0.0053 -0.0180 -0.0284 291 PHE A N 2310 C CA . PHE A 296 ? 0.4214 0.4711 0.4440 0.0049 -0.0181 -0.0290 291 PHE A CA 2311 C C . PHE A 296 ? 0.4087 0.4548 0.4265 0.0062 -0.0200 -0.0274 291 PHE A C 2312 O O . PHE A 296 ? 0.4118 0.4544 0.4230 0.0080 -0.0219 -0.0267 291 PHE A O 2313 C CB . PHE A 296 ? 0.4449 0.4998 0.4719 0.0061 -0.0188 -0.0333 291 PHE A CB 2314 C CG . PHE A 296 ? 0.4259 0.4841 0.4579 0.0051 -0.0174 -0.0353 291 PHE A CG 2315 C CD1 . PHE A 296 ? 0.4306 0.4897 0.4684 0.0023 -0.0154 -0.0343 291 PHE A CD1 2316 C CD2 . PHE A 296 ? 0.4129 0.4729 0.4432 0.0071 -0.0184 -0.0380 291 PHE A CD2 2317 C CE1 . PHE A 296 ? 0.4384 0.4998 0.4807 0.0015 -0.0144 -0.0363 291 PHE A CE1 2318 C CE2 . PHE A 296 ? 0.4253 0.4882 0.4602 0.0063 -0.0173 -0.0401 291 PHE A CE2 2319 C CZ . PHE A 296 ? 0.4074 0.4708 0.4484 0.0036 -0.0155 -0.0394 291 PHE A CZ 2320 N N . HIS A 297 ? 0.3950 0.4419 0.4159 0.0052 -0.0196 -0.0268 292 HIS A N 2321 C CA . HIS A 297 ? 0.4059 0.4503 0.4231 0.0067 -0.0217 -0.0261 292 HIS A CA 2322 C C . HIS A 297 ? 0.4018 0.4505 0.4239 0.0065 -0.0215 -0.0276 292 HIS A C 2323 O O . HIS A 297 ? 0.3732 0.4258 0.4014 0.0043 -0.0195 -0.0281 292 HIS A O 2324 C CB . HIS A 297 ? 0.4486 0.4872 0.4619 0.0055 -0.0216 -0.0220 292 HIS A CB 2325 C CG . HIS A 297 ? 0.4405 0.4797 0.4582 0.0027 -0.0193 -0.0199 292 HIS A CG 2326 N ND1 . HIS A 297 ? 0.4474 0.4870 0.4662 0.0027 -0.0199 -0.0195 292 HIS A ND1 2327 C CD2 . HIS A 297 ? 0.4646 0.5046 0.4860 0.0000 -0.0167 -0.0183 292 HIS A CD2 2328 C CE1 . HIS A 297 ? 0.4655 0.5056 0.4881 0.0001 -0.0176 -0.0175 292 HIS A CE1 2329 N NE2 . HIS A 297 ? 0.4739 0.5143 0.4983 -0.0015 -0.0157 -0.0168 292 HIS A NE2 2330 N N . ASN A 298 ? 0.4172 0.4655 0.4367 0.0088 -0.0239 -0.0286 293 ASN A N 2331 C CA . ASN A 298 ? 0.4428 0.4963 0.4668 0.0087 -0.0237 -0.0303 293 ASN A CA 2332 C C . ASN A 298 ? 0.4330 0.4840 0.4546 0.0094 -0.0250 -0.0288 293 ASN A C 2333 O O . ASN A 298 ? 0.3818 0.4371 0.4053 0.0105 -0.0259 -0.0308 293 ASN A O 2334 C CB . ASN A 298 ? 0.4116 0.4704 0.4368 0.0113 -0.0255 -0.0349 293 ASN A CB 2335 C CG . ASN A 298 ? 0.4514 0.5069 0.4702 0.0152 -0.0291 -0.0362 293 ASN A CG 2336 O OD1 . ASN A 298 ? 0.4590 0.5075 0.4720 0.0158 -0.0304 -0.0335 293 ASN A OD1 2337 N ND2 . ASN A 298 ? 0.4525 0.5127 0.4721 0.0180 -0.0311 -0.0403 293 ASN A ND2 2338 N N . ILE A 299 ? 0.4276 0.4722 0.4452 0.0086 -0.0250 -0.0253 294 ILE A N 2339 C CA . ILE A 299 ? 0.4401 0.4813 0.4547 0.0095 -0.0267 -0.0239 294 ILE A CA 2340 C C . ILE A 299 ? 0.4153 0.4597 0.4343 0.0076 -0.0250 -0.0229 294 ILE A C 2341 O O . ILE A 299 ? 0.4692 0.5161 0.4885 0.0093 -0.0265 -0.0245 294 ILE A O 2342 C CB . ILE A 299 ? 0.4940 0.5272 0.5028 0.0091 -0.0275 -0.0206 294 ILE A CB 2343 C CG1 . ILE A 299 ? 0.5301 0.5603 0.5334 0.0119 -0.0302 -0.0221 294 ILE A CG1 2344 C CG2 . ILE A 299 ? 0.5194 0.5485 0.5255 0.0096 -0.0292 -0.0189 294 ILE A CG2 2345 C CD1 . ILE A 299 ? 0.5341 0.5599 0.5338 0.0105 -0.0295 -0.0195 294 ILE A CD1 2346 N N . HIS A 300 ? 0.3991 0.4435 0.4214 0.0043 -0.0220 -0.0204 295 HIS A N 2347 C CA . HIS A 300 ? 0.3962 0.4428 0.4220 0.0024 -0.0204 -0.0188 295 HIS A CA 2348 C C . HIS A 300 ? 0.3876 0.4347 0.4173 -0.0008 -0.0173 -0.0168 295 HIS A C 2349 O O . HIS A 300 ? 0.3825 0.4261 0.4107 -0.0016 -0.0167 -0.0155 295 HIS A O 2350 C CB . HIS A 300 ? 0.4351 0.4763 0.4569 0.0029 -0.0217 -0.0165 295 HIS A CB 2351 C CG . HIS A 300 ? 0.4573 0.5011 0.4814 0.0023 -0.0213 -0.0159 295 HIS A CG 2352 N ND1 . HIS A 300 ? 0.4519 0.4969 0.4797 -0.0005 -0.0186 -0.0135 295 HIS A ND1 2353 C CD2 . HIS A 300 ? 0.4685 0.5142 0.4918 0.0045 -0.0233 -0.0175 295 HIS A CD2 2354 C CE1 . HIS A 300 ? 0.4690 0.5167 0.4980 -0.0002 -0.0188 -0.0135 295 HIS A CE1 2355 N NE2 . HIS A 300 ? 0.4378 0.4862 0.4642 0.0027 -0.0216 -0.0160 295 HIS A NE2 2356 N N . PRO A 301 ? 0.3741 0.4256 0.4089 -0.0027 -0.0154 -0.0164 296 PRO A N 2357 C CA . PRO A 301 ? 0.3542 0.4055 0.3928 -0.0057 -0.0128 -0.0143 296 PRO A CA 2358 C C . PRO A 301 ? 0.3615 0.4085 0.3991 -0.0073 -0.0118 -0.0109 296 PRO A C 2359 O O . PRO A 301 ? 0.3935 0.4391 0.4329 -0.0091 -0.0102 -0.0095 296 PRO A O 2360 C CB . PRO A 301 ? 0.3412 0.3984 0.3851 -0.0073 -0.0115 -0.0149 296 PRO A CB 2361 C CG . PRO A 301 ? 0.3298 0.3898 0.3721 -0.0055 -0.0130 -0.0160 296 PRO A CG 2362 C CD . PRO A 301 ? 0.3524 0.4101 0.3901 -0.0023 -0.0156 -0.0182 296 PRO A CD 2363 N N . LEU A 302 ? 0.3407 0.3861 0.3758 -0.0065 -0.0129 -0.0098 297 LEU A N 2364 C CA . LEU A 302 ? 0.3716 0.4137 0.4062 -0.0080 -0.0120 -0.0068 297 LEU A CA 2365 C C . LEU A 302 ? 0.3883 0.4246 0.4183 -0.0077 -0.0128 -0.0054 297 LEU A C 2366 O O . LEU A 302 ? 0.4164 0.4495 0.4434 -0.0073 -0.0140 -0.0041 297 LEU A O 2367 C CB . LEU A 302 ? 0.3623 0.4061 0.3972 -0.0075 -0.0125 -0.0062 297 LEU A CB 2368 C CG . LEU A 302 ? 0.3408 0.3910 0.3794 -0.0077 -0.0120 -0.0077 297 LEU A CG 2369 C CD1 . LEU A 302 ? 0.3479 0.4003 0.3864 -0.0072 -0.0125 -0.0072 297 LEU A CD1 2370 C CD2 . LEU A 302 ? 0.3465 0.3990 0.3899 -0.0104 -0.0096 -0.0067 297 LEU A CD2 2371 N N . THR A 303 ? 0.4009 0.4363 0.4308 -0.0083 -0.0120 -0.0056 298 THR A N 2372 C CA . THR A 303 ? 0.3857 0.4167 0.4115 -0.0084 -0.0124 -0.0043 298 THR A CA 2373 C C . THR A 303 ? 0.3762 0.4058 0.4032 -0.0108 -0.0105 -0.0018 298 THR A C 2374 O O . THR A 303 ? 0.3486 0.3806 0.3801 -0.0121 -0.0087 -0.0015 298 THR A O 2375 C CB . THR A 303 ? 0.4080 0.4397 0.4327 -0.0077 -0.0125 -0.0060 298 THR A CB 2376 O OG1 . THR A 303 ? 0.3744 0.4095 0.4041 -0.0090 -0.0105 -0.0069 298 THR A OG1 2377 C CG2 . THR A 303 ? 0.4263 0.4593 0.4494 -0.0052 -0.0146 -0.0087 298 THR A CG2 2378 N N . ILE A 304 ? 0.3705 0.3961 0.3934 -0.0112 -0.0111 -0.0001 299 ILE A N 2379 C CA . ILE A 304 ? 0.3809 0.4055 0.4045 -0.0133 -0.0095 0.0019 299 ILE A CA 2380 C C . ILE A 304 ? 0.3783 0.4007 0.3976 -0.0137 -0.0097 0.0024 299 ILE A C 2381 O O . ILE A 304 ? 0.3954 0.4142 0.4097 -0.0130 -0.0115 0.0030 299 ILE A O 2382 C CB . ILE A 304 ? 0.3539 0.3762 0.3767 -0.0141 -0.0099 0.0039 299 ILE A CB 2383 C CG1 . ILE A 304 ? 0.3624 0.3873 0.3889 -0.0137 -0.0098 0.0034 299 ILE A CG1 2384 C CG2 . ILE A 304 ? 0.3631 0.3852 0.3870 -0.0163 -0.0081 0.0056 299 ILE A CG2 2385 C CD1 . ILE A 304 ? 0.3936 0.4166 0.4193 -0.0140 -0.0105 0.0050 299 ILE A CD1 2386 N N . GLY A 305 ? 0.3833 0.4079 0.4046 -0.0147 -0.0078 0.0021 300 GLY A N 2387 C CA . GLY A 305 ? 0.4142 0.4383 0.4320 -0.0151 -0.0076 0.0024 300 GLY A CA 2388 C C . GLY A 305 ? 0.4205 0.4481 0.4405 -0.0143 -0.0068 0.0000 300 GLY A C 2389 O O . GLY A 305 ? 0.4202 0.4508 0.4455 -0.0141 -0.0060 -0.0014 300 GLY A O 2390 N N . GLU A 306 ? 0.4628 0.4902 0.4789 -0.0140 -0.0071 -0.0001 301 GLU A N 2391 C CA . GLU A 306 ? 0.5409 0.5717 0.5583 -0.0130 -0.0066 -0.0027 301 GLU A CA 2392 C C . GLU A 306 ? 0.4992 0.5291 0.5138 -0.0107 -0.0087 -0.0042 301 GLU A C 2393 O O . GLU A 306 ? 0.5622 0.5892 0.5709 -0.0102 -0.0101 -0.0032 301 GLU A O 2394 C CB . GLU A 306 ? 0.6077 0.6396 0.6222 -0.0139 -0.0057 -0.0021 301 GLU A CB 2395 C CG . GLU A 306 ? 0.7491 0.7821 0.7654 -0.0161 -0.0039 -0.0004 301 GLU A CG 2396 C CD . GLU A 306 ? 0.9717 1.0060 0.9838 -0.0172 -0.0031 0.0004 301 GLU A CD 2397 O OE1 . GLU A 306 ? 0.9656 1.0036 0.9782 -0.0161 -0.0026 -0.0018 301 GLU A OE1 2398 O OE2 . GLU A 306 ? 0.8270 0.8587 0.8354 -0.0191 -0.0030 0.0033 301 GLU A OE2 2399 N N . CYS A 307 ? 0.4510 0.4831 0.4696 -0.0095 -0.0090 -0.0066 302 CYS A N 2400 C CA . CYS A 307 ? 0.4641 0.4958 0.4806 -0.0073 -0.0110 -0.0083 302 CYS A CA 2401 C C . CYS A 307 ? 0.4467 0.4823 0.4658 -0.0059 -0.0110 -0.0117 302 CYS A C 2402 O O . CYS A 307 ? 0.4021 0.4407 0.4260 -0.0068 -0.0094 -0.0128 302 CYS A O 2403 C CB . CYS A 307 ? 0.5143 0.5458 0.5333 -0.0070 -0.0117 -0.0083 302 CYS A CB 2404 S SG . CYS A 307 ? 0.5087 0.5359 0.5251 -0.0083 -0.0120 -0.0048 302 CYS A SG 2405 N N . PRO A 308 ? 0.4622 0.4978 0.4784 -0.0036 -0.0130 -0.0136 303 PRO A N 2406 C CA . PRO A 308 ? 0.4535 0.4932 0.4731 -0.0023 -0.0132 -0.0172 303 PRO A CA 2407 C C . PRO A 308 ? 0.4366 0.4793 0.4630 -0.0031 -0.0123 -0.0184 303 PRO A C 2408 O O . PRO A 308 ? 0.4525 0.4941 0.4803 -0.0043 -0.0119 -0.0166 303 PRO A O 2409 C CB . PRO A 308 ? 0.4810 0.5197 0.4959 0.0004 -0.0158 -0.0187 303 PRO A CB 2410 C CG . PRO A 308 ? 0.4962 0.5294 0.5041 0.0004 -0.0170 -0.0155 303 PRO A CG 2411 C CD . PRO A 308 ? 0.5018 0.5333 0.5115 -0.0020 -0.0154 -0.0126 303 PRO A CD 2412 N N . LYS A 309 ? 0.3996 0.4462 0.4303 -0.0027 -0.0122 -0.0215 304 LYS A N 2413 C CA . LYS A 309 ? 0.3969 0.4464 0.4341 -0.0039 -0.0114 -0.0226 304 LYS A CA 2414 C C . LYS A 309 ? 0.4012 0.4521 0.4381 -0.0027 -0.0128 -0.0237 304 LYS A C 2415 O O . LYS A 309 ? 0.4319 0.4838 0.4662 -0.0004 -0.0145 -0.0260 304 LYS A O 2416 C CB . LYS A 309 ? 0.4033 0.4561 0.4452 -0.0041 -0.0109 -0.0255 304 LYS A CB 2417 C CG . LYS A 309 ? 0.4788 0.5310 0.5217 -0.0051 -0.0096 -0.0249 304 LYS A CG 2418 C CD . LYS A 309 ? 0.5740 0.6241 0.6187 -0.0073 -0.0081 -0.0217 304 LYS A CD 2419 C CE . LYS A 309 ? 0.6534 0.7035 0.7003 -0.0082 -0.0069 -0.0215 304 LYS A CE 2420 N NZ . LYS A 309 ? 0.7429 0.7921 0.7842 -0.0074 -0.0068 -0.0206 304 LYS A NZ 2421 N N . TYR A 310 ? 0.4104 0.4619 0.4500 -0.0041 -0.0122 -0.0223 305 TYR A N 2422 C CA . TYR A 310 ? 0.4165 0.4702 0.4560 -0.0030 -0.0134 -0.0235 305 TYR A CA 2423 C C . TYR A 310 ? 0.4198 0.4789 0.4642 -0.0031 -0.0134 -0.0268 305 TYR A C 2424 O O . TYR A 310 ? 0.4380 0.4990 0.4879 -0.0054 -0.0119 -0.0269 305 TYR A O 2425 C CB . TYR A 310 ? 0.3897 0.4429 0.4305 -0.0046 -0.0126 -0.0209 305 TYR A CB 2426 C CG . TYR A 310 ? 0.3883 0.4443 0.4289 -0.0034 -0.0138 -0.0221 305 TYR A CG 2427 C CD1 . TYR A 310 ? 0.4231 0.4774 0.4584 -0.0004 -0.0163 -0.0231 305 TYR A CD1 2428 C CD2 . TYR A 310 ? 0.3790 0.4392 0.4243 -0.0051 -0.0127 -0.0221 305 TYR A CD2 2429 C CE1 . TYR A 310 ? 0.4034 0.4609 0.4388 0.0010 -0.0176 -0.0246 305 TYR A CE1 2430 C CE2 . TYR A 310 ? 0.3867 0.4506 0.4320 -0.0040 -0.0137 -0.0233 305 TYR A CE2 2431 C CZ . TYR A 310 ? 0.4122 0.4750 0.4527 -0.0008 -0.0162 -0.0249 305 TYR A CZ 2432 O OH . TYR A 310 ? 0.4155 0.4828 0.4565 0.0004 -0.0173 -0.0266 305 TYR A OH 2433 N N . VAL A 311 ? 0.4335 0.4950 0.4762 -0.0006 -0.0153 -0.0296 306 VAL A N 2434 C CA . VAL A 311 ? 0.4300 0.4974 0.4774 -0.0006 -0.0155 -0.0332 306 VAL A CA 2435 C C . VAL A 311 ? 0.4429 0.5142 0.4897 0.0011 -0.0171 -0.0353 306 VAL A C 2436 O O . VAL A 311 ? 0.4207 0.4895 0.4625 0.0032 -0.0187 -0.0346 306 VAL A O 2437 C CB . VAL A 311 ? 0.4163 0.4845 0.4631 0.0010 -0.0164 -0.0362 306 VAL A CB 2438 C CG1 . VAL A 311 ? 0.4378 0.5034 0.4857 -0.0004 -0.0150 -0.0349 306 VAL A CG1 2439 C CG2 . VAL A 311 ? 0.3877 0.4537 0.4277 0.0046 -0.0189 -0.0373 306 VAL A CG2 2440 N N . LYS A 312 ? 0.4529 0.5305 0.5049 0.0002 -0.0167 -0.0380 307 LYS A N 2441 C CA . LYS A 312 ? 0.5308 0.6137 0.5829 0.0020 -0.0182 -0.0408 307 LYS A CA 2442 C C . LYS A 312 ? 0.5237 0.6089 0.5744 0.0051 -0.0203 -0.0451 307 LYS A C 2443 O O . LYS A 312 ? 0.6298 0.7201 0.6852 0.0043 -0.0200 -0.0480 307 LYS A O 2444 C CB . LYS A 312 ? 0.5481 0.6375 0.6069 -0.0011 -0.0164 -0.0411 307 LYS A CB 2445 C CG . LYS A 312 ? 0.6286 0.7251 0.6883 0.0005 -0.0177 -0.0446 307 LYS A CG 2446 C CD . LYS A 312 ? 0.7220 0.8246 0.7862 -0.0024 -0.0161 -0.0439 307 LYS A CD 2447 C CE . LYS A 312 ? 0.8119 0.9195 0.8741 0.0005 -0.0178 -0.0463 307 LYS A CE 2448 N NZ . LYS A 312 ? 0.8857 1.0030 0.9531 -0.0016 -0.0167 -0.0480 307 LYS A NZ 2449 N N . SER A 313 ? 0.5375 0.6185 0.5817 0.0086 -0.0226 -0.0454 308 SER A N 2450 C CA . SER A 313 ? 0.5518 0.6344 0.5936 0.0121 -0.0251 -0.0494 308 SER A CA 2451 C C . SER A 313 ? 0.5063 0.5853 0.5412 0.0159 -0.0280 -0.0495 308 SER A C 2452 O O . SER A 313 ? 0.5882 0.6614 0.6191 0.0157 -0.0281 -0.0460 308 SER A O 2453 C CB . SER A 313 ? 0.5860 0.6654 0.6260 0.0125 -0.0250 -0.0494 308 SER A CB 2454 O OG . SER A 313 ? 0.7397 0.8202 0.7852 0.0091 -0.0225 -0.0486 308 SER A OG 2455 N N . ASN A 314 ? 0.5401 0.6218 0.5733 0.0195 -0.0307 -0.0535 309 ASN A N 2456 C CA . ASN A 314 ? 0.6018 0.6791 0.6277 0.0237 -0.0342 -0.0539 309 ASN A CA 2457 C C . ASN A 314 ? 0.5646 0.6362 0.5846 0.0256 -0.0357 -0.0533 309 ASN A C 2458 O O . ASN A 314 ? 0.5974 0.6630 0.6104 0.0283 -0.0384 -0.0521 309 ASN A O 2459 C CB . ASN A 314 ? 0.6743 0.7584 0.7016 0.0269 -0.0366 -0.0590 309 ASN A CB 2460 C CG . ASN A 314 ? 0.7740 0.8655 0.8077 0.0247 -0.0348 -0.0600 309 ASN A CG 2461 O OD1 . ASN A 314 ? 0.9415 1.0414 0.9806 0.0243 -0.0344 -0.0637 309 ASN A OD1 2462 N ND2 . ASN A 314 ? 0.7842 0.8733 0.8176 0.0229 -0.0337 -0.0566 309 ASN A ND2 2463 N N . LYS A 315 ? 0.5817 0.6549 0.6043 0.0241 -0.0340 -0.0538 310 LYS A N 2464 C CA . LYS A 315 ? 0.6383 0.7100 0.6567 0.0269 -0.0359 -0.0556 310 LYS A CA 2465 C C . LYS A 315 ? 0.5470 0.6208 0.5695 0.0244 -0.0334 -0.0557 310 LYS A C 2466 O O . LYS A 315 ? 0.4723 0.5522 0.5020 0.0225 -0.0318 -0.0581 310 LYS A O 2467 C CB . LYS A 315 ? 0.7639 0.8419 0.7839 0.0302 -0.0383 -0.0610 310 LYS A CB 2468 C CG . LYS A 315 ? 0.8869 0.9622 0.8998 0.0350 -0.0421 -0.0630 310 LYS A CG 2469 C CD . LYS A 315 ? 0.9889 1.0721 1.0052 0.0379 -0.0441 -0.0690 310 LYS A CD 2470 C CE . LYS A 315 ? 1.0713 1.1625 1.0962 0.0351 -0.0415 -0.0719 310 LYS A CE 2471 N NZ . LYS A 315 ? 1.1170 1.2161 1.1450 0.0379 -0.0435 -0.0779 310 LYS A NZ 2472 N N . LEU A 316 ? 0.5004 0.5692 0.5185 0.0241 -0.0329 -0.0532 311 LEU A N 2473 C CA . LEU A 316 ? 0.5327 0.6037 0.5540 0.0227 -0.0311 -0.0541 311 LEU A CA 2474 C C . LEU A 316 ? 0.5669 0.6357 0.5817 0.0257 -0.0331 -0.0549 311 LEU A C 2475 O O . LEU A 316 ? 0.5474 0.6112 0.5568 0.0253 -0.0327 -0.0514 311 LEU A O 2476 C CB . LEU A 316 ? 0.5123 0.5809 0.5361 0.0187 -0.0280 -0.0503 311 LEU A CB 2477 C CG . LEU A 316 ? 0.4810 0.5520 0.5120 0.0152 -0.0256 -0.0494 311 LEU A CG 2478 C CD1 . LEU A 316 ? 0.4880 0.5554 0.5195 0.0122 -0.0232 -0.0454 311 LEU A CD1 2479 C CD2 . LEU A 316 ? 0.4512 0.5288 0.4900 0.0141 -0.0249 -0.0532 311 LEU A CD2 2480 N N . VAL A 317 ? 0.5544 0.6273 0.5694 0.0288 -0.0352 -0.0594 312 VAL A N 2481 C CA . VAL A 317 ? 0.5910 0.6616 0.5987 0.0323 -0.0378 -0.0602 312 VAL A CA 2482 C C . VAL A 317 ? 0.5500 0.6246 0.5598 0.0327 -0.0371 -0.0629 312 VAL A C 2483 O O . VAL A 317 ? 0.5030 0.5839 0.5190 0.0330 -0.0372 -0.0674 312 VAL A O 2484 C CB . VAL A 317 ? 0.6296 0.7014 0.6343 0.0366 -0.0415 -0.0635 312 VAL A CB 2485 C CG1 . VAL A 317 ? 0.6178 0.6858 0.6137 0.0403 -0.0443 -0.0634 312 VAL A CG1 2486 C CG2 . VAL A 317 ? 0.6062 0.6748 0.6094 0.0367 -0.0424 -0.0615 312 VAL A CG2 2487 N N . LEU A 318 ? 0.5134 0.5845 0.5183 0.0323 -0.0365 -0.0602 313 LEU A N 2488 C CA . LEU A 318 ? 0.5405 0.6151 0.5461 0.0332 -0.0362 -0.0628 313 LEU A CA 2489 C C . LEU A 318 ? 0.5727 0.6470 0.5712 0.0377 -0.0395 -0.0648 313 LEU A C 2490 O O . LEU A 318 ? 0.4892 0.5577 0.4792 0.0392 -0.0412 -0.0617 313 LEU A O 2491 C CB . LEU A 318 ? 0.5365 0.6085 0.5401 0.0308 -0.0338 -0.0591 313 LEU A CB 2492 C CG . LEU A 318 ? 0.4984 0.5712 0.5092 0.0266 -0.0305 -0.0576 313 LEU A CG 2493 C CD1 . LEU A 318 ? 0.5082 0.5781 0.5154 0.0248 -0.0287 -0.0538 313 LEU A CD1 2494 C CD2 . LEU A 318 ? 0.4822 0.5612 0.5019 0.0259 -0.0296 -0.0621 313 LEU A CD2 2495 N N . ALA A 319 ? 0.5955 0.6758 0.5975 0.0398 -0.0405 -0.0700 314 ALA A N 2496 C CA . ALA A 319 ? 0.6086 0.6891 0.6037 0.0440 -0.0433 -0.0720 314 ALA A CA 2497 C C . ALA A 319 ? 0.5888 0.6667 0.5779 0.0435 -0.0423 -0.0689 314 ALA A C 2498 O O . ALA A 319 ? 0.5387 0.6186 0.5319 0.0408 -0.0395 -0.0684 314 ALA A O 2499 C CB . ALA A 319 ? 0.6262 0.7143 0.6270 0.0460 -0.0443 -0.0785 314 ALA A CB 2500 N N . THR A 320 ? 0.6354 0.7087 0.6146 0.0462 -0.0448 -0.0667 315 THR A N 2501 C CA . THR A 320 ? 0.7276 0.7993 0.6998 0.0464 -0.0444 -0.0641 315 THR A CA 2502 C C . THR A 320 ? 0.7861 0.8603 0.7532 0.0509 -0.0474 -0.0675 315 THR A C 2503 O O . THR A 320 ? 0.8623 0.9397 0.8277 0.0515 -0.0467 -0.0683 315 THR A O 2504 C CB . THR A 320 ? 0.7665 0.8300 0.7303 0.0448 -0.0444 -0.0575 315 THR A CB 2505 O OG1 . THR A 320 ? 0.7890 0.8474 0.7491 0.0467 -0.0473 -0.0565 315 THR A OG1 2506 C CG2 . THR A 320 ? 0.7388 0.8014 0.7074 0.0400 -0.0406 -0.0541 315 THR A CG2 2507 N N . GLY A 321 ? 0.7876 0.8610 0.7528 0.0544 -0.0508 -0.0699 316 GLY A N 2508 C CA . GLY A 321 ? 0.7869 0.8626 0.7474 0.0592 -0.0541 -0.0735 316 GLY A CA 2509 C C . GLY A 321 ? 0.7463 0.8306 0.7152 0.0611 -0.0546 -0.0807 316 GLY A C 2510 O O . GLY A 321 ? 0.6442 0.7334 0.6226 0.0583 -0.0519 -0.0829 316 GLY A O 2511 N N . LEU A 322 ? 0.7796 0.8655 0.7448 0.0659 -0.0583 -0.0843 317 LEU A N 2512 C CA . LEU A 322 ? 0.8123 0.9066 0.7843 0.0683 -0.0594 -0.0915 317 LEU A CA 2513 C C . LEU A 322 ? 0.7060 0.8022 0.6824 0.0698 -0.0613 -0.0950 317 LEU A C 2514 O O . LEU A 322 ? 0.7061 0.7967 0.6785 0.0702 -0.0627 -0.0921 317 LEU A O 2515 C CB . LEU A 322 ? 0.8954 0.9909 0.8599 0.0730 -0.0624 -0.0936 317 LEU A CB 2516 C CG . LEU A 322 ? 0.9830 1.0764 0.9409 0.0719 -0.0608 -0.0896 317 LEU A CG 2517 C CD1 . LEU A 322 ? 1.0127 1.0971 0.9581 0.0728 -0.0626 -0.0833 317 LEU A CD1 2518 C CD2 . LEU A 322 ? 1.0767 1.1769 1.0346 0.0751 -0.0619 -0.0946 317 LEU A CD2 2519 N N . ARG A 323 ? 0.6891 0.7936 0.6740 0.0705 -0.0615 -0.1013 318 ARG A N 2520 C CA . ARG A 323 ? 0.7427 0.8509 0.7313 0.0729 -0.0639 -0.1058 318 ARG A CA 2521 C C . ARG A 323 ? 0.7344 0.8390 0.7132 0.0786 -0.0686 -0.1063 318 ARG A C 2522 O O . ARG A 323 ? 0.6893 0.7932 0.6615 0.0816 -0.0704 -0.1066 318 ARG A O 2523 C CB . ARG A 323 ? 0.7284 0.8465 0.7265 0.0732 -0.0637 -0.1129 318 ARG A CB 2524 C CG . ARG A 323 ? 0.7922 0.9161 0.8002 0.0713 -0.0629 -0.1163 318 ARG A CG 2525 C CD . ARG A 323 ? 0.7921 0.9253 0.8087 0.0715 -0.0629 -0.1231 318 ARG A CD 2526 N NE . ARG A 323 ? 0.8204 0.9547 0.8435 0.0668 -0.0592 -0.1221 318 ARG A NE 2527 C CZ . ARG A 323 ? 0.7751 0.9120 0.8076 0.0620 -0.0565 -0.1221 318 ARG A CZ 2528 N NH1 . ARG A 323 ? 0.8016 0.9406 0.8376 0.0612 -0.0567 -0.1229 318 ARG A NH1 2529 N NH2 . ARG A 323 ? 0.6865 0.8237 0.7243 0.0582 -0.0537 -0.1213 318 ARG A NH2 2530 N N . ASN A 324 ? 0.8209 0.9234 0.7986 0.0802 -0.0708 -0.1065 319 ASN A N 2531 C CA . ASN A 324 ? 0.8296 0.9265 0.7970 0.0855 -0.0757 -0.1059 319 ASN A CA 2532 C C . ASN A 324 ? 0.7798 0.8823 0.7488 0.0906 -0.0797 -0.1126 319 ASN A C 2533 O O . ASN A 324 ? 0.7978 0.9095 0.7747 0.0909 -0.0792 -0.1185 319 ASN A O 2534 C CB . ASN A 324 ? 0.8605 0.9483 0.8230 0.0840 -0.0758 -0.0999 319 ASN A CB 2535 C CG . ASN A 324 ? 0.8747 0.9534 0.8244 0.0881 -0.0802 -0.0967 319 ASN A CG 2536 O OD1 . ASN A 324 ? 0.8626 0.9409 0.8061 0.0913 -0.0823 -0.0975 319 ASN A OD1 2537 N ND2 . ASN A 324 ? 0.8524 0.9237 0.7981 0.0880 -0.0817 -0.0932 319 ASN A ND2 2538 N N . SER B 5 ? 1.0820 1.6937 1.1246 0.1823 -0.0355 -0.3337 0 SER C N 2539 C CA . SER B 5 ? 1.0909 1.6813 1.1387 0.1763 -0.0369 -0.3343 0 SER C CA 2540 C C . SER B 5 ? 1.1396 1.7085 1.1923 0.1715 -0.0365 -0.3312 0 SER C C 2541 O O . SER B 5 ? 1.0936 1.6581 1.1427 0.1696 -0.0336 -0.3210 0 SER C O 2542 C CB . SER B 5 ? 1.0314 1.6194 1.0739 0.1728 -0.0350 -0.3248 0 SER C CB 2543 O OG . SER B 5 ? 0.9651 1.5603 0.9992 0.1730 -0.0315 -0.3123 0 SER C OG 2544 N N . ASP B 6 ? 1.1360 1.6920 1.1970 0.1696 -0.0397 -0.3403 1 ASP C N 2545 C CA . ASP B 6 ? 1.0756 1.6114 1.1423 0.1654 -0.0400 -0.3393 1 ASP C CA 2546 C C . ASP B 6 ? 1.0812 1.5995 1.1455 0.1586 -0.0371 -0.3259 1 ASP C C 2547 O O . ASP B 6 ? 1.1175 1.6339 1.1787 0.1558 -0.0361 -0.3205 1 ASP C O 2548 C CB . ASP B 6 ? 0.9982 1.5244 1.0744 0.1644 -0.0443 -0.3516 1 ASP C CB 2549 C CG . ASP B 6 ? 0.9735 1.5136 1.0532 0.1712 -0.0477 -0.3657 1 ASP C CG 2550 O OD1 . ASP B 6 ? 0.8819 1.4380 0.9572 0.1766 -0.0465 -0.3658 1 ASP C OD1 2551 O OD2 . ASP B 6 ? 0.9364 1.4714 1.0234 0.1711 -0.0517 -0.3766 1 ASP C OD2 2552 N N . GLN B 7 ? 1.1144 1.6205 1.1803 0.1561 -0.0359 -0.3210 2 GLN C N 2553 C CA . GLN B 7 ? 1.0405 1.5289 1.1046 0.1497 -0.0333 -0.3088 2 GLN C CA 2554 C C . GLN B 7 ? 1.0057 1.4739 1.0772 0.1456 -0.0345 -0.3104 2 GLN C C 2555 O O . GLN B 7 ? 1.0261 1.4939 1.1015 0.1479 -0.0356 -0.3158 2 GLN C O 2556 C CB . GLN B 7 ? 1.1082 1.6017 1.1648 0.1500 -0.0297 -0.2971 2 GLN C CB 2557 C CG . GLN B 7 ? 1.1833 1.6838 1.2316 0.1492 -0.0272 -0.2872 2 GLN C CG 2558 C CD . GLN B 7 ? 1.2606 1.7644 1.3022 0.1488 -0.0240 -0.2752 2 GLN C CD 2559 O OE1 . GLN B 7 ? 1.1991 1.6917 1.2420 0.1462 -0.0229 -0.2706 2 GLN C OE1 2560 N NE2 . GLN B 7 ? 1.2614 1.7809 1.2957 0.1514 -0.0224 -0.2700 2 GLN C NE2 2561 N N . ILE B 8 ? 0.9722 1.4239 1.0454 0.1397 -0.0341 -0.3052 3 ILE C N 2562 C CA . ILE B 8 ? 0.9125 1.3444 0.9908 0.1351 -0.0342 -0.3026 3 ILE C CA 2563 C C . ILE B 8 ? 0.8719 1.2936 0.9448 0.1306 -0.0308 -0.2886 3 ILE C C 2564 O O . ILE B 8 ? 0.8725 1.2955 0.9404 0.1289 -0.0293 -0.2820 3 ILE C O 2565 C CB . ILE B 8 ? 0.8093 1.2283 0.8964 0.1318 -0.0374 -0.3100 3 ILE C CB 2566 C CG1 . ILE B 8 ? 0.8136 1.2153 0.9069 0.1286 -0.0380 -0.3097 3 ILE C CG1 2567 C CG2 . ILE B 8 ? 0.7554 1.1685 0.8410 0.1275 -0.0368 -0.3049 3 ILE C CG2 2568 C CD1 . ILE B 8 ? 0.7877 1.1782 0.8905 0.1262 -0.0417 -0.3185 3 ILE C CD1 2569 N N . CYS B 9 ? 0.8786 1.2908 0.9526 0.1289 -0.0296 -0.2840 4 CYS C N 2570 C CA . CYS B 9 ? 0.8330 1.2343 0.9026 0.1245 -0.0267 -0.2714 4 CYS C CA 2571 C C . CYS B 9 ? 0.8405 1.2219 0.9161 0.1197 -0.0272 -0.2701 4 CYS C C 2572 O O . CYS B 9 ? 0.7778 1.1546 0.8602 0.1205 -0.0292 -0.2775 4 CYS C O 2573 C CB . CYS B 9 ? 0.9549 1.3650 1.0186 0.1268 -0.0242 -0.2648 4 CYS C CB 2574 S SG . CYS B 9 ? 1.0176 1.4529 1.0745 0.1327 -0.0237 -0.2663 4 CYS C SG 2575 N N . ILE B 10 ? 0.8767 1.2462 0.9496 0.1150 -0.0254 -0.2604 5 ILE C N 2576 C CA . ILE B 10 ? 0.8271 1.1779 0.9043 0.1103 -0.0252 -0.2568 5 ILE C CA 2577 C C . ILE B 10 ? 0.8507 1.1994 0.9228 0.1096 -0.0224 -0.2471 5 ILE C C 2578 O O . ILE B 10 ? 0.7358 1.0925 0.8003 0.1105 -0.0204 -0.2401 5 ILE C O 2579 C CB . ILE B 10 ? 0.8391 1.1779 0.9176 0.1055 -0.0254 -0.2535 5 ILE C CB 2580 C CG1 . ILE B 10 ? 0.9069 1.2437 0.9934 0.1051 -0.0286 -0.2638 5 ILE C CG1 2581 C CG2 . ILE B 10 ? 0.8239 1.1455 0.9034 0.1007 -0.0241 -0.2457 5 ILE C CG2 2582 C CD1 . ILE B 10 ? 0.8787 1.2306 0.9636 0.1086 -0.0299 -0.2703 5 ILE C CD1 2583 N N . GLY B 11 ? 0.8532 1.1917 0.9296 0.1082 -0.0226 -0.2470 6 GLY C N 2584 C CA . GLY B 11 ? 0.8079 1.1436 0.8805 0.1073 -0.0202 -0.2384 6 GLY C CA 2585 C C . GLY B 11 ? 0.8522 1.1716 0.9304 0.1042 -0.0206 -0.2376 6 GLY C C 2586 O O . GLY B 11 ? 0.9184 1.2276 1.0033 0.1021 -0.0225 -0.2426 6 GLY C O 2587 N N . TYR B 12 ? 0.7922 1.1095 0.8680 0.1037 -0.0188 -0.2312 7 TYR C N 2588 C CA . TYR B 12 ? 0.7485 1.0504 0.8289 0.1006 -0.0188 -0.2292 7 TYR C CA 2589 C C . TYR B 12 ? 0.7799 1.0858 0.8597 0.1027 -0.0178 -0.2277 7 TYR C C 2590 O O . TYR B 12 ? 0.7322 1.0522 0.8069 0.1058 -0.0166 -0.2258 7 TYR C O 2591 C CB . TYR B 12 ? 0.7611 1.0497 0.8388 0.0953 -0.0173 -0.2194 7 TYR C CB 2592 C CG . TYR B 12 ? 0.7718 1.0654 0.8408 0.0949 -0.0148 -0.2095 7 TYR C CG 2593 C CD1 . TYR B 12 ? 0.7277 1.0298 0.7912 0.0957 -0.0143 -0.2075 7 TYR C CD1 2594 C CD2 . TYR B 12 ? 0.8045 1.0947 0.8709 0.0936 -0.0130 -0.2019 7 TYR C CD2 2595 C CE1 . TYR B 12 ? 0.7267 1.0332 0.7824 0.0953 -0.0124 -0.1983 7 TYR C CE1 2596 C CE2 . TYR B 12 ? 0.7925 1.0872 0.8511 0.0930 -0.0111 -0.1928 7 TYR C CE2 2597 C CZ . TYR B 12 ? 0.7504 1.0529 0.8038 0.0938 -0.0108 -0.1910 7 TYR C CZ 2598 O OH . TYR B 12 ? 0.8051 1.1115 0.8511 0.0932 -0.0092 -0.1818 7 TYR C OH 2599 N N . HIS B 13 ? 0.7956 1.0892 0.8809 0.1009 -0.0185 -0.2284 8 HIS C N 2600 C CA . HIS B 13 ? 0.7475 1.0430 0.8340 0.1030 -0.0180 -0.2286 8 HIS C CA 2601 C C . HIS B 13 ? 0.6755 0.9745 0.7551 0.1020 -0.0152 -0.2181 8 HIS C C 2602 O O . HIS B 13 ? 0.6437 0.9375 0.7185 0.0984 -0.0135 -0.2092 8 HIS C O 2603 C CB . HIS B 13 ? 0.8180 1.0971 0.9116 0.1005 -0.0193 -0.2302 8 HIS C CB 2604 C CG . HIS B 13 ? 0.8499 1.1296 0.9455 0.1026 -0.0191 -0.2310 8 HIS C CG 2605 N ND1 . HIS B 13 ? 0.9052 1.1925 1.0051 0.1076 -0.0212 -0.2408 8 HIS C ND1 2606 C CD2 . HIS B 13 ? 0.8817 1.1550 0.9759 0.1006 -0.0174 -0.2235 8 HIS C CD2 2607 C CE1 . HIS B 13 ? 0.9013 1.1874 1.0021 0.1087 -0.0205 -0.2391 8 HIS C CE1 2608 N NE2 . HIS B 13 ? 0.9034 1.1810 1.0009 0.1043 -0.0182 -0.2286 8 HIS C NE2 2609 N N . ALA B 14 ? 0.6834 0.9924 0.7625 0.1055 -0.0147 -0.2194 9 ALA C N 2610 C CA . ALA B 14 ? 0.7001 1.0132 0.7736 0.1047 -0.0122 -0.2099 9 ALA C CA 2611 C C . ALA B 14 ? 0.6935 1.0112 0.7701 0.1079 -0.0125 -0.2133 9 ALA C C 2612 O O . ALA B 14 ? 0.7452 1.0673 0.8267 0.1119 -0.0145 -0.2234 9 ALA C O 2613 C CB . ALA B 14 ? 0.6610 0.9897 0.7272 0.1063 -0.0109 -0.2058 9 ALA C CB 2614 N N . ASN B 15 ? 0.6591 0.9749 0.7330 0.1060 -0.0106 -0.2050 10 ASN C N 2615 C CA . ASN B 15 ? 0.6411 0.9602 0.7178 0.1085 -0.0106 -0.2071 10 ASN C CA 2616 C C . ASN B 15 ? 0.6468 0.9711 0.7180 0.1070 -0.0081 -0.1969 10 ASN C C 2617 O O . ASN B 15 ? 0.6694 0.9969 0.7347 0.1047 -0.0067 -0.1892 10 ASN C O 2618 C CB . ASN B 15 ? 0.6640 0.9665 0.7478 0.1070 -0.0121 -0.2108 10 ASN C CB 2619 C CG . ASN B 15 ? 0.6993 0.9845 0.7825 0.1009 -0.0110 -0.2018 10 ASN C CG 2620 O OD1 . ASN B 15 ? 0.6494 0.9343 0.7266 0.0978 -0.0090 -0.1924 10 ASN C OD1 2621 N ND2 . ASN B 15 ? 0.7273 0.9978 0.8167 0.0992 -0.0124 -0.2048 10 ASN C ND2 2622 N N . ASN B 16 ? 0.8007 1.1269 0.8739 0.1085 -0.0078 -0.1967 11 ASN C N 2623 C CA . ASN B 16 ? 0.9598 1.2921 1.0280 0.1068 -0.0055 -0.1867 11 ASN C CA 2624 C C . ASN B 16 ? 0.9218 1.2374 0.9911 0.1019 -0.0047 -0.1795 11 ASN C C 2625 O O . ASN B 16 ? 0.9196 1.2385 0.9874 0.1012 -0.0034 -0.1737 11 ASN C O 2626 C CB . ASN B 16 ? 1.0428 1.3946 1.1103 0.1121 -0.0051 -0.1897 11 ASN C CB 2627 C CG . ASN B 16 ? 1.1821 1.5358 1.2562 0.1173 -0.0071 -0.2015 11 ASN C CG 2628 O OD1 . ASN B 16 ? 1.3225 1.6615 1.4019 0.1161 -0.0083 -0.2041 11 ASN C OD1 2629 N ND2 . ASN B 16 ? 1.2511 1.6230 1.3249 0.1232 -0.0078 -0.2087 11 ASN C ND2 2630 N N . SER B 17 ? 0.9502 1.2486 1.0223 0.0985 -0.0056 -0.1799 12 SER C N 2631 C CA . SER B 17 ? 0.9333 1.2154 1.0053 0.0933 -0.0048 -0.1720 12 SER C CA 2632 C C . SER B 17 ? 0.9149 1.1982 0.9797 0.0896 -0.0029 -0.1608 12 SER C C 2633 O O . SER B 17 ? 0.8032 1.0921 0.8637 0.0894 -0.0027 -0.1592 12 SER C O 2634 C CB . SER B 17 ? 0.9141 1.1793 0.9900 0.0905 -0.0061 -0.1746 12 SER C CB 2635 O OG . SER B 17 ? 0.8430 1.0955 0.9161 0.0853 -0.0050 -0.1655 12 SER C OG 2636 N N . THR B 18 ? 0.9358 1.2138 0.9995 0.0867 -0.0018 -0.1533 13 THR C N 2637 C CA . THR B 18 ? 0.9493 1.2254 1.0067 0.0825 -0.0005 -0.1422 13 THR C CA 2638 C C . THR B 18 ? 0.8961 1.1530 0.9537 0.0775 -0.0005 -0.1370 13 THR C C 2639 O O . THR B 18 ? 0.8771 1.1303 0.9295 0.0740 0.0001 -0.1282 13 THR C O 2640 C CB . THR B 18 ? 0.9893 1.2744 1.0446 0.0824 0.0007 -0.1364 13 THR C CB 2641 O OG1 . THR B 18 ? 0.8658 1.1490 0.9267 0.0844 0.0003 -0.1410 13 THR C OG1 2642 C CG2 . THR B 18 ? 0.9445 1.2502 0.9962 0.0857 0.0013 -0.1365 13 THR C CG2 2643 N N . GLU B 19 ? 0.7946 1.0396 0.8579 0.0774 -0.0016 -0.1424 14 GLU C N 2644 C CA . GLU B 19 ? 0.8280 1.0553 0.8920 0.0731 -0.0018 -0.1386 14 GLU C CA 2645 C C . GLU B 19 ? 0.7588 0.9832 0.8171 0.0704 -0.0015 -0.1329 14 GLU C C 2646 O O . GLU B 19 ? 0.6528 0.8842 0.7093 0.0722 -0.0019 -0.1360 14 GLU C O 2647 C CB . GLU B 19 ? 0.9449 1.1628 1.0158 0.0738 -0.0032 -0.1465 14 GLU C CB 2648 C CG . GLU B 19 ? 1.0958 1.3110 1.1729 0.0757 -0.0039 -0.1513 14 GLU C CG 2649 C CD . GLU B 19 ? 1.2189 1.4244 1.2963 0.0725 -0.0030 -0.1444 14 GLU C CD 2650 O OE1 . GLU B 19 ? 1.2249 1.4175 1.3013 0.0685 -0.0028 -0.1392 14 GLU C OE1 2651 O OE2 . GLU B 19 ? 1.3658 1.5772 1.4442 0.0743 -0.0026 -0.1444 14 GLU C OE2 2652 N N . GLN B 20 ? 0.7160 0.9299 0.7714 0.0663 -0.0009 -0.1247 15 GLN C N 2653 C CA . GLN B 20 ? 0.7090 0.9184 0.7586 0.0637 -0.0009 -0.1186 15 GLN C CA 2654 C C . GLN B 20 ? 0.6155 0.8082 0.6667 0.0606 -0.0013 -0.1169 15 GLN C C 2655 O O . GLN B 20 ? 0.6286 0.8127 0.6840 0.0594 -0.0014 -0.1174 15 GLN C O 2656 C CB . GLN B 20 ? 0.7702 0.9839 0.8139 0.0618 0.0000 -0.1094 15 GLN C CB 2657 C CG . GLN B 20 ? 0.8781 1.1083 0.9179 0.0643 0.0002 -0.1092 15 GLN C CG 2658 C CD . GLN B 20 ? 0.9574 1.1911 0.9911 0.0618 0.0008 -0.0994 15 GLN C CD 2659 O OE1 . GLN B 20 ? 0.9379 1.1602 0.9690 0.0581 0.0006 -0.0926 15 GLN C OE1 2660 N NE2 . GLN B 20 ? 0.9902 1.2399 1.0216 0.0639 0.0013 -0.0987 15 GLN C NE2 2661 N N . VAL B 21 ? 0.6129 0.8013 0.6604 0.0592 -0.0016 -0.1145 16 VAL C N 2662 C CA . VAL B 21 ? 0.5963 0.7706 0.6454 0.0568 -0.0021 -0.1141 16 VAL C CA 2663 C C . VAL B 21 ? 0.5571 0.7282 0.5995 0.0550 -0.0022 -0.1076 16 VAL C C 2664 O O . VAL B 21 ? 0.5102 0.6906 0.5481 0.0563 -0.0022 -0.1064 16 VAL C O 2665 C CB . VAL B 21 ? 0.5898 0.7649 0.6443 0.0588 -0.0030 -0.1231 16 VAL C CB 2666 C CG1 . VAL B 21 ? 0.5800 0.7515 0.6322 0.0580 -0.0035 -0.1230 16 VAL C CG1 2667 C CG2 . VAL B 21 ? 0.5836 0.7506 0.6454 0.0584 -0.0034 -0.1272 16 VAL C CG2 2668 N N . ASP B 22 ? 0.5887 0.7467 0.6300 0.0520 -0.0024 -0.1031 17 ASP C N 2669 C CA . ASP B 22 ? 0.5974 0.7513 0.6325 0.0507 -0.0028 -0.0977 17 ASP C CA 2670 C C . ASP B 22 ? 0.5828 0.7308 0.6198 0.0507 -0.0034 -0.1016 17 ASP C C 2671 O O . ASP B 22 ? 0.4549 0.5985 0.4981 0.0507 -0.0035 -0.1066 17 ASP C O 2672 C CB . ASP B 22 ? 0.6968 0.8409 0.7283 0.0476 -0.0029 -0.0894 17 ASP C CB 2673 C CG . ASP B 22 ? 0.7496 0.8999 0.7780 0.0470 -0.0025 -0.0842 17 ASP C CG 2674 O OD1 . ASP B 22 ? 0.7368 0.8996 0.7655 0.0491 -0.0020 -0.0866 17 ASP C OD1 2675 O OD2 . ASP B 22 ? 0.8095 0.9525 0.8351 0.0443 -0.0027 -0.0775 17 ASP C OD2 2676 N N . THR B 23 ? 0.5509 0.6988 0.5826 0.0508 -0.0039 -0.0988 18 THR C N 2677 C CA . THR B 23 ? 0.5899 0.7343 0.6220 0.0511 -0.0044 -0.1016 18 THR C CA 2678 C C . THR B 23 ? 0.6525 0.7882 0.6784 0.0494 -0.0049 -0.0944 18 THR C C 2679 O O . THR B 23 ? 0.5277 0.6625 0.5491 0.0483 -0.0050 -0.0881 18 THR C O 2680 C CB . THR B 23 ? 0.6106 0.7673 0.6417 0.0540 -0.0047 -0.1062 18 THR C CB 2681 O OG1 . THR B 23 ? 0.6942 0.8560 0.7321 0.0556 -0.0047 -0.1145 18 THR C OG1 2682 C CG2 . THR B 23 ? 0.6090 0.7642 0.6366 0.0544 -0.0053 -0.1058 18 THR C CG2 2683 N N . ILE B 24 ? 0.6958 0.8253 0.7217 0.0490 -0.0055 -0.0951 19 ILE C N 2684 C CA . ILE B 24 ? 0.6947 0.8160 0.7146 0.0479 -0.0062 -0.0888 19 ILE C CA 2685 C C . ILE B 24 ? 0.6033 0.7303 0.6160 0.0492 -0.0068 -0.0852 19 ILE C C 2686 O O . ILE B 24 ? 0.6752 0.7967 0.6824 0.0482 -0.0075 -0.0789 19 ILE C O 2687 C CB . ILE B 24 ? 0.7039 0.8178 0.7255 0.0474 -0.0065 -0.0904 19 ILE C CB 2688 C CG1 . ILE B 24 ? 0.7674 0.8703 0.7848 0.0458 -0.0071 -0.0841 19 ILE C CG1 2689 C CG2 . ILE B 24 ? 0.7258 0.8454 0.7455 0.0495 -0.0070 -0.0934 19 ILE C CG2 2690 C CD1 . ILE B 24 ? 0.8538 0.9494 0.8741 0.0450 -0.0073 -0.0855 19 ILE C CD1 2691 N N . MET B 25 ? 0.6192 0.7574 0.6321 0.0515 -0.0066 -0.0893 20 MET C N 2692 C CA . MET B 25 ? 0.5936 0.7388 0.6002 0.0530 -0.0071 -0.0860 20 MET C CA 2693 C C . MET B 25 ? 0.5891 0.7447 0.5948 0.0536 -0.0066 -0.0850 20 MET C C 2694 O O . MET B 25 ? 0.5405 0.7012 0.5406 0.0544 -0.0071 -0.0808 20 MET C O 2695 C CB . MET B 25 ? 0.6914 0.8426 0.6976 0.0554 -0.0074 -0.0908 20 MET C CB 2696 C CG . MET B 25 ? 0.7137 0.8558 0.7191 0.0550 -0.0081 -0.0903 20 MET C CG 2697 S SD . MET B 25 ? 0.7390 0.8876 0.7399 0.0578 -0.0090 -0.0918 20 MET C SD 2698 C CE . MET B 25 ? 0.7712 0.9313 0.7792 0.0594 -0.0082 -0.1013 20 MET C CE 2699 N N . GLU B 26 ? 0.5908 0.7499 0.6019 0.0535 -0.0056 -0.0884 21 GLU C N 2700 C CA . GLU B 26 ? 0.6825 0.8530 0.6932 0.0544 -0.0050 -0.0878 21 GLU C CA 2701 C C . GLU B 26 ? 0.6394 0.8078 0.6538 0.0529 -0.0043 -0.0870 21 GLU C C 2702 O O . GLU B 26 ? 0.6830 0.8455 0.7030 0.0523 -0.0040 -0.0910 21 GLU C O 2703 C CB . GLU B 26 ? 0.7050 0.8883 0.7189 0.0575 -0.0046 -0.0955 21 GLU C CB 2704 C CG . GLU B 26 ? 0.7573 0.9460 0.7680 0.0596 -0.0052 -0.0972 21 GLU C CG 2705 C CD . GLU B 26 ? 0.8025 1.0031 0.8173 0.0626 -0.0050 -0.1057 21 GLU C CD 2706 O OE1 . GLU B 26 ? 0.7258 0.9385 0.7404 0.0644 -0.0045 -0.1068 21 GLU C OE1 2707 O OE2 . GLU B 26 ? 0.8660 1.0641 0.8841 0.0632 -0.0054 -0.1114 21 GLU C OE2 2708 N N . LYS B 27 ? 0.6793 0.8533 0.6909 0.0522 -0.0040 -0.0820 22 LYS C N 2709 C CA . LYS B 27 ? 0.7398 0.9138 0.7546 0.0510 -0.0033 -0.0811 22 LYS C CA 2710 C C . LYS B 27 ? 0.6460 0.8351 0.6632 0.0535 -0.0025 -0.0849 22 LYS C C 2711 O O . LYS B 27 ? 0.6316 0.8319 0.6463 0.0556 -0.0025 -0.0858 22 LYS C O 2712 C CB . LYS B 27 ? 0.8050 0.9733 0.8152 0.0480 -0.0038 -0.0719 22 LYS C CB 2713 C CG . LYS B 27 ? 0.8460 0.9993 0.8536 0.0458 -0.0048 -0.0680 22 LYS C CG 2714 C CD . LYS B 27 ? 0.9191 1.0658 0.9242 0.0426 -0.0053 -0.0603 22 LYS C CD 2715 C CE . LYS B 27 ? 1.0031 1.1359 1.0047 0.0408 -0.0066 -0.0561 22 LYS C CE 2716 N NZ . LYS B 27 ? 1.0478 1.1769 1.0449 0.0380 -0.0076 -0.0477 22 LYS C NZ 2717 N N . ASN B 28 ? 0.6894 0.8789 0.7115 0.0535 -0.0018 -0.0873 23 ASN C N 2718 C CA . ASN B 28 ? 0.7730 0.9765 0.7970 0.0557 -0.0011 -0.0901 23 ASN C CA 2719 C C . ASN B 28 ? 0.7982 1.0130 0.8236 0.0596 -0.0011 -0.0977 23 ASN C C 2720 O O . ASN B 28 ? 0.9049 1.1333 0.9278 0.0615 -0.0008 -0.0973 23 ASN C O 2721 C CB . ASN B 28 ? 0.8466 1.0567 0.8656 0.0543 -0.0008 -0.0818 23 ASN C CB 2722 C CG . ASN B 28 ? 0.9997 1.2010 1.0192 0.0509 -0.0007 -0.0760 23 ASN C CG 2723 O OD1 . ASN B 28 ? 1.0256 1.2146 1.0481 0.0495 -0.0009 -0.0772 23 ASN C OD1 2724 N ND2 . ASN B 28 ? 1.2413 1.4495 1.2579 0.0496 -0.0004 -0.0696 23 ASN C ND2 2725 N N . VAL B 29 ? 0.7266 0.9357 0.7564 0.0605 -0.0016 -0.1045 24 VAL C N 2726 C CA . VAL B 29 ? 0.6886 0.9069 0.7208 0.0639 -0.0019 -0.1128 24 VAL C CA 2727 C C . VAL B 29 ? 0.6796 0.9032 0.7183 0.0664 -0.0019 -0.1205 24 VAL C C 2728 O O . VAL B 29 ? 0.6537 0.8678 0.6977 0.0654 -0.0021 -0.1232 24 VAL C O 2729 C CB . VAL B 29 ? 0.6910 0.9001 0.7247 0.0633 -0.0028 -0.1161 24 VAL C CB 2730 C CG1 . VAL B 29 ? 0.7179 0.9360 0.7551 0.0667 -0.0033 -0.1254 24 VAL C CG1 2731 C CG2 . VAL B 29 ? 0.6593 0.8641 0.6863 0.0617 -0.0030 -0.1093 24 VAL C CG2 2732 N N . THR B 30 ? 0.6288 0.8679 0.6673 0.0698 -0.0016 -0.1239 25 THR C N 2733 C CA . THR B 30 ? 0.6158 0.8612 0.6600 0.0727 -0.0018 -0.1312 25 THR C CA 2734 C C . THR B 30 ? 0.5776 0.8203 0.6270 0.0745 -0.0030 -0.1406 25 THR C C 2735 O O . THR B 30 ? 0.5656 0.8117 0.6134 0.0754 -0.0035 -0.1430 25 THR C O 2736 C CB . THR B 30 ? 0.6721 0.9362 0.7141 0.0761 -0.0012 -0.1321 25 THR C CB 2737 O OG1 . THR B 30 ? 0.6500 0.9168 0.6866 0.0739 -0.0002 -0.1224 25 THR C OG1 2738 C CG2 . THR B 30 ? 0.6778 0.9479 0.7254 0.0792 -0.0013 -0.1391 25 THR C CG2 2739 N N . VAL B 31 ? 0.5521 0.7886 0.6080 0.0748 -0.0036 -0.1458 26 VAL C N 2740 C CA . VAL B 31 ? 0.6000 0.8329 0.6618 0.0760 -0.0050 -0.1545 26 VAL C CA 2741 C C . VAL B 31 ? 0.6703 0.9089 0.7380 0.0796 -0.0059 -0.1628 26 VAL C C 2742 O O . VAL B 31 ? 0.7488 0.9931 0.8164 0.0810 -0.0052 -0.1616 26 VAL C O 2743 C CB . VAL B 31 ? 0.5929 0.8084 0.6576 0.0723 -0.0055 -0.1529 26 VAL C CB 2744 C CG1 . VAL B 31 ? 0.5802 0.7907 0.6390 0.0694 -0.0049 -0.1457 26 VAL C CG1 2745 C CG2 . VAL B 31 ? 0.6181 0.8241 0.6859 0.0704 -0.0051 -0.1501 26 VAL C CG2 2746 N N . THR B 32 ? 0.6236 0.8601 0.6965 0.0810 -0.0075 -0.1713 27 THR C N 2747 C CA . THR B 32 ? 0.6385 0.8813 0.7171 0.0850 -0.0090 -0.1809 27 THR C CA 2748 C C . THR B 32 ? 0.7106 0.9423 0.7951 0.0841 -0.0095 -0.1820 27 THR C C 2749 O O . THR B 32 ? 0.8351 1.0723 0.9219 0.0870 -0.0098 -0.1854 27 THR C O 2750 C CB . THR B 32 ? 0.6041 0.8487 0.6854 0.0863 -0.0108 -0.1889 27 THR C CB 2751 O OG1 . THR B 32 ? 0.6707 0.9324 0.7492 0.0906 -0.0109 -0.1930 27 THR C OG1 2752 C CG2 . THR B 32 ? 0.5507 0.7874 0.6403 0.0869 -0.0129 -0.1970 27 THR C CG2 2753 N N . HIS B 33 ? 0.7567 0.9731 0.8433 0.0800 -0.0097 -0.1790 28 HIS C N 2754 C CA . HIS B 33 ? 0.7456 0.9495 0.8377 0.0783 -0.0102 -0.1787 28 HIS C CA 2755 C C . HIS B 33 ? 0.7524 0.9434 0.8419 0.0733 -0.0090 -0.1696 28 HIS C C 2756 O O . HIS B 33 ? 0.7115 0.9007 0.7972 0.0712 -0.0085 -0.1661 28 HIS C O 2757 C CB . HIS B 33 ? 0.8112 1.0086 0.9112 0.0790 -0.0126 -0.1874 28 HIS C CB 2758 C CG . HIS B 33 ? 1.0137 1.2227 1.1165 0.0839 -0.0143 -0.1975 28 HIS C CG 2759 N ND1 . HIS B 33 ? 1.0056 1.2175 1.1103 0.0847 -0.0160 -0.2039 28 HIS C ND1 2760 C CD2 . HIS B 33 ? 1.0184 1.2370 1.1225 0.0884 -0.0149 -0.2025 28 HIS C CD2 2761 C CE1 . HIS B 33 ? 0.9960 1.2186 1.1029 0.0896 -0.0175 -0.2125 28 HIS C CE1 2762 N NE2 . HIS B 33 ? 1.0150 1.2420 1.1216 0.0920 -0.0168 -0.2119 28 HIS C NE2 2763 N N . ALA B 34 ? 0.7587 0.9410 0.8503 0.0716 -0.0086 -0.1661 29 ALA C N 2764 C CA . ALA B 34 ? 0.6732 0.8437 0.7626 0.0672 -0.0075 -0.1577 29 ALA C CA 2765 C C . ALA B 34 ? 0.7308 0.8905 0.8255 0.0659 -0.0079 -0.1572 29 ALA C C 2766 O O . ALA B 34 ? 0.7647 0.9277 0.8630 0.0685 -0.0084 -0.1612 29 ALA C O 2767 C CB . ALA B 34 ? 0.6272 0.8024 0.7091 0.0661 -0.0057 -0.1492 29 ALA C CB 2768 N N . GLN B 35 ? 0.7945 0.9418 0.8893 0.0620 -0.0075 -0.1520 30 GLN C N 2769 C CA . GLN B 35 ? 0.7890 0.9253 0.8886 0.0603 -0.0078 -0.1506 30 GLN C CA 2770 C C . GLN B 35 ? 0.7711 0.8988 0.8666 0.0566 -0.0064 -0.1412 30 GLN C C 2771 O O . GLN B 35 ? 0.7245 0.8479 0.8168 0.0541 -0.0060 -0.1372 30 GLN C O 2772 C CB . GLN B 35 ? 0.8044 0.9326 0.9109 0.0594 -0.0096 -0.1558 30 GLN C CB 2773 C CG . GLN B 35 ? 0.8948 1.0188 1.0082 0.0609 -0.0108 -0.1600 30 GLN C CG 2774 C CD . GLN B 35 ? 0.9476 1.0598 1.0678 0.0585 -0.0123 -0.1618 30 GLN C CD 2775 O OE1 . GLN B 35 ? 1.0462 1.1584 1.1697 0.0585 -0.0138 -0.1670 30 GLN C OE1 2776 N NE2 . GLN B 35 ? 1.0036 1.1060 1.1260 0.0565 -0.0119 -0.1574 30 GLN C NE2 2777 N N . ASP B 36 ? 0.6590 0.7850 0.7549 0.0566 -0.0058 -0.1379 31 ASP C N 2778 C CA . ASP B 36 ? 0.6592 0.7774 0.7517 0.0533 -0.0046 -0.1293 31 ASP C CA 2779 C C . ASP B 36 ? 0.6078 0.7129 0.7054 0.0509 -0.0052 -0.1287 31 ASP C C 2780 O O . ASP B 36 ? 0.7390 0.8416 0.8428 0.0522 -0.0061 -0.1328 31 ASP C O 2781 C CB . ASP B 36 ? 0.6794 0.8024 0.7697 0.0541 -0.0037 -0.1259 31 ASP C CB 2782 C CG . ASP B 36 ? 0.7383 0.8570 0.8226 0.0509 -0.0025 -0.1166 31 ASP C CG 2783 O OD1 . ASP B 36 ? 0.7276 0.8359 0.8116 0.0480 -0.0025 -0.1129 31 ASP C OD1 2784 O OD2 . ASP B 36 ? 0.6532 0.7793 0.7335 0.0513 -0.0017 -0.1129 31 ASP C OD2 2785 N N . ILE B 37 ? 0.5130 0.6102 0.6082 0.0477 -0.0048 -0.1236 32 ILE C N 2786 C CA . ILE B 37 ? 0.5506 0.6357 0.6505 0.0453 -0.0053 -0.1222 32 ILE C CA 2787 C C . ILE B 37 ? 0.5383 0.6167 0.6360 0.0432 -0.0043 -0.1149 32 ILE C C 2788 O O . ILE B 37 ? 0.5810 0.6500 0.6812 0.0409 -0.0044 -0.1123 32 ILE C O 2789 C CB . ILE B 37 ? 0.5792 0.6596 0.6792 0.0432 -0.0057 -0.1220 32 ILE C CB 2790 C CG1 . ILE B 37 ? 0.5802 0.6617 0.6721 0.0419 -0.0047 -0.1161 32 ILE C CG1 2791 C CG2 . ILE B 37 ? 0.6230 0.7089 0.7267 0.0451 -0.0069 -0.1298 32 ILE C CG2 2792 C CD1 . ILE B 37 ? 0.5931 0.6702 0.6846 0.0400 -0.0050 -0.1154 32 ILE C CD1 2793 N N . LEU B 38 ? 0.5446 0.6284 0.6379 0.0439 -0.0034 -0.1115 33 LEU C N 2794 C CA . LEU B 38 ? 0.5355 0.6143 0.6270 0.0421 -0.0027 -0.1052 33 LEU C CA 2795 C C . LEU B 38 ? 0.5671 0.6473 0.6635 0.0441 -0.0029 -0.1078 33 LEU C C 2796 O O . LEU B 38 ? 0.5305 0.6204 0.6269 0.0468 -0.0028 -0.1110 33 LEU C O 2797 C CB . LEU B 38 ? 0.5004 0.5842 0.5841 0.0414 -0.0018 -0.0995 33 LEU C CB 2798 C CG . LEU B 38 ? 0.5612 0.6399 0.6424 0.0393 -0.0013 -0.0925 33 LEU C CG 2799 C CD1 . LEU B 38 ? 0.5447 0.6116 0.6263 0.0366 -0.0014 -0.0889 33 LEU C CD1 2800 C CD2 . LEU B 38 ? 0.5543 0.6386 0.6283 0.0385 -0.0008 -0.0875 33 LEU C CD2 2801 N N . GLU B 39 ? 0.5671 0.6381 0.6676 0.0427 -0.0031 -0.1062 34 GLU C N 2802 C CA . GLU B 39 ? 0.5821 0.6529 0.6867 0.0442 -0.0032 -0.1072 34 GLU C CA 2803 C C . GLU B 39 ? 0.5848 0.6588 0.6845 0.0436 -0.0021 -0.1011 34 GLU C C 2804 O O . GLU B 39 ? 0.6303 0.6985 0.7264 0.0407 -0.0016 -0.0947 34 GLU C O 2805 C CB . GLU B 39 ? 0.5894 0.6490 0.6999 0.0429 -0.0039 -0.1068 34 GLU C CB 2806 C CG . GLU B 39 ? 0.6123 0.6713 0.7279 0.0449 -0.0043 -0.1088 34 GLU C CG 2807 C CD . GLU B 39 ? 0.6338 0.7015 0.7524 0.0490 -0.0052 -0.1165 34 GLU C CD 2808 O OE1 . GLU B 39 ? 0.5947 0.6706 0.7113 0.0511 -0.0047 -0.1166 34 GLU C OE1 2809 O OE2 . GLU B 39 ? 0.6922 0.7589 0.8150 0.0499 -0.0066 -0.1225 34 GLU C OE2 2810 N N . LYS B 40 ? 0.5789 0.6623 0.6785 0.0462 -0.0019 -0.1032 35 LYS C N 2811 C CA . LYS B 40 ? 0.5773 0.6657 0.6727 0.0456 -0.0009 -0.0978 35 LYS C CA 2812 C C . LYS B 40 ? 0.5871 0.6761 0.6865 0.0473 -0.0010 -0.0985 35 LYS C C 2813 O O . LYS B 40 ? 0.6012 0.6940 0.6978 0.0468 -0.0002 -0.0940 35 LYS C O 2814 C CB . LYS B 40 ? 0.6042 0.7055 0.6953 0.0473 -0.0005 -0.0988 35 LYS C CB 2815 C CG . LYS B 40 ? 0.7223 0.8241 0.8072 0.0451 -0.0002 -0.0951 35 LYS C CG 2816 C CD . LYS B 40 ? 0.7341 0.8484 0.8166 0.0475 -0.0001 -0.0986 35 LYS C CD 2817 C CE . LYS B 40 ? 0.7912 0.9048 0.8780 0.0495 -0.0010 -0.1061 35 LYS C CE 2818 N NZ . LYS B 40 ? 0.8641 0.9868 0.9482 0.0511 -0.0011 -0.1093 35 LYS C NZ 2819 N N . THR B 41 ? 0.6368 0.7225 0.7428 0.0495 -0.0019 -0.1042 36 THR C N 2820 C CA . THR B 41 ? 0.6422 0.7300 0.7522 0.0521 -0.0022 -0.1059 36 THR C CA 2821 C C . THR B 41 ? 0.6283 0.7043 0.7435 0.0511 -0.0028 -0.1051 36 THR C C 2822 O O . THR B 41 ? 0.5568 0.6239 0.6750 0.0497 -0.0035 -0.1061 36 THR C O 2823 C CB . THR B 41 ? 0.7324 0.8292 0.8460 0.0568 -0.0031 -0.1144 36 THR C CB 2824 O OG1 . THR B 41 ? 0.6059 0.6965 0.7245 0.0575 -0.0045 -0.1201 36 THR C OG1 2825 C CG2 . THR B 41 ? 0.7786 0.8895 0.8874 0.0585 -0.0024 -0.1158 36 THR C CG2 2826 N N . HIS B 42 ? 0.6425 0.7195 0.7590 0.0521 -0.0025 -0.1032 37 HIS C N 2827 C CA . HIS B 42 ? 0.6693 0.7366 0.7907 0.0518 -0.0031 -0.1022 37 HIS C CA 2828 C C . HIS B 42 ? 0.6641 0.7370 0.7890 0.0557 -0.0035 -0.1052 37 HIS C C 2829 O O . HIS B 42 ? 0.7032 0.7875 0.8255 0.0578 -0.0029 -0.1060 37 HIS C O 2830 C CB . HIS B 42 ? 0.6351 0.6960 0.7529 0.0478 -0.0021 -0.0938 37 HIS C CB 2831 C CG . HIS B 42 ? 0.5810 0.6497 0.6936 0.0473 -0.0010 -0.0891 37 HIS C CG 2832 N ND1 . HIS B 42 ? 0.5433 0.6146 0.6575 0.0486 -0.0008 -0.0876 37 HIS C ND1 2833 C CD2 . HIS B 42 ? 0.6246 0.6995 0.7309 0.0456 -0.0001 -0.0855 37 HIS C CD2 2834 C CE1 . HIS B 42 ? 0.5975 0.6765 0.7066 0.0475 0.0001 -0.0832 37 HIS C CE1 2835 N NE2 . HIS B 42 ? 0.6009 0.6818 0.7051 0.0456 0.0004 -0.0818 37 HIS C NE2 2836 N N . ASN B 43 ? 0.6501 0.7148 0.7807 0.0566 -0.0045 -0.1064 38 ASN C N 2837 C CA . ASN B 43 ? 0.6194 0.6879 0.7544 0.0609 -0.0053 -0.1105 38 ASN C CA 2838 C C . ASN B 43 ? 0.6371 0.7084 0.7703 0.0607 -0.0042 -0.1051 38 ASN C C 2839 O O . ASN B 43 ? 0.7291 0.8022 0.8660 0.0641 -0.0049 -0.1076 38 ASN C O 2840 C CB . ASN B 43 ? 0.5924 0.6502 0.7347 0.0620 -0.0072 -0.1143 38 ASN C CB 2841 C CG . ASN B 43 ? 0.6422 0.6890 0.7860 0.0589 -0.0069 -0.1080 38 ASN C CG 2842 O OD1 . ASN B 43 ? 0.6545 0.7016 0.7938 0.0562 -0.0054 -0.1012 38 ASN C OD1 2843 N ND2 . ASN B 43 ? 0.6910 0.7284 0.8412 0.0595 -0.0085 -0.1103 38 ASN C ND2 2844 N N . GLY B 44 ? 0.6264 0.6972 0.7541 0.0568 -0.0028 -0.0977 39 GLY C N 2845 C CA . GLY B 44 ? 0.5219 0.5965 0.6474 0.0562 -0.0018 -0.0923 39 GLY C CA 2846 C C . GLY B 44 ? 0.5416 0.6077 0.6709 0.0561 -0.0022 -0.0898 39 GLY C C 2847 O O . GLY B 44 ? 0.4662 0.5359 0.5941 0.0560 -0.0015 -0.0858 39 GLY C O 2848 N N . LYS B 45 ? 0.6086 0.6637 0.7427 0.0558 -0.0033 -0.0915 40 LYS C N 2849 C CA . LYS B 45 ? 0.6825 0.7295 0.8212 0.0564 -0.0039 -0.0900 40 LYS C CA 2850 C C . LYS B 45 ? 0.6727 0.7070 0.8125 0.0526 -0.0041 -0.0857 40 LYS C C 2851 O O . LYS B 45 ? 0.6483 0.6791 0.7865 0.0502 -0.0040 -0.0854 40 LYS C O 2852 C CB . LYS B 45 ? 0.8106 0.8578 0.9559 0.0612 -0.0057 -0.0975 40 LYS C CB 2853 C CG . LYS B 45 ? 1.0007 1.0612 1.1452 0.0655 -0.0055 -0.1013 40 LYS C CG 2854 C CD . LYS B 45 ? 1.1395 1.2021 1.2897 0.0709 -0.0074 -0.1099 40 LYS C CD 2855 C CE . LYS B 45 ? 1.2472 1.3242 1.3958 0.0752 -0.0070 -0.1127 40 LYS C CE 2856 N NZ . LYS B 45 ? 1.3205 1.3997 1.4745 0.0811 -0.0091 -0.1215 40 LYS C NZ 2857 N N . LEU B 46 ? 0.6513 0.6797 0.7937 0.0524 -0.0042 -0.0821 41 LEU C N 2858 C CA . LEU B 46 ? 0.6015 0.6181 0.7459 0.0495 -0.0045 -0.0783 41 LEU C CA 2859 C C . LEU B 46 ? 0.5842 0.5937 0.7363 0.0516 -0.0063 -0.0826 41 LEU C C 2860 O O . LEU B 46 ? 0.6270 0.6369 0.7833 0.0550 -0.0072 -0.0850 41 LEU C O 2861 C CB . LEU B 46 ? 0.6255 0.6391 0.7687 0.0479 -0.0038 -0.0716 41 LEU C CB 2862 C CG . LEU B 46 ? 0.6485 0.6664 0.7847 0.0452 -0.0023 -0.0658 41 LEU C CG 2863 C CD1 . LEU B 46 ? 0.6818 0.6951 0.8185 0.0441 -0.0021 -0.0601 41 LEU C CD1 2864 C CD2 . LEU B 46 ? 0.6756 0.6913 0.8071 0.0416 -0.0018 -0.0636 41 LEU C CD2 2865 N N . CYS B 47 ? 0.5414 0.5439 0.6954 0.0494 -0.0068 -0.0831 42 CYS C N 2866 C CA . CYS B 47 ? 0.6341 0.6303 0.7954 0.0510 -0.0088 -0.0879 42 CYS C CA 2867 C C . CYS B 47 ? 0.6442 0.6296 0.8089 0.0480 -0.0093 -0.0836 42 CYS C C 2868 O O . CYS B 47 ? 0.6597 0.6429 0.8205 0.0445 -0.0080 -0.0777 42 CYS C O 2869 C CB . CYS B 47 ? 0.6280 0.6269 0.7895 0.0513 -0.0095 -0.0938 42 CYS C CB 2870 S SG . CYS B 47 ? 0.6422 0.6549 0.7999 0.0549 -0.0091 -0.0994 42 CYS C SG 2871 N N . ASP B 48 ? 0.6493 0.6283 0.8214 0.0495 -0.0113 -0.0871 43 ASP C N 2872 C CA . ASP B 48 ? 0.6720 0.6411 0.8483 0.0465 -0.0121 -0.0841 43 ASP C CA 2873 C C . ASP B 48 ? 0.6310 0.6003 0.8047 0.0433 -0.0116 -0.0842 43 ASP C C 2874 O O . ASP B 48 ? 0.6025 0.5779 0.7737 0.0441 -0.0115 -0.0887 43 ASP C O 2875 C CB . ASP B 48 ? 0.7083 0.6706 0.8933 0.0486 -0.0149 -0.0890 43 ASP C CB 2876 C CG . ASP B 48 ? 0.7139 0.6754 0.9024 0.0525 -0.0159 -0.0899 43 ASP C CG 2877 O OD1 . ASP B 48 ? 0.7639 0.7298 0.9484 0.0533 -0.0144 -0.0863 43 ASP C OD1 2878 O OD2 . ASP B 48 ? 0.8137 0.7700 1.0091 0.0548 -0.0185 -0.0944 43 ASP C OD2 2879 N N . LEU B 49 ? 0.6531 0.6159 0.8280 0.0397 -0.0114 -0.0793 44 LEU C N 2880 C CA . LEU B 49 ? 0.6526 0.6153 0.8254 0.0366 -0.0109 -0.0788 44 LEU C CA 2881 C C . LEU B 49 ? 0.6197 0.5747 0.8003 0.0353 -0.0129 -0.0803 44 LEU C C 2882 O O . LEU B 49 ? 0.5823 0.5308 0.7661 0.0336 -0.0132 -0.0754 44 LEU C O 2883 C CB . LEU B 49 ? 0.6718 0.6339 0.8390 0.0334 -0.0090 -0.0712 44 LEU C CB 2884 C CG . LEU B 49 ? 0.6737 0.6412 0.8331 0.0317 -0.0074 -0.0697 44 LEU C CG 2885 C CD1 . LEU B 49 ? 0.6486 0.6120 0.8058 0.0283 -0.0064 -0.0629 44 LEU C CD1 2886 C CD2 . LEU B 49 ? 0.6382 0.6091 0.7976 0.0319 -0.0079 -0.0753 44 LEU C CD2 2887 N N . ASN B 50 ? 0.6244 0.5803 0.8078 0.0359 -0.0144 -0.0866 45 ASN C N 2888 C CA . ASN B 50 ? 0.7226 0.6711 0.9140 0.0344 -0.0167 -0.0884 45 ASN C CA 2889 C C . ASN B 50 ? 0.7320 0.6732 0.9304 0.0358 -0.0185 -0.0879 45 ASN C C 2890 O O . ASN B 50 ? 0.6676 0.6013 0.8708 0.0332 -0.0194 -0.0838 45 ASN C O 2891 C CB . ASN B 50 ? 0.7445 0.6900 0.9355 0.0298 -0.0159 -0.0832 45 ASN C CB 2892 C CG . ASN B 50 ? 0.9003 0.8526 1.0845 0.0286 -0.0143 -0.0839 45 ASN C CG 2893 O OD1 . ASN B 50 ? 0.9486 0.9051 1.1325 0.0299 -0.0150 -0.0901 45 ASN C OD1 2894 N ND2 . ASN B 50 ? 1.0144 0.9677 1.1930 0.0263 -0.0122 -0.0775 45 ASN C ND2 2895 N N . GLY B 51 ? 0.6917 0.6355 0.8903 0.0401 -0.0191 -0.0917 46 GLY C N 2896 C CA . GLY B 51 ? 0.7122 0.6496 0.9172 0.0422 -0.0210 -0.0919 46 GLY C CA 2897 C C . GLY B 51 ? 0.7372 0.6725 0.9407 0.0419 -0.0197 -0.0848 46 GLY C C 2898 O O . GLY B 51 ? 0.7854 0.7163 0.9937 0.0444 -0.0213 -0.0852 46 GLY C O 2899 N N . VAL B 52 ? 0.7545 0.6925 0.9519 0.0392 -0.0171 -0.0782 47 VAL C N 2900 C CA . VAL B 52 ? 0.7355 0.6720 0.9315 0.0393 -0.0159 -0.0718 47 VAL C CA 2901 C C . VAL B 52 ? 0.7159 0.6605 0.9042 0.0408 -0.0137 -0.0702 47 VAL C C 2902 O O . VAL B 52 ? 0.6770 0.6276 0.8589 0.0395 -0.0120 -0.0699 47 VAL C O 2903 C CB . VAL B 52 ? 0.7440 0.6737 0.9423 0.0354 -0.0156 -0.0642 47 VAL C CB 2904 C CG1 . VAL B 52 ? 0.7278 0.6541 0.9290 0.0318 -0.0164 -0.0644 47 VAL C CG1 2905 C CG2 . VAL B 52 ? 0.7040 0.6366 0.8958 0.0340 -0.0132 -0.0572 47 VAL C CG2 2906 N N . LYS B 53 ? 0.7034 0.6480 0.8930 0.0436 -0.0140 -0.0694 48 LYS C N 2907 C CA . LYS B 53 ? 0.8168 0.7694 1.0005 0.0455 -0.0123 -0.0687 48 LYS C CA 2908 C C . LYS B 53 ? 0.7441 0.6984 0.9213 0.0423 -0.0100 -0.0614 48 LYS C C 2909 O O . LYS B 53 ? 0.6855 0.6340 0.8640 0.0397 -0.0099 -0.0560 48 LYS C O 2910 C CB . LYS B 53 ? 0.9481 0.8996 1.1357 0.0494 -0.0135 -0.0696 48 LYS C CB 2911 C CG . LYS B 53 ? 1.0609 1.0217 1.2439 0.0523 -0.0123 -0.0706 48 LYS C CG 2912 C CD . LYS B 53 ? 1.1469 1.1067 1.3340 0.0563 -0.0135 -0.0715 48 LYS C CD 2913 C CE . LYS B 53 ? 1.2383 1.2050 1.4204 0.0571 -0.0117 -0.0675 48 LYS C CE 2914 N NZ . LYS B 53 ? 1.2085 1.1831 1.3907 0.0620 -0.0121 -0.0723 48 LYS C NZ 2915 N N . PRO B 54 ? 0.6883 0.6507 0.8586 0.0426 -0.0085 -0.0611 49 PRO C N 2916 C CA . PRO B 54 ? 0.6703 0.6338 0.8348 0.0400 -0.0067 -0.0543 49 PRO C CA 2917 C C . PRO B 54 ? 0.6452 0.6080 0.8106 0.0413 -0.0066 -0.0504 49 PRO C C 2918 O O . PRO B 54 ? 0.7026 0.6658 0.8720 0.0446 -0.0076 -0.0533 49 PRO C O 2919 C CB . PRO B 54 ? 0.6843 0.6566 0.8418 0.0400 -0.0055 -0.0557 49 PRO C CB 2920 C CG . PRO B 54 ? 0.6923 0.6695 0.8523 0.0438 -0.0064 -0.0625 49 PRO C CG 2921 C CD . PRO B 54 ? 0.6737 0.6444 0.8412 0.0448 -0.0083 -0.0666 49 PRO C CD 2922 N N . LEU B 55 ? 0.6209 0.5826 0.7825 0.0388 -0.0054 -0.0440 50 LEU C N 2923 C CA . LEU B 55 ? 0.5740 0.5368 0.7348 0.0396 -0.0050 -0.0398 50 LEU C CA 2924 C C . LEU B 55 ? 0.5578 0.5290 0.7119 0.0398 -0.0038 -0.0397 50 LEU C C 2925 O O . LEU B 55 ? 0.5142 0.4873 0.6625 0.0371 -0.0029 -0.0373 50 LEU C O 2926 C CB . LEU B 55 ? 0.5746 0.5324 0.7343 0.0368 -0.0044 -0.0330 50 LEU C CB 2927 C CG . LEU B 55 ? 0.5628 0.5217 0.7212 0.0374 -0.0039 -0.0282 50 LEU C CG 2928 C CD1 . LEU B 55 ? 0.5910 0.5483 0.7555 0.0408 -0.0050 -0.0299 50 LEU C CD1 2929 C CD2 . LEU B 55 ? 0.6280 0.5822 0.7854 0.0346 -0.0035 -0.0219 50 LEU C CD2 2930 N N . ILE B 56 ? 0.5553 0.5318 0.7105 0.0430 -0.0041 -0.0423 51 ILE C N 2931 C CA . ILE B 56 ? 0.5666 0.5520 0.7162 0.0431 -0.0031 -0.0423 51 ILE C CA 2932 C C . ILE B 56 ? 0.5646 0.5518 0.7128 0.0433 -0.0027 -0.0376 51 ILE C C 2933 O O . ILE B 56 ? 0.6259 0.6135 0.7783 0.0462 -0.0033 -0.0384 51 ILE C O 2934 C CB . ILE B 56 ? 0.6201 0.6123 0.7714 0.0466 -0.0036 -0.0488 51 ILE C CB 2935 C CG1 . ILE B 56 ? 0.6447 0.6353 0.7970 0.0463 -0.0041 -0.0536 51 ILE C CG1 2936 C CG2 . ILE B 56 ? 0.6498 0.6523 0.7955 0.0466 -0.0026 -0.0482 51 ILE C CG2 2937 C CD1 . ILE B 56 ? 0.6360 0.6336 0.7896 0.0498 -0.0047 -0.0604 51 ILE C CD1 2938 N N . LEU B 57 ? 0.5733 0.5618 0.7158 0.0402 -0.0018 -0.0327 52 LEU C N 2939 C CA . LEU B 57 ? 0.6200 0.6087 0.7612 0.0397 -0.0015 -0.0276 52 LEU C CA 2940 C C . LEU B 57 ? 0.6598 0.6574 0.7985 0.0408 -0.0012 -0.0273 52 LEU C C 2941 O O . LEU B 57 ? 0.6726 0.6711 0.8117 0.0413 -0.0012 -0.0239 52 LEU C O 2942 C CB . LEU B 57 ? 0.5597 0.5444 0.6964 0.0360 -0.0011 -0.0223 52 LEU C CB 2943 C CG . LEU B 57 ? 0.5294 0.5056 0.6698 0.0352 -0.0014 -0.0208 52 LEU C CG 2944 C CD1 . LEU B 57 ? 0.5044 0.4779 0.6398 0.0320 -0.0010 -0.0159 52 LEU C CD1 2945 C CD2 . LEU B 57 ? 0.5815 0.5542 0.7278 0.0374 -0.0020 -0.0195 52 LEU C CD2 2946 N N . LYS B 58 ? 0.6180 0.6226 0.7541 0.0411 -0.0009 -0.0305 53 LYS C N 2947 C CA . LYS B 58 ? 0.7116 0.7261 0.8460 0.0424 -0.0006 -0.0305 53 LYS C CA 2948 C C . LYS B 58 ? 0.7328 0.7494 0.8618 0.0391 -0.0002 -0.0246 53 LYS C C 2949 O O . LYS B 58 ? 0.6884 0.7040 0.8124 0.0358 0.0000 -0.0225 53 LYS C O 2950 C CB . LYS B 58 ? 0.8196 0.8362 0.9595 0.0467 -0.0011 -0.0329 53 LYS C CB 2951 C CG . LYS B 58 ? 1.0290 1.0422 1.1746 0.0500 -0.0020 -0.0389 53 LYS C CG 2952 C CD . LYS B 58 ? 1.1791 1.2001 1.3278 0.0548 -0.0024 -0.0436 53 LYS C CD 2953 C CE . LYS B 58 ? 1.3489 1.3676 1.5023 0.0578 -0.0031 -0.0427 53 LYS C CE 2954 N NZ . LYS B 58 ? 1.4387 1.4681 1.5926 0.0615 -0.0031 -0.0449 53 LYS C NZ 2955 N N . ASP B 59 ? 0.6694 0.6887 0.7994 0.0400 -0.0003 -0.0219 54 ASP C N 2956 C CA . ASP B 59 ? 0.6862 0.7081 0.8115 0.0370 -0.0002 -0.0167 54 ASP C CA 2957 C C . ASP B 59 ? 0.6306 0.6441 0.7549 0.0349 -0.0004 -0.0121 54 ASP C C 2958 O O . ASP B 59 ? 0.5878 0.6027 0.7089 0.0328 -0.0006 -0.0077 54 ASP C O 2959 C CB . ASP B 59 ? 0.8140 0.8446 0.9403 0.0389 -0.0001 -0.0159 54 ASP C CB 2960 C CG . ASP B 59 ? 0.9351 0.9638 1.0677 0.0430 -0.0004 -0.0174 54 ASP C CG 2961 O OD1 . ASP B 59 ? 1.0028 1.0232 1.1390 0.0442 -0.0007 -0.0187 54 ASP C OD1 2962 O OD2 . ASP B 59 ? 1.1617 1.1977 1.2958 0.0451 -0.0004 -0.0173 54 ASP C OD2 2963 N N . CYS B 60 ? 0.5771 0.5825 0.7045 0.0355 -0.0005 -0.0130 55 CYS C N 2964 C CA . CYS B 60 ? 0.6530 0.6513 0.7794 0.0336 -0.0007 -0.0087 55 CYS C CA 2965 C C . CYS B 60 ? 0.5971 0.5903 0.7203 0.0310 -0.0006 -0.0084 55 CYS C C 2966 O O . CYS B 60 ? 0.5157 0.5079 0.6401 0.0314 -0.0005 -0.0122 55 CYS C O 2967 C CB . CYS B 60 ? 0.7225 0.7154 0.8552 0.0361 -0.0009 -0.0084 55 CYS C CB 2968 S SG . CYS B 60 ? 0.9541 0.9529 1.0901 0.0393 -0.0011 -0.0080 55 CYS C SG 2969 N N . SER B 61 ? 0.5660 0.5561 0.6855 0.0285 -0.0008 -0.0040 56 SER C N 2970 C CA . SER B 61 ? 0.5437 0.5281 0.6607 0.0265 -0.0008 -0.0032 56 SER C CA 2971 C C . SER B 61 ? 0.5176 0.4956 0.6397 0.0276 -0.0007 -0.0026 56 SER C C 2972 O O . SER B 61 ? 0.4420 0.4194 0.5688 0.0296 -0.0008 -0.0019 56 SER C O 2973 C CB . SER B 61 ? 0.5019 0.4857 0.6130 0.0240 -0.0013 0.0010 56 SER C CB 2974 O OG . SER B 61 ? 0.5337 0.5154 0.6466 0.0245 -0.0014 0.0045 56 SER C OG 2975 N N . VAL B 62 ? 0.4770 0.4506 0.5984 0.0263 -0.0007 -0.0029 57 VAL C N 2976 C CA . VAL B 62 ? 0.4700 0.4378 0.5961 0.0268 -0.0006 -0.0017 57 VAL C CA 2977 C C . VAL B 62 ? 0.4895 0.4559 0.6155 0.0267 -0.0007 0.0033 57 VAL C C 2978 O O . VAL B 62 ? 0.4967 0.4605 0.6279 0.0281 -0.0008 0.0046 57 VAL C O 2979 C CB . VAL B 62 ? 0.4231 0.3874 0.5474 0.0250 -0.0005 -0.0020 57 VAL C CB 2980 C CG1 . VAL B 62 ? 0.4116 0.3707 0.5402 0.0249 -0.0005 0.0004 57 VAL C CG1 2981 C CG2 . VAL B 62 ? 0.4476 0.4131 0.5732 0.0254 -0.0005 -0.0073 57 VAL C CG2 2982 N N . ALA B 63 ? 0.4679 0.4362 0.5880 0.0251 -0.0009 0.0062 58 ALA C N 2983 C CA . ALA B 63 ? 0.4516 0.4193 0.5713 0.0252 -0.0011 0.0108 58 ALA C CA 2984 C C . ALA B 63 ? 0.4328 0.4031 0.5565 0.0273 -0.0011 0.0114 58 ALA C C 2985 O O . ALA B 63 ? 0.4611 0.4293 0.5881 0.0284 -0.0011 0.0142 58 ALA C O 2986 C CB . ALA B 63 ? 0.3928 0.3621 0.5052 0.0232 -0.0016 0.0131 58 ALA C CB 2987 N N . GLY B 64 ? 0.4718 0.4470 0.5949 0.0280 -0.0012 0.0088 59 GLY C N 2988 C CA . GLY B 64 ? 0.5028 0.4816 0.6292 0.0302 -0.0012 0.0091 59 GLY C CA 2989 C C . GLY B 64 ? 0.5095 0.4853 0.6432 0.0330 -0.0012 0.0072 59 GLY C C 2990 O O . GLY B 64 ? 0.4845 0.4596 0.6217 0.0348 -0.0014 0.0093 59 GLY C O 2991 N N . TRP B 65 ? 0.5306 0.5042 0.6664 0.0333 -0.0012 0.0032 60 TRP C N 2992 C CA . TRP B 65 ? 0.5290 0.4985 0.6718 0.0356 -0.0015 0.0010 60 TRP C CA 2993 C C . TRP B 65 ? 0.5249 0.4883 0.6707 0.0351 -0.0016 0.0052 60 TRP C C 2994 O O . TRP B 65 ? 0.5579 0.5193 0.7088 0.0372 -0.0021 0.0063 60 TRP C O 2995 C CB . TRP B 65 ? 0.5395 0.5082 0.6832 0.0354 -0.0015 -0.0039 60 TRP C CB 2996 C CG . TRP B 65 ? 0.6055 0.5690 0.7556 0.0368 -0.0021 -0.0059 60 TRP C CG 2997 C CD1 . TRP B 65 ? 0.6502 0.6130 0.8061 0.0401 -0.0029 -0.0085 60 TRP C CD1 2998 C CD2 . TRP B 65 ? 0.5987 0.5564 0.7506 0.0351 -0.0023 -0.0059 60 TRP C CD2 2999 N NE1 . TRP B 65 ? 0.7101 0.6664 0.8716 0.0403 -0.0037 -0.0100 60 TRP C NE1 3000 C CE2 . TRP B 65 ? 0.6538 0.6072 0.8131 0.0372 -0.0032 -0.0083 60 TRP C CE2 3001 C CE3 . TRP B 65 ? 0.6123 0.5684 0.7606 0.0322 -0.0018 -0.0042 60 TRP C CE3 3002 C CZ2 . TRP B 65 ? 0.6389 0.5863 0.8021 0.0360 -0.0038 -0.0088 60 TRP C CZ2 3003 C CZ3 . TRP B 65 ? 0.6080 0.5588 0.7600 0.0312 -0.0021 -0.0046 60 TRP C CZ3 3004 C CH2 . TRP B 65 ? 0.6269 0.5735 0.7864 0.0329 -0.0031 -0.0068 60 TRP C CH2 3005 N N . LEU B 66 ? 0.5282 0.4893 0.6708 0.0325 -0.0013 0.0076 61 LEU C N 3006 C CA . LEU B 66 ? 0.5123 0.4683 0.6575 0.0318 -0.0014 0.0117 61 LEU C CA 3007 C C . LEU B 66 ? 0.5086 0.4656 0.6539 0.0327 -0.0014 0.0165 61 LEU C C 3008 O O . LEU B 66 ? 0.4971 0.4507 0.6476 0.0338 -0.0017 0.0189 61 LEU C O 3009 C CB . LEU B 66 ? 0.5089 0.4638 0.6496 0.0291 -0.0010 0.0134 61 LEU C CB 3010 C CG . LEU B 66 ? 0.5076 0.4593 0.6497 0.0278 -0.0009 0.0112 61 LEU C CG 3011 C CD1 . LEU B 66 ? 0.5094 0.4609 0.6464 0.0255 -0.0005 0.0144 61 LEU C CD1 3012 C CD2 . LEU B 66 ? 0.5178 0.4646 0.6677 0.0286 -0.0013 0.0114 61 LEU C CD2 3013 N N . LEU B 67 ? 0.4669 0.4284 0.6066 0.0319 -0.0012 0.0180 62 LEU C N 3014 C CA . LEU B 67 ? 0.4614 0.4245 0.6006 0.0326 -0.0013 0.0225 62 LEU C CA 3015 C C . LEU B 67 ? 0.4669 0.4322 0.6103 0.0356 -0.0016 0.0217 62 LEU C C 3016 O O . LEU B 67 ? 0.4151 0.3809 0.5599 0.0367 -0.0018 0.0254 62 LEU C O 3017 C CB . LEU B 67 ? 0.4741 0.4410 0.6061 0.0308 -0.0014 0.0243 62 LEU C CB 3018 C CG . LEU B 67 ? 0.5438 0.5085 0.6716 0.0285 -0.0013 0.0262 62 LEU C CG 3019 C CD1 . LEU B 67 ? 0.4937 0.4615 0.6140 0.0267 -0.0017 0.0263 62 LEU C CD1 3020 C CD2 . LEU B 67 ? 0.5989 0.5614 0.7286 0.0289 -0.0012 0.0311 62 LEU C CD2 3021 N N . GLY B 68 ? 0.4251 0.3921 0.5704 0.0369 -0.0018 0.0169 63 GLY C N 3022 C CA . GLY B 68 ? 0.4340 0.4043 0.5826 0.0400 -0.0021 0.0155 63 GLY C CA 3023 C C . GLY B 68 ? 0.4434 0.4209 0.5878 0.0400 -0.0020 0.0163 63 GLY C C 3024 O O . GLY B 68 ? 0.4823 0.4624 0.6289 0.0421 -0.0022 0.0180 63 GLY C O 3025 N N . ASN B 69 ? 0.4835 0.4647 0.6223 0.0376 -0.0018 0.0152 64 ASN C N 3026 C CA . ASN B 69 ? 0.5226 0.5114 0.6580 0.0374 -0.0018 0.0150 64 ASN C CA 3027 C C . ASN B 69 ? 0.5575 0.5504 0.6975 0.0410 -0.0019 0.0124 64 ASN C C 3028 O O . ASN B 69 ? 0.5145 0.5066 0.6580 0.0429 -0.0020 0.0080 64 ASN C O 3029 C CB . ASN B 69 ? 0.5507 0.5422 0.6811 0.0348 -0.0017 0.0125 64 ASN C CB 3030 C CG . ASN B 69 ? 0.5599 0.5593 0.6866 0.0339 -0.0019 0.0130 64 ASN C CG 3031 O OD1 . ASN B 69 ? 0.6019 0.6064 0.7310 0.0360 -0.0019 0.0127 64 ASN C OD1 3032 N ND2 . ASN B 69 ? 0.5840 0.5845 0.7049 0.0306 -0.0021 0.0137 64 ASN C ND2 3033 N N . PRO B 70 ? 0.5665 0.5644 0.7066 0.0422 -0.0021 0.0147 65 PRO C N 3034 C CA . PRO B 70 ? 0.5974 0.5985 0.7427 0.0463 -0.0023 0.0122 65 PRO C CA 3035 C C . PRO B 70 ? 0.6314 0.6391 0.7764 0.0473 -0.0022 0.0074 65 PRO C C 3036 O O . PRO B 70 ? 0.7378 0.7471 0.8872 0.0511 -0.0024 0.0041 65 PRO C O 3037 C CB . PRO B 70 ? 0.6092 0.6146 0.7542 0.0471 -0.0025 0.0161 65 PRO C CB 3038 C CG . PRO B 70 ? 0.5780 0.5842 0.7171 0.0431 -0.0025 0.0199 65 PRO C CG 3039 C CD . PRO B 70 ? 0.5592 0.5589 0.6960 0.0405 -0.0023 0.0195 65 PRO C CD 3040 N N . MET B 71 ? 0.7055 0.7167 0.8454 0.0443 -0.0019 0.0067 66 MET C N 3041 C CA . MET B 71 ? 0.7616 0.7785 0.9016 0.0453 -0.0017 0.0018 66 MET C CA 3042 C C . MET B 71 ? 0.7673 0.7784 0.9097 0.0462 -0.0017 -0.0024 66 MET C C 3043 O O . MET B 71 ? 0.7611 0.7764 0.9033 0.0470 -0.0015 -0.0065 66 MET C O 3044 C CB . MET B 71 ? 0.8116 0.8351 0.9455 0.0418 -0.0014 0.0029 66 MET C CB 3045 C CG . MET B 71 ? 0.9752 1.0100 1.1093 0.0434 -0.0013 0.0016 66 MET C CG 3046 S SD . MET B 71 ? 1.0528 1.0928 1.1878 0.0444 -0.0017 0.0057 66 MET C SD 3047 C CE . MET B 71 ? 1.0568 1.1009 1.1848 0.0388 -0.0019 0.0099 66 MET C CE 3048 N N . CYS B 72 ? 0.8261 0.8282 0.9710 0.0460 -0.0019 -0.0013 67 CYS C N 3049 C CA . CYS B 72 ? 0.9757 0.9720 1.1234 0.0466 -0.0021 -0.0051 67 CYS C CA 3050 C C . CYS B 72 ? 1.0506 1.0410 1.2056 0.0502 -0.0029 -0.0063 67 CYS C C 3051 O O . CYS B 72 ? 0.9241 0.9087 1.0824 0.0507 -0.0034 -0.0093 67 CYS C O 3052 C CB . CYS B 72 ? 0.9459 0.9359 1.0904 0.0428 -0.0018 -0.0027 67 CYS C CB 3053 S SG . CYS B 72 ? 0.8426 0.8363 0.9788 0.0384 -0.0013 -0.0010 67 CYS C SG 3054 N N . ASP B 73 ? 1.3480 1.3396 1.5055 0.0525 -0.0032 -0.0041 68 ASP C N 3055 C CA . ASP B 73 ? 1.5969 1.5816 1.7610 0.0556 -0.0042 -0.0037 68 ASP C CA 3056 C C . ASP B 73 ? 1.7249 1.7035 1.8942 0.0573 -0.0052 -0.0086 68 ASP C C 3057 O O . ASP B 73 ? 1.5386 1.5089 1.7129 0.0580 -0.0061 -0.0074 68 ASP C O 3058 C CB . ASP B 73 ? 1.4530 1.4428 1.6200 0.0598 -0.0047 -0.0042 68 ASP C CB 3059 C CG . ASP B 73 ? 1.3905 1.3867 1.5537 0.0587 -0.0041 0.0004 68 ASP C CG 3060 O OD1 . ASP B 73 ? 1.0493 1.0418 1.2121 0.0574 -0.0040 0.0056 68 ASP C OD1 3061 O OD2 . ASP B 73 ? 1.3346 1.3400 1.4953 0.0594 -0.0037 -0.0012 68 ASP C OD2 3062 N N . GLU B 74 ? 1.8503 1.8330 2.0180 0.0576 -0.0050 -0.0137 69 GLU C N 3063 C CA . GLU B 74 ? 1.9040 1.8875 2.0761 0.0615 -0.0061 -0.0204 69 GLU C CA 3064 C C . GLU B 74 ? 1.9890 1.9622 2.1665 0.0618 -0.0073 -0.0218 69 GLU C C 3065 O O . GLU B 74 ? 1.8507 1.8227 2.0317 0.0642 -0.0084 -0.0278 69 GLU C O 3066 C CB . GLU B 74 ? 1.8603 1.8510 2.0284 0.0608 -0.0054 -0.0248 69 GLU C CB 3067 C CG . GLU B 74 ? 1.7000 1.6984 1.8611 0.0575 -0.0040 -0.0213 69 GLU C CG 3068 C CD . GLU B 74 ? 1.5550 1.5635 1.7126 0.0579 -0.0034 -0.0250 69 GLU C CD 3069 O OE1 . GLU B 74 ? 1.5355 1.5453 1.6951 0.0600 -0.0038 -0.0307 69 GLU C OE1 3070 O OE2 . GLU B 74 ? 1.3212 1.3366 1.4740 0.0557 -0.0025 -0.0219 69 GLU C OE2 3071 N N . PHE B 75 ? 2.0966 2.0629 2.2752 0.0595 -0.0073 -0.0163 70 PHE C N 3072 C CA . PHE B 75 ? 2.0985 2.0558 2.2798 0.0572 -0.0078 -0.0157 70 PHE C CA 3073 C C . PHE B 75 ? 2.0844 2.0359 2.2726 0.0601 -0.0098 -0.0208 70 PHE C C 3074 O O . PHE B 75 ? 1.8433 1.7879 2.0372 0.0614 -0.0111 -0.0190 70 PHE C O 3075 C CB . PHE B 75 ? 2.0453 1.9972 2.2271 0.0547 -0.0076 -0.0086 70 PHE C CB 3076 C CG . PHE B 75 ? 2.1504 2.0956 2.3334 0.0513 -0.0076 -0.0074 70 PHE C CG 3077 C CD1 . PHE B 75 ? 1.9792 1.9266 2.1564 0.0476 -0.0063 -0.0064 70 PHE C CD1 3078 C CD2 . PHE B 75 ? 2.1788 2.1156 2.3687 0.0519 -0.0092 -0.0076 70 PHE C CD2 3079 C CE1 . PHE B 75 ? 1.7930 1.7351 1.9712 0.0447 -0.0064 -0.0055 70 PHE C CE1 3080 C CE2 . PHE B 75 ? 2.0758 2.0073 2.2668 0.0486 -0.0093 -0.0065 70 PHE C CE2 3081 C CZ . PHE B 75 ? 1.8326 1.7671 2.0177 0.0451 -0.0078 -0.0054 70 PHE C CZ 3082 N N . ILE B 76 ? 2.1786 2.1334 2.3664 0.0612 -0.0101 -0.0272 71 ILE C N 3083 C CA . ILE B 76 ? 2.1310 2.0797 2.3244 0.0626 -0.0119 -0.0324 71 ILE C CA 3084 C C . ILE B 76 ? 1.9081 1.8508 2.1010 0.0577 -0.0115 -0.0296 71 ILE C C 3085 O O . ILE B 76 ? 1.8545 1.8005 2.0415 0.0543 -0.0097 -0.0267 71 ILE C O 3086 C CB . ILE B 76 ? 2.0352 1.9905 2.2275 0.0652 -0.0122 -0.0402 71 ILE C CB 3087 C CG1 . ILE B 76 ? 1.9875 1.9494 2.1809 0.0705 -0.0128 -0.0431 71 ILE C CG1 3088 C CG2 . ILE B 76 ? 1.9057 1.8548 2.1028 0.0656 -0.0140 -0.0456 71 ILE C CG2 3089 C CD1 . ILE B 76 ? 1.9232 1.8786 2.1234 0.0745 -0.0150 -0.0437 71 ILE C CD1 3090 N N . ARG B 77 ? 1.6507 1.5846 1.8500 0.0576 -0.0133 -0.0302 72 ARG C N 3091 C CA . ARG B 77 ? 1.3759 1.3046 1.5757 0.0534 -0.0132 -0.0286 72 ARG C CA 3092 C C . ARG B 77 ? 1.1865 1.1171 1.3856 0.0532 -0.0135 -0.0354 72 ARG C C 3093 O O . ARG B 77 ? 1.0921 1.0228 1.2947 0.0568 -0.0152 -0.0418 72 ARG C O 3094 C CB . ARG B 77 ? 1.4982 1.4167 1.7057 0.0531 -0.0152 -0.0266 72 ARG C CB 3095 C CG . ARG B 77 ? 1.6560 1.5713 1.8666 0.0548 -0.0158 -0.0214 72 ARG C CG 3096 C CD . ARG B 77 ? 1.7577 1.6657 1.9765 0.0583 -0.0188 -0.0248 72 ARG C CD 3097 N NE . ARG B 77 ? 1.6858 1.5915 1.9076 0.0610 -0.0195 -0.0211 72 ARG C NE 3098 C CZ . ARG B 77 ? 1.6200 1.5173 1.8493 0.0630 -0.0222 -0.0211 72 ARG C CZ 3099 N NH1 . ARG B 77 ? 1.4971 1.3869 1.7320 0.0623 -0.0245 -0.0246 72 ARG C NH1 3100 N NH2 . ARG B 77 ? 1.6706 1.5666 1.9019 0.0657 -0.0227 -0.0175 72 ARG C NH2 3101 N N . VAL B 78 ? 1.1563 1.0891 1.3507 0.0495 -0.0120 -0.0341 73 VAL C N 3102 C CA . VAL B 78 ? 1.1319 1.0620 1.3280 0.0476 -0.0127 -0.0378 73 VAL C CA 3103 C C . VAL B 78 ? 0.9995 0.9228 1.1979 0.0439 -0.0127 -0.0316 73 VAL C C 3104 O O . VAL B 78 ? 1.0179 0.9431 1.2118 0.0414 -0.0110 -0.0258 73 VAL C O 3105 C CB . VAL B 78 ? 1.0904 1.0277 1.2795 0.0460 -0.0111 -0.0401 73 VAL C CB 3106 N N . PRO B 79 ? 0.9270 0.8424 1.1326 0.0436 -0.0148 -0.0325 74 PRO C N 3107 C CA . PRO B 79 ? 0.8071 0.7170 1.0152 0.0397 -0.0147 -0.0262 74 PRO C CA 3108 C C . PRO B 79 ? 0.7091 0.6201 0.9146 0.0358 -0.0139 -0.0264 74 PRO C C 3109 O O . PRO B 79 ? 0.6791 0.5876 0.8851 0.0325 -0.0134 -0.0209 74 PRO C O 3110 C CB . PRO B 79 ? 0.8380 0.7392 1.0553 0.0408 -0.0176 -0.0273 74 PRO C CB 3111 C CG . PRO B 79 ? 0.8967 0.7986 1.1161 0.0443 -0.0193 -0.0361 74 PRO C CG 3112 C CD . PRO B 79 ? 0.9124 0.8235 1.1248 0.0469 -0.0175 -0.0386 74 PRO C CD 3113 N N . GLU B 80 ? 0.6491 0.5642 0.8520 0.0365 -0.0137 -0.0326 75 GLU C N 3114 C CA . GLU B 80 ? 0.6846 0.6022 0.8838 0.0333 -0.0127 -0.0330 75 GLU C CA 3115 C C . GLU B 80 ? 0.6105 0.5356 0.8035 0.0348 -0.0116 -0.0382 75 GLU C C 3116 O O . GLU B 80 ? 0.6491 0.5768 0.8426 0.0383 -0.0123 -0.0428 75 GLU C O 3117 C CB . GLU B 80 ? 0.7142 0.6261 0.9199 0.0314 -0.0146 -0.0354 75 GLU C CB 3118 C CG . GLU B 80 ? 0.8161 0.7271 1.0259 0.0341 -0.0167 -0.0439 75 GLU C CG 3119 C CD . GLU B 80 ? 0.9200 0.8272 1.1343 0.0316 -0.0182 -0.0468 75 GLU C CD 3120 O OE1 . GLU B 80 ? 0.9359 0.8398 1.1559 0.0337 -0.0207 -0.0529 75 GLU C OE1 3121 O OE2 . GLU B 80 ? 0.9938 0.9019 1.2060 0.0278 -0.0171 -0.0434 75 GLU C OE2 3122 N N . TRP B 81 ? 0.5572 0.4861 0.7445 0.0323 -0.0101 -0.0372 76 TRP C N 3123 C CA . TRP B 81 ? 0.5094 0.4456 0.6907 0.0332 -0.0091 -0.0415 76 TRP C CA 3124 C C . TRP B 81 ? 0.5392 0.4770 0.7167 0.0302 -0.0083 -0.0413 76 TRP C C 3125 O O . TRP B 81 ? 0.5499 0.4846 0.7278 0.0273 -0.0079 -0.0367 76 TRP C O 3126 C CB . TRP B 81 ? 0.4995 0.4413 0.6746 0.0345 -0.0076 -0.0391 76 TRP C CB 3127 C CG . TRP B 81 ? 0.5556 0.4974 0.7262 0.0319 -0.0062 -0.0320 76 TRP C CG 3128 C CD1 . TRP B 81 ? 0.5538 0.4987 0.7178 0.0296 -0.0049 -0.0299 76 TRP C CD1 3129 C CD2 . TRP B 81 ? 0.5164 0.4553 0.6885 0.0319 -0.0061 -0.0263 76 TRP C CD2 3130 N NE1 . TRP B 81 ? 0.5486 0.4925 0.7099 0.0281 -0.0040 -0.0235 76 TRP C NE1 3131 C CE2 . TRP B 81 ? 0.5455 0.4860 0.7118 0.0295 -0.0047 -0.0211 76 TRP C CE2 3132 C CE3 . TRP B 81 ? 0.5270 0.4619 0.7049 0.0338 -0.0071 -0.0251 76 TRP C CE3 3133 C CZ2 . TRP B 81 ? 0.5783 0.5172 0.7442 0.0289 -0.0042 -0.0149 76 TRP C CZ2 3134 C CZ3 . TRP B 81 ? 0.6127 0.5459 0.7903 0.0331 -0.0066 -0.0186 76 TRP C CZ3 3135 C CH2 . TRP B 81 ? 0.5580 0.4933 0.7297 0.0306 -0.0052 -0.0136 76 TRP C CH2 3136 N N . SER B 82 ? 0.4941 0.4373 0.6681 0.0311 -0.0080 -0.0463 77 SER C N 3137 C CA . SER B 82 ? 0.5074 0.4524 0.6780 0.0287 -0.0074 -0.0471 77 SER C CA 3138 C C . SER B 82 ? 0.5136 0.4640 0.6752 0.0276 -0.0055 -0.0442 77 SER C C 3139 O O . SER B 82 ? 0.4752 0.4261 0.6335 0.0252 -0.0048 -0.0424 77 SER C O 3140 C CB . SER B 82 ? 0.5102 0.4577 0.6827 0.0303 -0.0084 -0.0546 77 SER C CB 3141 O OG . SER B 82 ? 0.5339 0.4870 0.7037 0.0334 -0.0082 -0.0580 77 SER C OG 3142 N N . TYR B 83 ? 0.4602 0.4150 0.6182 0.0295 -0.0049 -0.0441 78 TYR C N 3143 C CA . TYR B 83 ? 0.4787 0.4377 0.6286 0.0283 -0.0035 -0.0406 78 TYR C CA 3144 C C . TYR B 83 ? 0.4934 0.4547 0.6419 0.0299 -0.0031 -0.0384 78 TYR C C 3145 O O . TYR B 83 ? 0.5907 0.5513 0.7441 0.0323 -0.0039 -0.0404 78 TYR C O 3146 C CB . TYR B 83 ? 0.4815 0.4461 0.6264 0.0283 -0.0031 -0.0443 78 TYR C CB 3147 C CG . TYR B 83 ? 0.4774 0.4473 0.6234 0.0311 -0.0035 -0.0502 78 TYR C CG 3148 C CD1 . TYR B 83 ? 0.4798 0.4484 0.6320 0.0329 -0.0048 -0.0559 78 TYR C CD1 3149 C CD2 . TYR B 83 ? 0.4687 0.4452 0.6095 0.0320 -0.0028 -0.0502 78 TYR C CD2 3150 C CE1 . TYR B 83 ? 0.4985 0.4727 0.6512 0.0358 -0.0053 -0.0616 78 TYR C CE1 3151 C CE2 . TYR B 83 ? 0.5459 0.5284 0.6874 0.0347 -0.0031 -0.0554 78 TYR C CE2 3152 C CZ . TYR B 83 ? 0.5067 0.4882 0.6540 0.0368 -0.0043 -0.0613 78 TYR C CZ 3153 O OH . TYR B 83 ? 0.5195 0.5080 0.6671 0.0399 -0.0046 -0.0665 78 TYR C OH 3154 N N . ILE B 84 ? 0.4306 0.3942 0.5727 0.0287 -0.0022 -0.0342 79 ILE C N 3155 C CA . ILE B 84 ? 0.4524 0.4193 0.5926 0.0299 -0.0018 -0.0322 79 ILE C CA 3156 C C . ILE B 84 ? 0.4400 0.4141 0.5745 0.0301 -0.0013 -0.0339 79 ILE C C 3157 O O . ILE B 84 ? 0.5159 0.4912 0.6453 0.0283 -0.0010 -0.0335 79 ILE C O 3158 C CB . ILE B 84 ? 0.4797 0.4442 0.6172 0.0282 -0.0014 -0.0257 79 ILE C CB 3159 C CG1 . ILE B 84 ? 0.5090 0.4671 0.6522 0.0279 -0.0018 -0.0232 79 ILE C CG1 3160 C CG2 . ILE B 84 ? 0.4928 0.4611 0.6281 0.0292 -0.0011 -0.0236 79 ILE C CG2 3161 C CD1 . ILE B 84 ? 0.4565 0.4127 0.5977 0.0267 -0.0014 -0.0169 79 ILE C CD1 3162 N N . VAL B 85 ? 0.4823 0.4613 0.6176 0.0324 -0.0014 -0.0357 80 VAL C N 3163 C CA . VAL B 85 ? 0.4830 0.4697 0.6132 0.0326 -0.0009 -0.0366 80 VAL C CA 3164 C C . VAL B 85 ? 0.4607 0.4498 0.5885 0.0322 -0.0006 -0.0321 80 VAL C C 3165 O O . VAL B 85 ? 0.5401 0.5288 0.6716 0.0341 -0.0008 -0.0316 80 VAL C O 3166 C CB . VAL B 85 ? 0.5054 0.4978 0.6387 0.0357 -0.0013 -0.0424 80 VAL C CB 3167 C CG1 . VAL B 85 ? 0.5469 0.5482 0.6750 0.0358 -0.0007 -0.0425 80 VAL C CG1 3168 C CG2 . VAL B 85 ? 0.5771 0.5676 0.7131 0.0362 -0.0018 -0.0474 80 VAL C CG2 3169 N N . GLU B 86 ? 0.4716 0.4625 0.5929 0.0298 -0.0003 -0.0287 81 GLU C N 3170 C CA . GLU B 86 ? 0.4891 0.4824 0.6073 0.0289 -0.0002 -0.0243 81 GLU C CA 3171 C C . GLU B 86 ? 0.5045 0.5056 0.6180 0.0283 0.0000 -0.0249 81 GLU C C 3172 O O . GLU B 86 ? 0.5129 0.5158 0.6237 0.0275 0.0000 -0.0270 81 GLU C O 3173 C CB . GLU B 86 ? 0.5083 0.4958 0.6232 0.0263 -0.0002 -0.0195 81 GLU C CB 3174 C CG . GLU B 86 ? 0.5365 0.5233 0.6504 0.0257 -0.0004 -0.0148 81 GLU C CG 3175 C CD . GLU B 86 ? 0.5731 0.5544 0.6835 0.0234 -0.0006 -0.0107 81 GLU C CD 3176 O OE1 . GLU B 86 ? 0.5506 0.5309 0.6560 0.0216 -0.0008 -0.0104 81 GLU C OE1 3177 O OE2 . GLU B 86 ? 0.6067 0.5849 0.7190 0.0236 -0.0007 -0.0076 81 GLU C OE2 3178 N N . ARG B 87 ? 0.5012 0.5076 0.6141 0.0287 0.0000 -0.0231 82 ARG C N 3179 C CA . ARG B 87 ? 0.5190 0.5330 0.6272 0.0274 0.0000 -0.0224 82 ARG C CA 3180 C C . ARG B 87 ? 0.4979 0.5090 0.5998 0.0238 -0.0003 -0.0181 82 ARG C C 3181 O O . ARG B 87 ? 0.4562 0.4607 0.5575 0.0226 -0.0006 -0.0153 82 ARG C O 3182 C CB . ARG B 87 ? 0.5897 0.6107 0.6992 0.0286 0.0001 -0.0213 82 ARG C CB 3183 C CG . ARG B 87 ? 0.7116 0.7376 0.8264 0.0326 0.0003 -0.0263 82 ARG C CG 3184 C CD . ARG B 87 ? 0.8651 0.8988 0.9811 0.0341 0.0004 -0.0253 82 ARG C CD 3185 N NE . ARG B 87 ? 1.0453 1.0817 1.1670 0.0385 0.0004 -0.0303 82 ARG C NE 3186 C CZ . ARG B 87 ? 1.0533 1.0959 1.1776 0.0412 0.0005 -0.0307 82 ARG C CZ 3187 N NH1 . ARG B 87 ? 1.0387 1.0860 1.1605 0.0395 0.0006 -0.0262 82 ARG C NH1 3188 N NH2 . ARG B 87 ? 1.0603 1.1044 1.1899 0.0455 0.0002 -0.0357 82 ARG C NH2 3189 N N . ALA B 88 ? 0.5050 0.5213 0.6024 0.0223 -0.0005 -0.0178 83 ALA C N 3190 C CA . ALA B 88 ? 0.5303 0.5436 0.6215 0.0189 -0.0013 -0.0139 83 ALA C CA 3191 C C . ALA B 88 ? 0.6001 0.6111 0.6902 0.0175 -0.0019 -0.0093 83 ALA C C 3192 O O . ALA B 88 ? 0.6333 0.6378 0.7205 0.0158 -0.0025 -0.0067 83 ALA C O 3193 C CB . ALA B 88 ? 0.5089 0.5289 0.5959 0.0174 -0.0015 -0.0135 83 ALA C CB 3194 N N . ASN B 89 ? 0.6397 0.6562 0.7321 0.0184 -0.0017 -0.0085 84 ASN C N 3195 C CA . ASN B 89 ? 0.6891 0.7049 0.7808 0.0171 -0.0023 -0.0042 84 ASN C CA 3196 C C . ASN B 89 ? 0.6266 0.6446 0.7238 0.0198 -0.0017 -0.0049 84 ASN C C 3197 O O . ASN B 89 ? 0.5458 0.5714 0.6440 0.0203 -0.0016 -0.0044 84 ASN C O 3198 C CB . ASN B 89 ? 0.8114 0.8332 0.8988 0.0144 -0.0031 -0.0012 84 ASN C CB 3199 C CG . ASN B 89 ? 0.9108 0.9293 0.9923 0.0115 -0.0041 0.0002 84 ASN C CG 3200 O OD1 . ASN B 89 ? 1.0504 1.0617 1.1292 0.0101 -0.0050 0.0023 84 ASN C OD1 3201 N ND2 . ASN B 89 ? 1.0004 1.0246 1.0801 0.0108 -0.0041 -0.0009 84 ASN C ND2 3202 N N . PRO B 90 ? 0.5836 0.5953 0.6845 0.0216 -0.0014 -0.0059 85 PRO C N 3203 C CA . PRO B 90 ? 0.5663 0.5793 0.6725 0.0243 -0.0010 -0.0063 85 PRO C CA 3204 C C . PRO B 90 ? 0.5512 0.5670 0.6556 0.0230 -0.0015 -0.0020 85 PRO C C 3205 O O . PRO B 90 ? 0.5458 0.5586 0.6458 0.0201 -0.0023 0.0015 85 PRO C O 3206 C CB . PRO B 90 ? 0.5727 0.5771 0.6819 0.0252 -0.0009 -0.0063 85 PRO C CB 3207 C CG . PRO B 90 ? 0.5866 0.5863 0.6927 0.0235 -0.0010 -0.0071 85 PRO C CG 3208 C CD . PRO B 90 ? 0.5571 0.5603 0.6571 0.0209 -0.0015 -0.0056 85 PRO C CD 3209 N N . ALA B 91 ? 0.5548 0.5770 0.6627 0.0252 -0.0013 -0.0026 86 ALA C N 3210 C CA . ALA B 91 ? 0.6253 0.6517 0.7320 0.0241 -0.0017 0.0011 86 ALA C CA 3211 C C . ALA B 91 ? 0.6238 0.6443 0.7324 0.0247 -0.0020 0.0038 86 ALA C C 3212 O O . ALA B 91 ? 0.6427 0.6634 0.7487 0.0228 -0.0027 0.0077 86 ALA C O 3213 C CB . ALA B 91 ? 0.6193 0.6557 0.7289 0.0264 -0.0013 -0.0004 86 ALA C CB 3214 N N . ASN B 92 ? 0.5366 0.5520 0.6497 0.0274 -0.0015 0.0017 87 ASN C N 3215 C CA . ASN B 92 ? 0.5743 0.5847 0.6898 0.0283 -0.0016 0.0044 87 ASN C CA 3216 C C . ASN B 92 ? 0.5923 0.5938 0.7068 0.0271 -0.0017 0.0054 87 ASN C C 3217 O O . ASN B 92 ? 0.4823 0.4797 0.5993 0.0282 -0.0013 0.0026 87 ASN C O 3218 C CB . ASN B 92 ? 0.6506 0.6622 0.7725 0.0324 -0.0012 0.0021 87 ASN C CB 3219 C CG . ASN B 92 ? 0.6313 0.6527 0.7542 0.0340 -0.0011 0.0008 87 ASN C CG 3220 O OD1 . ASN B 92 ? 0.6429 0.6678 0.7689 0.0367 -0.0008 -0.0034 87 ASN C OD1 3221 N ND2 . ASN B 92 ? 0.5655 0.5919 0.6858 0.0324 -0.0015 0.0043 87 ASN C ND2 3222 N N . ASP B 93 ? 0.5790 0.5779 0.6898 0.0249 -0.0023 0.0094 88 ASP C N 3223 C CA . ASP B 93 ? 0.5133 0.5053 0.6220 0.0236 -0.0025 0.0108 88 ASP C CA 3224 C C . ASP B 93 ? 0.5000 0.4895 0.6089 0.0237 -0.0028 0.0149 88 ASP C C 3225 O O . ASP B 93 ? 0.5629 0.5516 0.6768 0.0260 -0.0024 0.0155 88 ASP C O 3226 C CB . ASP B 93 ? 0.5958 0.5878 0.6983 0.0207 -0.0031 0.0106 88 ASP C CB 3227 C CG . ASP B 93 ? 0.6393 0.6247 0.7388 0.0194 -0.0034 0.0118 88 ASP C CG 3228 O OD1 . ASP B 93 ? 0.5926 0.5741 0.6949 0.0204 -0.0027 0.0102 88 ASP C OD1 3229 O OD2 . ASP B 93 ? 0.7649 0.7496 0.8592 0.0173 -0.0045 0.0143 88 ASP C OD2 3230 N N . LEU B 94 ? 0.4664 0.4547 0.5700 0.0214 -0.0037 0.0178 89 LEU C N 3231 C CA . LEU B 94 ? 0.5009 0.4879 0.6046 0.0217 -0.0041 0.0215 89 LEU C CA 3232 C C . LEU B 94 ? 0.4658 0.4588 0.5687 0.0214 -0.0048 0.0232 89 LEU C C 3233 O O . LEU B 94 ? 0.4544 0.4491 0.5524 0.0189 -0.0059 0.0246 89 LEU C O 3234 C CB . LEU B 94 ? 0.5134 0.4963 0.6123 0.0200 -0.0049 0.0236 89 LEU C CB 3235 C CG . LEU B 94 ? 0.5525 0.5301 0.6519 0.0202 -0.0043 0.0223 89 LEU C CG 3236 C CD1 . LEU B 94 ? 0.5453 0.5200 0.6388 0.0185 -0.0053 0.0238 89 LEU C CD1 3237 C CD2 . LEU B 94 ? 0.5057 0.4809 0.6109 0.0223 -0.0034 0.0234 89 LEU C CD2 3238 N N . CYS B 95 ? 0.4733 0.4695 0.5813 0.0238 -0.0042 0.0230 90 CYS C N 3239 C CA . CYS B 95 ? 0.4812 0.4840 0.5891 0.0238 -0.0046 0.0243 90 CYS C CA 3240 C C . CYS B 95 ? 0.4611 0.4635 0.5653 0.0222 -0.0058 0.0283 90 CYS C C 3241 O O . CYS B 95 ? 0.4444 0.4506 0.5448 0.0198 -0.0069 0.0294 90 CYS C O 3242 C CB . CYS B 95 ? 0.4987 0.5043 0.6128 0.0274 -0.0038 0.0235 90 CYS C CB 3243 S SG . CYS B 95 ? 0.5570 0.5568 0.6762 0.0303 -0.0034 0.0254 90 CYS C SG 3244 N N . TYR B 96 ? 0.4086 0.4064 0.5137 0.0232 -0.0057 0.0303 91 TYR C N 3245 C CA . TYR B 96 ? 0.3983 0.3951 0.4993 0.0217 -0.0069 0.0336 91 TYR C CA 3246 C C . TYR B 96 ? 0.4020 0.3941 0.4982 0.0196 -0.0075 0.0329 91 TYR C C 3247 O O . TYR B 96 ? 0.4845 0.4723 0.5819 0.0204 -0.0067 0.0317 91 TYR C O 3248 C CB . TYR B 96 ? 0.3845 0.3795 0.4886 0.0240 -0.0065 0.0364 91 TYR C CB 3249 C CG . TYR B 96 ? 0.3996 0.3961 0.5001 0.0230 -0.0078 0.0397 91 TYR C CG 3250 C CD1 . TYR B 96 ? 0.4008 0.4025 0.5025 0.0236 -0.0083 0.0414 91 TYR C CD1 3251 C CD2 . TYR B 96 ? 0.4077 0.4007 0.5032 0.0214 -0.0088 0.0406 91 TYR C CD2 3252 C CE1 . TYR B 96 ? 0.4147 0.4181 0.5129 0.0226 -0.0097 0.0441 91 TYR C CE1 3253 C CE2 . TYR B 96 ? 0.4470 0.4414 0.5388 0.0206 -0.0104 0.0430 91 TYR C CE2 3254 C CZ . TYR B 96 ? 0.4627 0.4622 0.5559 0.0210 -0.0109 0.0448 91 TYR C CZ 3255 O OH . TYR B 96 ? 0.4480 0.4489 0.5374 0.0201 -0.0126 0.0469 91 TYR C OH 3256 N N . PRO B 97 ? 0.3954 0.3882 0.4860 0.0170 -0.0091 0.0336 92 PRO C N 3257 C CA . PRO B 97 ? 0.4126 0.4013 0.4986 0.0151 -0.0098 0.0322 92 PRO C CA 3258 C C . PRO B 97 ? 0.4158 0.3993 0.4998 0.0158 -0.0101 0.0334 92 PRO C C 3259 O O . PRO B 97 ? 0.4045 0.3883 0.4893 0.0170 -0.0102 0.0359 92 PRO C O 3260 C CB . PRO B 97 ? 0.4155 0.4063 0.4964 0.0122 -0.0119 0.0331 92 PRO C CB 3261 C CG . PRO B 97 ? 0.4018 0.3965 0.4839 0.0126 -0.0125 0.0357 92 PRO C CG 3262 C CD . PRO B 97 ? 0.4330 0.4306 0.5216 0.0154 -0.0105 0.0354 92 PRO C CD 3263 N N . GLY B 98 ? 0.4198 0.3994 0.5014 0.0152 -0.0100 0.0316 93 GLY C N 3264 C CA . GLY B 98 ? 0.4435 0.4191 0.5233 0.0159 -0.0101 0.0324 93 GLY C CA 3265 C C . GLY B 98 ? 0.4363 0.4085 0.5158 0.0159 -0.0093 0.0299 93 GLY C C 3266 O O . GLY B 98 ? 0.4465 0.4184 0.5234 0.0144 -0.0098 0.0278 93 GLY C O 3267 N N . ASN B 99 ? 0.4219 0.3919 0.5042 0.0174 -0.0081 0.0305 94 ASN C N 3268 C CA . ASN B 99 ? 0.4210 0.3881 0.5037 0.0175 -0.0073 0.0283 94 ASN C CA 3269 C C . ASN B 99 ? 0.4571 0.4232 0.5460 0.0191 -0.0056 0.0288 94 ASN C C 3270 O O . ASN B 99 ? 0.4220 0.3890 0.5144 0.0203 -0.0052 0.0315 94 ASN C O 3271 C CB . ASN B 99 ? 0.4695 0.4343 0.5467 0.0172 -0.0084 0.0289 94 ASN C CB 3272 C CG . ASN B 99 ? 0.4867 0.4512 0.5572 0.0156 -0.0105 0.0284 94 ASN C CG 3273 O OD1 . ASN B 99 ? 0.5391 0.5039 0.6062 0.0154 -0.0121 0.0303 94 ASN C OD1 3274 N ND2 . ASN B 99 ? 0.5028 0.4666 0.5716 0.0143 -0.0108 0.0258 94 ASN C ND2 3275 N N . LEU B 100 ? 0.4636 0.4279 0.5540 0.0190 -0.0048 0.0263 95 LEU C N 3276 C CA . LEU B 100 ? 0.4337 0.3961 0.5293 0.0199 -0.0036 0.0266 95 LEU C CA 3277 C C . LEU B 100 ? 0.4190 0.3796 0.5114 0.0194 -0.0037 0.0260 95 LEU C C 3278 O O . LEU B 100 ? 0.3669 0.3268 0.4563 0.0185 -0.0040 0.0231 95 LEU C O 3279 C CB . LEU B 100 ? 0.4688 0.4311 0.5696 0.0203 -0.0027 0.0234 95 LEU C CB 3280 C CG . LEU B 100 ? 0.5354 0.4962 0.6437 0.0216 -0.0018 0.0241 95 LEU C CG 3281 C CD1 . LEU B 100 ? 0.5607 0.5208 0.6729 0.0219 -0.0013 0.0200 95 LEU C CD1 3282 C CD2 . LEU B 100 ? 0.5830 0.5419 0.6926 0.0216 -0.0014 0.0269 95 LEU C CD2 3283 N N . ASN B 101 ? 0.4217 0.3819 0.5145 0.0200 -0.0035 0.0289 96 ASN C N 3284 C CA . ASN B 101 ? 0.4093 0.3687 0.4986 0.0197 -0.0037 0.0288 96 ASN C CA 3285 C C . ASN B 101 ? 0.4052 0.3631 0.4976 0.0193 -0.0027 0.0262 96 ASN C C 3286 O O . ASN B 101 ? 0.3913 0.3485 0.4901 0.0194 -0.0018 0.0257 96 ASN C O 3287 C CB . ASN B 101 ? 0.4409 0.4014 0.5307 0.0207 -0.0035 0.0328 96 ASN C CB 3288 C CG . ASN B 101 ? 0.4660 0.4269 0.5506 0.0209 -0.0041 0.0329 96 ASN C CG 3289 O OD1 . ASN B 101 ? 0.5255 0.4861 0.6034 0.0208 -0.0055 0.0316 96 ASN C OD1 3290 N ND2 . ASN B 101 ? 0.3995 0.3611 0.4870 0.0212 -0.0031 0.0346 96 ASN C ND2 3291 N N . ASP B 102 ? 0.4048 0.3622 0.4927 0.0188 -0.0032 0.0243 97 ASP C N 3292 C CA . ASP B 102 ? 0.4069 0.3633 0.4971 0.0183 -0.0024 0.0216 97 ASP C CA 3293 C C . ASP B 102 ? 0.3778 0.3336 0.4724 0.0180 -0.0019 0.0185 97 ASP C C 3294 O O . ASP B 102 ? 0.4082 0.3632 0.5084 0.0179 -0.0011 0.0173 97 ASP C O 3295 C CB . ASP B 102 ? 0.4548 0.4114 0.5494 0.0186 -0.0015 0.0240 97 ASP C CB 3296 C CG . ASP B 102 ? 0.5250 0.4831 0.6146 0.0190 -0.0019 0.0257 97 ASP C CG 3297 O OD1 . ASP B 102 ? 0.5596 0.5175 0.6427 0.0191 -0.0029 0.0238 97 ASP C OD1 3298 O OD2 . ASP B 102 ? 0.6209 0.5805 0.7128 0.0194 -0.0014 0.0291 97 ASP C OD2 3299 N N . TYR B 103 ? 0.3505 0.3072 0.4429 0.0178 -0.0025 0.0173 98 TYR C N 3300 C CA . TYR B 103 ? 0.3589 0.3162 0.4557 0.0180 -0.0020 0.0148 98 TYR C CA 3301 C C . TYR B 103 ? 0.3454 0.3022 0.4437 0.0177 -0.0015 0.0109 98 TYR C C 3302 O O . TYR B 103 ? 0.3728 0.3292 0.4769 0.0182 -0.0009 0.0090 98 TYR C O 3303 C CB . TYR B 103 ? 0.3771 0.3364 0.4702 0.0177 -0.0028 0.0143 98 TYR C CB 3304 C CG . TYR B 103 ? 0.4259 0.3873 0.5230 0.0182 -0.0023 0.0118 98 TYR C CG 3305 C CD1 . TYR B 103 ? 0.3930 0.3539 0.4972 0.0195 -0.0015 0.0114 98 TYR C CD1 3306 C CD2 . TYR B 103 ? 0.3798 0.3438 0.4733 0.0174 -0.0029 0.0101 98 TYR C CD2 3307 C CE1 . TYR B 103 ? 0.4330 0.3961 0.5405 0.0204 -0.0013 0.0089 98 TYR C CE1 3308 C CE2 . TYR B 103 ? 0.3818 0.3489 0.4787 0.0182 -0.0025 0.0080 98 TYR C CE2 3309 C CZ . TYR B 103 ? 0.4285 0.3953 0.5323 0.0198 -0.0017 0.0071 98 TYR C CZ 3310 O OH . TYR B 103 ? 0.4445 0.4146 0.5516 0.0210 -0.0014 0.0046 98 TYR C OH 3311 N N . GLU B 104 ? 0.3559 0.3126 0.4489 0.0170 -0.0020 0.0096 99 GLU C N 3312 C CA . GLU B 104 ? 0.3834 0.3403 0.4770 0.0167 -0.0017 0.0057 99 GLU C CA 3313 C C . GLU B 104 ? 0.3779 0.3335 0.4766 0.0168 -0.0010 0.0052 99 GLU C C 3314 O O . GLU B 104 ? 0.4152 0.3708 0.5179 0.0169 -0.0006 0.0020 99 GLU C O 3315 C CB . GLU B 104 ? 0.4059 0.3630 0.4922 0.0160 -0.0026 0.0046 99 GLU C CB 3316 C CG . GLU B 104 ? 0.4179 0.3763 0.4993 0.0155 -0.0036 0.0049 99 GLU C CG 3317 C CD . GLU B 104 ? 0.4709 0.4285 0.5486 0.0154 -0.0046 0.0085 99 GLU C CD 3318 O OE1 . GLU B 104 ? 0.4526 0.4090 0.5303 0.0159 -0.0046 0.0108 99 GLU C OE1 3319 O OE2 . GLU B 104 ? 0.6414 0.6000 0.7163 0.0147 -0.0055 0.0093 99 GLU C OE2 3320 N N . GLU B 105 ? 0.3898 0.3446 0.4885 0.0168 -0.0009 0.0085 100 GLU C N 3321 C CA . GLU B 105 ? 0.4009 0.3547 0.5048 0.0165 -0.0002 0.0089 100 GLU C CA 3322 C C . GLU B 105 ? 0.4021 0.3546 0.5138 0.0168 0.0001 0.0094 100 GLU C C 3323 O O . GLU B 105 ? 0.4539 0.4053 0.5711 0.0165 0.0003 0.0075 100 GLU C O 3324 C CB . GLU B 105 ? 0.4032 0.3576 0.5050 0.0164 -0.0002 0.0128 100 GLU C CB 3325 C CG . GLU B 105 ? 0.4118 0.3672 0.5068 0.0164 -0.0007 0.0117 100 GLU C CG 3326 C CD . GLU B 105 ? 0.4558 0.4116 0.5529 0.0158 -0.0003 0.0088 100 GLU C CD 3327 O OE1 . GLU B 105 ? 0.4771 0.4328 0.5806 0.0152 0.0003 0.0094 100 GLU C OE1 3328 O OE2 . GLU B 105 ? 0.4481 0.4043 0.5402 0.0159 -0.0007 0.0060 100 GLU C OE2 3329 N N . LEU B 106 ? 0.4373 0.3899 0.5496 0.0175 0.0000 0.0117 101 LEU C N 3330 C CA . LEU B 106 ? 0.4023 0.3536 0.5218 0.0183 0.0002 0.0118 101 LEU C CA 3331 C C . LEU B 106 ? 0.3852 0.3364 0.5076 0.0188 0.0001 0.0067 101 LEU C C 3332 O O . LEU B 106 ? 0.4267 0.3759 0.5555 0.0191 0.0000 0.0052 101 LEU C O 3333 C CB . LEU B 106 ? 0.4084 0.3605 0.5272 0.0192 0.0000 0.0148 101 LEU C CB 3334 C CG . LEU B 106 ? 0.3908 0.3416 0.5163 0.0204 0.0000 0.0151 101 LEU C CG 3335 C CD1 . LEU B 106 ? 0.4093 0.3574 0.5412 0.0201 0.0002 0.0175 101 LEU C CD1 3336 C CD2 . LEU B 106 ? 0.4089 0.3613 0.5328 0.0213 -0.0001 0.0183 101 LEU C CD2 3337 N N . LYS B 107 ? 0.4036 0.3571 0.5212 0.0189 0.0000 0.0042 102 LYS C N 3338 C CA . LYS B 107 ? 0.4431 0.3977 0.5628 0.0196 -0.0001 -0.0006 102 LYS C CA 3339 C C . LYS B 107 ? 0.4861 0.4397 0.6082 0.0190 0.0000 -0.0037 102 LYS C C 3340 O O . LYS B 107 ? 0.5697 0.5227 0.6970 0.0198 -0.0002 -0.0072 102 LYS C O 3341 C CB . LYS B 107 ? 0.4388 0.3969 0.5525 0.0195 -0.0003 -0.0021 102 LYS C CB 3342 C CG . LYS B 107 ? 0.4858 0.4457 0.5985 0.0201 -0.0005 0.0000 102 LYS C CG 3343 C CD . LYS B 107 ? 0.5625 0.5265 0.6712 0.0201 -0.0007 -0.0020 102 LYS C CD 3344 C CE . LYS B 107 ? 0.6109 0.5754 0.7119 0.0185 -0.0013 -0.0004 102 LYS C CE 3345 N NZ . LYS B 107 ? 0.7171 0.6856 0.8151 0.0182 -0.0015 -0.0026 102 LYS C NZ 3346 N N . HIS B 108 ? 0.4628 0.4163 0.5811 0.0178 0.0000 -0.0026 103 HIS C N 3347 C CA . HIS B 108 ? 0.4316 0.3844 0.5519 0.0171 0.0000 -0.0053 103 HIS C CA 3348 C C . HIS B 108 ? 0.4641 0.4140 0.5923 0.0168 0.0000 -0.0043 103 HIS C C 3349 O O . HIS B 108 ? 0.3905 0.3395 0.5233 0.0167 -0.0001 -0.0078 103 HIS C O 3350 C CB . HIS B 108 ? 0.4272 0.3808 0.5417 0.0161 0.0001 -0.0039 103 HIS C CB 3351 C CG . HIS B 108 ? 0.4066 0.3609 0.5217 0.0156 0.0001 -0.0075 103 HIS C CG 3352 N ND1 . HIS B 108 ? 0.4192 0.3727 0.5379 0.0146 0.0003 -0.0068 103 HIS C ND1 3353 C CD2 . HIS B 108 ? 0.4078 0.3640 0.5206 0.0158 0.0000 -0.0118 103 HIS C CD2 3354 C CE1 . HIS B 108 ? 0.4056 0.3602 0.5240 0.0143 0.0002 -0.0106 103 HIS C CE1 3355 N NE2 . HIS B 108 ? 0.4251 0.3813 0.5400 0.0151 0.0000 -0.0137 103 HIS C NE2 3356 N N . LEU B 109 ? 0.4959 0.4445 0.6257 0.0166 0.0002 0.0004 104 LEU C N 3357 C CA . LEU B 109 ? 0.4962 0.4418 0.6338 0.0162 0.0000 0.0023 104 LEU C CA 3358 C C . LEU B 109 ? 0.5340 0.4775 0.6776 0.0175 -0.0005 -0.0008 104 LEU C C 3359 O O . LEU B 109 ? 0.6245 0.5655 0.7746 0.0172 -0.0011 -0.0026 104 LEU C O 3360 C CB . LEU B 109 ? 0.5114 0.4567 0.6486 0.0162 0.0003 0.0083 104 LEU C CB 3361 C CG . LEU B 109 ? 0.5786 0.5220 0.7216 0.0151 0.0003 0.0126 104 LEU C CG 3362 C CD1 . LEU B 109 ? 0.5715 0.5134 0.7180 0.0161 0.0001 0.0164 104 LEU C CD1 3363 C CD2 . LEU B 109 ? 0.6291 0.5700 0.7790 0.0140 -0.0001 0.0103 104 LEU C CD2 3364 N N . LEU B 110 ? 0.5266 0.4715 0.6683 0.0191 -0.0005 -0.0014 105 LEU C N 3365 C CA . LEU B 110 ? 0.4785 0.4220 0.6257 0.0209 -0.0012 -0.0043 105 LEU C CA 3366 C C . LEU B 110 ? 0.5073 0.4526 0.6544 0.0217 -0.0015 -0.0107 105 LEU C C 3367 O O . LEU B 110 ? 0.5227 0.4677 0.6739 0.0236 -0.0021 -0.0139 105 LEU C O 3368 C CB . LEU B 110 ? 0.4948 0.4401 0.6400 0.0224 -0.0010 -0.0024 105 LEU C CB 3369 C CG . LEU B 110 ? 0.5075 0.4515 0.6532 0.0222 -0.0008 0.0036 105 LEU C CG 3370 C CD1 . LEU B 110 ? 0.5129 0.4596 0.6553 0.0235 -0.0007 0.0053 105 LEU C CD1 3371 C CD2 . LEU B 110 ? 0.5426 0.4822 0.6966 0.0226 -0.0015 0.0048 105 LEU C CD2 3372 N N . SER B 111 ? 0.5110 0.4587 0.6535 0.0206 -0.0011 -0.0127 106 SER C N 3373 C CA . SER B 111 ? 0.5171 0.4676 0.6587 0.0216 -0.0013 -0.0185 106 SER C CA 3374 C C . SER B 111 ? 0.5214 0.4692 0.6706 0.0224 -0.0023 -0.0227 106 SER C C 3375 O O . SER B 111 ? 0.5134 0.4629 0.6646 0.0244 -0.0028 -0.0272 106 SER C O 3376 C CB . SER B 111 ? 0.5279 0.4809 0.6635 0.0202 -0.0009 -0.0195 106 SER C CB 3377 O OG . SER B 111 ? 0.5077 0.4584 0.6457 0.0186 -0.0010 -0.0192 106 SER C OG 3378 N N . ARG B 112 ? 0.5673 0.5113 0.7211 0.0209 -0.0027 -0.0211 107 ARG C N 3379 C CA . ARG B 112 ? 0.5909 0.5313 0.7525 0.0213 -0.0040 -0.0244 107 ARG C CA 3380 C C . ARG B 112 ? 0.5899 0.5251 0.7573 0.0203 -0.0045 -0.0197 107 ARG C C 3381 O O . ARG B 112 ? 0.6252 0.5598 0.7919 0.0180 -0.0040 -0.0153 107 ARG C O 3382 C CB . ARG B 112 ? 0.6565 0.5976 0.8186 0.0200 -0.0043 -0.0281 107 ARG C CB 3383 C CG . ARG B 112 ? 0.7231 0.6599 0.8938 0.0199 -0.0059 -0.0314 107 ARG C CG 3384 C CD . ARG B 112 ? 0.8033 0.7404 0.9748 0.0179 -0.0062 -0.0336 107 ARG C CD 3385 N NE . ARG B 112 ? 0.8976 0.8383 1.0676 0.0194 -0.0066 -0.0403 107 ARG C NE 3386 C CZ . ARG B 112 ? 1.0240 0.9671 1.1923 0.0182 -0.0065 -0.0430 107 ARG C CZ 3387 N NH1 . ARG B 112 ? 1.0438 0.9864 1.2119 0.0154 -0.0061 -0.0397 107 ARG C NH1 3388 N NH2 . ARG B 112 ? 1.0919 1.0387 1.2588 0.0198 -0.0068 -0.0491 107 ARG C NH2 3389 N N . ILE B 113 ? 0.5937 0.5256 0.7673 0.0220 -0.0057 -0.0210 108 ILE C N 3390 C CA . ILE B 113 ? 0.6192 0.5461 0.7985 0.0215 -0.0063 -0.0163 108 ILE C CA 3391 C C . ILE B 113 ? 0.6822 0.6038 0.8703 0.0222 -0.0084 -0.0200 108 ILE C C 3392 O O . ILE B 113 ? 0.6469 0.5687 0.8366 0.0249 -0.0094 -0.0255 108 ILE C O 3393 C CB . ILE B 113 ? 0.6415 0.5693 0.8186 0.0232 -0.0057 -0.0127 108 ILE C CB 3394 C CG1 . ILE B 113 ? 0.6487 0.5807 0.8181 0.0219 -0.0041 -0.0082 108 ILE C CG1 3395 C CG2 . ILE B 113 ? 0.6886 0.6112 0.8723 0.0233 -0.0067 -0.0084 108 ILE C CG2 3396 C CD1 . ILE B 113 ? 0.6038 0.5344 0.7734 0.0193 -0.0036 -0.0024 108 ILE C CD1 3397 N N . ASN B 114 ? 0.6755 0.5925 0.8692 0.0199 -0.0093 -0.0167 109 ASN C N 3398 C CA . ASN B 114 ? 0.7057 0.6168 0.9081 0.0199 -0.0116 -0.0197 109 ASN C CA 3399 C C . ASN B 114 ? 0.6990 0.6050 0.9070 0.0219 -0.0129 -0.0177 109 ASN C C 3400 O O . ASN B 114 ? 0.5596 0.4617 0.7731 0.0239 -0.0150 -0.0224 109 ASN C O 3401 C CB . ASN B 114 ? 0.7847 0.6936 0.9909 0.0160 -0.0120 -0.0167 109 ASN C CB 3402 C CG . ASN B 114 ? 0.8324 0.7345 1.0480 0.0154 -0.0147 -0.0192 109 ASN C CG 3403 O OD1 . ASN B 114 ? 0.8155 0.7127 1.0370 0.0136 -0.0158 -0.0143 109 ASN C OD1 3404 N ND2 . ASN B 114 ? 0.7878 0.6897 1.0050 0.0169 -0.0161 -0.0269 109 ASN C ND2 3405 N N . HIS B 115 ? 0.6959 0.6021 0.9022 0.0216 -0.0119 -0.0109 110 HIS C N 3406 C CA . HIS B 115 ? 0.6805 0.5829 0.8909 0.0240 -0.0129 -0.0087 110 HIS C CA 3407 C C . HIS B 115 ? 0.6049 0.5117 0.8093 0.0249 -0.0110 -0.0039 110 HIS C C 3408 O O . HIS B 115 ? 0.6407 0.5500 0.8414 0.0226 -0.0095 0.0013 110 HIS C O 3409 C CB . HIS B 115 ? 0.7017 0.5971 0.9203 0.0221 -0.0146 -0.0041 110 HIS C CB 3410 C CG . HIS B 115 ? 0.7466 0.6378 0.9694 0.0247 -0.0157 -0.0017 110 HIS C CG 3411 N ND1 . HIS B 115 ? 0.8474 0.7350 1.0743 0.0282 -0.0178 -0.0072 110 HIS C ND1 3412 C CD2 . HIS B 115 ? 0.8099 0.7006 1.0330 0.0246 -0.0151 0.0053 110 HIS C CD2 3413 C CE1 . HIS B 115 ? 0.7917 0.6763 1.0215 0.0302 -0.0185 -0.0035 110 HIS C CE1 3414 N NE2 . HIS B 115 ? 0.8476 0.7340 1.0752 0.0279 -0.0169 0.0042 110 HIS C NE2 3415 N N . PHE B 116 ? 0.6334 0.5411 0.8371 0.0284 -0.0112 -0.0058 111 PHE C N 3416 C CA . PHE B 116 ? 0.6293 0.5415 0.8273 0.0294 -0.0096 -0.0018 111 PHE C CA 3417 C C . PHE B 116 ? 0.6173 0.5268 0.8195 0.0326 -0.0107 -0.0008 111 PHE C C 3418 O O . PHE B 116 ? 0.5560 0.4648 0.7607 0.0357 -0.0119 -0.0061 111 PHE C O 3419 C CB . PHE B 116 ? 0.6062 0.5252 0.7966 0.0304 -0.0082 -0.0059 111 PHE C CB 3420 C CG . PHE B 116 ? 0.6260 0.5500 0.8096 0.0304 -0.0065 -0.0017 111 PHE C CG 3421 C CD1 . PHE B 116 ? 0.6129 0.5386 0.7922 0.0277 -0.0053 0.0030 111 PHE C CD1 3422 C CD2 . PHE B 116 ? 0.6675 0.5949 0.8489 0.0332 -0.0063 -0.0027 111 PHE C CD2 3423 C CE1 . PHE B 116 ? 0.6146 0.5447 0.7874 0.0277 -0.0040 0.0065 111 PHE C CE1 3424 C CE2 . PHE B 116 ? 0.6514 0.5834 0.8267 0.0329 -0.0050 0.0011 111 PHE C CE2 3425 C CZ . PHE B 116 ? 0.5981 0.5312 0.7690 0.0302 -0.0039 0.0056 111 PHE C CZ 3426 N N . GLU B 117 ? 0.5765 0.4849 0.7793 0.0322 -0.0103 0.0060 112 GLU C N 3427 C CA . GLU B 117 ? 0.5818 0.4874 0.7888 0.0351 -0.0114 0.0075 112 GLU C CA 3428 C C . GLU B 117 ? 0.5776 0.4867 0.7808 0.0354 -0.0100 0.0138 112 GLU C C 3429 O O . GLU B 117 ? 0.5633 0.4723 0.7657 0.0329 -0.0092 0.0199 112 GLU C O 3430 C CB . GLU B 117 ? 0.7089 0.6062 0.9248 0.0344 -0.0136 0.0095 112 GLU C CB 3431 C CG . GLU B 117 ? 0.7737 0.6668 0.9948 0.0380 -0.0152 0.0102 112 GLU C CG 3432 C CD . GLU B 117 ? 0.8867 0.7710 1.1168 0.0370 -0.0176 0.0133 112 GLU C CD 3433 O OE1 . GLU B 117 ? 0.9406 0.8218 1.1736 0.0335 -0.0181 0.0140 112 GLU C OE1 3434 O OE2 . GLU B 117 ? 0.8480 0.7285 1.0823 0.0397 -0.0190 0.0151 112 GLU C OE2 3435 N N . LYS B 118 ? 0.5938 0.5063 0.7949 0.0386 -0.0099 0.0122 113 LYS C N 3436 C CA . LYS B 118 ? 0.6341 0.5500 0.8319 0.0393 -0.0088 0.0177 113 LYS C CA 3437 C C . LYS B 118 ? 0.6225 0.5331 0.8267 0.0403 -0.0100 0.0227 113 LYS C C 3438 O O . LYS B 118 ? 0.6243 0.5305 0.8342 0.0429 -0.0118 0.0201 113 LYS C O 3439 C CB . LYS B 118 ? 0.6451 0.5670 0.8387 0.0423 -0.0083 0.0143 113 LYS C CB 3440 C CG . LYS B 118 ? 0.6465 0.5729 0.8360 0.0427 -0.0072 0.0196 113 LYS C CG 3441 C CD . LYS B 118 ? 0.6883 0.6224 0.8713 0.0437 -0.0062 0.0169 113 LYS C CD 3442 C CE . LYS B 118 ? 0.7315 0.6677 0.9168 0.0478 -0.0070 0.0126 113 LYS C CE 3443 N NZ . LYS B 118 ? 0.8408 0.7784 1.0269 0.0498 -0.0071 0.0169 113 LYS C NZ 3444 N N . ILE B 119 ? 0.6399 0.5514 0.8427 0.0385 -0.0091 0.0298 114 ILE C N 3445 C CA . ILE B 119 ? 0.6505 0.5582 0.8585 0.0393 -0.0100 0.0356 114 ILE C CA 3446 C C . ILE B 119 ? 0.7148 0.6280 0.9181 0.0398 -0.0086 0.0413 114 ILE C C 3447 O O . ILE B 119 ? 0.7153 0.6342 0.9117 0.0381 -0.0070 0.0424 114 ILE C O 3448 C CB . ILE B 119 ? 0.6760 0.5786 0.8889 0.0361 -0.0107 0.0400 114 ILE C CB 3449 C CG1 . ILE B 119 ? 0.6931 0.6004 0.9005 0.0325 -0.0088 0.0432 114 ILE C CG1 3450 C CG2 . ILE B 119 ? 0.6732 0.5698 0.8919 0.0356 -0.0124 0.0347 114 ILE C CG2 3451 C CD1 . ILE B 119 ? 0.7246 0.6289 0.9367 0.0296 -0.0091 0.0496 114 ILE C CD1 3452 N N . LEU B 120 ? 0.7315 0.6427 0.9386 0.0421 -0.0095 0.0450 115 LEU C N 3453 C CA . LEU B 120 ? 0.7156 0.6318 0.9191 0.0426 -0.0084 0.0507 115 LEU C CA 3454 C C . LEU B 120 ? 0.6949 0.6104 0.8993 0.0396 -0.0079 0.0577 115 LEU C C 3455 O O . LEU B 120 ? 0.7342 0.6436 0.9452 0.0388 -0.0091 0.0603 115 LEU C O 3456 C CB . LEU B 120 ? 0.6890 0.6035 0.8965 0.0465 -0.0096 0.0519 115 LEU C CB 3457 C CG . LEU B 120 ? 0.7927 0.7128 0.9968 0.0479 -0.0087 0.0571 115 LEU C CG 3458 C CD1 . LEU B 120 ? 0.7885 0.7167 0.9844 0.0478 -0.0072 0.0546 115 LEU C CD1 3459 C CD2 . LEU B 120 ? 0.7864 0.7041 0.9955 0.0520 -0.0102 0.0574 115 LEU C CD2 3460 N N . ILE B 121 ? 0.5856 0.5072 0.7834 0.0380 -0.0062 0.0608 116 ILE C N 3461 C CA . ILE B 121 ? 0.5457 0.4682 0.7438 0.0356 -0.0056 0.0677 116 ILE C CA 3462 C C . ILE B 121 ? 0.5411 0.4683 0.7369 0.0367 -0.0050 0.0740 116 ILE C C 3463 O O . ILE B 121 ? 0.5214 0.4483 0.7200 0.0356 -0.0050 0.0806 116 ILE C O 3464 C CB . ILE B 121 ? 0.5776 0.5031 0.7707 0.0324 -0.0044 0.0666 116 ILE C CB 3465 C CG1 . ILE B 121 ? 0.6226 0.5546 0.8069 0.0328 -0.0032 0.0638 116 ILE C CG1 3466 C CG2 . ILE B 121 ? 0.6014 0.5222 0.7977 0.0311 -0.0052 0.0611 116 ILE C CG2 3467 C CD1 . ILE B 121 ? 0.6447 0.5806 0.8234 0.0302 -0.0021 0.0652 116 ILE C CD1 3468 N N . ILE B 122 ? 0.5406 0.4726 0.7312 0.0387 -0.0045 0.0723 117 ILE C N 3469 C CA . ILE B 122 ? 0.6105 0.5472 0.7988 0.0401 -0.0040 0.0776 117 ILE C CA 3470 C C . ILE B 122 ? 0.6985 0.6365 0.8869 0.0436 -0.0046 0.0754 117 ILE C C 3471 O O . ILE B 122 ? 0.7278 0.6701 0.9108 0.0442 -0.0041 0.0714 117 ILE C O 3472 C CB . ILE B 122 ? 0.6186 0.5622 0.7987 0.0387 -0.0027 0.0785 117 ILE C CB 3473 C CG1 . ILE B 122 ? 0.6668 0.6103 0.8464 0.0356 -0.0021 0.0809 117 ILE C CG1 3474 C CG2 . ILE B 122 ? 0.5963 0.5450 0.7742 0.0404 -0.0025 0.0838 117 ILE C CG2 3475 C CD1 . ILE B 122 ? 0.6439 0.5937 0.8152 0.0345 -0.0011 0.0810 117 ILE C CD1 3476 N N . PRO B 123 ? 0.6962 0.6306 0.8909 0.0460 -0.0057 0.0782 118 PRO C N 3477 C CA . PRO B 123 ? 0.6902 0.6254 0.8856 0.0495 -0.0064 0.0749 118 PRO C CA 3478 C C . PRO B 123 ? 0.6793 0.6223 0.8688 0.0506 -0.0055 0.0768 118 PRO C C 3479 O O . PRO B 123 ? 0.6330 0.5793 0.8203 0.0496 -0.0049 0.0824 118 PRO C O 3480 C CB . PRO B 123 ? 0.7164 0.6455 0.9199 0.0518 -0.0080 0.0781 118 PRO C CB 3481 C CG . PRO B 123 ? 0.7430 0.6668 0.9508 0.0489 -0.0083 0.0817 118 PRO C CG 3482 C CD . PRO B 123 ? 0.6887 0.6172 0.8906 0.0454 -0.0067 0.0832 118 PRO C CD 3483 N N . LYS B 124 ? 0.6467 0.5931 0.8337 0.0526 -0.0056 0.0722 119 LYS C N 3484 C CA . LYS B 124 ? 0.6614 0.6153 0.8433 0.0536 -0.0051 0.0736 119 LYS C CA 3485 C C . LYS B 124 ? 0.6795 0.6346 0.8638 0.0555 -0.0053 0.0802 119 LYS C C 3486 O O . LYS B 124 ? 0.7556 0.7166 0.9353 0.0550 -0.0047 0.0837 119 LYS C O 3487 C CB . LYS B 124 ? 0.6727 0.6295 0.8540 0.0562 -0.0054 0.0684 119 LYS C CB 3488 C CG . LYS B 124 ? 0.7602 0.7208 0.9358 0.0543 -0.0048 0.0630 119 LYS C CG 3489 C CD . LYS B 124 ? 0.8391 0.8062 1.0126 0.0566 -0.0049 0.0605 119 LYS C CD 3490 C CE . LYS B 124 ? 0.9514 0.9220 1.1199 0.0547 -0.0045 0.0552 119 LYS C CE 3491 N NZ . LYS B 124 ? 1.0610 1.0397 1.2257 0.0555 -0.0044 0.0547 119 LYS C NZ 3492 N N . SER B 125 ? 0.6526 0.6022 0.8439 0.0577 -0.0065 0.0818 120 SER C N 3493 C CA . SER B 125 ? 0.6708 0.6212 0.8651 0.0601 -0.0070 0.0879 120 SER C CA 3494 C C . SER B 125 ? 0.6886 0.6400 0.8821 0.0579 -0.0063 0.0950 120 SER C C 3495 O O . SER B 125 ? 0.6919 0.6458 0.8865 0.0594 -0.0064 0.1008 120 SER C O 3496 C CB . SER B 125 ? 0.7202 0.6633 0.9226 0.0631 -0.0087 0.0876 120 SER C CB 3497 O OG . SER B 125 ? 0.7060 0.6410 0.9132 0.0611 -0.0094 0.0871 120 SER C OG 3498 N N . SER B 126 ? 0.6821 0.6323 0.8737 0.0544 -0.0056 0.0946 121 SER C N 3499 C CA . SER B 126 ? 0.7097 0.6614 0.9008 0.0523 -0.0050 0.1011 121 SER C CA 3500 C C . SER B 126 ? 0.7058 0.6662 0.8895 0.0518 -0.0039 0.1032 121 SER C C 3501 O O . SER B 126 ? 0.6847 0.6482 0.8675 0.0510 -0.0034 0.1091 121 SER C O 3502 C CB . SER B 126 ? 0.7283 0.6758 0.9205 0.0488 -0.0047 0.0999 121 SER C CB 3503 O OG . SER B 126 ? 0.7587 0.7099 0.9441 0.0470 -0.0037 0.0954 121 SER C OG 3504 N N . TRP B 127 ? 0.7420 0.7066 0.9202 0.0524 -0.0037 0.0984 122 TRP C N 3505 C CA . TRP B 127 ? 0.7452 0.7177 0.9163 0.0520 -0.0031 0.0997 122 TRP C CA 3506 C C . TRP B 127 ? 0.7203 0.6973 0.8917 0.0549 -0.0035 0.1033 122 TRP C C 3507 O O . TRP B 127 ? 0.7963 0.7762 0.9660 0.0565 -0.0038 0.1001 122 TRP C O 3508 C CB . TRP B 127 ? 0.7275 0.7023 0.8926 0.0507 -0.0029 0.0932 122 TRP C CB 3509 C CG . TRP B 127 ? 0.6586 0.6293 0.8228 0.0479 -0.0025 0.0893 122 TRP C CG 3510 C CD1 . TRP B 127 ? 0.6424 0.6087 0.8088 0.0476 -0.0027 0.0837 122 TRP C CD1 3511 C CD2 . TRP B 127 ? 0.5880 0.5594 0.7490 0.0453 -0.0019 0.0907 122 TRP C CD2 3512 N NE1 . TRP B 127 ? 0.5760 0.5399 0.7407 0.0448 -0.0023 0.0816 122 TRP C NE1 3513 C CE2 . TRP B 127 ? 0.5714 0.5384 0.7328 0.0434 -0.0018 0.0859 122 TRP C CE2 3514 C CE3 . TRP B 127 ? 0.6065 0.5822 0.7644 0.0447 -0.0015 0.0956 122 TRP C CE3 3515 C CZ2 . TRP B 127 ? 0.5339 0.5006 0.6927 0.0409 -0.0012 0.0858 122 TRP C CZ2 3516 C CZ3 . TRP B 127 ? 0.5866 0.5622 0.7418 0.0423 -0.0009 0.0955 122 TRP C CZ3 3517 C CH2 . TRP B 127 ? 0.5687 0.5397 0.7243 0.0404 -0.0008 0.0906 122 TRP C CH2 3518 N N . THR B 128 ? 0.6909 0.6690 0.8648 0.0557 -0.0034 0.1101 123 THR C N 3519 C CA . THR B 128 ? 0.7298 0.7118 0.9050 0.0588 -0.0039 0.1139 123 THR C CA 3520 C C . THR B 128 ? 0.7595 0.7503 0.9276 0.0591 -0.0036 0.1144 123 THR C C 3521 O O . THR B 128 ? 0.7635 0.7583 0.9311 0.0615 -0.0041 0.1146 123 THR C O 3522 C CB . THR B 128 ? 0.6933 0.6733 0.8741 0.0598 -0.0041 0.1214 123 THR C CB 3523 O OG1 . THR B 128 ? 0.6723 0.6547 0.8508 0.0573 -0.0033 0.1253 123 THR C OG1 3524 C CG2 . THR B 128 ? 0.6773 0.6479 0.8659 0.0602 -0.0050 0.1206 123 THR C CG2 3525 N N . ASN B 129 ? 0.7560 0.7498 0.9186 0.0566 -0.0030 0.1143 124 ASN C N 3526 C CA . ASN B 129 ? 0.7415 0.7433 0.8974 0.0567 -0.0031 0.1149 124 ASN C CA 3527 C C . ASN B 129 ? 0.7289 0.7325 0.8787 0.0551 -0.0033 0.1086 124 ASN C C 3528 O O . ASN B 129 ? 0.7779 0.7874 0.9217 0.0548 -0.0037 0.1087 124 ASN C O 3529 C CB . ASN B 129 ? 0.7770 0.7822 0.9306 0.0557 -0.0026 0.1198 124 ASN C CB 3530 C CG . ASN B 129 ? 0.8245 0.8294 0.9838 0.0573 -0.0024 0.1270 124 ASN C CG 3531 O OD1 . ASN B 129 ? 0.7835 0.7891 0.9462 0.0598 -0.0028 0.1295 124 ASN C OD1 3532 N ND2 . ASN B 129 ? 0.8403 0.8445 1.0009 0.0557 -0.0018 0.1307 124 ASN C ND2 3533 N N . HIS B 130 ? 0.7016 0.7004 0.8528 0.0542 -0.0034 0.1032 125 HIS C N 3534 C CA . HIS B 130 ? 0.6494 0.6497 0.7951 0.0525 -0.0037 0.0973 125 HIS C CA 3535 C C . HIS B 130 ? 0.6081 0.6069 0.7566 0.0537 -0.0040 0.0933 125 HIS C C 3536 O O . HIS B 130 ? 0.6551 0.6497 0.8098 0.0553 -0.0039 0.0936 125 HIS C O 3537 C CB . HIS B 130 ? 0.6075 0.6042 0.7504 0.0496 -0.0033 0.0943 125 HIS C CB 3538 C CG . HIS B 130 ? 0.5819 0.5806 0.7220 0.0486 -0.0029 0.0980 125 HIS C CG 3539 N ND1 . HIS B 130 ? 0.6003 0.5970 0.7448 0.0489 -0.0023 0.1028 125 HIS C ND1 3540 C CD2 . HIS B 130 ? 0.5843 0.5873 0.7176 0.0476 -0.0033 0.0978 125 HIS C CD2 3541 C CE1 . HIS B 130 ? 0.6054 0.6059 0.7459 0.0482 -0.0021 0.1054 125 HIS C CE1 3542 N NE2 . HIS B 130 ? 0.5697 0.5739 0.7033 0.0476 -0.0028 0.1023 125 HIS C NE2 3543 N N . GLU B 131 ? 0.6426 0.6452 0.7867 0.0528 -0.0044 0.0894 126 GLU C N 3544 C CA . GLU B 131 ? 0.6512 0.6540 0.7972 0.0538 -0.0047 0.0852 126 GLU C CA 3545 C C . GLU B 131 ? 0.6115 0.6089 0.7586 0.0522 -0.0043 0.0804 126 GLU C C 3546 O O . GLU B 131 ? 0.5956 0.5922 0.7382 0.0494 -0.0042 0.0783 126 GLU C O 3547 C CB . GLU B 131 ? 0.6915 0.7010 0.8320 0.0528 -0.0054 0.0831 126 GLU C CB 3548 C CG . GLU B 131 ? 0.7713 0.7861 0.9136 0.0552 -0.0059 0.0830 126 GLU C CG 3549 C CD . GLU B 131 ? 0.8187 0.8308 0.9679 0.0585 -0.0057 0.0831 126 GLU C CD 3550 O OE1 . GLU B 131 ? 0.6500 0.6587 0.8018 0.0587 -0.0054 0.0790 126 GLU C OE1 3551 O OE2 . GLU B 131 ? 0.9771 0.9907 1.1291 0.0612 -0.0058 0.0873 126 GLU C OE2 3552 N N . THR B 132 ? 0.5947 0.5885 0.7474 0.0541 -0.0043 0.0785 127 THR C N 3553 C CA . THR B 132 ? 0.5860 0.5749 0.7403 0.0530 -0.0040 0.0738 127 THR C CA 3554 C C . THR B 132 ? 0.6043 0.5954 0.7590 0.0540 -0.0043 0.0687 127 THR C C 3555 O O . THR B 132 ? 0.5716 0.5594 0.7277 0.0534 -0.0041 0.0644 127 THR C O 3556 C CB . THR B 132 ? 0.6160 0.5978 0.7770 0.0543 -0.0040 0.0751 127 THR C CB 3557 O OG1 . THR B 132 ? 0.5709 0.5529 0.7371 0.0580 -0.0046 0.0758 127 THR C OG1 3558 C CG2 . THR B 132 ? 0.6631 0.6430 0.8247 0.0533 -0.0037 0.0807 127 THR C CG2 3559 N N . SER B 133 ? 0.5843 0.5819 0.7377 0.0554 -0.0047 0.0690 128 SER C N 3560 C CA . SER B 133 ? 0.6325 0.6336 0.7868 0.0567 -0.0049 0.0647 128 SER C CA 3561 C C . SER B 133 ? 0.6156 0.6239 0.7640 0.0545 -0.0051 0.0630 128 SER C C 3562 O O . SER B 133 ? 0.6967 0.7092 0.8453 0.0551 -0.0052 0.0596 128 SER C O 3563 C CB . SER B 133 ? 0.7210 0.7242 0.8802 0.0609 -0.0053 0.0663 128 SER C CB 3564 O OG . SER B 133 ? 0.7691 0.7785 0.9256 0.0612 -0.0056 0.0700 128 SER C OG 3565 N N . LEU B 134 ? 0.5767 0.5863 0.7198 0.0518 -0.0053 0.0653 129 LEU C N 3566 C CA . LEU B 134 ? 0.5952 0.6108 0.7326 0.0492 -0.0058 0.0642 129 LEU C CA 3567 C C . LEU B 134 ? 0.5837 0.5970 0.7163 0.0455 -0.0059 0.0613 129 LEU C C 3568 O O . LEU B 134 ? 0.6079 0.6254 0.7359 0.0430 -0.0066 0.0603 129 LEU C O 3569 C CB . LEU B 134 ? 0.6997 0.7189 0.8340 0.0489 -0.0065 0.0684 129 LEU C CB 3570 C CG . LEU B 134 ? 0.7533 0.7797 0.8890 0.0512 -0.0070 0.0703 129 LEU C CG 3571 C CD1 . LEU B 134 ? 0.7357 0.7621 0.8777 0.0551 -0.0066 0.0697 129 LEU C CD1 3572 C CD2 . LEU B 134 ? 0.7213 0.7495 0.8553 0.0517 -0.0075 0.0751 129 LEU C CD2 3573 N N . GLY B 135 ? 0.5068 0.5135 0.6407 0.0449 -0.0052 0.0601 130 GLY C N 3574 C CA . GLY B 135 ? 0.4954 0.4998 0.6250 0.0417 -0.0053 0.0574 130 GLY C CA 3575 C C . GLY B 135 ? 0.4919 0.4967 0.6225 0.0414 -0.0050 0.0526 130 GLY C C 3576 O O . GLY B 135 ? 0.4275 0.4275 0.5605 0.0416 -0.0044 0.0502 130 GLY C O 3577 N N . VAL B 136 ? 0.5004 0.5115 0.6292 0.0408 -0.0055 0.0512 131 VAL C N 3578 C CA . VAL B 136 ? 0.5269 0.5402 0.6564 0.0406 -0.0052 0.0470 131 VAL C CA 3579 C C . VAL B 136 ? 0.4845 0.5027 0.6084 0.0372 -0.0061 0.0466 131 VAL C C 3580 O O . VAL B 136 ? 0.4722 0.4926 0.5930 0.0360 -0.0069 0.0493 131 VAL C O 3581 C CB . VAL B 136 ? 0.5798 0.5975 0.7145 0.0442 -0.0050 0.0458 131 VAL C CB 3582 C CG1 . VAL B 136 ? 0.6020 0.6137 0.7427 0.0476 -0.0045 0.0458 131 VAL C CG1 3583 C CG2 . VAL B 136 ? 0.5656 0.5901 0.6998 0.0451 -0.0056 0.0486 131 VAL C CG2 3584 N N . SER B 137 ? 0.4623 0.4823 0.5850 0.0358 -0.0059 0.0432 132 SER C N 3585 C CA . SER B 137 ? 0.4284 0.4520 0.5458 0.0322 -0.0069 0.0431 132 SER C CA 3586 C C . SER B 137 ? 0.4346 0.4640 0.5529 0.0320 -0.0066 0.0401 132 SER C C 3587 O O . SER B 137 ? 0.4434 0.4713 0.5648 0.0338 -0.0057 0.0370 132 SER C O 3588 C CB . SER B 137 ? 0.4650 0.4825 0.5780 0.0294 -0.0073 0.0426 132 SER C CB 3589 O OG . SER B 137 ? 0.5067 0.5268 0.6146 0.0257 -0.0085 0.0422 132 SER C OG 3590 N N . ALA B 138 ? 0.4132 0.4494 0.5286 0.0296 -0.0076 0.0409 133 ALA C N 3591 C CA . ALA B 138 ? 0.4250 0.4673 0.5401 0.0284 -0.0075 0.0386 133 ALA C CA 3592 C C . ALA B 138 ? 0.4437 0.4816 0.5562 0.0263 -0.0073 0.0361 133 ALA C C 3593 O O . ALA B 138 ? 0.3973 0.4394 0.5105 0.0262 -0.0068 0.0335 133 ALA C O 3594 C CB . ALA B 138 ? 0.4281 0.4779 0.5402 0.0253 -0.0089 0.0407 133 ALA C CB 3595 N N . ALA B 139 ? 0.4271 0.4572 0.5367 0.0248 -0.0077 0.0368 134 ALA C N 3596 C CA . ALA B 139 ? 0.4394 0.4650 0.5468 0.0232 -0.0074 0.0342 134 ALA C CA 3597 C C . ALA B 139 ? 0.4500 0.4728 0.5620 0.0263 -0.0058 0.0310 134 ALA C C 3598 O O . ALA B 139 ? 0.4352 0.4560 0.5461 0.0255 -0.0055 0.0283 134 ALA C O 3599 C CB . ALA B 139 ? 0.4540 0.4723 0.5570 0.0211 -0.0082 0.0357 134 ALA C CB 3600 N N . CYS B 140 ? 0.5161 0.5381 0.6331 0.0299 -0.0052 0.0312 135 CYS C N 3601 C CA . CYS B 140 ? 0.5286 0.5471 0.6504 0.0330 -0.0041 0.0283 135 CYS C CA 3602 C C . CYS B 140 ? 0.5274 0.5513 0.6542 0.0367 -0.0038 0.0272 135 CYS C C 3603 O O . CYS B 140 ? 0.4876 0.5088 0.6187 0.0397 -0.0036 0.0281 135 CYS C O 3604 C CB . CYS B 140 ? 0.5763 0.5864 0.6997 0.0338 -0.0039 0.0299 135 CYS C CB 3605 S SG . CYS B 140 ? 0.6572 0.6610 0.7750 0.0303 -0.0043 0.0309 135 CYS C SG 3606 N N . PRO B 141 ? 0.5721 0.6042 0.6984 0.0366 -0.0037 0.0253 136 PRO C N 3607 C CA . PRO B 141 ? 0.5715 0.6101 0.7022 0.0403 -0.0035 0.0241 136 PRO C CA 3608 C C . PRO B 141 ? 0.5517 0.5876 0.6873 0.0441 -0.0029 0.0200 136 PRO C C 3609 O O . PRO B 141 ? 0.5021 0.5335 0.6373 0.0434 -0.0026 0.0173 136 PRO C O 3610 C CB . PRO B 141 ? 0.5818 0.6305 0.7101 0.0386 -0.0036 0.0234 136 PRO C CB 3611 C CG . PRO B 141 ? 0.5877 0.6337 0.7117 0.0349 -0.0037 0.0224 136 PRO C CG 3612 C CD . PRO B 141 ? 0.5943 0.6306 0.7162 0.0331 -0.0040 0.0244 136 PRO C CD 3613 N N . TYR B 142 ? 0.4902 0.5278 0.6305 0.0483 -0.0030 0.0196 137 TYR C N 3614 C CA . TYR B 142 ? 0.4991 0.5365 0.6442 0.0524 -0.0028 0.0151 137 TYR C CA 3615 C C . TYR B 142 ? 0.5090 0.5573 0.6556 0.0552 -0.0028 0.0139 137 TYR C C 3616 O O . TYR B 142 ? 0.4375 0.4885 0.5858 0.0571 -0.0031 0.0164 137 TYR C O 3617 C CB . TYR B 142 ? 0.5047 0.5332 0.6547 0.0554 -0.0031 0.0154 137 TYR C CB 3618 C CG . TYR B 142 ? 0.5311 0.5598 0.6863 0.0601 -0.0033 0.0103 137 TYR C CG 3619 C CD1 . TYR B 142 ? 0.5719 0.5996 0.7274 0.0602 -0.0032 0.0055 137 TYR C CD1 3620 C CD2 . TYR B 142 ? 0.5569 0.5873 0.7167 0.0647 -0.0039 0.0100 137 TYR C CD2 3621 C CE1 . TYR B 142 ? 0.5152 0.5432 0.6754 0.0648 -0.0037 0.0003 137 TYR C CE1 3622 C CE2 . TYR B 142 ? 0.5725 0.6029 0.7369 0.0694 -0.0044 0.0050 137 TYR C CE2 3623 C CZ . TYR B 142 ? 0.5350 0.5643 0.6997 0.0694 -0.0044 0.0000 137 TYR C CZ 3624 O OH . TYR B 142 ? 0.5580 0.5873 0.7276 0.0746 -0.0052 -0.0052 137 TYR C OH 3625 N N . GLN B 143 ? 0.5224 0.5774 0.6685 0.0557 -0.0025 0.0100 138 GLN C N 3626 C CA . GLN B 143 ? 0.5627 0.6301 0.7097 0.0580 -0.0025 0.0088 138 GLN C CA 3627 C C . GLN B 143 ? 0.5551 0.6296 0.6994 0.0556 -0.0026 0.0134 138 GLN C C 3628 O O . GLN B 143 ? 0.5387 0.6184 0.6855 0.0587 -0.0029 0.0142 138 GLN C O 3629 C CB . GLN B 143 ? 0.6472 0.7147 0.8000 0.0642 -0.0028 0.0062 138 GLN C CB 3630 C CG . GLN B 143 ? 0.7969 0.8557 0.9531 0.0668 -0.0030 0.0018 138 GLN C CG 3631 C CD . GLN B 143 ? 0.9024 0.9658 1.0631 0.0728 -0.0035 -0.0032 138 GLN C CD 3632 O OE1 . GLN B 143 ? 1.0218 1.0813 1.1871 0.0770 -0.0042 -0.0036 138 GLN C OE1 3633 N NE2 . GLN B 143 ? 0.9529 1.0253 1.1124 0.0734 -0.0031 -0.0069 138 GLN C NE2 3634 N N . GLY B 144 ? 0.5476 0.6219 0.6868 0.0502 -0.0027 0.0162 139 GLY C N 3635 C CA . GLY B 144 ? 0.5445 0.6245 0.6809 0.0471 -0.0033 0.0207 139 GLY C CA 3636 C C . GLY B 144 ? 0.5716 0.6461 0.7080 0.0469 -0.0038 0.0248 139 GLY C C 3637 O O . GLY B 144 ? 0.6294 0.7075 0.7629 0.0438 -0.0045 0.0285 139 GLY C O 3638 N N . THR B 145 ? 0.5689 0.6348 0.7086 0.0499 -0.0037 0.0244 140 THR C N 3639 C CA . THR B 145 ? 0.6103 0.6723 0.7506 0.0503 -0.0041 0.0283 140 THR C CA 3640 C C . THR B 145 ? 0.5579 0.6089 0.6960 0.0477 -0.0042 0.0303 140 THR C C 3641 O O . THR B 145 ? 0.5613 0.6058 0.6999 0.0476 -0.0039 0.0280 140 THR C O 3642 C CB . THR B 145 ? 0.6803 0.7417 0.8266 0.0562 -0.0041 0.0273 140 THR C CB 3643 O OG1 . THR B 145 ? 0.7355 0.7917 0.8827 0.0568 -0.0044 0.0313 140 THR C OG1 3644 C CG2 . THR B 145 ? 0.7205 0.7753 0.8704 0.0591 -0.0038 0.0231 140 THR C CG2 3645 N N . PRO B 146 ? 0.5303 0.5799 0.6661 0.0457 -0.0048 0.0345 141 PRO C N 3646 C CA . PRO B 146 ? 0.5352 0.5760 0.6681 0.0430 -0.0049 0.0360 141 PRO C CA 3647 C C . PRO B 146 ? 0.5766 0.6086 0.7133 0.0456 -0.0044 0.0354 141 PRO C C 3648 O O . PRO B 146 ? 0.5912 0.6228 0.7324 0.0493 -0.0044 0.0362 141 PRO C O 3649 C CB . PRO B 146 ? 0.5459 0.5880 0.6759 0.0412 -0.0058 0.0404 141 PRO C CB 3650 C CG . PRO B 146 ? 0.5997 0.6523 0.7289 0.0406 -0.0062 0.0407 141 PRO C CG 3651 C CD . PRO B 146 ? 0.5650 0.6220 0.6993 0.0449 -0.0055 0.0377 141 PRO C CD 3652 N N . SER B 147 ? 0.5425 0.5677 0.6776 0.0437 -0.0042 0.0343 142 SER C N 3653 C CA . SER B 147 ? 0.4835 0.5003 0.6224 0.0455 -0.0038 0.0339 142 SER C CA 3654 C C . SER B 147 ? 0.5186 0.5288 0.6538 0.0423 -0.0037 0.0351 142 SER C C 3655 O O . SER B 147 ? 0.4499 0.4611 0.5801 0.0393 -0.0042 0.0376 142 SER C O 3656 C CB . SER B 147 ? 0.4709 0.4872 0.6138 0.0481 -0.0034 0.0291 142 SER C CB 3657 O OG . SER B 147 ? 0.4243 0.4327 0.5718 0.0503 -0.0034 0.0287 142 SER C OG 3658 N N . PHE B 148 ? 0.4822 0.4857 0.6200 0.0429 -0.0033 0.0334 143 PHE C N 3659 C CA . PHE B 148 ? 0.5041 0.5016 0.6390 0.0402 -0.0032 0.0346 143 PHE C CA 3660 C C . PHE B 148 ? 0.5092 0.5006 0.6476 0.0409 -0.0028 0.0318 143 PHE C C 3661 O O . PHE B 148 ? 0.5222 0.5125 0.6659 0.0438 -0.0028 0.0297 143 PHE C O 3662 C CB . PHE B 148 ? 0.5144 0.5098 0.6493 0.0404 -0.0034 0.0397 143 PHE C CB 3663 C CG . PHE B 148 ? 0.5078 0.4995 0.6383 0.0375 -0.0035 0.0415 143 PHE C CG 3664 C CD1 . PHE B 148 ? 0.4769 0.4713 0.6010 0.0346 -0.0041 0.0417 143 PHE C CD1 3665 C CD2 . PHE B 148 ? 0.4535 0.4393 0.5862 0.0378 -0.0031 0.0431 143 PHE C CD2 3666 C CE1 . PHE B 148 ? 0.4866 0.4777 0.6065 0.0325 -0.0044 0.0429 143 PHE C CE1 3667 C CE2 . PHE B 148 ? 0.4845 0.4680 0.6131 0.0355 -0.0032 0.0447 143 PHE C CE2 3668 C CZ . PHE B 148 ? 0.4686 0.4545 0.5906 0.0331 -0.0038 0.0443 143 PHE C CZ 3669 N N . PHE B 149 ? 0.5016 0.4890 0.6370 0.0383 -0.0026 0.0319 144 PHE C N 3670 C CA . PHE B 149 ? 0.5155 0.4968 0.6539 0.0384 -0.0023 0.0299 144 PHE C CA 3671 C C . PHE B 149 ? 0.5291 0.5063 0.6742 0.0412 -0.0024 0.0314 144 PHE C C 3672 O O . PHE B 149 ? 0.6162 0.5927 0.7620 0.0416 -0.0025 0.0358 144 PHE C O 3673 C CB . PHE B 149 ? 0.4828 0.4602 0.6173 0.0356 -0.0022 0.0318 144 PHE C CB 3674 C CG . PHE B 149 ? 0.4524 0.4324 0.5803 0.0328 -0.0024 0.0305 144 PHE C CG 3675 C CD1 . PHE B 149 ? 0.4478 0.4281 0.5746 0.0320 -0.0022 0.0263 144 PHE C CD1 3676 C CD2 . PHE B 149 ? 0.4827 0.4645 0.6053 0.0311 -0.0029 0.0335 144 PHE C CD2 3677 C CE1 . PHE B 149 ? 0.4819 0.4639 0.6026 0.0293 -0.0025 0.0255 144 PHE C CE1 3678 C CE2 . PHE B 149 ? 0.4776 0.4608 0.5941 0.0285 -0.0034 0.0325 144 PHE C CE2 3679 C CZ . PHE B 149 ? 0.4717 0.4548 0.5872 0.0276 -0.0032 0.0287 144 PHE C CZ 3680 N N . ARG B 150 ? 0.5045 0.4789 0.6546 0.0430 -0.0025 0.0279 145 ARG C N 3681 C CA . ARG B 150 ? 0.5133 0.4837 0.6702 0.0459 -0.0030 0.0289 145 ARG C CA 3682 C C . ARG B 150 ? 0.4704 0.4336 0.6305 0.0450 -0.0031 0.0316 145 ARG C C 3683 O O . ARG B 150 ? 0.4911 0.4509 0.6565 0.0470 -0.0036 0.0338 145 ARG C O 3684 C CB . ARG B 150 ? 0.6064 0.5771 0.7675 0.0487 -0.0035 0.0234 145 ARG C CB 3685 C CG . ARG B 150 ? 0.7149 0.6939 0.8738 0.0503 -0.0034 0.0215 145 ARG C CG 3686 C CD . ARG B 150 ? 0.8451 0.8268 1.0059 0.0524 -0.0037 0.0154 145 ARG C CD 3687 N NE . ARG B 150 ? 1.0027 0.9823 1.1699 0.0567 -0.0046 0.0139 145 ARG C NE 3688 C CZ . ARG B 150 ? 1.2251 1.2086 1.3939 0.0596 -0.0049 0.0154 145 ARG C CZ 3689 N NH1 . ARG B 150 ? 1.0821 1.0726 1.2465 0.0584 -0.0043 0.0183 145 ARG C NH1 3690 N NH2 . ARG B 150 ? 1.2749 1.2553 1.4499 0.0637 -0.0060 0.0139 145 ARG C NH2 3691 N N . ASN B 151 ? 0.4666 0.4278 0.6236 0.0420 -0.0026 0.0317 146 ASN C N 3692 C CA . ASN B 151 ? 0.4348 0.3901 0.5947 0.0408 -0.0027 0.0343 146 ASN C CA 3693 C C . ASN B 151 ? 0.4332 0.3892 0.5901 0.0392 -0.0022 0.0402 146 ASN C C 3694 O O . ASN B 151 ? 0.3807 0.3327 0.5403 0.0382 -0.0022 0.0432 146 ASN C O 3695 C CB . ASN B 151 ? 0.4825 0.4354 0.6417 0.0388 -0.0025 0.0305 146 ASN C CB 3696 C CG . ASN B 151 ? 0.4732 0.4252 0.6360 0.0406 -0.0030 0.0247 146 ASN C CG 3697 O OD1 . ASN B 151 ? 0.5988 0.5521 0.7590 0.0396 -0.0028 0.0204 146 ASN C OD1 3698 N ND2 . ASN B 151 ? 0.4843 0.4342 0.6529 0.0436 -0.0038 0.0242 146 ASN C ND2 3699 N N . VAL B 152 ? 0.3960 0.3572 0.5476 0.0389 -0.0021 0.0418 147 VAL C N 3700 C CA . VAL B 152 ? 0.4182 0.3808 0.5666 0.0378 -0.0018 0.0469 147 VAL C CA 3701 C C . VAL B 152 ? 0.4430 0.4100 0.5906 0.0395 -0.0021 0.0492 147 VAL C C 3702 O O . VAL B 152 ? 0.4255 0.3950 0.5739 0.0410 -0.0024 0.0464 147 VAL C O 3703 C CB . VAL B 152 ? 0.4426 0.4070 0.5838 0.0351 -0.0016 0.0461 147 VAL C CB 3704 C CG1 . VAL B 152 ? 0.4526 0.4130 0.5944 0.0333 -0.0013 0.0445 147 VAL C CG1 3705 C CG2 . VAL B 152 ? 0.4354 0.4039 0.5718 0.0345 -0.0018 0.0424 147 VAL C CG2 3706 N N . VAL B 153 ? 0.4694 0.4381 0.6152 0.0394 -0.0021 0.0542 148 VAL C N 3707 C CA . VAL B 153 ? 0.4933 0.4664 0.6387 0.0412 -0.0024 0.0570 148 VAL C CA 3708 C C . VAL B 153 ? 0.4749 0.4522 0.6137 0.0397 -0.0026 0.0592 148 VAL C C 3709 O O . VAL B 153 ? 0.4891 0.4658 0.6261 0.0387 -0.0024 0.0622 148 VAL C O 3710 C CB . VAL B 153 ? 0.5207 0.4919 0.6717 0.0432 -0.0025 0.0618 148 VAL C CB 3711 C CG1 . VAL B 153 ? 0.4707 0.4465 0.6217 0.0455 -0.0029 0.0640 148 VAL C CG1 3712 C CG2 . VAL B 153 ? 0.6325 0.5980 0.7905 0.0446 -0.0027 0.0600 148 VAL C CG2 3713 N N . TRP B 154 ? 0.4630 0.4453 0.5987 0.0398 -0.0031 0.0579 149 TRP C N 3714 C CA . TRP B 154 ? 0.4534 0.4398 0.5829 0.0385 -0.0037 0.0596 149 TRP C CA 3715 C C . TRP B 154 ? 0.5055 0.4947 0.6366 0.0406 -0.0039 0.0644 149 TRP C C 3716 O O . TRP B 154 ? 0.5474 0.5406 0.6793 0.0420 -0.0042 0.0646 149 TRP C O 3717 C CB . TRP B 154 ? 0.4368 0.4270 0.5627 0.0374 -0.0043 0.0562 149 TRP C CB 3718 C CG . TRP B 154 ? 0.4118 0.4056 0.5312 0.0356 -0.0053 0.0571 149 TRP C CG 3719 C CD1 . TRP B 154 ? 0.4731 0.4674 0.5891 0.0352 -0.0058 0.0602 149 TRP C CD1 3720 C CD2 . TRP B 154 ? 0.3866 0.3843 0.5023 0.0340 -0.0061 0.0548 149 TRP C CD2 3721 N NE1 . TRP B 154 ? 0.4667 0.4644 0.5769 0.0335 -0.0071 0.0596 149 TRP C NE1 3722 C CE2 . TRP B 154 ? 0.4373 0.4369 0.5474 0.0325 -0.0074 0.0565 149 TRP C CE2 3723 C CE3 . TRP B 154 ? 0.3786 0.3786 0.4950 0.0336 -0.0061 0.0516 149 TRP C CE3 3724 C CZ2 . TRP B 154 ? 0.4573 0.4602 0.5628 0.0304 -0.0087 0.0552 149 TRP C CZ2 3725 C CZ3 . TRP B 154 ? 0.4102 0.4143 0.5220 0.0314 -0.0072 0.0506 149 TRP C CZ3 3726 C CH2 . TRP B 154 ? 0.4288 0.4339 0.5354 0.0297 -0.0086 0.0525 149 TRP C CH2 3727 N N . LEU B 155 ? 0.5178 0.5056 0.6492 0.0407 -0.0036 0.0683 150 LEU C N 3728 C CA . LEU B 155 ? 0.5056 0.4966 0.6380 0.0425 -0.0038 0.0734 150 LEU C CA 3729 C C . LEU B 155 ? 0.5142 0.5111 0.6409 0.0421 -0.0047 0.0742 150 LEU C C 3730 O O . LEU B 155 ? 0.4787 0.4764 0.5995 0.0401 -0.0053 0.0726 150 LEU C O 3731 C CB . LEU B 155 ? 0.5095 0.4985 0.6432 0.0425 -0.0032 0.0775 150 LEU C CB 3732 C CG . LEU B 155 ? 0.4989 0.4820 0.6389 0.0427 -0.0026 0.0777 150 LEU C CG 3733 C CD1 . LEU B 155 ? 0.5455 0.5280 0.6857 0.0421 -0.0021 0.0820 150 LEU C CD1 3734 C CD2 . LEU B 155 ? 0.5428 0.5246 0.6895 0.0454 -0.0027 0.0790 150 LEU C CD2 3735 N N . ILE B 156 ? 0.5927 0.5935 0.7212 0.0442 -0.0050 0.0767 151 ILE C N 3736 C CA . ILE B 156 ? 0.5923 0.5992 0.7162 0.0440 -0.0061 0.0776 151 ILE C CA 3737 C C . ILE B 156 ? 0.5676 0.5775 0.6926 0.0462 -0.0061 0.0831 151 ILE C C 3738 O O . ILE B 156 ? 0.5830 0.5908 0.7133 0.0481 -0.0053 0.0860 151 ILE C O 3739 C CB . ILE B 156 ? 0.5964 0.6067 0.7212 0.0445 -0.0065 0.0750 151 ILE C CB 3740 C CG1 . ILE B 156 ? 0.6421 0.6506 0.7647 0.0420 -0.0066 0.0699 151 ILE C CG1 3741 C CG2 . ILE B 156 ? 0.5624 0.5794 0.6837 0.0445 -0.0077 0.0764 151 ILE C CG2 3742 C CD1 . ILE B 156 ? 0.6049 0.6137 0.7206 0.0391 -0.0076 0.0685 151 ILE C CD1 3743 N N . LYS B 157 ? 0.5741 0.5890 0.6943 0.0459 -0.0071 0.0844 152 LYS C N 3744 C CA . LYS B 157 ? 0.6111 0.6302 0.7320 0.0481 -0.0072 0.0894 152 LYS C CA 3745 C C . LYS B 157 ? 0.6159 0.6369 0.7423 0.0508 -0.0069 0.0915 152 LYS C C 3746 O O . LYS B 157 ? 0.6093 0.6308 0.7373 0.0510 -0.0071 0.0886 152 LYS C O 3747 C CB . LYS B 157 ? 0.5777 0.6023 0.6923 0.0475 -0.0087 0.0895 152 LYS C CB 3748 C CG . LYS B 157 ? 0.5745 0.6037 0.6883 0.0474 -0.0098 0.0878 152 LYS C CG 3749 C CD . LYS B 157 ? 0.6252 0.6593 0.7328 0.0465 -0.0116 0.0877 152 LYS C CD 3750 C CE . LYS B 157 ? 0.6063 0.6455 0.7133 0.0461 -0.0128 0.0863 152 LYS C CE 3751 N NZ . LYS B 157 ? 0.6291 0.6717 0.7296 0.0443 -0.0150 0.0852 152 LYS C NZ 3752 N N . LYS B 158 ? 0.6013 0.6236 0.7306 0.0531 -0.0065 0.0966 153 LYS C N 3753 C CA . LYS B 158 ? 0.6633 0.6871 0.7980 0.0561 -0.0064 0.0991 153 LYS C CA 3754 C C . LYS B 158 ? 0.6772 0.7076 0.8104 0.0580 -0.0069 0.1038 153 LYS C C 3755 O O . LYS B 158 ? 0.7024 0.7344 0.8331 0.0577 -0.0068 0.1068 153 LYS C O 3756 C CB . LYS B 158 ? 0.6980 0.7157 0.8394 0.0574 -0.0054 0.1014 153 LYS C CB 3757 C CG . LYS B 158 ? 0.7483 0.7661 0.8955 0.0607 -0.0055 0.1029 153 LYS C CG 3758 C CD . LYS B 158 ? 0.8495 0.8606 1.0034 0.0619 -0.0050 0.1055 153 LYS C CD 3759 C CE . LYS B 158 ? 0.9044 0.9157 1.0639 0.0656 -0.0054 0.1076 153 LYS C CE 3760 N NZ . LYS B 158 ? 0.9475 0.9509 1.1140 0.0667 -0.0053 0.1088 153 LYS C NZ 3761 N N . ASN B 159 ? 0.6554 0.6903 0.7901 0.0600 -0.0074 0.1043 154 ASN C N 3762 C CA . ASN B 159 ? 0.6890 0.7314 0.8211 0.0613 -0.0082 0.1074 154 ASN C CA 3763 C C . ASN B 159 ? 0.7111 0.7556 0.8360 0.0584 -0.0092 0.1044 154 ASN C C 3764 O O . ASN B 159 ? 0.8286 0.8715 0.9515 0.0561 -0.0096 0.0995 154 ASN C O 3765 C CB . ASN B 159 ? 0.6796 0.7225 0.8146 0.0636 -0.0076 0.1138 154 ASN C CB 3766 C CG . ASN B 159 ? 0.7372 0.7753 0.8799 0.0660 -0.0068 0.1159 154 ASN C CG 3767 O OD1 . ASN B 159 ? 0.7716 0.8045 0.9178 0.0661 -0.0061 0.1185 154 ASN C OD1 3768 N ND2 . ASN B 159 ? 0.7232 0.7629 0.8686 0.0679 -0.0072 0.1143 154 ASN C ND2 3769 N N . ASP B 160 ? 0.6748 0.7229 0.7956 0.0584 -0.0097 0.1067 155 ASP C N 3770 C CA . ASP B 160 ? 0.7008 0.7492 0.8150 0.0555 -0.0109 0.1027 155 ASP C CA 3771 C C . ASP B 160 ? 0.6927 0.7380 0.8048 0.0547 -0.0104 0.1036 155 ASP C C 3772 O O . ASP B 160 ? 0.7284 0.7769 0.8351 0.0544 -0.0114 0.1036 155 ASP C O 3773 C CB . ASP B 160 ? 0.7699 0.8257 0.8795 0.0557 -0.0128 0.1026 155 ASP C CB 3774 C CG . ASP B 160 ? 0.8137 0.8691 0.9169 0.0525 -0.0145 0.0980 155 ASP C CG 3775 O OD1 . ASP B 160 ? 0.8669 0.9269 0.9654 0.0525 -0.0162 0.0981 155 ASP C OD1 3776 O OD2 . ASP B 160 ? 0.9980 1.0484 1.1009 0.0501 -0.0144 0.0942 155 ASP C OD2 3777 N N . ALA B 161 ? 0.6026 0.6421 0.7191 0.0547 -0.0089 0.1044 156 ALA C N 3778 C CA . ALA B 161 ? 0.6382 0.6754 0.7535 0.0541 -0.0082 0.1060 156 ALA C CA 3779 C C . ALA B 161 ? 0.6045 0.6341 0.7223 0.0523 -0.0071 0.1034 156 ALA C C 3780 O O . ALA B 161 ? 0.5473 0.5730 0.6695 0.0522 -0.0066 0.1018 156 ALA C O 3781 C CB . ALA B 161 ? 0.5935 0.6339 0.7121 0.0566 -0.0073 0.1125 156 ALA C CB 3782 N N . TYR B 162 ? 0.5714 0.5996 0.6862 0.0510 -0.0069 0.1030 157 TYR C N 3783 C CA . TYR B 162 ? 0.5807 0.6025 0.6975 0.0493 -0.0060 0.1010 157 TYR C CA 3784 C C . TYR B 162 ? 0.6135 0.6368 0.7301 0.0497 -0.0052 0.1052 157 TYR C C 3785 O O . TYR B 162 ? 0.5640 0.5892 0.6752 0.0490 -0.0057 0.1041 157 TYR C O 3786 C CB . TYR B 162 ? 0.5203 0.5394 0.6321 0.0467 -0.0068 0.0950 157 TYR C CB 3787 C CG . TYR B 162 ? 0.5275 0.5399 0.6418 0.0450 -0.0058 0.0921 157 TYR C CG 3788 C CD1 . TYR B 162 ? 0.4973 0.5073 0.6126 0.0445 -0.0049 0.0936 157 TYR C CD1 3789 C CD2 . TYR B 162 ? 0.4879 0.4970 0.6032 0.0438 -0.0060 0.0876 157 TYR C CD2 3790 C CE1 . TYR B 162 ? 0.4963 0.5005 0.6140 0.0428 -0.0042 0.0908 157 TYR C CE1 3791 C CE2 . TYR B 162 ? 0.4537 0.4570 0.5711 0.0423 -0.0052 0.0847 157 TYR C CE2 3792 C CZ . TYR B 162 ? 0.4928 0.4935 0.6113 0.0418 -0.0043 0.0862 157 TYR C CZ 3793 O OH . TYR B 162 ? 0.4976 0.4929 0.6181 0.0403 -0.0037 0.0831 157 TYR C OH 3794 N N . PRO B 163 ? 0.6679 0.6908 0.7905 0.0511 -0.0042 0.1104 158 PRO C N 3795 C CA . PRO B 163 ? 0.6783 0.7028 0.8017 0.0511 -0.0034 0.1147 158 PRO C CA 3796 C C . PRO B 163 ? 0.6790 0.6982 0.8026 0.0488 -0.0027 0.1120 158 PRO C C 3797 O O . PRO B 163 ? 0.6391 0.6523 0.7648 0.0474 -0.0026 0.1079 158 PRO C O 3798 C CB . PRO B 163 ? 0.6879 0.7119 0.8187 0.0527 -0.0026 0.1207 158 PRO C CB 3799 C CG . PRO B 163 ? 0.6768 0.6964 0.8115 0.0532 -0.0028 0.1181 158 PRO C CG 3800 C CD . PRO B 163 ? 0.6916 0.7124 0.8207 0.0525 -0.0039 0.1123 158 PRO C CD 3801 N N . THR B 164 ? 0.6543 0.6765 0.7759 0.0485 -0.0023 0.1144 159 THR C N 3802 C CA . THR B 164 ? 0.6259 0.6447 0.7466 0.0465 -0.0018 0.1119 159 THR C CA 3803 C C . THR B 164 ? 0.6183 0.6311 0.7466 0.0453 -0.0008 0.1136 159 THR C C 3804 O O . THR B 164 ? 0.7086 0.7224 0.8420 0.0460 -0.0001 0.1194 159 THR C O 3805 C CB . THR B 164 ? 0.6676 0.6925 0.7843 0.0470 -0.0016 0.1146 159 THR C CB 3806 O OG1 . THR B 164 ? 0.6671 0.6968 0.7763 0.0482 -0.0030 0.1121 159 THR C OG1 3807 C CG2 . THR B 164 ? 0.6974 0.7192 0.8136 0.0450 -0.0010 0.1124 159 THR C CG2 3808 N N . ILE B 165 ? 0.5664 0.5728 0.6954 0.0436 -0.0007 0.1084 160 ILE C N 3809 C CA . ILE B 165 ? 0.5709 0.5709 0.7070 0.0424 -0.0001 0.1087 160 ILE C CA 3810 C C . ILE B 165 ? 0.6088 0.6093 0.7456 0.0409 0.0006 0.1109 160 ILE C C 3811 O O . ILE B 165 ? 0.5714 0.5743 0.7024 0.0401 0.0005 0.1084 160 ILE C O 3812 C CB . ILE B 165 ? 0.5760 0.5701 0.7119 0.0412 -0.0004 0.1019 160 ILE C CB 3813 C CG1 . ILE B 165 ? 0.6295 0.6236 0.7662 0.0428 -0.0011 0.1004 160 ILE C CG1 3814 C CG2 . ILE B 165 ? 0.5683 0.5558 0.7107 0.0398 0.0000 0.1012 160 ILE C CG2 3815 C CD1 . ILE B 165 ? 0.6612 0.6527 0.7950 0.0419 -0.0016 0.0936 160 ILE C CD1 3816 N N . LYS B 166 ? 0.6114 0.6096 0.7553 0.0404 0.0012 0.1157 161 LYS C N 3817 C CA . LYS B 166 ? 0.6933 0.6911 0.8396 0.0384 0.0019 0.1177 161 LYS C CA 3818 C C . LYS B 166 ? 0.6623 0.6528 0.8171 0.0371 0.0019 0.1187 161 LYS C C 3819 O O . LYS B 166 ? 0.7775 0.7674 0.9379 0.0378 0.0018 0.1241 161 LYS C O 3820 C CB . LYS B 166 ? 0.7494 0.7546 0.8954 0.0389 0.0025 0.1248 161 LYS C CB 3821 C CG . LYS B 166 ? 0.8863 0.8996 1.0240 0.0405 0.0023 0.1242 161 LYS C CG 3822 C CD . LYS B 166 ? 0.9541 0.9758 1.0916 0.0413 0.0029 0.1311 161 LYS C CD 3823 C CE . LYS B 166 ? 1.0531 1.0827 1.1826 0.0437 0.0023 0.1305 161 LYS C CE 3824 N NZ . LYS B 166 ? 1.0950 1.1335 1.2215 0.0444 0.0028 0.1343 161 LYS C NZ 3825 N N . ILE B 167 ? 0.6505 0.6351 0.8064 0.0354 0.0018 0.1134 162 ILE C N 3826 C CA . ILE B 167 ? 0.6438 0.6209 0.8079 0.0343 0.0015 0.1136 162 ILE C CA 3827 C C . ILE B 167 ? 0.5837 0.5582 0.7489 0.0316 0.0018 0.1113 162 ILE C C 3828 O O . ILE B 167 ? 0.5443 0.5217 0.7036 0.0309 0.0022 0.1081 162 ILE C O 3829 C CB . ILE B 167 ? 0.6509 0.6225 0.8166 0.0355 0.0007 0.1082 162 ILE C CB 3830 C CG1 . ILE B 167 ? 0.6880 0.6592 0.8475 0.0349 0.0008 0.1008 162 ILE C CG1 3831 C CG2 . ILE B 167 ? 0.6249 0.5993 0.7900 0.0383 0.0004 0.1106 162 ILE C CG2 3832 C CD1 . ILE B 167 ? 0.7506 0.7160 0.9128 0.0354 0.0001 0.0951 162 ILE C CD1 3833 N N . SER B 168 ? 0.5712 0.5399 0.7443 0.0302 0.0014 0.1129 163 SER C N 3834 C CA . SER B 168 ? 0.6286 0.5941 0.8035 0.0276 0.0015 0.1100 163 SER C CA 3835 C C . SER B 168 ? 0.5549 0.5115 0.7371 0.0270 0.0005 0.1075 163 SER C C 3836 O O . SER B 168 ? 0.6786 0.6320 0.8657 0.0284 -0.0002 0.1098 163 SER C O 3837 C CB . SER B 168 ? 0.6244 0.5948 0.8004 0.0256 0.0023 0.1159 163 SER C CB 3838 O OG . SER B 168 ? 0.6591 0.6277 0.8427 0.0251 0.0018 0.1226 163 SER C OG 3839 N N . TYR B 169 ? 0.5949 0.5479 0.7775 0.0253 0.0004 0.1021 164 TYR C N 3840 C CA . TYR B 169 ? 0.5622 0.5069 0.7517 0.0246 -0.0007 0.0989 164 TYR C CA 3841 C C . TYR B 169 ? 0.6179 0.5612 0.8105 0.0214 -0.0006 0.0990 164 TYR C C 3842 O O . TYR B 169 ? 0.6308 0.5772 0.8182 0.0202 0.0000 0.0957 164 TYR C O 3843 C CB . TYR B 169 ? 0.5543 0.4959 0.7411 0.0261 -0.0011 0.0907 164 TYR C CB 3844 C CG . TYR B 169 ? 0.5522 0.4859 0.7457 0.0255 -0.0023 0.0866 164 TYR C CG 3845 C CD1 . TYR B 169 ? 0.6198 0.5478 0.8199 0.0272 -0.0037 0.0873 164 TYR C CD1 3846 C CD2 . TYR B 169 ? 0.5404 0.4722 0.7338 0.0233 -0.0023 0.0820 164 TYR C CD2 3847 C CE1 . TYR B 169 ? 0.5611 0.4817 0.7675 0.0269 -0.0052 0.0831 164 TYR C CE1 3848 C CE2 . TYR B 169 ? 0.5719 0.4967 0.7714 0.0229 -0.0037 0.0780 164 TYR C CE2 3849 C CZ . TYR B 169 ? 0.5666 0.4857 0.7725 0.0247 -0.0052 0.0784 164 TYR C CZ 3850 O OH . TYR B 169 ? 0.6583 0.5703 0.8703 0.0245 -0.0067 0.0740 164 TYR C OH 3851 N N . ASN B 170 ? 0.6211 0.5594 0.8222 0.0200 -0.0017 0.1026 165 ASN C N 3852 C CA . ASN B 170 ? 0.6561 0.5922 0.8615 0.0167 -0.0020 0.1028 165 ASN C CA 3853 C C . ASN B 170 ? 0.6139 0.5420 0.8230 0.0164 -0.0033 0.0956 165 ASN C C 3854 O O . ASN B 170 ? 0.5955 0.5174 0.8092 0.0181 -0.0047 0.0941 165 ASN C O 3855 C CB . ASN B 170 ? 0.7471 0.6823 0.9600 0.0150 -0.0027 0.1113 165 ASN C CB 3856 C CG . ASN B 170 ? 0.7905 0.7244 1.0084 0.0111 -0.0030 0.1129 165 ASN C CG 3857 O OD1 . ASN B 170 ? 0.7857 0.7146 1.0059 0.0098 -0.0039 0.1072 165 ASN C OD1 3858 N ND2 . ASN B 170 ? 0.8489 0.7880 1.0688 0.0091 -0.0025 0.1210 165 ASN C ND2 3859 N N . ASN B 171 ? 0.5985 0.5270 0.8057 0.0145 -0.0030 0.0909 166 ASN C N 3860 C CA . ASN B 171 ? 0.5990 0.5205 0.8099 0.0142 -0.0043 0.0840 166 ASN C CA 3861 C C . ASN B 171 ? 0.6541 0.5693 0.8749 0.0117 -0.0061 0.0868 166 ASN C C 3862 O O . ASN B 171 ? 0.6715 0.5870 0.8946 0.0086 -0.0062 0.0872 166 ASN C O 3863 C CB . ASN B 171 ? 0.5722 0.4965 0.7774 0.0132 -0.0035 0.0778 166 ASN C CB 3864 C CG . ASN B 171 ? 0.5601 0.4781 0.7687 0.0132 -0.0048 0.0704 166 ASN C CG 3865 O OD1 . ASN B 171 ? 0.5576 0.4691 0.7725 0.0142 -0.0065 0.0692 166 ASN C OD1 3866 N ND2 . ASN B 171 ? 0.5390 0.4591 0.7436 0.0120 -0.0042 0.0655 166 ASN C ND2 3867 N N . THR B 172 ? 0.7426 0.6517 0.9695 0.0131 -0.0077 0.0885 167 THR C N 3868 C CA . THR B 172 ? 0.7407 0.6425 0.9776 0.0109 -0.0099 0.0911 167 THR C CA 3869 C C . THR B 172 ? 0.7354 0.6297 0.9760 0.0110 -0.0117 0.0830 167 THR C C 3870 O O . THR B 172 ? 0.8121 0.6993 1.0610 0.0094 -0.0139 0.0838 167 THR C O 3871 C CB . THR B 172 ? 0.7108 0.6083 0.9530 0.0127 -0.0112 0.0966 167 THR C CB 3872 O OG1 . THR B 172 ? 0.6597 0.5547 0.8999 0.0168 -0.0117 0.0915 167 THR C OG1 3873 C CG2 . THR B 172 ? 0.7272 0.6322 0.9665 0.0125 -0.0096 0.1052 167 THR C CG2 3874 N N . ASN B 173 ? 0.7464 0.6425 0.9811 0.0128 -0.0110 0.0752 168 ASN C N 3875 C CA . ASN B 173 ? 0.7234 0.6140 0.9610 0.0127 -0.0125 0.0673 168 ASN C CA 3876 C C . ASN B 173 ? 0.7631 0.6552 1.0018 0.0086 -0.0123 0.0669 168 ASN C C 3877 O O . ASN B 173 ? 0.7220 0.6201 0.9584 0.0062 -0.0108 0.0723 168 ASN C O 3878 C CB . ASN B 173 ? 0.7195 0.6125 0.9504 0.0160 -0.0117 0.0595 168 ASN C CB 3879 C CG . ASN B 173 ? 0.7306 0.6241 0.9595 0.0199 -0.0115 0.0603 168 ASN C CG 3880 O OD1 . ASN B 173 ? 0.7606 0.6482 0.9946 0.0222 -0.0134 0.0583 168 ASN C OD1 3881 N ND2 . ASN B 173 ? 0.6524 0.5531 0.8740 0.0207 -0.0094 0.0632 168 ASN C ND2 3882 N N . GLN B 174 ? 0.7591 0.6463 1.0013 0.0080 -0.0139 0.0604 169 GLN C N 3883 C CA . GLN B 174 ? 0.7906 0.6790 1.0341 0.0042 -0.0139 0.0592 169 GLN C CA 3884 C C . GLN B 174 ? 0.7688 0.6630 1.0041 0.0049 -0.0121 0.0530 169 GLN C C 3885 O O . GLN B 174 ? 0.7908 0.6872 1.0257 0.0023 -0.0118 0.0514 169 GLN C O 3886 C CB . GLN B 174 ? 0.9264 0.8060 1.1791 0.0029 -0.0170 0.0558 169 GLN C CB 3887 C CG . GLN B 174 ? 1.0468 0.9225 1.3083 -0.0008 -0.0187 0.0634 169 GLN C CG 3888 C CD . GLN B 174 ? 1.0875 0.9632 1.3505 0.0000 -0.0184 0.0720 169 GLN C CD 3889 O OE1 . GLN B 174 ? 1.2012 1.0746 1.4632 0.0037 -0.0187 0.0710 169 GLN C OE1 3890 N NE2 . GLN B 174 ? 1.0929 0.9721 1.3584 -0.0035 -0.0178 0.0806 169 GLN C NE2 3891 N N . GLU B 175 ? 0.7837 0.6804 1.0124 0.0084 -0.0110 0.0497 170 GLU C N 3892 C CA . GLU B 175 ? 0.7759 0.6775 0.9967 0.0094 -0.0095 0.0436 170 GLU C CA 3893 C C . GLU B 175 ? 0.6811 0.5900 0.8932 0.0104 -0.0072 0.0467 170 GLU C C 3894 O O . GLU B 175 ? 0.6580 0.5678 0.8697 0.0117 -0.0069 0.0517 170 GLU C O 3895 C CB . GLU B 175 ? 0.8294 0.7279 1.0498 0.0127 -0.0105 0.0359 170 GLU C CB 3896 C CG . GLU B 175 ? 0.9377 0.8307 1.1644 0.0118 -0.0126 0.0303 170 GLU C CG 3897 C CD . GLU B 175 ? 1.0728 0.9594 1.3046 0.0149 -0.0148 0.0264 170 GLU C CD 3898 O OE1 . GLU B 175 ? 1.3863 1.2678 1.6242 0.0151 -0.0162 0.0309 170 GLU C OE1 3899 O OE2 . GLU B 175 ? 1.1523 1.0391 1.3822 0.0171 -0.0152 0.0188 170 GLU C OE2 3900 N N . ASP B 176 ? 0.6027 0.5167 0.8081 0.0097 -0.0059 0.0438 171 ASP C N 3901 C CA . ASP B 176 ? 0.5924 0.5128 0.7888 0.0111 -0.0040 0.0450 171 ASP C CA 3902 C C . ASP B 176 ? 0.5283 0.4481 0.7221 0.0144 -0.0040 0.0430 171 ASP C C 3903 O O . ASP B 176 ? 0.5025 0.4185 0.6990 0.0160 -0.0051 0.0381 171 ASP C O 3904 C CB . ASP B 176 ? 0.6201 0.5443 0.8099 0.0106 -0.0031 0.0400 171 ASP C CB 3905 C CG . ASP B 176 ? 0.6635 0.5908 0.8533 0.0077 -0.0026 0.0422 171 ASP C CG 3906 O OD1 . ASP B 176 ? 0.7313 0.6593 0.9251 0.0058 -0.0026 0.0484 171 ASP C OD1 3907 O OD2 . ASP B 176 ? 0.6885 0.6180 0.8744 0.0072 -0.0022 0.0376 171 ASP C OD2 3908 N N . LEU B 177 ? 0.4995 0.4237 0.6879 0.0155 -0.0029 0.0468 172 LEU C N 3909 C CA . LEU B 177 ? 0.5142 0.4389 0.6998 0.0184 -0.0028 0.0456 172 LEU C CA 3910 C C . LEU B 177 ? 0.5025 0.4329 0.6785 0.0191 -0.0016 0.0435 172 LEU C C 3911 O O . LEU B 177 ? 0.4850 0.4196 0.6563 0.0180 -0.0006 0.0468 172 LEU C O 3912 C CB . LEU B 177 ? 0.5468 0.4715 0.7351 0.0191 -0.0029 0.0525 172 LEU C CB 3913 C CG . LEU B 177 ? 0.6367 0.5577 0.8294 0.0216 -0.0039 0.0528 172 LEU C CG 3914 C CD1 . LEU B 177 ? 0.6514 0.5656 0.8514 0.0220 -0.0057 0.0485 172 LEU C CD1 3915 C CD2 . LEU B 177 ? 0.6858 0.6072 0.8814 0.0214 -0.0039 0.0609 172 LEU C CD2 3916 N N . LEU B 178 ? 0.4949 0.4254 0.6680 0.0208 -0.0017 0.0381 173 LEU C N 3917 C CA . LEU B 178 ? 0.4500 0.3854 0.6146 0.0213 -0.0009 0.0366 173 LEU C CA 3918 C C . LEU B 178 ? 0.4337 0.3708 0.5968 0.0232 -0.0008 0.0398 173 LEU C C 3919 O O . LEU B 178 ? 0.4352 0.3703 0.6016 0.0251 -0.0014 0.0384 173 LEU C O 3920 C CB . LEU B 178 ? 0.4405 0.3760 0.6027 0.0220 -0.0011 0.0296 173 LEU C CB 3921 C CG . LEU B 178 ? 0.4459 0.3857 0.6001 0.0228 -0.0005 0.0277 173 LEU C CG 3922 C CD1 . LEU B 178 ? 0.4372 0.3802 0.5846 0.0214 0.0000 0.0296 173 LEU C CD1 3923 C CD2 . LEU B 178 ? 0.4328 0.3729 0.5860 0.0234 -0.0008 0.0212 173 LEU C CD2 3924 N N . ILE B 179 ? 0.4215 0.3624 0.5796 0.0229 -0.0001 0.0440 174 ILE C N 3925 C CA . ILE B 179 ? 0.4349 0.3783 0.5911 0.0245 0.0000 0.0474 174 ILE C CA 3926 C C . ILE B 179 ? 0.4500 0.3978 0.5975 0.0248 0.0002 0.0460 174 ILE C C 3927 O O . ILE B 179 ? 0.4599 0.4095 0.6024 0.0235 0.0005 0.0452 174 ILE C O 3928 C CB . ILE B 179 ? 0.4241 0.3684 0.5824 0.0242 0.0001 0.0544 174 ILE C CB 3929 C CG1 . ILE B 179 ? 0.4536 0.3932 0.6209 0.0235 -0.0004 0.0563 174 ILE C CG1 3930 C CG2 . ILE B 179 ? 0.4357 0.3827 0.5925 0.0261 0.0001 0.0578 174 ILE C CG2 3931 C CD1 . ILE B 179 ? 0.4777 0.4185 0.6479 0.0230 -0.0002 0.0637 174 ILE C CD1 3932 N N . LEU B 180 ? 0.4294 0.3788 0.5753 0.0264 0.0000 0.0456 175 LEU C N 3933 C CA . LEU B 180 ? 0.4397 0.3929 0.5783 0.0265 0.0000 0.0444 175 LEU C CA 3934 C C . LEU B 180 ? 0.4339 0.3899 0.5712 0.0278 -0.0002 0.0483 175 LEU C C 3935 O O . LEU B 180 ? 0.5080 0.4630 0.6503 0.0293 -0.0003 0.0503 175 LEU C O 3936 C CB . LEU B 180 ? 0.4568 0.4101 0.5942 0.0269 -0.0003 0.0389 175 LEU C CB 3937 C CG . LEU B 180 ? 0.4847 0.4357 0.6230 0.0259 -0.0002 0.0342 175 LEU C CG 3938 C CD1 . LEU B 180 ? 0.4937 0.4418 0.6389 0.0271 -0.0005 0.0314 175 LEU C CD1 3939 C CD2 . LEU B 180 ? 0.5300 0.4835 0.6618 0.0252 -0.0003 0.0305 175 LEU C CD2 3940 N N . TRP B 181 ? 0.4007 0.3601 0.5310 0.0274 -0.0004 0.0492 176 TRP C N 3941 C CA . TRP B 181 ? 0.4314 0.3943 0.5593 0.0285 -0.0007 0.0525 176 TRP C CA 3942 C C . TRP B 181 ? 0.4229 0.3883 0.5428 0.0277 -0.0013 0.0505 176 TRP C C 3943 O O . TRP B 181 ? 0.4079 0.3724 0.5246 0.0264 -0.0014 0.0473 176 TRP C O 3944 C CB . TRP B 181 ? 0.4574 0.4216 0.5862 0.0288 -0.0004 0.0582 176 TRP C CB 3945 C CG . TRP B 181 ? 0.4443 0.4097 0.5686 0.0276 -0.0003 0.0585 176 TRP C CG 3946 C CD1 . TRP B 181 ? 0.4539 0.4226 0.5712 0.0276 -0.0008 0.0592 176 TRP C CD1 3947 C CD2 . TRP B 181 ? 0.4672 0.4303 0.5935 0.0263 0.0002 0.0576 176 TRP C CD2 3948 N NE1 . TRP B 181 ? 0.4338 0.4028 0.5487 0.0267 -0.0005 0.0589 176 TRP C NE1 3949 C CE2 . TRP B 181 ? 0.4410 0.4069 0.5614 0.0258 0.0001 0.0581 176 TRP C CE2 3950 C CE3 . TRP B 181 ? 0.4789 0.4382 0.6118 0.0256 0.0006 0.0567 176 TRP C CE3 3951 C CZ2 . TRP B 181 ? 0.4457 0.4110 0.5664 0.0246 0.0005 0.0576 176 TRP C CZ2 3952 C CZ3 . TRP B 181 ? 0.4716 0.4303 0.6049 0.0241 0.0009 0.0563 176 TRP C CZ3 3953 C CH2 . TRP B 181 ? 0.4620 0.4239 0.5892 0.0237 0.0010 0.0569 176 TRP C CH2 3954 N N . GLY B 182 ? 0.4241 0.3929 0.5409 0.0284 -0.0019 0.0527 177 GLY C N 3955 C CA . GLY B 182 ? 0.4193 0.3901 0.5289 0.0276 -0.0029 0.0509 177 GLY C CA 3956 C C . GLY B 182 ? 0.4125 0.3868 0.5182 0.0282 -0.0038 0.0542 177 GLY C C 3957 O O . GLY B 182 ? 0.4141 0.3901 0.5229 0.0296 -0.0034 0.0580 177 GLY C O 3958 N N . VAL B 183 ? 0.3995 0.3750 0.4985 0.0273 -0.0050 0.0525 178 VAL C N 3959 C CA . VAL B 183 ? 0.3973 0.3760 0.4920 0.0278 -0.0063 0.0545 178 VAL C CA 3960 C C . VAL B 183 ? 0.4305 0.4105 0.5226 0.0267 -0.0075 0.0523 178 VAL C C 3961 O O . VAL B 183 ? 0.4890 0.4672 0.5791 0.0252 -0.0078 0.0489 178 VAL C O 3962 C CB . VAL B 183 ? 0.3961 0.3751 0.4849 0.0276 -0.0072 0.0547 178 VAL C CB 3963 C CG1 . VAL B 183 ? 0.4029 0.3792 0.4871 0.0260 -0.0080 0.0507 178 VAL C CG1 3964 C CG2 . VAL B 183 ? 0.3961 0.3786 0.4805 0.0284 -0.0087 0.0566 178 VAL C CG2 3965 N N . HIS B 184 ? 0.4034 0.3868 0.4954 0.0276 -0.0081 0.0546 179 HIS C N 3966 C CA . HIS B 184 ? 0.4508 0.4364 0.5403 0.0265 -0.0095 0.0532 179 HIS C CA 3967 C C . HIS B 184 ? 0.4705 0.4572 0.5531 0.0257 -0.0116 0.0533 179 HIS C C 3968 O O . HIS B 184 ? 0.5326 0.5214 0.6139 0.0270 -0.0121 0.0559 179 HIS C O 3969 C CB . HIS B 184 ? 0.4452 0.4345 0.5391 0.0278 -0.0091 0.0553 179 HIS C CB 3970 C CG . HIS B 184 ? 0.4717 0.4642 0.5631 0.0266 -0.0105 0.0543 179 HIS C CG 3971 N ND1 . HIS B 184 ? 0.5366 0.5334 0.6274 0.0273 -0.0115 0.0567 179 HIS C ND1 3972 C CD2 . HIS B 184 ? 0.5061 0.4987 0.5954 0.0244 -0.0113 0.0514 179 HIS C CD2 3973 C CE1 . HIS B 184 ? 0.5801 0.5794 0.6688 0.0255 -0.0128 0.0553 179 HIS C CE1 3974 N NE2 . HIS B 184 ? 0.5718 0.5687 0.6595 0.0237 -0.0127 0.0522 179 HIS C NE2 3975 N N . HIS B 185 ? 0.4866 0.4717 0.5649 0.0235 -0.0130 0.0504 180 HIS C N 3976 C CA . HIS B 185 ? 0.4389 0.4243 0.5108 0.0225 -0.0156 0.0500 180 HIS C CA 3977 C C . HIS B 185 ? 0.4551 0.4441 0.5270 0.0215 -0.0168 0.0505 180 HIS C C 3978 O O . HIS B 185 ? 0.4301 0.4195 0.5028 0.0197 -0.0169 0.0490 180 HIS C O 3979 C CB . HIS B 185 ? 0.4648 0.4463 0.5322 0.0205 -0.0167 0.0468 180 HIS C CB 3980 C CG . HIS B 185 ? 0.4304 0.4087 0.4978 0.0213 -0.0155 0.0458 180 HIS C CG 3981 N ND1 . HIS B 185 ? 0.4466 0.4248 0.5117 0.0230 -0.0157 0.0470 180 HIS C ND1 3982 C CD2 . HIS B 185 ? 0.4147 0.3904 0.4840 0.0207 -0.0141 0.0438 180 HIS C CD2 3983 C CE1 . HIS B 185 ? 0.4692 0.4450 0.5352 0.0233 -0.0144 0.0460 180 HIS C CE1 3984 N NE2 . HIS B 185 ? 0.4221 0.3960 0.4904 0.0219 -0.0135 0.0439 180 HIS C NE2 3985 N N . SER B 186 ? 0.4419 0.4341 0.5129 0.0227 -0.0178 0.0529 181 SER C N 3986 C CA . SER B 186 ? 0.4656 0.4619 0.5368 0.0219 -0.0190 0.0538 181 SER C CA 3987 C C . SER B 186 ? 0.4776 0.4727 0.5426 0.0194 -0.0221 0.0520 181 SER C C 3988 O O . SER B 186 ? 0.4849 0.4761 0.5455 0.0190 -0.0233 0.0504 181 SER C O 3989 C CB . SER B 186 ? 0.5008 0.5012 0.5736 0.0244 -0.0188 0.0571 181 SER C CB 3990 O OG . SER B 186 ? 0.5328 0.5325 0.6016 0.0257 -0.0198 0.0578 181 SER C OG 3991 N N . ASN B 187 ? 0.4701 0.4689 0.5351 0.0178 -0.0236 0.0525 182 ASN C N 3992 C CA . ASN B 187 ? 0.5401 0.5376 0.6000 0.0148 -0.0268 0.0510 182 ASN C CA 3993 C C . ASN B 187 ? 0.5474 0.5456 0.6027 0.0149 -0.0298 0.0515 182 ASN C C 3994 O O . ASN B 187 ? 0.4904 0.4853 0.5407 0.0128 -0.0327 0.0498 182 ASN C O 3995 C CB . ASN B 187 ? 0.5203 0.5214 0.5826 0.0123 -0.0269 0.0510 182 ASN C CB 3996 C CG . ASN B 187 ? 0.5994 0.5997 0.6652 0.0121 -0.0244 0.0498 182 ASN C CG 3997 O OD1 . ASN B 187 ? 0.5430 0.5386 0.6071 0.0118 -0.0240 0.0480 182 ASN C OD1 3998 N ND2 . ASN B 187 ? 0.6756 0.6808 0.7464 0.0124 -0.0229 0.0506 182 ASN C ND2 3999 N N . ASN B 188 ? 0.5585 0.5608 0.6156 0.0174 -0.0293 0.0537 183 ASN C N 4000 C CA . ASN B 188 ? 0.5779 0.5819 0.6311 0.0180 -0.0320 0.0542 183 ASN C CA 4001 C C . ASN B 188 ? 0.5691 0.5778 0.6251 0.0215 -0.0304 0.0571 183 ASN C C 4002 O O . ASN B 188 ? 0.6357 0.6463 0.6969 0.0230 -0.0275 0.0589 183 ASN C O 4003 C CB . ASN B 188 ? 0.5823 0.5887 0.6342 0.0150 -0.0348 0.0540 183 ASN C CB 4004 C CG . ASN B 188 ? 0.6161 0.6280 0.6734 0.0145 -0.0331 0.0557 183 ASN C CG 4005 O OD1 . ASN B 188 ? 0.6408 0.6575 0.7016 0.0170 -0.0315 0.0580 183 ASN C OD1 4006 N ND2 . ASN B 188 ? 0.6138 0.6255 0.6719 0.0113 -0.0334 0.0548 183 ASN C ND2 4007 N N . ALA B 189 ? 0.6425 0.6531 0.6947 0.0228 -0.0327 0.0574 184 ALA C N 4008 C CA . ALA B 189 ? 0.6639 0.6793 0.7178 0.0262 -0.0316 0.0603 184 ALA C CA 4009 C C . ALA B 189 ? 0.6175 0.6385 0.6770 0.0268 -0.0299 0.0630 184 ALA C C 4010 O O . ALA B 189 ? 0.6269 0.6503 0.6903 0.0295 -0.0275 0.0658 184 ALA C O 4011 C CB . ALA B 189 ? 0.6866 0.7039 0.7352 0.0272 -0.0348 0.0596 184 ALA C CB 4012 N N . ALA B 190 ? 0.5977 0.6206 0.6577 0.0242 -0.0313 0.0624 185 ALA C N 4013 C CA . ALA B 190 ? 0.6488 0.6776 0.7140 0.0249 -0.0299 0.0648 185 ALA C CA 4014 C C . ALA B 190 ? 0.6327 0.6605 0.7035 0.0259 -0.0265 0.0656 185 ALA C C 4015 O O . ALA B 190 ? 0.7039 0.7351 0.7792 0.0286 -0.0245 0.0683 185 ALA C O 4016 C CB . ALA B 190 ? 0.6333 0.6649 0.6977 0.0217 -0.0322 0.0639 185 ALA C CB 4017 N N . GLU B 191 ? 0.6492 0.6724 0.7200 0.0239 -0.0259 0.0633 186 GLU C N 4018 C CA . GLU B 191 ? 0.5840 0.6058 0.6601 0.0248 -0.0228 0.0634 186 GLU C CA 4019 C C . GLU B 191 ? 0.5634 0.5832 0.6415 0.0278 -0.0208 0.0651 186 GLU C C 4020 O O . GLU B 191 ? 0.5174 0.5383 0.6009 0.0299 -0.0185 0.0669 186 GLU C O 4021 C CB . GLU B 191 ? 0.5965 0.6139 0.6712 0.0220 -0.0229 0.0603 186 GLU C CB 4022 C CG . GLU B 191 ? 0.6140 0.6297 0.6936 0.0228 -0.0201 0.0597 186 GLU C CG 4023 C CD . GLU B 191 ? 0.6902 0.7027 0.7683 0.0200 -0.0204 0.0567 186 GLU C CD 4024 O OE1 . GLU B 191 ? 0.8313 0.8467 0.9087 0.0175 -0.0216 0.0560 186 GLU C OE1 4025 O OE2 . GLU B 191 ? 0.6131 0.6206 0.6907 0.0202 -0.0194 0.0553 186 GLU C OE2 4026 N N . GLN B 192 ? 0.5449 0.5618 0.6186 0.0281 -0.0217 0.0647 187 GLN C N 4027 C CA . GLN B 192 ? 0.5664 0.5820 0.6415 0.0307 -0.0199 0.0666 187 GLN C CA 4028 C C . GLN B 192 ? 0.6015 0.6220 0.6802 0.0336 -0.0189 0.0706 187 GLN C C 4029 O O . GLN B 192 ? 0.5989 0.6189 0.6827 0.0354 -0.0166 0.0727 187 GLN C O 4030 C CB . GLN B 192 ? 0.5603 0.5738 0.6295 0.0308 -0.0215 0.0654 187 GLN C CB 4031 C CG . GLN B 192 ? 0.5845 0.5974 0.6546 0.0332 -0.0198 0.0674 187 GLN C CG 4032 C CD . GLN B 192 ? 0.5842 0.5928 0.6584 0.0329 -0.0173 0.0670 187 GLN C CD 4033 O OE1 . GLN B 192 ? 0.5523 0.5571 0.6264 0.0308 -0.0173 0.0640 187 GLN C OE1 4034 N NE2 . GLN B 192 ? 0.5629 0.5722 0.6406 0.0350 -0.0154 0.0700 187 GLN C NE2 4035 N N . THR B 193 ? 0.6064 0.6318 0.6828 0.0341 -0.0207 0.0716 188 THR C N 4036 C CA . THR B 193 ? 0.6729 0.7035 0.7525 0.0369 -0.0199 0.0756 188 THR C CA 4037 C C . THR B 193 ? 0.6007 0.6332 0.6861 0.0373 -0.0185 0.0766 188 THR C C 4038 O O . THR B 193 ? 0.6070 0.6410 0.6972 0.0397 -0.0167 0.0797 188 THR C O 4039 C CB . THR B 193 ? 0.7566 0.7926 0.8320 0.0377 -0.0223 0.0764 188 THR C CB 4040 O OG1 . THR B 193 ? 0.7409 0.7780 0.8140 0.0351 -0.0246 0.0740 188 THR C OG1 4041 C CG2 . THR B 193 ? 0.8115 0.8462 0.8814 0.0383 -0.0236 0.0755 188 THR C CG2 4042 N N . ASN B 194 ? 0.6417 0.6740 0.7268 0.0348 -0.0193 0.0739 189 ASN C N 4043 C CA . ASN B 194 ? 0.6564 0.6910 0.7469 0.0353 -0.0180 0.0743 189 ASN C CA 4044 C C . ASN B 194 ? 0.6183 0.6491 0.7142 0.0369 -0.0154 0.0748 189 ASN C C 4045 O O . ASN B 194 ? 0.6865 0.7195 0.7875 0.0391 -0.0142 0.0765 189 ASN C O 4046 C CB . ASN B 194 ? 0.7591 0.7940 0.8481 0.0322 -0.0192 0.0712 189 ASN C CB 4047 C CG . ASN B 194 ? 0.8894 0.9308 0.9807 0.0323 -0.0197 0.0721 189 ASN C CG 4048 O OD1 . ASN B 194 ? 1.0135 1.0589 1.1017 0.0311 -0.0219 0.0723 189 ASN C OD1 4049 N ND2 . ASN B 194 ? 0.9676 1.0104 1.0645 0.0341 -0.0178 0.0725 189 ASN C ND2 4050 N N . LEU B 195 ? 0.6117 0.6367 0.7064 0.0358 -0.0148 0.0730 190 LEU C N 4051 C CA . LEU B 195 ? 0.5567 0.5775 0.6565 0.0369 -0.0126 0.0728 190 LEU C CA 4052 C C . LEU B 195 ? 0.5201 0.5392 0.6219 0.0390 -0.0114 0.0761 190 LEU C C 4053 O O . LEU B 195 ? 0.4532 0.4707 0.5605 0.0408 -0.0098 0.0778 190 LEU C O 4054 C CB . LEU B 195 ? 0.5452 0.5609 0.6430 0.0345 -0.0125 0.0691 190 LEU C CB 4055 C CG . LEU B 195 ? 0.5715 0.5885 0.6682 0.0321 -0.0133 0.0659 190 LEU C CG 4056 C CD1 . LEU B 195 ? 0.6071 0.6190 0.7012 0.0299 -0.0133 0.0627 190 LEU C CD1 4057 C CD2 . LEU B 195 ? 0.5624 0.5818 0.6647 0.0335 -0.0121 0.0657 190 LEU C CD2 4058 N N . TYR B 196 ? 0.4979 0.5174 0.5950 0.0389 -0.0122 0.0772 191 TYR C N 4059 C CA . TYR B 196 ? 0.5192 0.5374 0.6178 0.0405 -0.0111 0.0802 191 TYR C CA 4060 C C . TYR B 196 ? 0.5171 0.5404 0.6134 0.0424 -0.0118 0.0838 191 TYR C C 4061 O O . TYR B 196 ? 0.5493 0.5727 0.6467 0.0438 -0.0108 0.0869 191 TYR C O 4062 C CB . TYR B 196 ? 0.5581 0.5716 0.6535 0.0388 -0.0110 0.0776 191 TYR C CB 4063 C CG . TYR B 196 ? 0.4847 0.4935 0.5812 0.0368 -0.0105 0.0736 191 TYR C CG 4064 C CD1 . TYR B 196 ? 0.4392 0.4453 0.5419 0.0374 -0.0088 0.0738 191 TYR C CD1 4065 C CD2 . TYR B 196 ? 0.4978 0.5050 0.5892 0.0344 -0.0119 0.0697 191 TYR C CD2 4066 C CE1 . TYR B 196 ? 0.4645 0.4671 0.5683 0.0359 -0.0084 0.0700 191 TYR C CE1 4067 C CE2 . TYR B 196 ? 0.4687 0.4724 0.5613 0.0326 -0.0115 0.0663 191 TYR C CE2 4068 C CZ . TYR B 196 ? 0.4444 0.4461 0.5431 0.0335 -0.0096 0.0664 191 TYR C CZ 4069 O OH . TYR B 196 ? 0.3818 0.3806 0.4817 0.0322 -0.0091 0.0630 191 TYR C OH 4070 N N . LYS B 197 ? 0.5348 0.5626 0.6278 0.0424 -0.0135 0.0835 192 LYS C N 4071 C CA . LYS B 197 ? 0.5930 0.6264 0.6835 0.0442 -0.0145 0.0864 192 LYS C CA 4072 C C . LYS B 197 ? 0.5842 0.6172 0.6689 0.0441 -0.0155 0.0855 192 LYS C C 4073 O O . LYS B 197 ? 0.6148 0.6502 0.6940 0.0436 -0.0178 0.0837 192 LYS C O 4074 C CB . LYS B 197 ? 0.6785 0.7142 0.7744 0.0471 -0.0127 0.0916 192 LYS C CB 4075 C CG . LYS B 197 ? 0.6934 0.7358 0.7873 0.0494 -0.0135 0.0953 192 LYS C CG 4076 C CD . LYS B 197 ? 0.7658 0.8134 0.8582 0.0496 -0.0151 0.0948 192 LYS C CD 4077 C CE . LYS B 197 ? 0.8093 0.8641 0.9011 0.0524 -0.0156 0.0990 192 LYS C CE 4078 N NZ . LYS B 197 ? 0.8508 0.9101 0.9379 0.0518 -0.0181 0.0967 192 LYS C NZ 4079 N N . ASN B 198 ? 0.5660 0.5962 0.6522 0.0444 -0.0139 0.0866 193 ASN C N 4080 C CA . ASN B 198 ? 0.5715 0.6019 0.6527 0.0447 -0.0146 0.0860 193 ASN C CA 4081 C C . ASN B 198 ? 0.5818 0.6081 0.6576 0.0424 -0.0164 0.0807 193 ASN C C 4082 O O . ASN B 198 ? 0.6216 0.6430 0.6991 0.0403 -0.0158 0.0781 193 ASN C O 4083 C CB . ASN B 198 ? 0.5493 0.5777 0.6342 0.0453 -0.0123 0.0886 193 ASN C CB 4084 C CG . ASN B 198 ? 0.5173 0.5484 0.6083 0.0473 -0.0107 0.0940 193 ASN C CG 4085 O OD1 . ASN B 198 ? 0.6313 0.6683 0.7217 0.0492 -0.0112 0.0970 193 ASN C OD1 4086 N ND2 . ASN B 198 ? 0.5245 0.5515 0.6215 0.0468 -0.0088 0.0954 193 ASN C ND2 4087 N N . PRO B 199 ? 0.6680 0.6965 0.7375 0.0427 -0.0187 0.0790 194 PRO C N 4088 C CA . PRO B 199 ? 0.6608 0.6850 0.7251 0.0404 -0.0209 0.0741 194 PRO C CA 4089 C C . PRO B 199 ? 0.6381 0.6580 0.7004 0.0400 -0.0204 0.0721 194 PRO C C 4090 O O . PRO B 199 ? 0.6407 0.6554 0.7013 0.0377 -0.0211 0.0685 194 PRO C O 4091 C CB . PRO B 199 ? 0.7203 0.7486 0.7787 0.0415 -0.0239 0.0732 194 PRO C CB 4092 C CG . PRO B 199 ? 0.6697 0.7042 0.7291 0.0448 -0.0228 0.0774 194 PRO C CG 4093 C CD . PRO B 199 ? 0.7308 0.7661 0.7977 0.0452 -0.0199 0.0814 194 PRO C CD 4094 N N . THR B 200 ? 0.6287 0.6511 0.6909 0.0422 -0.0192 0.0745 195 THR C N 4095 C CA . THR B 200 ? 0.6600 0.6797 0.7201 0.0422 -0.0188 0.0730 195 THR C CA 4096 C C . THR B 200 ? 0.6186 0.6371 0.6853 0.0421 -0.0156 0.0760 195 THR C C 4097 O O . THR B 200 ? 0.5341 0.5568 0.6037 0.0440 -0.0141 0.0804 195 THR C O 4098 C CB . THR B 200 ? 0.7110 0.7356 0.7658 0.0449 -0.0201 0.0735 195 THR C CB 4099 O OG1 . THR B 200 ? 0.7208 0.7455 0.7696 0.0448 -0.0235 0.0701 195 THR C OG1 4100 C CG2 . THR B 200 ? 0.6597 0.6827 0.7124 0.0454 -0.0195 0.0723 195 THR C CG2 4101 N N . THR B 201 ? 0.5617 0.5743 0.6305 0.0400 -0.0147 0.0736 196 THR C N 4102 C CA . THR B 201 ? 0.4848 0.4955 0.5603 0.0396 -0.0120 0.0759 196 THR C CA 4103 C C . THR B 201 ? 0.4889 0.4957 0.5640 0.0386 -0.0112 0.0738 196 THR C C 4104 O O . THR B 201 ? 0.4703 0.4752 0.5397 0.0380 -0.0127 0.0702 196 THR C O 4105 C CB . THR B 201 ? 0.4593 0.4672 0.5397 0.0383 -0.0113 0.0754 196 THR C CB 4106 O OG1 . THR B 201 ? 0.4418 0.4456 0.5194 0.0361 -0.0124 0.0707 196 THR C OG1 4107 C CG2 . THR B 201 ? 0.5279 0.5403 0.6091 0.0395 -0.0120 0.0777 196 THR C CG2 4108 N N . TYR B 202 ? 0.4925 0.4980 0.5738 0.0383 -0.0090 0.0762 197 TYR C N 4109 C CA . TYR B 202 ? 0.5428 0.5452 0.6249 0.0374 -0.0079 0.0749 197 TYR C CA 4110 C C . TYR B 202 ? 0.4899 0.4893 0.5799 0.0365 -0.0059 0.0767 197 TYR C C 4111 O O . TYR B 202 ? 0.5263 0.5268 0.6212 0.0372 -0.0053 0.0798 197 TYR C O 4112 C CB . TYR B 202 ? 0.5611 0.5682 0.6406 0.0390 -0.0077 0.0773 197 TYR C CB 4113 C CG . TYR B 202 ? 0.5475 0.5593 0.6320 0.0404 -0.0063 0.0834 197 TYR C CG 4114 C CD1 . TYR B 202 ? 0.5908 0.6080 0.6741 0.0423 -0.0070 0.0863 197 TYR C CD1 4115 C CD2 . TYR B 202 ? 0.5933 0.6041 0.6840 0.0396 -0.0043 0.0863 197 TYR C CD2 4116 C CE1 . TYR B 202 ? 0.6176 0.6393 0.7054 0.0436 -0.0057 0.0923 197 TYR C CE1 4117 C CE2 . TYR B 202 ? 0.6714 0.6861 0.7669 0.0407 -0.0032 0.0924 197 TYR C CE2 4118 C CZ . TYR B 202 ? 0.6283 0.6487 0.7223 0.0427 -0.0038 0.0955 197 TYR C CZ 4119 O OH . TYR B 202 ? 0.6116 0.6362 0.7102 0.0438 -0.0027 0.1017 197 TYR C OH 4120 N N . ILE B 203 ? 0.5146 0.5103 0.6059 0.0351 -0.0051 0.0745 198 ILE C N 4121 C CA . ILE B 203 ? 0.5165 0.5094 0.6151 0.0343 -0.0034 0.0762 198 ILE C CA 4122 C C . ILE B 203 ? 0.5313 0.5248 0.6300 0.0338 -0.0026 0.0770 198 ILE C C 4123 O O . ILE B 203 ? 0.5163 0.5087 0.6101 0.0332 -0.0032 0.0733 198 ILE C O 4124 C CB . ILE B 203 ? 0.4981 0.4855 0.5994 0.0327 -0.0032 0.0722 198 ILE C CB 4125 C CG1 . ILE B 203 ? 0.5082 0.4958 0.6096 0.0331 -0.0040 0.0714 198 ILE C CG1 4126 C CG2 . ILE B 203 ? 0.5023 0.4865 0.6112 0.0321 -0.0018 0.0736 198 ILE C CG2 4127 C CD1 . ILE B 203 ? 0.5535 0.5374 0.6540 0.0316 -0.0044 0.0663 198 ILE C CD1 4128 N N . SER B 204 ? 0.4954 0.4905 0.5997 0.0340 -0.0013 0.0818 199 SER C N 4129 C CA . SER B 204 ? 0.4935 0.4894 0.5990 0.0333 -0.0004 0.0829 199 SER C CA 4130 C C . SER B 204 ? 0.4791 0.4703 0.5923 0.0316 0.0005 0.0834 199 SER C C 4131 O O . SER B 204 ? 0.4863 0.4760 0.6053 0.0317 0.0009 0.0861 199 SER C O 4132 C CB . SER B 204 ? 0.5169 0.5199 0.6222 0.0347 0.0000 0.0886 199 SER C CB 4133 O OG . SER B 204 ? 0.5555 0.5633 0.6531 0.0365 -0.0012 0.0874 199 SER C OG 4134 N N . VAL B 205 ? 0.4706 0.4595 0.5840 0.0300 0.0009 0.0807 200 VAL C N 4135 C CA . VAL B 205 ? 0.4714 0.4556 0.5922 0.0283 0.0017 0.0805 200 VAL C CA 4136 C C . VAL B 205 ? 0.4733 0.4595 0.5952 0.0271 0.0024 0.0820 200 VAL C C 4137 O O . VAL B 205 ? 0.5073 0.4953 0.6236 0.0271 0.0022 0.0793 200 VAL C O 4138 C CB . VAL B 205 ? 0.4763 0.4548 0.5966 0.0274 0.0012 0.0743 200 VAL C CB 4139 C CG1 . VAL B 205 ? 0.5096 0.4829 0.6380 0.0261 0.0017 0.0739 200 VAL C CG1 4140 C CG2 . VAL B 205 ? 0.4684 0.4465 0.5855 0.0285 0.0004 0.0724 200 VAL C CG2 4141 N N . GLY B 206 ? 0.5181 0.5040 0.6473 0.0261 0.0031 0.0866 201 GLY C N 4142 C CA . GLY B 206 ? 0.5337 0.5222 0.6651 0.0246 0.0038 0.0889 201 GLY C CA 4143 C C . GLY B 206 ? 0.5584 0.5417 0.6986 0.0224 0.0041 0.0897 201 GLY C C 4144 O O . GLY B 206 ? 0.5966 0.5763 0.7427 0.0224 0.0039 0.0919 201 GLY C O 4145 N N . THR B 207 ? 0.5191 0.5019 0.6602 0.0205 0.0044 0.0877 202 THR C N 4146 C CA . THR B 207 ? 0.5346 0.5134 0.6842 0.0181 0.0045 0.0890 202 THR C CA 4147 C C . THR B 207 ? 0.5536 0.5382 0.7036 0.0165 0.0052 0.0921 202 THR C C 4148 O O . THR B 207 ? 0.6066 0.5985 0.7521 0.0178 0.0056 0.0953 202 THR C O 4149 C CB . THR B 207 ? 0.5425 0.5141 0.6936 0.0171 0.0040 0.0822 202 THR C CB 4150 O OG1 . THR B 207 ? 0.5316 0.5048 0.6773 0.0167 0.0041 0.0776 202 THR C OG1 4151 C CG2 . THR B 207 ? 0.5216 0.4892 0.6711 0.0188 0.0034 0.0787 202 THR C CG2 4152 N N . SER B 208 ? 0.5824 0.5642 0.7375 0.0140 0.0052 0.0911 203 SER C N 4153 C CA . SER B 208 ? 0.5821 0.5700 0.7370 0.0126 0.0058 0.0935 203 SER C CA 4154 C C . SER B 208 ? 0.5575 0.5481 0.7043 0.0136 0.0059 0.0881 203 SER C C 4155 O O . SER B 208 ? 0.6251 0.6228 0.7691 0.0137 0.0065 0.0899 203 SER C O 4156 C CB . SER B 208 ? 0.6122 0.5967 0.7762 0.0092 0.0056 0.0950 203 SER C CB 4157 O OG . SER B 208 ? 0.6545 0.6324 0.8194 0.0083 0.0050 0.0882 203 SER C OG 4158 N N . THR B 209 ? 0.5808 0.5663 0.7236 0.0146 0.0054 0.0816 204 THR C N 4159 C CA . THR B 209 ? 0.5917 0.5789 0.7266 0.0157 0.0052 0.0761 204 THR C CA 4160 C C . THR B 209 ? 0.5983 0.5854 0.7253 0.0183 0.0046 0.0734 204 THR C C 4161 O O . THR B 209 ? 0.5597 0.5502 0.6793 0.0198 0.0044 0.0712 204 THR C O 4162 C CB . THR B 209 ? 0.5652 0.5465 0.7019 0.0141 0.0049 0.0701 204 THR C CB 4163 O OG1 . THR B 209 ? 0.5571 0.5315 0.6976 0.0140 0.0044 0.0680 204 THR C OG1 4164 C CG2 . THR B 209 ? 0.5801 0.5624 0.7232 0.0114 0.0053 0.0720 204 THR C CG2 4165 N N . LEU B 210 ? 0.5886 0.5718 0.7173 0.0189 0.0043 0.0737 205 LEU C N 4166 C CA . LEU B 210 ? 0.5364 0.5189 0.6586 0.0210 0.0036 0.0709 205 LEU C CA 4167 C C . LEU B 210 ? 0.5347 0.5233 0.6534 0.0229 0.0035 0.0754 205 LEU C C 4168 O O . LEU B 210 ? 0.5021 0.4934 0.6253 0.0229 0.0041 0.0811 205 LEU C O 4169 C CB . LEU B 210 ? 0.5274 0.5039 0.6533 0.0208 0.0032 0.0693 205 LEU C CB 4170 C CG . LEU B 210 ? 0.5641 0.5397 0.6840 0.0225 0.0024 0.0661 205 LEU C CG 4171 C CD1 . LEU B 210 ? 0.5301 0.5039 0.6442 0.0222 0.0019 0.0602 205 LEU C CD1 4172 C CD2 . LEU B 210 ? 0.5510 0.5222 0.6756 0.0226 0.0022 0.0658 205 LEU C CD2 4173 N N . ASN B 211 ? 0.5352 0.5257 0.6457 0.0248 0.0027 0.0727 206 ASN C N 4174 C CA . ASN B 211 ? 0.5088 0.5052 0.6151 0.0270 0.0024 0.0761 206 ASN C CA 4175 C C . ASN B 211 ? 0.4821 0.4767 0.5814 0.0285 0.0010 0.0720 206 ASN C C 4176 O O . ASN B 211 ? 0.5073 0.5035 0.5997 0.0296 0.0001 0.0692 206 ASN C O 4177 C CB . ASN B 211 ? 0.4567 0.4601 0.5598 0.0278 0.0027 0.0778 206 ASN C CB 4178 C CG . ASN B 211 ? 0.4538 0.4644 0.5531 0.0304 0.0024 0.0816 206 ASN C CG 4179 O OD1 . ASN B 211 ? 0.4628 0.4737 0.5636 0.0311 0.0023 0.0844 206 ASN C OD1 4180 N ND2 . ASN B 211 ? 0.4684 0.4853 0.5626 0.0320 0.0022 0.0816 206 ASN C ND2 4181 N N . GLN B 212 ? 0.4873 0.4786 0.5884 0.0285 0.0007 0.0719 207 GLN C N 4182 C CA . GLN B 212 ? 0.5071 0.4955 0.6026 0.0291 -0.0006 0.0675 207 GLN C CA 4183 C C . GLN B 212 ? 0.4915 0.4831 0.5844 0.0308 -0.0014 0.0700 207 GLN C C 4184 O O . GLN B 212 ? 0.5299 0.5235 0.6274 0.0313 -0.0007 0.0745 207 GLN C O 4185 C CB . GLN B 212 ? 0.4905 0.4727 0.5901 0.0275 -0.0004 0.0645 207 GLN C CB 4186 C CG . GLN B 212 ? 0.5122 0.4916 0.6072 0.0276 -0.0017 0.0605 207 GLN C CG 4187 C CD . GLN B 212 ? 0.5286 0.5032 0.6282 0.0263 -0.0013 0.0577 207 GLN C CD 4188 O OE1 . GLN B 212 ? 0.5432 0.5171 0.6461 0.0266 -0.0013 0.0588 207 GLN C OE1 4189 N NE2 . GLN B 212 ? 0.5085 0.4803 0.6085 0.0250 -0.0010 0.0541 207 GLN C NE2 4190 N N . ARG B 213 ? 0.4969 0.4886 0.5827 0.0318 -0.0030 0.0668 208 ARG C N 4191 C CA . ARG B 213 ? 0.5167 0.5102 0.6000 0.0331 -0.0040 0.0680 208 ARG C CA 4192 C C . ARG B 213 ? 0.5212 0.5107 0.6004 0.0324 -0.0056 0.0634 208 ARG C C 4193 O O . ARG B 213 ? 0.4720 0.4600 0.5456 0.0323 -0.0069 0.0597 208 ARG C O 4194 C CB . ARG B 213 ? 0.5747 0.5744 0.6529 0.0354 -0.0048 0.0698 208 ARG C CB 4195 C CG . ARG B 213 ? 0.6520 0.6550 0.7283 0.0370 -0.0058 0.0719 208 ARG C CG 4196 C CD . ARG B 213 ? 0.8045 0.8127 0.8739 0.0394 -0.0073 0.0717 208 ARG C CD 4197 N NE . ARG B 213 ? 0.8319 0.8427 0.8983 0.0408 -0.0088 0.0723 208 ARG C NE 4198 C CZ . ARG B 213 ? 0.7458 0.7612 0.8153 0.0420 -0.0081 0.0769 208 ARG C CZ 4199 N NH1 . ARG B 213 ? 0.7934 0.8109 0.8693 0.0416 -0.0059 0.0817 208 ARG C NH1 4200 N NH2 . ARG B 213 ? 0.7546 0.7723 0.8209 0.0433 -0.0097 0.0770 208 ARG C NH2 4201 N N . LEU B 214 ? 0.5065 0.4948 0.5884 0.0321 -0.0057 0.0640 209 LEU C N 4202 C CA . LEU B 214 ? 0.4647 0.4500 0.5434 0.0312 -0.0071 0.0603 209 LEU C CA 4203 C C . LEU B 214 ? 0.5636 0.5520 0.6391 0.0324 -0.0086 0.0616 209 LEU C C 4204 O O . LEU B 214 ? 0.5917 0.5836 0.6703 0.0336 -0.0080 0.0656 209 LEU C O 4205 C CB . LEU B 214 ? 0.4485 0.4302 0.5328 0.0297 -0.0062 0.0591 209 LEU C CB 4206 C CG . LEU B 214 ? 0.4295 0.4081 0.5183 0.0286 -0.0047 0.0579 209 LEU C CG 4207 C CD1 . LEU B 214 ? 0.4606 0.4366 0.5555 0.0279 -0.0038 0.0573 209 LEU C CD1 4208 C CD2 . LEU B 214 ? 0.4661 0.4423 0.5501 0.0276 -0.0054 0.0537 209 LEU C CD2 4209 N N . VAL B 215 ? 0.5807 0.5678 0.6501 0.0319 -0.0107 0.0583 210 VAL C N 4210 C CA . VAL B 215 ? 0.5801 0.5698 0.6458 0.0327 -0.0126 0.0588 210 VAL C CA 4211 C C . VAL B 215 ? 0.5666 0.5531 0.6308 0.0307 -0.0140 0.0557 210 VAL C C 4212 O O . VAL B 215 ? 0.6196 0.6024 0.6809 0.0293 -0.0148 0.0523 210 VAL C O 4213 C CB . VAL B 215 ? 0.6308 0.6225 0.6895 0.0344 -0.0146 0.0579 210 VAL C CB 4214 C CG1 . VAL B 215 ? 0.6183 0.6125 0.6730 0.0352 -0.0169 0.0579 210 VAL C CG1 4215 C CG2 . VAL B 215 ? 0.6509 0.6470 0.7109 0.0364 -0.0131 0.0612 210 VAL C CG2 4216 N N . PRO B 216 ? 0.5026 0.4909 0.5689 0.0306 -0.0143 0.0571 211 PRO C N 4217 C CA . PRO B 216 ? 0.5398 0.5264 0.6046 0.0286 -0.0157 0.0547 211 PRO C CA 4218 C C . PRO B 216 ? 0.5437 0.5290 0.6010 0.0279 -0.0187 0.0521 211 PRO C C 4219 O O . PRO B 216 ? 0.5333 0.5207 0.5866 0.0295 -0.0202 0.0527 211 PRO C O 4220 C CB . PRO B 216 ? 0.5602 0.5507 0.6283 0.0292 -0.0155 0.0574 211 PRO C CB 4221 C CG . PRO B 216 ? 0.5428 0.5355 0.6160 0.0312 -0.0133 0.0611 211 PRO C CG 4222 C CD . PRO B 216 ? 0.4957 0.4886 0.5656 0.0323 -0.0134 0.0613 211 PRO C CD 4223 N N . LYS B 217 ? 0.5256 0.5076 0.5813 0.0255 -0.0198 0.0492 212 LYS C N 4224 C CA . LYS B 217 ? 0.5347 0.5144 0.5838 0.0242 -0.0230 0.0467 212 LYS C CA 4225 C C . LYS B 217 ? 0.5537 0.5350 0.6035 0.0224 -0.0243 0.0470 212 LYS C C 4226 O O . LYS B 217 ? 0.5550 0.5356 0.6073 0.0203 -0.0237 0.0463 212 LYS C O 4227 C CB . LYS B 217 ? 0.5497 0.5245 0.5965 0.0227 -0.0233 0.0436 212 LYS C CB 4228 C CG . LYS B 217 ? 0.5552 0.5287 0.6003 0.0245 -0.0226 0.0430 212 LYS C CG 4229 C CD . LYS B 217 ? 0.5799 0.5489 0.6232 0.0230 -0.0227 0.0400 212 LYS C CD 4230 C CE . LYS B 217 ? 0.5937 0.5628 0.6423 0.0233 -0.0195 0.0403 212 LYS C CE 4231 N NZ . LYS B 217 ? 0.6396 0.6049 0.6873 0.0216 -0.0195 0.0374 212 LYS C NZ 4232 N N . ILE B 218 ? 0.5614 0.5456 0.6090 0.0234 -0.0261 0.0483 213 ILE C N 4233 C CA . ILE B 218 ? 0.5686 0.5554 0.6170 0.0219 -0.0274 0.0491 213 ILE C CA 4234 C C . ILE B 218 ? 0.5456 0.5292 0.5884 0.0195 -0.0310 0.0465 213 ILE C C 4235 O O . ILE B 218 ? 0.5230 0.5059 0.5610 0.0204 -0.0336 0.0457 213 ILE C O 4236 C CB . ILE B 218 ? 0.5421 0.5341 0.5913 0.0241 -0.0276 0.0517 213 ILE C CB 4237 C CG1 . ILE B 218 ? 0.5538 0.5485 0.6090 0.0263 -0.0241 0.0546 213 ILE C CG1 4238 C CG2 . ILE B 218 ? 0.5374 0.5324 0.5868 0.0225 -0.0293 0.0523 213 ILE C CG2 4239 C CD1 . ILE B 218 ? 0.5613 0.5612 0.6173 0.0288 -0.0240 0.0578 213 ILE C CD1 4240 N N . ALA B 219 ? 0.5692 0.5511 0.6129 0.0165 -0.0312 0.0454 214 ALA C N 4241 C CA . ALA B 219 ? 0.5416 0.5195 0.5804 0.0137 -0.0345 0.0433 214 ALA C CA 4242 C C . ALA B 219 ? 0.5074 0.4863 0.5486 0.0102 -0.0344 0.0434 214 ALA C C 4243 O O . ALA B 219 ? 0.5677 0.5498 0.6141 0.0104 -0.0316 0.0445 214 ALA C O 4244 C CB . ALA B 219 ? 0.5154 0.4879 0.5508 0.0141 -0.0347 0.0410 214 ALA C CB 4245 N N . THR B 220 ? 0.4803 0.4564 0.5176 0.0072 -0.0377 0.0422 215 THR C N 4246 C CA . THR B 220 ? 0.4245 0.4019 0.4634 0.0036 -0.0381 0.0425 215 THR C CA 4247 C C . THR B 220 ? 0.4165 0.3907 0.4555 0.0026 -0.0367 0.0411 215 THR C C 4248 O O . THR B 220 ? 0.4588 0.4276 0.4936 0.0024 -0.0382 0.0393 215 THR C O 4249 C CB . THR B 220 ? 0.4171 0.3929 0.4518 0.0005 -0.0426 0.0424 215 THR C CB 4250 O OG1 . THR B 220 ? 0.4572 0.4365 0.4919 0.0015 -0.0439 0.0436 215 THR C OG1 4251 C CG2 . THR B 220 ? 0.4302 0.4088 0.4670 -0.0035 -0.0430 0.0434 215 THR C CG2 4252 N N . ARG B 221 ? 0.4367 0.4148 0.4805 0.0017 -0.0342 0.0417 216 ARG C N 4253 C CA . ARG B 221 ? 0.4365 0.4130 0.4812 0.0007 -0.0326 0.0404 216 ARG C CA 4254 C C . ARG B 221 ? 0.4640 0.4451 0.5112 -0.0023 -0.0325 0.0413 216 ARG C C 4255 O O . ARG B 221 ? 0.4916 0.4776 0.5406 -0.0032 -0.0331 0.0430 216 ARG C O 4256 C CB . ARG B 221 ? 0.4564 0.4337 0.5053 0.0038 -0.0288 0.0399 216 ARG C CB 4257 C CG . ARG B 221 ? 0.4610 0.4344 0.5078 0.0067 -0.0286 0.0392 216 ARG C CG 4258 C CD . ARG B 221 ? 0.4547 0.4297 0.5065 0.0095 -0.0250 0.0395 216 ARG C CD 4259 N NE . ARG B 221 ? 0.4870 0.4666 0.5425 0.0109 -0.0241 0.0418 216 ARG C NE 4260 C CZ . ARG B 221 ? 0.5180 0.4983 0.5735 0.0133 -0.0240 0.0433 216 ARG C CZ 4261 N NH1 . ARG B 221 ? 0.5485 0.5257 0.6006 0.0148 -0.0246 0.0427 216 ARG C NH1 4262 N NH2 . ARG B 221 ? 0.5917 0.5765 0.6507 0.0145 -0.0232 0.0455 216 ARG C NH2 4263 N N . SER B 222 ? 0.4845 0.4646 0.5315 -0.0038 -0.0319 0.0402 217 SER C N 4264 C CA . SER B 222 ? 0.4755 0.4609 0.5249 -0.0066 -0.0316 0.0411 217 SER C CA 4265 C C . SER B 222 ? 0.4787 0.4704 0.5343 -0.0043 -0.0282 0.0413 217 SER C C 4266 O O . SER B 222 ? 0.5605 0.5510 0.6184 -0.0010 -0.0259 0.0405 217 SER C O 4267 C CB . SER B 222 ? 0.5012 0.4840 0.5485 -0.0086 -0.0320 0.0399 217 SER C CB 4268 O OG . SER B 222 ? 0.6136 0.5901 0.6550 -0.0106 -0.0356 0.0397 217 SER C OG 4269 N N . GLN B 223 ? 0.5363 0.5348 0.5947 -0.0061 -0.0278 0.0424 218 GLN C N 4270 C CA . GLN B 223 ? 0.5544 0.5592 0.6188 -0.0037 -0.0247 0.0422 218 GLN C CA 4271 C C . GLN B 223 ? 0.4565 0.4608 0.5225 -0.0027 -0.0224 0.0399 218 GLN C C 4272 O O . GLN B 223 ? 0.4960 0.5001 0.5599 -0.0051 -0.0232 0.0395 218 GLN C O 4273 C CB . GLN B 223 ? 0.5834 0.5969 0.6503 -0.0056 -0.0250 0.0439 218 GLN C CB 4274 C CG . GLN B 223 ? 0.6991 0.7151 0.7652 -0.0069 -0.0272 0.0463 218 GLN C CG 4275 C CD . GLN B 223 ? 0.8045 0.8303 0.8751 -0.0067 -0.0263 0.0478 218 GLN C CD 4276 O OE1 . GLN B 223 ? 0.7792 0.8111 0.8523 -0.0075 -0.0251 0.0476 218 GLN C OE1 4277 N NE2 . GLN B 223 ? 0.8231 0.8508 0.8946 -0.0055 -0.0268 0.0493 218 GLN C NE2 4278 N N . VAL B 224 ? 0.5243 0.5288 0.5944 0.0008 -0.0197 0.0387 219 VAL C N 4279 C CA . VAL B 224 ? 0.5143 0.5199 0.5872 0.0021 -0.0174 0.0363 219 VAL C CA 4280 C C . VAL B 224 ? 0.5113 0.5220 0.5903 0.0052 -0.0152 0.0360 219 VAL C C 4281 O O . VAL B 224 ? 0.5759 0.5854 0.6568 0.0074 -0.0147 0.0370 219 VAL C O 4282 C CB . VAL B 224 ? 0.4905 0.4889 0.5621 0.0036 -0.0167 0.0343 219 VAL C CB 4283 C CG1 . VAL B 224 ? 0.4744 0.4742 0.5490 0.0048 -0.0145 0.0316 219 VAL C CG1 4284 C CG2 . VAL B 224 ? 0.4930 0.4860 0.5584 0.0010 -0.0191 0.0344 219 VAL C CG2 4285 N N . ASN B 225 ? 0.5209 0.5377 0.6028 0.0054 -0.0140 0.0347 220 ASN C N 4286 C CA . ASN B 225 ? 0.5357 0.5587 0.6232 0.0083 -0.0123 0.0343 220 ASN C CA 4287 C C . ASN B 225 ? 0.4574 0.4834 0.5459 0.0087 -0.0131 0.0370 220 ASN C C 4288 O O . ASN B 225 ? 0.5212 0.5477 0.6135 0.0119 -0.0119 0.0372 220 ASN C O 4289 C CB . ASN B 225 ? 0.5771 0.5963 0.6687 0.0122 -0.0102 0.0319 220 ASN C CB 4290 C CG . ASN B 225 ? 0.6507 0.6665 0.7415 0.0121 -0.0095 0.0289 220 ASN C CG 4291 O OD1 . ASN B 225 ? 0.6630 0.6727 0.7547 0.0137 -0.0086 0.0275 220 ASN C OD1 4292 N ND2 . ASN B 225 ? 0.6736 0.6938 0.7626 0.0100 -0.0098 0.0281 220 ASN C ND2 4293 N N . GLY B 226 ? 0.4890 0.5165 0.5738 0.0053 -0.0153 0.0393 221 GLY C N 4294 C CA . GLY B 226 ? 0.4610 0.4920 0.5463 0.0051 -0.0164 0.0419 221 GLY C CA 4295 C C . GLY B 226 ? 0.4706 0.4956 0.5541 0.0061 -0.0172 0.0432 221 GLY C C 4296 O O . GLY B 226 ? 0.5308 0.5585 0.6145 0.0060 -0.0183 0.0453 221 GLY C O 4297 N N . GLN B 227 ? 0.4527 0.4700 0.5345 0.0070 -0.0169 0.0420 222 GLN C N 4298 C CA . GLN B 227 ? 0.4796 0.4921 0.5603 0.0086 -0.0172 0.0432 222 GLN C CA 4299 C C . GLN B 227 ? 0.4490 0.4550 0.5239 0.0068 -0.0192 0.0430 222 GLN C C 4300 O O . GLN B 227 ? 0.3925 0.3952 0.4651 0.0054 -0.0194 0.0413 222 GLN C O 4301 C CB . GLN B 227 ? 0.5202 0.5298 0.6049 0.0123 -0.0148 0.0422 222 GLN C CB 4302 C CG . GLN B 227 ? 0.5284 0.5433 0.6192 0.0149 -0.0129 0.0419 222 GLN C CG 4303 C CD . GLN B 227 ? 0.5223 0.5424 0.6148 0.0158 -0.0135 0.0444 222 GLN C CD 4304 O OE1 . GLN B 227 ? 0.5879 0.6147 0.6830 0.0161 -0.0132 0.0444 222 GLN C OE1 4305 N NE2 . GLN B 227 ? 0.6022 0.6199 0.6928 0.0162 -0.0144 0.0465 222 GLN C NE2 4306 N N . ARG B 228 ? 0.4168 0.4214 0.4893 0.0069 -0.0208 0.0447 223 ARG C N 4307 C CA . ARG B 228 ? 0.4671 0.4657 0.5342 0.0059 -0.0228 0.0444 223 ARG C CA 4308 C C . ARG B 228 ? 0.4403 0.4348 0.5079 0.0090 -0.0214 0.0442 223 ARG C C 4309 O O . ARG B 228 ? 0.4556 0.4449 0.5191 0.0090 -0.0224 0.0433 223 ARG C O 4310 C CB . ARG B 228 ? 0.5344 0.5341 0.5980 0.0041 -0.0259 0.0459 223 ARG C CB 4311 C CG . ARG B 228 ? 0.5658 0.5692 0.6285 0.0003 -0.0277 0.0464 223 ARG C CG 4312 C CD . ARG B 228 ? 0.6546 0.6595 0.7145 -0.0018 -0.0309 0.0480 223 ARG C CD 4313 N NE . ARG B 228 ? 0.7248 0.7248 0.7796 -0.0051 -0.0339 0.0472 223 ARG C NE 4314 C CZ . ARG B 228 ? 0.8199 0.8216 0.8738 -0.0090 -0.0355 0.0477 223 ARG C CZ 4315 N NH1 . ARG B 228 ? 0.7799 0.7894 0.8377 -0.0103 -0.0345 0.0490 223 ARG C NH1 4316 N NH2 . ARG B 228 ? 0.8216 0.8175 0.8708 -0.0116 -0.0383 0.0469 223 ARG C NH2 4317 N N . GLY B 229 ? 0.4186 0.4155 0.4912 0.0118 -0.0192 0.0452 224 GLY C N 4318 C CA . GLY B 229 ? 0.3899 0.3835 0.4641 0.0146 -0.0176 0.0454 224 GLY C CA 4319 C C . GLY B 229 ? 0.3789 0.3687 0.4542 0.0149 -0.0160 0.0431 224 GLY C C 4320 O O . GLY B 229 ? 0.3266 0.3171 0.4022 0.0133 -0.0157 0.0412 224 GLY C O 4321 N N . ARG B 230 ? 0.3552 0.3418 0.4312 0.0168 -0.0149 0.0434 225 ARG C N 4322 C CA . ARG B 230 ? 0.3902 0.3735 0.4675 0.0171 -0.0134 0.0413 225 ARG C CA 4323 C C . ARG B 230 ? 0.3636 0.3459 0.4455 0.0196 -0.0115 0.0426 225 ARG C C 4324 O O . ARG B 230 ? 0.3581 0.3413 0.4401 0.0210 -0.0117 0.0452 225 ARG C O 4325 C CB . ARG B 230 ? 0.4229 0.4020 0.4944 0.0158 -0.0148 0.0399 225 ARG C CB 4326 C CG . ARG B 230 ? 0.4311 0.4099 0.4977 0.0130 -0.0170 0.0386 225 ARG C CG 4327 C CD . ARG B 230 ? 0.4343 0.4141 0.5027 0.0116 -0.0162 0.0366 225 ARG C CD 4328 N NE . ARG B 230 ? 0.4712 0.4508 0.5350 0.0086 -0.0184 0.0360 225 ARG C NE 4329 C CZ . ARG B 230 ? 0.4545 0.4379 0.5179 0.0067 -0.0198 0.0371 225 ARG C CZ 4330 N NH1 . ARG B 230 ? 0.4411 0.4292 0.5083 0.0076 -0.0191 0.0387 225 ARG C NH1 4331 N NH2 . ARG B 230 ? 0.5188 0.5012 0.5780 0.0037 -0.0220 0.0368 225 ARG C NH2 4332 N N . MET B 231 ? 0.3740 0.3544 0.4595 0.0201 -0.0098 0.0408 226 MET C N 4333 C CA . MET B 231 ? 0.4120 0.3906 0.5020 0.0220 -0.0082 0.0418 226 MET C CA 4334 C C . MET B 231 ? 0.4385 0.4133 0.5277 0.0215 -0.0076 0.0397 226 MET C C 4335 O O . MET B 231 ? 0.4504 0.4244 0.5400 0.0207 -0.0073 0.0367 226 MET C O 4336 C CB . MET B 231 ? 0.4808 0.4610 0.5774 0.0236 -0.0069 0.0419 226 MET C CB 4337 C CG . MET B 231 ? 0.5031 0.4870 0.6009 0.0247 -0.0073 0.0449 226 MET C CG 4338 S SD . MET B 231 ? 0.5001 0.4857 0.6057 0.0271 -0.0060 0.0452 226 MET C SD 4339 C CE . MET B 231 ? 0.5134 0.5038 0.6185 0.0281 -0.0069 0.0489 226 MET C CE 4340 N N . ASP B 232 ? 0.4197 0.3928 0.5078 0.0222 -0.0075 0.0413 227 ASP C N 4341 C CA . ASP B 232 ? 0.4395 0.4096 0.5268 0.0219 -0.0070 0.0397 227 ASP C CA 4342 C C . ASP B 232 ? 0.4414 0.4105 0.5352 0.0232 -0.0053 0.0411 227 ASP C C 4343 O O . ASP B 232 ? 0.4820 0.4521 0.5778 0.0244 -0.0049 0.0446 227 ASP C O 4344 C CB . ASP B 232 ? 0.4289 0.3984 0.5101 0.0218 -0.0082 0.0404 227 ASP C CB 4345 C CG . ASP B 232 ? 0.4395 0.4083 0.5140 0.0203 -0.0103 0.0385 227 ASP C CG 4346 O OD1 . ASP B 232 ? 0.4091 0.3779 0.4834 0.0189 -0.0106 0.0364 227 ASP C OD1 4347 O OD2 . ASP B 232 ? 0.5258 0.4944 0.5951 0.0205 -0.0118 0.0391 227 ASP C OD2 4348 N N . PHE B 233 ? 0.4512 0.4184 0.5484 0.0228 -0.0044 0.0384 228 PHE C N 4349 C CA . PHE B 233 ? 0.4281 0.3935 0.5318 0.0237 -0.0031 0.0392 228 PHE C CA 4350 C C . PHE B 233 ? 0.4278 0.3912 0.5310 0.0231 -0.0026 0.0388 228 PHE C C 4351 O O . PHE B 233 ? 0.4629 0.4258 0.5613 0.0221 -0.0031 0.0364 228 PHE C O 4352 C CB . PHE B 233 ? 0.4471 0.4121 0.5556 0.0240 -0.0025 0.0362 228 PHE C CB 4353 C CG . PHE B 233 ? 0.4848 0.4522 0.5954 0.0252 -0.0027 0.0373 228 PHE C CG 4354 C CD1 . PHE B 233 ? 0.5250 0.4953 0.6324 0.0245 -0.0034 0.0356 228 PHE C CD1 4355 C CD2 . PHE B 233 ? 0.4930 0.4604 0.6089 0.0268 -0.0023 0.0404 228 PHE C CD2 4356 C CE1 . PHE B 233 ? 0.5308 0.5042 0.6402 0.0256 -0.0036 0.0367 228 PHE C CE1 4357 C CE2 . PHE B 233 ? 0.4590 0.4291 0.5768 0.0281 -0.0025 0.0413 228 PHE C CE2 4358 C CZ . PHE B 233 ? 0.4864 0.4597 0.6010 0.0276 -0.0031 0.0393 228 PHE C CZ 4359 N N . PHE B 234 ? 0.4128 0.3754 0.5211 0.0238 -0.0017 0.0414 229 PHE C N 4360 C CA . PHE B 234 ? 0.4066 0.3681 0.5153 0.0232 -0.0012 0.0418 229 PHE C CA 4361 C C . PHE B 234 ? 0.4460 0.4052 0.5626 0.0232 -0.0004 0.0422 229 PHE C C 4362 O O . PHE B 234 ? 0.4841 0.4426 0.6056 0.0241 -0.0002 0.0431 229 PHE C O 4363 C CB . PHE B 234 ? 0.4052 0.3693 0.5109 0.0238 -0.0014 0.0459 229 PHE C CB 4364 C CG . PHE B 234 ? 0.4024 0.3682 0.5000 0.0238 -0.0027 0.0451 229 PHE C CG 4365 C CD1 . PHE B 234 ? 0.4484 0.4159 0.5436 0.0243 -0.0036 0.0459 229 PHE C CD1 4366 C CD2 . PHE B 234 ? 0.4526 0.4183 0.5450 0.0234 -0.0032 0.0433 229 PHE C CD2 4367 C CE1 . PHE B 234 ? 0.4372 0.4056 0.5250 0.0242 -0.0051 0.0449 229 PHE C CE1 4368 C CE2 . PHE B 234 ? 0.4206 0.3871 0.5056 0.0235 -0.0047 0.0423 229 PHE C CE2 4369 C CZ . PHE B 234 ? 0.4092 0.3768 0.4920 0.0238 -0.0058 0.0430 229 PHE C CZ 4370 N N . TRP B 235 ? 0.4509 0.4088 0.5691 0.0223 0.0000 0.0415 230 TRP C N 4371 C CA . TRP B 235 ? 0.4855 0.4406 0.6114 0.0220 0.0005 0.0416 230 TRP C CA 4372 C C . TRP B 235 ? 0.4951 0.4504 0.6229 0.0209 0.0010 0.0440 230 TRP C C 4373 O O . TRP B 235 ? 0.4559 0.4136 0.5784 0.0206 0.0010 0.0445 230 TRP C O 4374 C CB . TRP B 235 ? 0.4900 0.4427 0.6177 0.0216 0.0004 0.0361 230 TRP C CB 4375 C CG . TRP B 235 ? 0.5036 0.4568 0.6262 0.0206 0.0003 0.0326 230 TRP C CG 4376 C CD1 . TRP B 235 ? 0.4877 0.4426 0.6031 0.0205 -0.0001 0.0306 230 TRP C CD1 4377 C CD2 . TRP B 235 ? 0.4933 0.4453 0.6176 0.0194 0.0006 0.0307 230 TRP C CD2 4378 N NE1 . TRP B 235 ? 0.4850 0.4396 0.5974 0.0196 -0.0001 0.0277 230 TRP C NE1 4379 C CE2 . TRP B 235 ? 0.5155 0.4687 0.6332 0.0190 0.0004 0.0275 230 TRP C CE2 4380 C CE3 . TRP B 235 ? 0.5265 0.4764 0.6573 0.0187 0.0009 0.0313 230 TRP C CE3 4381 C CZ2 . TRP B 235 ? 0.4529 0.4056 0.5702 0.0180 0.0006 0.0250 230 TRP C CZ2 4382 C CZ3 . TRP B 235 ? 0.4896 0.4393 0.6202 0.0174 0.0011 0.0288 230 TRP C CZ3 4383 C CH2 . TRP B 235 ? 0.4776 0.4289 0.6015 0.0172 0.0009 0.0255 230 TRP C CH2 4384 N N . THR B 236 ? 0.5157 0.4685 0.6510 0.0205 0.0012 0.0454 231 THR C N 4385 C CA . THR B 236 ? 0.5219 0.4748 0.6600 0.0190 0.0016 0.0474 231 THR C CA 4386 C C . THR B 236 ? 0.5183 0.4670 0.6649 0.0182 0.0014 0.0466 231 THR C C 4387 O O . THR B 236 ? 0.5095 0.4552 0.6602 0.0191 0.0009 0.0455 231 THR C O 4388 C CB . THR B 236 ? 0.5370 0.4935 0.6752 0.0192 0.0020 0.0539 231 THR C CB 4389 O OG1 . THR B 236 ? 0.5205 0.4788 0.6599 0.0177 0.0024 0.0557 231 THR C OG1 4390 C CG2 . THR B 236 ? 0.4965 0.4512 0.6412 0.0198 0.0019 0.0579 231 THR C CG2 4391 N N . ILE B 237 ? 0.5484 0.4969 0.6977 0.0164 0.0016 0.0469 232 ILE C N 4392 C CA . ILE B 237 ? 0.5260 0.4703 0.6838 0.0152 0.0011 0.0466 232 ILE C CA 4393 C C . ILE B 237 ? 0.5213 0.4668 0.6836 0.0142 0.0013 0.0536 232 ILE C C 4394 O O . ILE B 237 ? 0.5070 0.4563 0.6674 0.0130 0.0019 0.0564 232 ILE C O 4395 C CB . ILE B 237 ? 0.4972 0.4409 0.6554 0.0135 0.0010 0.0424 232 ILE C CB 4396 C CG1 . ILE B 237 ? 0.4973 0.4407 0.6505 0.0144 0.0009 0.0359 232 ILE C CG1 4397 C CG2 . ILE B 237 ? 0.5411 0.4802 0.7083 0.0121 0.0002 0.0420 232 ILE C CG2 4398 C CD1 . ILE B 237 ? 0.5221 0.4625 0.6776 0.0160 0.0003 0.0329 232 ILE C CD1 4399 N N . LEU B 238 ? 0.5501 0.4925 0.7181 0.0148 0.0007 0.0565 233 LEU C N 4400 C CA . LEU B 238 ? 0.5792 0.5224 0.7520 0.0139 0.0008 0.0636 233 LEU C CA 4401 C C . LEU B 238 ? 0.5987 0.5376 0.7799 0.0116 0.0000 0.0637 233 LEU C C 4402 O O . LEU B 238 ? 0.5534 0.4863 0.7398 0.0119 -0.0011 0.0607 233 LEU C O 4403 C CB . LEU B 238 ? 0.5678 0.5097 0.7425 0.0159 0.0005 0.0669 233 LEU C CB 4404 C CG . LEU B 238 ? 0.5548 0.4984 0.7340 0.0152 0.0006 0.0750 233 LEU C CG 4405 C CD1 . LEU B 238 ? 0.5722 0.5234 0.7455 0.0149 0.0017 0.0789 233 LEU C CD1 4406 C CD2 . LEU B 238 ? 0.5098 0.4516 0.6913 0.0174 0.0001 0.0776 233 LEU C CD2 4407 N N . LYS B 239 ? 0.6566 0.5986 0.8389 0.0092 0.0004 0.0671 234 LYS C N 4408 C CA . LYS B 239 ? 0.6519 0.5904 0.8420 0.0064 -0.0004 0.0672 234 LYS C CA 4409 C C . LYS B 239 ? 0.6381 0.5719 0.8368 0.0058 -0.0015 0.0722 234 LYS C C 4410 O O . LYS B 239 ? 0.5647 0.5003 0.7631 0.0071 -0.0012 0.0775 234 LYS C O 4411 C CB . LYS B 239 ? 0.7089 0.6532 0.8982 0.0040 0.0003 0.0704 234 LYS C CB 4412 C CG . LYS B 239 ? 0.8069 0.7559 0.9880 0.0045 0.0013 0.0661 234 LYS C CG 4413 C CD . LYS B 239 ? 0.9447 0.8894 1.1265 0.0041 0.0006 0.0585 234 LYS C CD 4414 C CE . LYS B 239 ? 1.1139 1.0629 1.2932 0.0024 0.0011 0.0569 234 LYS C CE 4415 N NZ . LYS B 239 ? 1.2514 1.1964 1.4320 0.0019 0.0003 0.0496 234 LYS C NZ 4416 N N . PRO B 240 ? 0.6967 0.6246 0.9033 0.0039 -0.0030 0.0707 235 PRO C N 4417 C CA . PRO B 240 ? 0.7398 0.6620 0.9552 0.0033 -0.0046 0.0750 235 PRO C CA 4418 C C . PRO B 240 ? 0.7309 0.6564 0.9486 0.0024 -0.0041 0.0844 235 PRO C C 4419 O O . PRO B 240 ? 0.8994 0.8217 1.1198 0.0041 -0.0048 0.0873 235 PRO C O 4420 C CB . PRO B 240 ? 0.7240 0.6407 0.9467 0.0006 -0.0063 0.0722 235 PRO C CB 4421 C CG . PRO B 240 ? 0.7064 0.6234 0.9241 0.0016 -0.0059 0.0636 235 PRO C CG 4422 C CD . PRO B 240 ? 0.6981 0.6234 0.9060 0.0025 -0.0037 0.0642 235 PRO C CD 4423 N N . ASN B 241 ? 0.6932 0.6255 0.9096 0.0003 -0.0030 0.0897 236 ASN C N 4424 C CA . ASN B 241 ? 0.7300 0.6647 0.9488 0.0005 -0.0028 0.0984 236 ASN C CA 4425 C C . ASN B 241 ? 0.6442 0.5874 0.8549 0.0027 -0.0010 0.1016 236 ASN C C 4426 O O . ASN B 241 ? 0.5645 0.5122 0.7763 0.0024 -0.0005 0.1092 236 ASN C O 4427 C CB . ASN B 241 ? 0.8866 0.8208 1.1141 -0.0032 -0.0037 0.1055 236 ASN C CB 4428 C CG . ASN B 241 ? 0.9807 0.9052 1.2172 -0.0035 -0.0060 0.1069 236 ASN C CG 4429 O OD1 . ASN B 241 ? 1.1030 1.0269 1.3417 -0.0023 -0.0063 0.1126 236 ASN C OD1 4430 N ND2 . ASN B 241 ? 0.9576 0.8743 1.1990 -0.0045 -0.0078 0.1011 236 ASN C ND2 4431 N N . ASP B 242 ? 0.6897 0.6348 0.8923 0.0051 -0.0001 0.0956 237 ASP C N 4432 C CA . ASP B 242 ? 0.6668 0.6195 0.8609 0.0073 0.0012 0.0972 237 ASP C CA 4433 C C . ASP B 242 ? 0.6060 0.5567 0.7987 0.0104 0.0010 0.0976 237 ASP C C 4434 O O . ASP B 242 ? 0.5987 0.5424 0.7960 0.0112 -0.0001 0.0955 237 ASP C O 4435 C CB . ASP B 242 ? 0.6568 0.6122 0.8429 0.0080 0.0020 0.0906 237 ASP C CB 4436 C CG . ASP B 242 ? 0.7315 0.6957 0.9094 0.0094 0.0032 0.0927 237 ASP C CG 4437 O OD1 . ASP B 242 ? 0.6410 0.6106 0.8194 0.0096 0.0038 0.0997 237 ASP C OD1 4438 O OD2 . ASP B 242 ? 0.7661 0.7318 0.9368 0.0105 0.0036 0.0871 237 ASP C OD2 4439 N N . ALA B 243 ? 0.6333 0.5907 0.8199 0.0122 0.0020 0.1006 238 ALA C N 4440 C CA . ALA B 243 ? 0.5971 0.5539 0.7815 0.0152 0.0018 0.1008 238 ALA C CA 4441 C C . ALA B 243 ? 0.5593 0.5213 0.7337 0.0172 0.0026 0.0971 238 ALA C C 4442 O O . ALA B 243 ? 0.5313 0.4989 0.7008 0.0166 0.0034 0.0972 238 ALA C O 4443 C CB . ALA B 243 ? 0.6034 0.5633 0.7911 0.0156 0.0019 0.1093 238 ALA C CB 4444 N N . ILE B 244 ? 0.4962 0.4563 0.6680 0.0195 0.0023 0.0943 239 ILE C N 4445 C CA . ILE B 244 ? 0.4981 0.4620 0.6611 0.0213 0.0026 0.0909 239 ILE C CA 4446 C C . ILE B 244 ? 0.5437 0.5118 0.7047 0.0235 0.0027 0.0956 239 ILE C C 4447 O O . ILE B 244 ? 0.5184 0.4838 0.6844 0.0244 0.0023 0.0983 239 ILE C O 4448 C CB . ILE B 244 ? 0.4982 0.4573 0.6595 0.0221 0.0021 0.0834 239 ILE C CB 4449 C CG1 . ILE B 244 ? 0.5195 0.4824 0.6715 0.0235 0.0022 0.0800 239 ILE C CG1 4450 C CG2 . ILE B 244 ? 0.4721 0.4263 0.6386 0.0235 0.0013 0.0834 239 ILE C CG2 4451 C CD1 . ILE B 244 ? 0.5562 0.5156 0.7057 0.0233 0.0019 0.0726 239 ILE C CD1 4452 N N . HIS B 245 ? 0.5514 0.5261 0.7050 0.0245 0.0032 0.0962 240 HIS C N 4453 C CA . HIS B 245 ? 0.5856 0.5655 0.7369 0.0266 0.0032 0.1009 240 HIS C CA 4454 C C . HIS B 245 ? 0.5866 0.5685 0.7299 0.0284 0.0028 0.0967 240 HIS C C 4455 O O . HIS B 245 ? 0.5673 0.5521 0.7039 0.0284 0.0028 0.0937 240 HIS C O 4456 C CB . HIS B 245 ? 0.5870 0.5744 0.7373 0.0263 0.0039 0.1069 240 HIS C CB 4457 C CG . HIS B 245 ? 0.6550 0.6412 0.8127 0.0240 0.0043 0.1111 240 HIS C CG 4458 N ND1 . HIS B 245 ? 0.6355 0.6216 0.8000 0.0237 0.0043 0.1179 240 HIS C ND1 4459 C CD2 . HIS B 245 ? 0.7180 0.7031 0.8776 0.0216 0.0045 0.1097 240 HIS C CD2 4460 C CE1 . HIS B 245 ? 0.6679 0.6528 0.8383 0.0210 0.0044 0.1206 240 HIS C CE1 4461 N NE2 . HIS B 245 ? 0.7242 0.7086 0.8918 0.0197 0.0046 0.1156 240 HIS C NE2 4462 N N . PHE B 246 ? 0.5804 0.5610 0.7246 0.0300 0.0023 0.0967 241 PHE C N 4463 C CA . PHE B 246 ? 0.5434 0.5255 0.6812 0.0315 0.0018 0.0932 241 PHE C CA 4464 C C . PHE B 246 ? 0.5855 0.5740 0.7207 0.0335 0.0017 0.0980 241 PHE C C 4465 O O . PHE B 246 ? 0.6317 0.6212 0.7719 0.0341 0.0019 0.1035 241 PHE C O 4466 C CB . PHE B 246 ? 0.5035 0.4806 0.6443 0.0321 0.0012 0.0899 241 PHE C CB 4467 C CG . PHE B 246 ? 0.4989 0.4705 0.6409 0.0306 0.0012 0.0841 241 PHE C CG 4468 C CD1 . PHE B 246 ? 0.4950 0.4669 0.6306 0.0301 0.0009 0.0787 241 PHE C CD1 4469 C CD2 . PHE B 246 ? 0.4839 0.4503 0.6334 0.0298 0.0012 0.0840 241 PHE C CD2 4470 C CE1 . PHE B 246 ? 0.4790 0.4465 0.6156 0.0289 0.0008 0.0734 241 PHE C CE1 4471 C CE2 . PHE B 246 ? 0.5037 0.4655 0.6543 0.0286 0.0010 0.0784 241 PHE C CE2 4472 C CZ . PHE B 246 ? 0.5223 0.4850 0.6663 0.0282 0.0010 0.0731 241 PHE C CZ 4473 N N . GLU B 247 ? 0.5450 0.5374 0.6725 0.0344 0.0011 0.0957 242 GLU C N 4474 C CA . GLU B 247 ? 0.5495 0.5478 0.6738 0.0364 0.0007 0.0988 242 GLU C CA 4475 C C . GLU B 247 ? 0.5639 0.5625 0.6814 0.0370 -0.0004 0.0938 242 GLU C C 4476 O O . GLU B 247 ? 0.6294 0.6270 0.7416 0.0362 -0.0009 0.0893 242 GLU C O 4477 C CB . GLU B 247 ? 0.5625 0.5676 0.6840 0.0370 0.0011 0.1030 242 GLU C CB 4478 C CG . GLU B 247 ? 0.6597 0.6719 0.7770 0.0394 0.0005 0.1057 242 GLU C CG 4479 C CD . GLU B 247 ? 0.7351 0.7552 0.8496 0.0405 0.0008 0.1098 242 GLU C CD 4480 O OE1 . GLU B 247 ? 0.7971 0.8186 0.9161 0.0396 0.0019 0.1142 242 GLU C OE1 4481 O OE2 . GLU B 247 ? 0.7276 0.7529 0.8354 0.0422 0.0000 0.1088 242 GLU C OE2 4482 N N . SER B 248 ? 0.5348 0.5349 0.6522 0.0384 -0.0010 0.0947 243 SER C N 4483 C CA . SER B 248 ? 0.5070 0.5079 0.6184 0.0387 -0.0023 0.0905 243 SER C CA 4484 C C . SER B 248 ? 0.5181 0.5232 0.6289 0.0406 -0.0029 0.0931 243 SER C C 4485 O O . SER B 248 ? 0.5707 0.5762 0.6871 0.0416 -0.0023 0.0970 243 SER C O 4486 C CB . SER B 248 ? 0.5398 0.5351 0.6525 0.0374 -0.0025 0.0855 243 SER C CB 4487 O OG . SER B 248 ? 0.4687 0.4652 0.5755 0.0373 -0.0039 0.0818 243 SER C OG 4488 N N . ASN B 249 ? 0.4858 0.4942 0.5899 0.0411 -0.0043 0.0910 244 ASN C N 4489 C CA . ASN B 249 ? 0.4887 0.5012 0.5920 0.0426 -0.0052 0.0926 244 ASN C CA 4490 C C . ASN B 249 ? 0.4916 0.5022 0.5921 0.0416 -0.0064 0.0878 244 ASN C C 4491 O O . ASN B 249 ? 0.5472 0.5615 0.6446 0.0424 -0.0077 0.0879 244 ASN C O 4492 C CB . ASN B 249 ? 0.5130 0.5321 0.6112 0.0443 -0.0060 0.0949 244 ASN C CB 4493 C CG . ASN B 249 ? 0.5482 0.5672 0.6388 0.0436 -0.0076 0.0902 244 ASN C CG 4494 O OD1 . ASN B 249 ? 0.5733 0.5873 0.6627 0.0417 -0.0076 0.0861 244 ASN C OD1 4495 N ND2 . ASN B 249 ? 0.5404 0.5648 0.6259 0.0451 -0.0090 0.0907 244 ASN C ND2 4496 N N . GLY B 250 ? 0.5507 0.5558 0.6524 0.0398 -0.0062 0.0838 245 GLY C N 4497 C CA . GLY B 250 ? 0.5215 0.5254 0.6214 0.0387 -0.0072 0.0798 245 GLY C CA 4498 C C . GLY B 250 ? 0.5286 0.5275 0.6273 0.0365 -0.0072 0.0750 245 GLY C C 4499 O O . GLY B 250 ? 0.5114 0.5080 0.6092 0.0358 -0.0067 0.0742 245 GLY C O 4500 N N . ASN B 251 ? 0.5394 0.5372 0.6384 0.0355 -0.0076 0.0720 246 ASN C N 4501 C CA . ASN B 251 ? 0.4935 0.4874 0.5907 0.0334 -0.0078 0.0673 246 ASN C CA 4502 C C . ASN B 251 ? 0.4609 0.4506 0.5626 0.0330 -0.0063 0.0664 246 ASN C C 4503 O O . ASN B 251 ? 0.4561 0.4427 0.5558 0.0315 -0.0064 0.0629 246 ASN C O 4504 C CB . ASN B 251 ? 0.5120 0.5057 0.6019 0.0322 -0.0094 0.0652 246 ASN C CB 4505 C CG . ASN B 251 ? 0.4911 0.4887 0.5764 0.0325 -0.0113 0.0659 246 ASN C CG 4506 O OD1 . ASN B 251 ? 0.5095 0.5108 0.5946 0.0343 -0.0114 0.0692 246 ASN C OD1 4507 N ND2 . ASN B 251 ? 0.4850 0.4822 0.5665 0.0306 -0.0130 0.0628 246 ASN C ND2 4508 N N . PHE B 252 ? 0.4670 0.4562 0.5749 0.0345 -0.0051 0.0694 247 PHE C N 4509 C CA . PHE B 252 ? 0.4562 0.4411 0.5689 0.0341 -0.0038 0.0690 247 PHE C CA 4510 C C . PHE B 252 ? 0.4963 0.4788 0.6140 0.0343 -0.0034 0.0664 247 PHE C C 4511 O O . PHE B 252 ? 0.5590 0.5430 0.6798 0.0358 -0.0034 0.0677 247 PHE C O 4512 C CB . PHE B 252 ? 0.4612 0.4470 0.5778 0.0354 -0.0030 0.0742 247 PHE C CB 4513 C CG . PHE B 252 ? 0.4442 0.4257 0.5666 0.0350 -0.0019 0.0748 247 PHE C CG 4514 C CD1 . PHE B 252 ? 0.4490 0.4272 0.5707 0.0333 -0.0016 0.0712 247 PHE C CD1 4515 C CD2 . PHE B 252 ? 0.4707 0.4519 0.5993 0.0362 -0.0013 0.0795 247 PHE C CD2 4516 C CE1 . PHE B 252 ? 0.4663 0.4409 0.5936 0.0327 -0.0008 0.0720 247 PHE C CE1 4517 C CE2 . PHE B 252 ? 0.4540 0.4311 0.5883 0.0355 -0.0006 0.0806 247 PHE C CE2 4518 C CZ . PHE B 252 ? 0.4512 0.4251 0.5849 0.0337 -0.0003 0.0768 247 PHE C CZ 4519 N N . ILE B 253 ? 0.5135 0.4924 0.6317 0.0330 -0.0031 0.0626 248 ILE C N 4520 C CA . ILE B 253 ? 0.4892 0.4656 0.6122 0.0334 -0.0027 0.0597 248 ILE C CA 4521 C C . ILE B 253 ? 0.4583 0.4305 0.5871 0.0335 -0.0018 0.0606 248 ILE C C 4522 O O . ILE B 253 ? 0.4894 0.4591 0.6171 0.0320 -0.0015 0.0588 248 ILE C O 4523 C CB . ILE B 253 ? 0.4751 0.4511 0.5946 0.0317 -0.0030 0.0545 248 ILE C CB 4524 C CG1 . ILE B 253 ? 0.4970 0.4768 0.6099 0.0308 -0.0042 0.0541 248 ILE C CG1 4525 C CG2 . ILE B 253 ? 0.4817 0.4571 0.6059 0.0327 -0.0027 0.0516 248 ILE C CG2 4526 C CD1 . ILE B 253 ? 0.4764 0.4603 0.5902 0.0320 -0.0047 0.0555 248 ILE C CD1 4527 N N . ALA B 254 ? 0.4571 0.4281 0.5921 0.0352 -0.0016 0.0632 249 ALA C N 4528 C CA . ALA B 254 ? 0.4712 0.4385 0.6118 0.0353 -0.0011 0.0657 249 ALA C CA 4529 C C . ALA B 254 ? 0.4804 0.4428 0.6262 0.0352 -0.0011 0.0620 249 ALA C C 4530 O O . ALA B 254 ? 0.4569 0.4192 0.6038 0.0363 -0.0014 0.0585 249 ALA C O 4531 C CB . ALA B 254 ? 0.5199 0.4882 0.6645 0.0371 -0.0011 0.0711 249 ALA C CB 4532 N N . PRO B 255 ? 0.4641 0.4228 0.6133 0.0340 -0.0008 0.0627 250 PRO C N 4533 C CA . PRO B 255 ? 0.4904 0.4442 0.6453 0.0342 -0.0010 0.0593 250 PRO C CA 4534 C C . PRO B 255 ? 0.5622 0.5142 0.7232 0.0367 -0.0016 0.0609 250 PRO C C 4535 O O . PRO B 255 ? 0.5391 0.4926 0.7013 0.0377 -0.0016 0.0662 250 PRO C O 4536 C CB . PRO B 255 ? 0.5115 0.4621 0.6694 0.0324 -0.0007 0.0614 250 PRO C CB 4537 C CG . PRO B 255 ? 0.5265 0.4813 0.6788 0.0312 -0.0002 0.0648 250 PRO C CG 4538 C CD . PRO B 255 ? 0.5041 0.4634 0.6527 0.0327 -0.0003 0.0670 250 PRO C CD 4539 N N . GLU B 256 ? 0.5162 0.4654 0.6807 0.0379 -0.0021 0.0563 251 GLU C N 4540 C CA . GLU B 256 ? 0.5653 0.5113 0.7366 0.0404 -0.0029 0.0569 251 GLU C CA 4541 C C . GLU B 256 ? 0.5383 0.4780 0.7151 0.0399 -0.0036 0.0536 251 GLU C C 4542 O O . GLU B 256 ? 0.5221 0.4572 0.7046 0.0396 -0.0041 0.0567 251 GLU C O 4543 C CB . GLU B 256 ? 0.6258 0.5752 0.7959 0.0429 -0.0032 0.0539 251 GLU C CB 4544 C CG . GLU B 256 ? 0.6759 0.6229 0.8524 0.0463 -0.0042 0.0547 251 GLU C CG 4545 C CD . GLU B 256 ? 0.7316 0.6832 0.9066 0.0489 -0.0044 0.0515 251 GLU C CD 4546 O OE1 . GLU B 256 ? 0.7903 0.7478 0.9592 0.0480 -0.0038 0.0500 251 GLU C OE1 4547 O OE2 . GLU B 256 ? 0.9485 0.8981 1.1288 0.0520 -0.0053 0.0503 251 GLU C OE2 4548 N N . TYR B 257 ? 0.6016 0.5415 0.7768 0.0396 -0.0036 0.0474 252 TYR C N 4549 C CA . TYR B 257 ? 0.5726 0.5073 0.7520 0.0388 -0.0042 0.0436 252 TYR C CA 4550 C C . TYR B 257 ? 0.5351 0.4703 0.7107 0.0355 -0.0034 0.0429 252 TYR C C 4551 O O . TYR B 257 ? 0.5741 0.5139 0.7431 0.0343 -0.0024 0.0439 252 TYR C O 4552 C CB . TYR B 257 ? 0.6031 0.5382 0.7832 0.0409 -0.0047 0.0368 252 TYR C CB 4553 C CG . TYR B 257 ? 0.5779 0.5122 0.7623 0.0445 -0.0057 0.0364 252 TYR C CG 4554 C CD1 . TYR B 257 ? 0.6204 0.5486 0.8122 0.0463 -0.0072 0.0342 252 TYR C CD1 4555 C CD2 . TYR B 257 ? 0.5921 0.5321 0.7732 0.0464 -0.0053 0.0376 252 TYR C CD2 4556 C CE1 . TYR B 257 ? 0.6257 0.5533 0.8214 0.0502 -0.0083 0.0333 252 TYR C CE1 4557 C CE2 . TYR B 257 ? 0.6049 0.5449 0.7898 0.0500 -0.0062 0.0370 252 TYR C CE2 4558 C CZ . TYR B 257 ? 0.5979 0.5316 0.7900 0.0521 -0.0077 0.0349 252 TYR C CZ 4559 O OH . TYR B 257 ? 0.6543 0.5881 0.8501 0.0561 -0.0087 0.0343 252 TYR C OH 4560 N N . ALA B 258 ? 0.5137 0.4442 0.6936 0.0344 -0.0039 0.0408 253 ALA C N 4561 C CA . ALA B 258 ? 0.5097 0.4403 0.6871 0.0314 -0.0033 0.0401 253 ALA C CA 4562 C C . ALA B 258 ? 0.4910 0.4170 0.6734 0.0312 -0.0043 0.0349 253 ALA C C 4563 O O . ALA B 258 ? 0.5461 0.4693 0.7331 0.0335 -0.0054 0.0321 253 ALA C O 4564 C CB . ALA B 258 ? 0.5508 0.4810 0.7293 0.0295 -0.0029 0.0467 253 ALA C CB 4565 N N . TYR B 259 ? 0.4970 0.4226 0.6782 0.0287 -0.0040 0.0333 254 TYR C N 4566 C CA . TYR B 259 ? 0.5470 0.4691 0.7321 0.0286 -0.0049 0.0275 254 TYR C CA 4567 C C . TYR B 259 ? 0.5976 0.5161 0.7869 0.0258 -0.0053 0.0290 254 TYR C C 4568 O O . TYR B 259 ? 0.5650 0.4863 0.7505 0.0235 -0.0043 0.0309 254 TYR C O 4569 C CB . TYR B 259 ? 0.5453 0.4714 0.7243 0.0286 -0.0042 0.0218 254 TYR C CB 4570 C CG . TYR B 259 ? 0.5989 0.5294 0.7735 0.0310 -0.0038 0.0198 254 TYR C CG 4571 C CD1 . TYR B 259 ? 0.5737 0.5092 0.7413 0.0304 -0.0027 0.0225 254 TYR C CD1 4572 C CD2 . TYR B 259 ? 0.5629 0.4929 0.7405 0.0338 -0.0047 0.0152 254 TYR C CD2 4573 C CE1 . TYR B 259 ? 0.5208 0.4606 0.6847 0.0321 -0.0025 0.0209 254 TYR C CE1 4574 C CE2 . TYR B 259 ? 0.5391 0.4740 0.7129 0.0357 -0.0043 0.0136 254 TYR C CE2 4575 C CZ . TYR B 259 ? 0.5276 0.4674 0.6947 0.0347 -0.0032 0.0166 254 TYR C CZ 4576 O OH . TYR B 259 ? 0.5456 0.4903 0.7093 0.0363 -0.0030 0.0152 254 TYR C OH 4577 N N . LYS B 260 ? 0.5808 0.4932 0.7781 0.0262 -0.0070 0.0279 255 LYS C N 4578 C CA . LYS B 260 ? 0.6346 0.5435 0.8364 0.0233 -0.0077 0.0280 255 LYS C CA 4579 C C . LYS B 260 ? 0.5981 0.5090 0.7968 0.0226 -0.0074 0.0215 255 LYS C C 4580 O O . LYS B 260 ? 0.5870 0.4983 0.7846 0.0249 -0.0078 0.0154 255 LYS C O 4581 C CB . LYS B 260 ? 0.7410 0.6423 0.9523 0.0239 -0.0100 0.0278 255 LYS C CB 4582 C CG . LYS B 260 ? 0.8115 0.7106 1.0264 0.0249 -0.0105 0.0344 255 LYS C CG 4583 C CD . LYS B 260 ? 0.8626 0.7541 1.0870 0.0236 -0.0126 0.0370 255 LYS C CD 4584 C CE . LYS B 260 ? 0.8916 0.7769 1.1217 0.0259 -0.0151 0.0305 255 LYS C CE 4585 N NZ . LYS B 260 ? 0.9513 0.8291 1.1903 0.0236 -0.0173 0.0327 255 LYS C NZ 4586 N N . ILE B 261 ? 0.5517 0.4640 0.7488 0.0196 -0.0068 0.0227 256 ILE C N 4587 C CA . ILE B 261 ? 0.6673 0.5825 0.8602 0.0190 -0.0063 0.0171 256 ILE C CA 4588 C C . ILE B 261 ? 0.6292 0.5424 0.8262 0.0160 -0.0068 0.0171 256 ILE C C 4589 O O . ILE B 261 ? 0.6513 0.5644 0.8501 0.0137 -0.0066 0.0230 256 ILE C O 4590 C CB . ILE B 261 ? 0.6721 0.5938 0.8555 0.0190 -0.0044 0.0184 256 ILE C CB 4591 C CG1 . ILE B 261 ? 0.7059 0.6305 0.8843 0.0183 -0.0038 0.0134 256 ILE C CG1 4592 C CG2 . ILE B 261 ? 0.7405 0.6643 0.9222 0.0170 -0.0034 0.0253 256 ILE C CG2 4593 C CD1 . ILE B 261 ? 0.7623 0.6924 0.9316 0.0185 -0.0024 0.0142 256 ILE C CD1 4594 N N . VAL B 262 ? 0.5867 0.4984 0.7855 0.0160 -0.0078 0.0107 257 VAL C N 4595 C CA . VAL B 262 ? 0.6321 0.5430 0.8338 0.0130 -0.0082 0.0100 257 VAL C CA 4596 C C . VAL B 262 ? 0.6129 0.5280 0.8088 0.0131 -0.0074 0.0044 257 VAL C C 4597 O O . VAL B 262 ? 0.6013 0.5164 0.7962 0.0154 -0.0079 -0.0014 257 VAL C O 4598 C CB . VAL B 262 ? 0.6605 0.5645 0.8719 0.0124 -0.0107 0.0079 257 VAL C CB 4599 C CG1 . VAL B 262 ? 0.6755 0.5793 0.8896 0.0092 -0.0113 0.0063 257 VAL C CG1 4600 C CG2 . VAL B 262 ? 0.6501 0.5496 0.8675 0.0117 -0.0116 0.0145 257 VAL C CG2 4601 N N . LYS B 263 ? 0.7041 0.6229 0.8965 0.0108 -0.0064 0.0061 258 LYS C N 4602 C CA . LYS B 263 ? 0.7670 0.6905 0.9521 0.0110 -0.0053 0.0020 258 LYS C CA 4603 C C . LYS B 263 ? 0.8266 0.7500 1.0137 0.0101 -0.0061 -0.0038 258 LYS C C 4604 O O . LYS B 263 ? 1.0130 0.9370 1.1988 0.0120 -0.0065 -0.0100 258 LYS C O 4605 C CB . LYS B 263 ? 0.8056 0.7340 0.9841 0.0098 -0.0037 0.0066 258 LYS C CB 4606 C CG . LYS B 263 ? 0.8162 0.7486 0.9858 0.0117 -0.0026 0.0047 258 LYS C CG 4607 C CD . LYS B 263 ? 0.7558 0.6900 0.9224 0.0123 -0.0027 -0.0019 258 LYS C CD 4608 C CE . LYS B 263 ? 0.7369 0.6757 0.8940 0.0129 -0.0015 -0.0020 258 LYS C CE 4609 N NZ . LYS B 263 ? 0.7525 0.6933 0.9064 0.0140 -0.0016 -0.0081 258 LYS C NZ 4610 N N . LYS B 264 ? 0.7175 0.6411 0.9075 0.0072 -0.0064 -0.0022 259 LYS C N 4611 C CA . LYS B 264 ? 0.8872 0.8108 1.0792 0.0064 -0.0073 -0.0081 259 LYS C CA 4612 C C . LYS B 264 ? 0.9205 0.8499 1.1036 0.0074 -0.0059 -0.0117 259 LYS C C 4613 O O . LYS B 264 ? 1.0869 1.0203 1.2643 0.0066 -0.0045 -0.0084 259 LYS C O 4614 C CB . LYS B 264 ? 0.9071 0.8255 1.1058 0.0079 -0.0093 -0.0133 259 LYS C CB 4615 C CG . LYS B 264 ? 1.0127 0.9283 1.2186 0.0058 -0.0112 -0.0166 259 LYS C CG 4616 C CD . LYS B 264 ? 1.0438 0.9518 1.2590 0.0058 -0.0136 -0.0161 259 LYS C CD 4617 C CE . LYS B 264 ? 0.9697 0.8757 1.1881 0.0035 -0.0134 -0.0075 259 LYS C CE 4618 N NZ . LYS B 264 ? 0.9797 0.8781 1.2068 0.0039 -0.0157 -0.0067 259 LYS C NZ 4619 N N . GLY B 265 ? 0.7918 0.7219 0.9736 0.0093 -0.0064 -0.0183 260 GLY C N 4620 C CA . GLY B 265 ? 0.7468 0.6821 0.9205 0.0102 -0.0052 -0.0212 260 GLY C CA 4621 C C . GLY B 265 ? 0.6878 0.6265 0.8530 0.0120 -0.0038 -0.0200 260 GLY C C 4622 O O . GLY B 265 ? 0.6035 0.5411 0.7680 0.0131 -0.0035 -0.0168 260 GLY C O 4623 N N . ASP B 266 ? 0.7240 0.6668 0.8828 0.0124 -0.0032 -0.0228 261 ASP C N 4624 C CA . ASP B 266 ? 0.7304 0.6767 0.8807 0.0136 -0.0021 -0.0219 261 ASP C CA 4625 C C . ASP B 266 ? 0.6801 0.6292 0.8274 0.0154 -0.0022 -0.0275 261 ASP C C 4626 O O . ASP B 266 ? 0.5776 0.5274 0.7273 0.0156 -0.0029 -0.0325 261 ASP C O 4627 C CB . ASP B 266 ? 0.7795 0.7286 0.9238 0.0123 -0.0013 -0.0195 261 ASP C CB 4628 C CG . ASP B 266 ? 0.9595 0.9076 1.1043 0.0111 -0.0009 -0.0131 261 ASP C CG 4629 O OD1 . ASP B 266 ? 0.9927 0.9404 1.1346 0.0119 -0.0004 -0.0095 261 ASP C OD1 4630 O OD2 . ASP B 266 ? 0.9238 0.8720 1.0717 0.0093 -0.0010 -0.0119 261 ASP C OD2 4631 N N . SER B 267 ? 0.6088 0.5600 0.7507 0.0167 -0.0017 -0.0265 262 SER C N 4632 C CA . SER B 267 ? 0.5717 0.5264 0.7105 0.0184 -0.0017 -0.0310 262 SER C CA 4633 C C . SER B 267 ? 0.5330 0.4905 0.6637 0.0185 -0.0010 -0.0283 262 SER C C 4634 O O . SER B 267 ? 0.5280 0.4852 0.6546 0.0172 -0.0006 -0.0248 262 SER C O 4635 C CB . SER B 267 ? 0.5568 0.5104 0.7010 0.0203 -0.0024 -0.0333 262 SER C CB 4636 O OG . SER B 267 ? 0.6030 0.5607 0.7456 0.0220 -0.0025 -0.0383 262 SER C OG 4637 N N . THR B 268 ? 0.5330 0.4932 0.6616 0.0199 -0.0009 -0.0295 263 THR C N 4638 C CA . THR B 268 ? 0.4894 0.4515 0.6111 0.0197 -0.0005 -0.0263 263 THR C CA 4639 C C . THR B 268 ? 0.5013 0.4659 0.6236 0.0213 -0.0005 -0.0270 263 THR C C 4640 O O . THR B 268 ? 0.5060 0.4705 0.6339 0.0228 -0.0009 -0.0299 263 THR C O 4641 C CB . THR B 268 ? 0.4704 0.4356 0.5851 0.0191 -0.0004 -0.0272 263 THR C CB 4642 O OG1 . THR B 268 ? 0.4709 0.4363 0.5792 0.0184 -0.0003 -0.0232 263 THR C OG1 4643 C CG2 . THR B 268 ? 0.4754 0.4451 0.5894 0.0203 -0.0004 -0.0320 263 THR C CG2 4644 N N . ILE B 269 ? 0.4569 0.4236 0.5734 0.0210 -0.0003 -0.0242 264 ILE C N 4645 C CA . ILE B 269 ? 0.4807 0.4508 0.5973 0.0223 -0.0003 -0.0246 264 ILE C CA 4646 C C . ILE B 269 ? 0.4782 0.4539 0.5915 0.0228 -0.0003 -0.0280 264 ILE C C 4647 O O . ILE B 269 ? 0.5002 0.4771 0.6074 0.0214 -0.0003 -0.0270 264 ILE C O 4648 C CB . ILE B 269 ? 0.4810 0.4510 0.5933 0.0214 -0.0003 -0.0196 264 ILE C CB 4649 C CG1 . ILE B 269 ? 0.5201 0.4852 0.6347 0.0209 -0.0003 -0.0157 264 ILE C CG1 4650 C CG2 . ILE B 269 ? 0.4592 0.4332 0.5721 0.0227 -0.0003 -0.0198 264 ILE C CG2 4651 C CD1 . ILE B 269 ? 0.5977 0.5605 0.7201 0.0223 -0.0003 -0.0164 264 ILE C CD1 4652 N N . MET B 270 ? 0.4773 0.4565 0.5942 0.0248 -0.0004 -0.0319 265 MET C N 4653 C CA . MET B 270 ? 0.5137 0.4996 0.6276 0.0255 -0.0003 -0.0350 265 MET C CA 4654 C C . MET B 270 ? 0.5076 0.4984 0.6190 0.0258 -0.0001 -0.0328 265 MET C C 4655 O O . MET B 270 ? 0.5158 0.5064 0.6306 0.0270 -0.0001 -0.0320 265 MET C O 4656 C CB . MET B 270 ? 0.5444 0.5326 0.6635 0.0278 -0.0005 -0.0411 265 MET C CB 4657 C CG . MET B 270 ? 0.5848 0.5812 0.7012 0.0290 -0.0004 -0.0443 265 MET C CG 4658 S SD . MET B 270 ? 0.6194 0.6188 0.7408 0.0317 -0.0008 -0.0520 265 MET C SD 4659 C CE . MET B 270 ? 0.6620 0.6565 0.7825 0.0296 -0.0010 -0.0526 265 MET C CE 4660 N N . LYS B 271 ? 0.4854 0.4804 0.5907 0.0245 -0.0001 -0.0316 266 LYS C N 4661 C CA . LYS B 271 ? 0.5287 0.5293 0.6315 0.0244 0.0000 -0.0296 266 LYS C CA 4662 C C . LYS B 271 ? 0.5375 0.5463 0.6414 0.0263 0.0001 -0.0339 266 LYS C C 4663 O O . LYS B 271 ? 0.5416 0.5531 0.6428 0.0260 0.0001 -0.0360 266 LYS C O 4664 C CB . LYS B 271 ? 0.5587 0.5590 0.6543 0.0216 -0.0004 -0.0252 266 LYS C CB 4665 C CG . LYS B 271 ? 0.5632 0.5564 0.6569 0.0198 -0.0008 -0.0209 266 LYS C CG 4666 C CD . LYS B 271 ? 0.6050 0.5961 0.7023 0.0205 -0.0008 -0.0186 266 LYS C CD 4667 C CE . LYS B 271 ? 0.6746 0.6630 0.7677 0.0185 -0.0014 -0.0135 266 LYS C CE 4668 N NZ . LYS B 271 ? 0.7144 0.7050 0.8098 0.0192 -0.0014 -0.0112 266 LYS C NZ 4669 N N . SER B 272 ? 0.5531 0.5658 0.6610 0.0286 0.0002 -0.0355 267 SER C N 4670 C CA . SER B 272 ? 0.6084 0.6299 0.7177 0.0311 0.0004 -0.0398 267 SER C CA 4671 C C . SER B 272 ? 0.6127 0.6397 0.7240 0.0327 0.0005 -0.0389 267 SER C C 4672 O O . SER B 272 ? 0.5903 0.6131 0.7045 0.0332 0.0004 -0.0371 267 SER C O 4673 C CB . SER B 272 ? 0.6146 0.6347 0.7294 0.0338 0.0002 -0.0458 267 SER C CB 4674 O OG . SER B 272 ? 0.6668 0.6959 0.7820 0.0362 0.0003 -0.0503 267 SER C OG 4675 N N . GLU B 273 ? 0.6389 0.6759 0.7489 0.0338 0.0008 -0.0404 268 GLU C N 4676 C CA . GLU B 273 ? 0.6548 0.6985 0.7669 0.0358 0.0010 -0.0400 268 GLU C CA 4677 C C . GLU B 273 ? 0.6805 0.7278 0.7984 0.0404 0.0008 -0.0464 268 GLU C C 4678 O O . GLU B 273 ? 0.6544 0.7064 0.7752 0.0430 0.0008 -0.0471 268 GLU C O 4679 C CB . GLU B 273 ? 0.6926 0.7460 0.8000 0.0341 0.0013 -0.0372 268 GLU C CB 4680 C CG . GLU B 273 ? 0.7400 0.7899 0.8414 0.0295 0.0010 -0.0314 268 GLU C CG 4681 C CD . GLU B 273 ? 0.8127 0.8545 0.9142 0.0278 0.0006 -0.0270 268 GLU C CD 4682 O OE1 . GLU B 273 ? 0.7798 0.8244 0.8833 0.0286 0.0007 -0.0254 268 GLU C OE1 4683 O OE2 . GLU B 273 ? 0.7291 0.7623 0.8283 0.0257 0.0003 -0.0251 268 GLU C OE2 4684 N N . MET B 274 ? 0.6668 0.7116 0.7865 0.0416 0.0005 -0.0511 269 MET C N 4685 C CA . MET B 274 ? 0.7368 0.7846 0.8618 0.0460 0.0000 -0.0577 269 MET C CA 4686 C C . MET B 274 ? 0.7615 0.8020 0.8926 0.0483 -0.0007 -0.0588 269 MET C C 4687 O O . MET B 274 ? 0.7653 0.7972 0.8968 0.0461 -0.0007 -0.0548 269 MET C O 4688 C CB . MET B 274 ? 0.7766 0.8235 0.9016 0.0464 -0.0002 -0.0624 269 MET C CB 4689 C CG . MET B 274 ? 0.7855 0.8414 0.9049 0.0451 0.0004 -0.0620 269 MET C CG 4690 S SD . MET B 274 ? 0.8591 0.9176 0.9798 0.0473 0.0000 -0.0693 269 MET C SD 4691 C CE . MET B 274 ? 0.8775 0.9215 1.0013 0.0456 -0.0007 -0.0699 269 MET C CE 4692 N N . GLU B 275 ? 0.8403 0.8842 0.9761 0.0527 -0.0014 -0.0643 270 GLU C N 4693 C CA . GLU B 275 ? 0.8915 0.9282 1.0336 0.0552 -0.0024 -0.0660 270 GLU C CA 4694 C C . GLU B 275 ? 0.7925 0.8235 0.9391 0.0568 -0.0037 -0.0719 270 GLU C C 4695 O O . GLU B 275 ? 0.7959 0.8304 0.9410 0.0569 -0.0037 -0.0757 270 GLU C O 4696 C CB . GLU B 275 ? 1.0350 1.0794 1.1796 0.0595 -0.0027 -0.0680 270 GLU C CB 4697 C CG . GLU B 275 ? 1.1845 1.2229 1.3327 0.0604 -0.0032 -0.0650 270 GLU C CG 4698 C CD . GLU B 275 ? 1.1571 1.2000 1.3017 0.0585 -0.0021 -0.0587 270 GLU C CD 4699 O OE1 . GLU B 275 ? 1.0930 1.1464 1.2335 0.0579 -0.0012 -0.0577 270 GLU C OE1 4700 O OE2 . GLU B 275 ? 1.2463 1.2824 1.3924 0.0575 -0.0023 -0.0545 270 GLU C OE2 4701 N N . TYR B 276 ? 0.7342 0.7565 0.8865 0.0582 -0.0049 -0.0728 271 TYR C N 4702 C CA . TYR B 276 ? 0.7417 0.7578 0.8993 0.0597 -0.0065 -0.0783 271 TYR C CA 4703 C C . TYR B 276 ? 0.7085 0.7327 0.8675 0.0640 -0.0073 -0.0862 271 TYR C C 4704 O O . TYR B 276 ? 0.6780 0.7108 0.8368 0.0674 -0.0072 -0.0880 271 TYR C O 4705 C CB . TYR B 276 ? 0.7176 0.7248 0.8816 0.0613 -0.0079 -0.0780 271 TYR C CB 4706 C CG . TYR B 276 ? 0.7750 0.7734 0.9448 0.0619 -0.0098 -0.0822 271 TYR C CG 4707 C CD1 . TYR B 276 ? 0.8139 0.8077 0.9828 0.0583 -0.0096 -0.0817 271 TYR C CD1 4708 C CD2 . TYR B 276 ? 0.7461 0.7408 0.9225 0.0658 -0.0118 -0.0864 271 TYR C CD2 4709 C CE1 . TYR B 276 ? 0.7950 0.7809 0.9696 0.0584 -0.0115 -0.0853 271 TYR C CE1 4710 C CE2 . TYR B 276 ? 0.8115 0.7976 0.9935 0.0660 -0.0139 -0.0901 271 TYR C CE2 4711 C CZ . TYR B 276 ? 0.8259 0.8079 1.0072 0.0621 -0.0137 -0.0895 271 TYR C CZ 4712 O OH . TYR B 276 ? 0.8605 0.8342 1.0478 0.0620 -0.0158 -0.0930 271 TYR C OH 4713 N N . GLY B 277 ? 0.6674 0.6894 0.8278 0.0639 -0.0082 -0.0908 272 GLY C N 4714 C CA . GLY B 277 ? 0.6434 0.6731 0.8050 0.0679 -0.0091 -0.0987 272 GLY C CA 4715 C C . GLY B 277 ? 0.6229 0.6457 0.7915 0.0707 -0.0117 -0.1055 272 GLY C C 4716 O O . GLY B 277 ? 0.7388 0.7665 0.9084 0.0734 -0.0127 -0.1123 272 GLY C O 4717 N N . HIS B 278 ? 0.6551 0.6667 0.8287 0.0700 -0.0129 -0.1035 273 HIS C N 4718 C CA . HIS B 278 ? 0.7955 0.7998 0.9765 0.0728 -0.0157 -0.1097 273 HIS C CA 4719 C C . HIS B 278 ? 0.8293 0.8332 1.0113 0.0721 -0.0168 -0.1151 273 HIS C C 4720 O O . HIS B 278 ? 0.8821 0.8877 1.0676 0.0761 -0.0188 -0.1229 273 HIS C O 4721 C CB . HIS B 278 ? 0.8244 0.8346 1.0082 0.0791 -0.0171 -0.1151 273 HIS C CB 4722 C CG . HIS B 278 ? 0.8491 0.8611 1.0318 0.0800 -0.0160 -0.1100 273 HIS C CG 4723 N ND1 . HIS B 278 ? 0.8820 0.8843 1.0695 0.0803 -0.0172 -0.1072 273 HIS C ND1 4724 C CD2 . HIS B 278 ? 0.8234 0.8462 1.0010 0.0805 -0.0140 -0.1070 273 HIS C CD2 4725 C CE1 . HIS B 278 ? 0.8397 0.8468 1.0248 0.0812 -0.0159 -0.1029 273 HIS C CE1 4726 N NE2 . HIS B 278 ? 0.8248 0.8443 1.0040 0.0813 -0.0140 -0.1028 273 HIS C NE2 4727 N N . CYS B 279 ? 0.8617 0.8634 1.0402 0.0672 -0.0154 -0.1110 274 CYS C N 4728 C CA . CYS B 279 ? 0.7886 0.7907 0.9666 0.0658 -0.0158 -0.1150 274 CYS C CA 4729 C C . CYS B 279 ? 0.7121 0.7039 0.8916 0.0607 -0.0158 -0.1103 274 CYS C C 4730 O O . CYS B 279 ? 0.7333 0.7190 0.9131 0.0584 -0.0151 -0.1038 274 CYS C O 4731 C CB . CYS B 279 ? 0.7826 0.7961 0.9530 0.0650 -0.0136 -0.1143 274 CYS C CB 4732 S SG . CYS B 279 ? 0.9206 0.9366 1.0837 0.0612 -0.0106 -0.1041 274 CYS C SG 4733 N N . ASN B 280 ? 0.7200 0.7105 0.9004 0.0592 -0.0166 -0.1136 275 ASN C N 4734 C CA . ASN B 280 ? 0.7156 0.6979 0.8971 0.0543 -0.0164 -0.1093 275 ASN C CA 4735 C C . ASN B 280 ? 0.7032 0.6911 0.8792 0.0520 -0.0151 -0.1096 275 ASN C C 4736 O O . ASN B 280 ? 0.6740 0.6700 0.8480 0.0544 -0.0152 -0.1150 275 ASN C O 4737 C CB . ASN B 280 ? 0.7088 0.6815 0.8989 0.0544 -0.0194 -0.1129 275 ASN C CB 4738 C CG . ASN B 280 ? 0.7396 0.7045 0.9312 0.0493 -0.0192 -0.1081 275 ASN C CG 4739 O OD1 . ASN B 280 ? 0.7296 0.6916 0.9189 0.0464 -0.0176 -0.1006 275 ASN C OD1 4740 N ND2 . ASN B 280 ? 0.8117 0.7739 1.0072 0.0482 -0.0210 -0.1124 275 ASN C ND2 4741 N N . THR B 281 ? 0.6978 0.6818 0.8712 0.0476 -0.0138 -0.1035 276 THR C N 4742 C CA . THR B 281 ? 0.7083 0.6966 0.8764 0.0453 -0.0125 -0.1031 276 THR C CA 4743 C C . THR B 281 ? 0.6661 0.6474 0.8346 0.0407 -0.0122 -0.0981 276 THR C C 4744 O O . THR B 281 ? 0.7458 0.7197 0.9174 0.0390 -0.0124 -0.0936 276 THR C O 4745 C CB . THR B 281 ? 0.6823 0.6791 0.8421 0.0454 -0.0102 -0.0997 276 THR C CB 4746 O OG1 . THR B 281 ? 0.6224 0.6240 0.7774 0.0439 -0.0094 -0.1004 276 THR C OG1 4747 C CG2 . THR B 281 ? 0.7042 0.6972 0.8609 0.0428 -0.0087 -0.0914 276 THR C CG2 4748 N N . LYS B 282 ? 0.6681 0.6525 0.8335 0.0390 -0.0117 -0.0991 277 LYS C N 4749 C CA . LYS B 282 ? 0.6910 0.6712 0.8551 0.0349 -0.0110 -0.0945 277 LYS C CA 4750 C C . LYS B 282 ? 0.5673 0.5509 0.7230 0.0333 -0.0087 -0.0885 277 LYS C C 4751 O O . LYS B 282 ? 0.4821 0.4620 0.6361 0.0302 -0.0079 -0.0833 277 LYS C O 4752 C CB . LYS B 282 ? 0.8340 0.8160 0.9995 0.0342 -0.0119 -0.0994 277 LYS C CB 4753 C CG . LYS B 282 ? 1.1327 1.1124 1.3060 0.0362 -0.0146 -0.1065 277 LYS C CG 4754 C CD . LYS B 282 ? 1.3366 1.3147 1.5140 0.0346 -0.0161 -0.1105 277 LYS C CD 4755 C CE . LYS B 282 ? 1.3664 1.3402 1.5525 0.0364 -0.0192 -0.1171 277 LYS C CE 4756 N NZ . LYS B 282 ? 1.2960 1.2596 1.4892 0.0337 -0.0207 -0.1137 277 LYS C NZ 4757 N N . CYS B 283 ? 0.5114 0.5023 0.6620 0.0354 -0.0078 -0.0893 278 CYS C N 4758 C CA . CYS B 283 ? 0.5222 0.5171 0.6645 0.0340 -0.0059 -0.0845 278 CYS C CA 4759 C C . CYS B 283 ? 0.5088 0.5084 0.6477 0.0358 -0.0051 -0.0828 278 CYS C C 4760 O O . CYS B 283 ? 0.5082 0.5149 0.6465 0.0384 -0.0053 -0.0870 278 CYS C O 4761 C CB . CYS B 283 ? 0.5184 0.5193 0.6566 0.0340 -0.0057 -0.0876 278 CYS C CB 4762 S SG . CYS B 283 ? 0.5784 0.5840 0.7066 0.0325 -0.0039 -0.0822 278 CYS C SG 4763 N N . GLN B 284 ? 0.5632 0.5595 0.7002 0.0343 -0.0043 -0.0767 279 GLN C N 4764 C CA . GLN B 284 ? 0.5309 0.5316 0.6649 0.0357 -0.0036 -0.0745 279 GLN C CA 4765 C C . GLN B 284 ? 0.5675 0.5716 0.6935 0.0338 -0.0024 -0.0698 279 GLN C C 4766 O O . GLN B 284 ? 0.5692 0.5689 0.6924 0.0311 -0.0020 -0.0657 279 GLN C O 4767 C CB . GLN B 284 ? 0.5398 0.5346 0.6774 0.0355 -0.0037 -0.0709 279 GLN C CB 4768 C CG . GLN B 284 ? 0.5154 0.5147 0.6514 0.0372 -0.0033 -0.0694 279 GLN C CG 4769 C CD . GLN B 284 ? 0.4956 0.5013 0.6346 0.0411 -0.0040 -0.0757 279 GLN C CD 4770 O OE1 . GLN B 284 ? 0.4852 0.4878 0.6305 0.0431 -0.0053 -0.0801 279 GLN C OE1 4771 N NE2 . GLN B 284 ? 0.5691 0.5839 0.7036 0.0422 -0.0032 -0.0760 279 GLN C NE2 4772 N N . THR B 285 ? 0.5273 0.5393 0.6498 0.0351 -0.0019 -0.0703 280 THR C N 4773 C CA . THR B 285 ? 0.4997 0.5145 0.6150 0.0332 -0.0010 -0.0651 280 THR C CA 4774 C C . THR B 285 ? 0.5246 0.5421 0.6398 0.0340 -0.0007 -0.0624 280 THR C C 4775 O O . THR B 285 ? 0.5643 0.5841 0.6840 0.0366 -0.0010 -0.0655 280 THR C O 4776 C CB . THR B 285 ? 0.5139 0.5364 0.6243 0.0334 -0.0007 -0.0670 280 THR C CB 4777 O OG1 . THR B 285 ? 0.5138 0.5453 0.6237 0.0356 -0.0005 -0.0689 280 THR C OG1 4778 C CG2 . THR B 285 ? 0.5787 0.6011 0.6915 0.0342 -0.0013 -0.0723 280 THR C CG2 4779 N N . PRO B 286 ? 0.5554 0.5731 0.6651 0.0318 -0.0002 -0.0568 281 PRO C N 4780 C CA . PRO B 286 ? 0.5713 0.5923 0.6809 0.0324 0.0000 -0.0542 281 PRO C CA 4781 C C . PRO B 286 ? 0.6178 0.6495 0.7272 0.0347 0.0002 -0.0571 281 PRO C C 4782 O O . PRO B 286 ? 0.7266 0.7616 0.8368 0.0356 0.0004 -0.0556 281 PRO C O 4783 C CB . PRO B 286 ? 0.5657 0.5848 0.6691 0.0292 0.0002 -0.0478 281 PRO C CB 4784 C CG . PRO B 286 ? 0.5724 0.5853 0.6737 0.0273 0.0000 -0.0471 281 PRO C CG 4785 C CD . PRO B 286 ? 0.5585 0.5742 0.6620 0.0290 0.0000 -0.0529 281 PRO C CD 4786 N N . ILE B 287 ? 0.5626 0.6001 0.6705 0.0357 0.0002 -0.0608 282 ILE C N 4787 C CA . ILE B 287 ? 0.5137 0.5627 0.6215 0.0382 0.0005 -0.0639 282 ILE C CA 4788 C C . ILE B 287 ? 0.5775 0.6290 0.6908 0.0420 0.0000 -0.0715 282 ILE C C 4789 O O . ILE B 287 ? 0.5212 0.5827 0.6350 0.0449 0.0000 -0.0751 282 ILE C O 4790 C CB . ILE B 287 ? 0.5171 0.5735 0.6186 0.0368 0.0009 -0.0622 282 ILE C CB 4791 C CG1 . ILE B 287 ? 0.5218 0.5759 0.6217 0.0362 0.0007 -0.0647 282 ILE C CG1 4792 C CG2 . ILE B 287 ? 0.5146 0.5692 0.6108 0.0332 0.0011 -0.0548 282 ILE C CG2 4793 C CD1 . ILE B 287 ? 0.5053 0.5677 0.5996 0.0354 0.0010 -0.0637 282 ILE C CD1 4794 N N . GLY B 288 ? 0.5202 0.5629 0.6376 0.0421 -0.0007 -0.0739 283 GLY C N 4795 C CA . GLY B 288 ? 0.5421 0.5855 0.6654 0.0454 -0.0017 -0.0812 283 GLY C CA 4796 C C . GLY B 288 ? 0.5243 0.5599 0.6501 0.0443 -0.0025 -0.0835 283 GLY C C 4797 O O . GLY B 288 ? 0.5179 0.5501 0.6400 0.0413 -0.0020 -0.0802 283 GLY C O 4798 N N . ALA B 289 ? 0.5180 0.5511 0.6502 0.0468 -0.0038 -0.0892 284 ALA C N 4799 C CA . ALA B 289 ? 0.5732 0.5991 0.7091 0.0458 -0.0048 -0.0920 284 ALA C CA 4800 C C . ALA B 289 ? 0.5378 0.5694 0.6721 0.0466 -0.0050 -0.0969 284 ALA C C 4801 O O . ALA B 289 ? 0.5054 0.5466 0.6380 0.0491 -0.0049 -0.1002 284 ALA C O 4802 C CB . ALA B 289 ? 0.5805 0.6007 0.7244 0.0481 -0.0064 -0.0960 284 ALA C CB 4803 N N . ILE B 290 ? 0.5599 0.5862 0.6951 0.0443 -0.0054 -0.0972 285 ILE C N 4804 C CA . ILE B 290 ? 0.6129 0.6439 0.7462 0.0446 -0.0056 -0.1013 285 ILE C CA 4805 C C . ILE B 290 ? 0.6245 0.6510 0.7650 0.0456 -0.0075 -0.1072 285 ILE C C 4806 O O . ILE B 290 ? 0.6749 0.6923 0.8197 0.0438 -0.0081 -0.1055 285 ILE C O 4807 C CB . ILE B 290 ? 0.5654 0.5941 0.6933 0.0409 -0.0047 -0.0965 285 ILE C CB 4808 C CG1 . ILE B 290 ? 0.5760 0.6099 0.6962 0.0399 -0.0032 -0.0912 285 ILE C CG1 4809 C CG2 . ILE B 290 ? 0.5329 0.5644 0.6607 0.0410 -0.0052 -0.1010 285 ILE C CG2 4810 C CD1 . ILE B 290 ? 0.5991 0.6288 0.7142 0.0365 -0.0025 -0.0859 285 ILE C CD1 4811 N N . ASN B 291 ? 0.6765 0.7094 0.8183 0.0483 -0.0084 -0.1141 286 ASN C N 4812 C CA . ASN B 291 ? 0.7283 0.7569 0.8770 0.0492 -0.0105 -0.1205 286 ASN C CA 4813 C C . ASN B 291 ? 0.6966 0.7313 0.8429 0.0494 -0.0107 -0.1245 286 ASN C C 4814 O O . ASN B 291 ? 0.6527 0.6970 0.7974 0.0525 -0.0108 -0.1292 286 ASN C O 4815 C CB . ASN B 291 ? 0.7276 0.7574 0.8820 0.0535 -0.0123 -0.1266 286 ASN C CB 4816 C CG . ASN B 291 ? 0.7754 0.8012 0.9368 0.0546 -0.0149 -0.1339 286 ASN C CG 4817 O OD1 . ASN B 291 ? 0.7292 0.7483 0.8930 0.0515 -0.0155 -0.1329 286 ASN C OD1 4818 N ND2 . ASN B 291 ? 0.9743 1.0047 1.1391 0.0592 -0.0166 -0.1414 286 ASN C ND2 4819 N N . SER B 292 ? 0.6712 0.7010 0.8173 0.0461 -0.0106 -0.1225 287 SER C N 4820 C CA . SER B 292 ? 0.6636 0.6994 0.8059 0.0456 -0.0103 -0.1246 287 SER C CA 4821 C C . SER B 292 ? 0.6514 0.6809 0.7962 0.0425 -0.0110 -0.1242 287 SER C C 4822 O O . SER B 292 ? 0.6500 0.6711 0.7967 0.0397 -0.0109 -0.1195 287 SER C O 4823 C CB . SER B 292 ? 0.6292 0.6706 0.7628 0.0447 -0.0082 -0.1189 287 SER C CB 4824 O OG . SER B 292 ? 0.6532 0.7005 0.7829 0.0445 -0.0079 -0.1208 287 SER C OG 4825 N N . SER B 293 ? 0.6238 0.6583 0.7683 0.0432 -0.0117 -0.1292 288 SER C N 4826 C CA . SER B 293 ? 0.6645 0.6955 0.8103 0.0403 -0.0122 -0.1289 288 SER C CA 4827 C C . SER B 293 ? 0.5595 0.5958 0.6974 0.0392 -0.0105 -0.1255 288 SER C C 4828 O O . SER B 293 ? 0.6181 0.6529 0.7558 0.0371 -0.0106 -0.1251 288 SER C O 4829 C CB . SER B 293 ? 0.6887 0.7213 0.8404 0.0417 -0.0145 -0.1373 288 SER C CB 4830 O OG . SER B 293 ? 0.7871 0.8117 0.9468 0.0416 -0.0164 -0.1394 288 SER C OG 4831 N N . MET B 294 ? 0.5522 0.5950 0.6838 0.0407 -0.0091 -0.1235 289 MET C N 4832 C CA . MET B 294 ? 0.5933 0.6411 0.7172 0.0399 -0.0078 -0.1204 289 MET C CA 4833 C C . MET B 294 ? 0.6225 0.6633 0.7436 0.0365 -0.0068 -0.1132 289 MET C C 4834 O O . MET B 294 ? 0.6526 0.6864 0.7756 0.0351 -0.0066 -0.1093 289 MET C O 4835 C CB . MET B 294 ? 0.6434 0.6995 0.7615 0.0420 -0.0067 -0.1191 289 MET C CB 4836 C CG . MET B 294 ? 0.7180 0.7837 0.8376 0.0458 -0.0074 -0.1263 289 MET C CG 4837 S SD . MET B 294 ? 0.7556 0.8247 0.8780 0.0465 -0.0089 -0.1337 289 MET C SD 4838 C CE . MET B 294 ? 0.8186 0.9004 0.9412 0.0515 -0.0096 -0.1411 289 MET C CE 4839 N N . PRO B 295 ? 0.5789 0.6216 0.6955 0.0353 -0.0064 -0.1118 290 PRO C N 4840 C CA . PRO B 295 ? 0.5550 0.5918 0.6685 0.0325 -0.0056 -0.1056 290 PRO C CA 4841 C C . PRO B 295 ? 0.5182 0.5545 0.6249 0.0319 -0.0043 -0.0989 290 PRO C C 4842 O O . PRO B 295 ? 0.5250 0.5554 0.6298 0.0299 -0.0039 -0.0937 290 PRO C O 4843 C CB . PRO B 295 ? 0.5454 0.5862 0.6563 0.0322 -0.0058 -0.1074 290 PRO C CB 4844 C CG . PRO B 295 ? 0.5402 0.5903 0.6488 0.0349 -0.0059 -0.1119 290 PRO C CG 4845 C CD . PRO B 295 ? 0.5808 0.6317 0.6950 0.0368 -0.0067 -0.1163 290 PRO C CD 4846 N N . PHE B 296 ? 0.5513 0.5940 0.6540 0.0337 -0.0039 -0.0991 291 PHE C N 4847 C CA . PHE B 296 ? 0.5381 0.5808 0.6343 0.0330 -0.0029 -0.0930 291 PHE C CA 4848 C C . PHE B 296 ? 0.5503 0.5965 0.6472 0.0345 -0.0026 -0.0931 291 PHE C C 4849 O O . PHE B 296 ? 0.5628 0.6138 0.6638 0.0368 -0.0031 -0.0985 291 PHE C O 4850 C CB . PHE B 296 ? 0.5503 0.5986 0.6393 0.0333 -0.0026 -0.0917 291 PHE C CB 4851 C CG . PHE B 296 ? 0.5689 0.6152 0.6569 0.0323 -0.0029 -0.0920 291 PHE C CG 4852 C CD1 . PHE B 296 ? 0.5945 0.6334 0.6810 0.0302 -0.0028 -0.0874 291 PHE C CD1 4853 C CD2 . PHE B 296 ? 0.6154 0.6676 0.7041 0.0336 -0.0034 -0.0971 291 PHE C CD2 4854 C CE1 . PHE B 296 ? 0.6236 0.6612 0.7092 0.0294 -0.0031 -0.0877 291 PHE C CE1 4855 C CE2 . PHE B 296 ? 0.6404 0.6911 0.7282 0.0327 -0.0037 -0.0974 291 PHE C CE2 4856 C CZ . PHE B 296 ? 0.6528 0.6963 0.7391 0.0306 -0.0035 -0.0926 291 PHE C CZ 4857 N N . HIS B 297 ? 0.5283 0.5719 0.6217 0.0333 -0.0020 -0.0872 292 HIS C N 4858 C CA . HIS B 297 ? 0.5493 0.5969 0.6426 0.0345 -0.0017 -0.0864 292 HIS C CA 4859 C C . HIS B 297 ? 0.5082 0.5560 0.5948 0.0329 -0.0011 -0.0797 292 HIS C C 4860 O O . HIS B 297 ? 0.5078 0.5503 0.5906 0.0308 -0.0011 -0.0756 292 HIS C O 4861 C CB . HIS B 297 ? 0.5536 0.5962 0.6534 0.0348 -0.0019 -0.0873 292 HIS C CB 4862 C CG . HIS B 297 ? 0.5643 0.5984 0.6635 0.0324 -0.0016 -0.0812 292 HIS C CG 4863 N ND1 . HIS B 297 ? 0.5092 0.5431 0.6060 0.0319 -0.0011 -0.0767 292 HIS C ND1 4864 C CD2 . HIS B 297 ? 0.5342 0.5602 0.6350 0.0305 -0.0018 -0.0792 292 HIS C CD2 4865 C CE1 . HIS B 297 ? 0.4828 0.5087 0.5797 0.0299 -0.0011 -0.0723 292 HIS C CE1 4866 N NE2 . HIS B 297 ? 0.5122 0.5334 0.6114 0.0291 -0.0014 -0.0736 292 HIS C NE2 4867 N N . ASN B 298 ? 0.5041 0.5582 0.5892 0.0338 -0.0007 -0.0788 293 ASN C N 4868 C CA . ASN B 298 ? 0.5164 0.5706 0.5955 0.0319 -0.0004 -0.0723 293 ASN C CA 4869 C C . ASN B 298 ? 0.4625 0.5170 0.5432 0.0319 -0.0001 -0.0697 293 ASN C C 4870 O O . ASN B 298 ? 0.5217 0.5797 0.5984 0.0309 0.0000 -0.0656 293 ASN C O 4871 C CB . ASN B 298 ? 0.5008 0.5639 0.5747 0.0325 -0.0003 -0.0720 293 ASN C CB 4872 C CG . ASN B 298 ? 0.4762 0.5498 0.5524 0.0350 0.0000 -0.0757 293 ASN C CG 4873 O OD1 . ASN B 298 ? 0.4873 0.5613 0.5691 0.0369 0.0000 -0.0796 293 ASN C OD1 4874 N ND2 . ASN B 298 ? 0.5099 0.5923 0.5815 0.0354 0.0001 -0.0745 293 ASN C ND2 4875 N N . ILE B 299 ? 0.5004 0.5514 0.5872 0.0329 -0.0002 -0.0723 294 ILE C N 4876 C CA . ILE B 299 ? 0.5134 0.5660 0.6026 0.0335 0.0000 -0.0710 294 ILE C CA 4877 C C . ILE B 299 ? 0.5661 0.6124 0.6527 0.0309 0.0001 -0.0643 294 ILE C C 4878 O O . ILE B 299 ? 0.5882 0.6387 0.6720 0.0303 0.0003 -0.0608 294 ILE C O 4879 C CB . ILE B 299 ? 0.4940 0.5449 0.5909 0.0359 -0.0003 -0.0765 294 ILE C CB 4880 C CG1 . ILE B 299 ? 0.4830 0.5428 0.5815 0.0389 -0.0005 -0.0831 294 ILE C CG1 4881 C CG2 . ILE B 299 ? 0.5189 0.5700 0.6184 0.0367 -0.0001 -0.0749 294 ILE C CG2 4882 C CD1 . ILE B 299 ? 0.5101 0.5663 0.6148 0.0404 -0.0014 -0.0892 294 ILE C CD1 4883 N N . HIS B 300 ? 0.5232 0.5599 0.6104 0.0293 0.0000 -0.0624 295 HIS C N 4884 C CA . HIS B 300 ? 0.5355 0.5661 0.6209 0.0271 -0.0001 -0.0567 295 HIS C CA 4885 C C . HIS B 300 ? 0.5347 0.5563 0.6203 0.0257 -0.0003 -0.0554 295 HIS C C 4886 O O . HIS B 300 ? 0.5075 0.5269 0.5978 0.0266 -0.0004 -0.0592 295 HIS C O 4887 C CB . HIS B 300 ? 0.5364 0.5666 0.6271 0.0283 0.0000 -0.0571 295 HIS C CB 4888 C CG . HIS B 300 ? 0.6203 0.6478 0.7086 0.0265 0.0000 -0.0513 295 HIS C CG 4889 N ND1 . HIS B 300 ? 0.5527 0.5715 0.6407 0.0248 -0.0001 -0.0477 295 HIS C ND1 4890 C CD2 . HIS B 300 ? 0.5971 0.6298 0.6835 0.0262 0.0002 -0.0486 295 HIS C CD2 4891 C CE1 . HIS B 300 ? 0.5405 0.5590 0.6264 0.0235 -0.0001 -0.0432 295 HIS C CE1 4892 N NE2 . HIS B 300 ? 0.5535 0.5802 0.6385 0.0243 0.0000 -0.0436 295 HIS C NE2 4893 N N . PRO B 301 ? 0.4581 0.4748 0.5391 0.0236 -0.0006 -0.0502 296 PRO C N 4894 C CA . PRO B 301 ? 0.3920 0.4011 0.4732 0.0225 -0.0008 -0.0488 296 PRO C CA 4895 C C . PRO B 301 ? 0.4207 0.4240 0.5072 0.0223 -0.0007 -0.0479 296 PRO C C 4896 O O . PRO B 301 ? 0.4553 0.4538 0.5439 0.0219 -0.0008 -0.0483 296 PRO C O 4897 C CB . PRO B 301 ? 0.4102 0.4166 0.4843 0.0206 -0.0014 -0.0436 296 PRO C CB 4898 C CG . PRO B 301 ? 0.4161 0.4266 0.4881 0.0202 -0.0014 -0.0411 296 PRO C CG 4899 C CD . PRO B 301 ? 0.4565 0.4752 0.5313 0.0221 -0.0009 -0.0456 296 PRO C CD 4900 N N . LEU B 302 ? 0.4508 0.4546 0.5393 0.0226 -0.0005 -0.0465 297 LEU C N 4901 C CA . LEU B 302 ? 0.4682 0.4663 0.5609 0.0224 -0.0005 -0.0446 297 LEU C CA 4902 C C . LEU B 302 ? 0.4581 0.4558 0.5585 0.0241 -0.0004 -0.0489 297 LEU C C 4903 O O . LEU B 302 ? 0.4623 0.4603 0.5664 0.0251 -0.0004 -0.0490 297 LEU C O 4904 C CB . LEU B 302 ? 0.4577 0.4559 0.5483 0.0217 -0.0005 -0.0403 297 LEU C CB 4905 C CG . LEU B 302 ? 0.4805 0.4792 0.5636 0.0199 -0.0009 -0.0363 297 LEU C CG 4906 C CD1 . LEU B 302 ? 0.4931 0.4916 0.5747 0.0190 -0.0011 -0.0321 297 LEU C CD1 4907 C CD2 . LEU B 302 ? 0.4840 0.4770 0.5637 0.0187 -0.0013 -0.0344 297 LEU C CD2 4908 N N . THR B 303 ? 0.4209 0.4177 0.5238 0.0243 -0.0006 -0.0524 298 THR C N 4909 C CA . THR B 303 ? 0.4193 0.4153 0.5294 0.0257 -0.0010 -0.0570 298 THR C CA 4910 C C . THR B 303 ? 0.4167 0.4054 0.5316 0.0247 -0.0012 -0.0551 298 THR C C 4911 O O . THR B 303 ? 0.4298 0.4147 0.5423 0.0229 -0.0010 -0.0513 298 THR C O 4912 C CB . THR B 303 ? 0.4278 0.4268 0.5385 0.0263 -0.0013 -0.0620 298 THR C CB 4913 O OG1 . THR B 303 ? 0.4232 0.4193 0.5310 0.0245 -0.0013 -0.0601 298 THR C OG1 4914 C CG2 . THR B 303 ? 0.4493 0.4563 0.5558 0.0276 -0.0011 -0.0641 298 THR C CG2 4915 N N . ILE B 304 ? 0.4808 0.4679 0.6026 0.0260 -0.0017 -0.0578 299 ILE C N 4916 C CA . ILE B 304 ? 0.5218 0.5021 0.6492 0.0251 -0.0022 -0.0563 299 ILE C CA 4917 C C . ILE B 304 ? 0.5127 0.4925 0.6467 0.0261 -0.0032 -0.0620 299 ILE C C 4918 O O . ILE B 304 ? 0.6449 0.6277 0.7817 0.0285 -0.0037 -0.0664 299 ILE C O 4919 C CB . ILE B 304 ? 0.4888 0.4661 0.6189 0.0256 -0.0021 -0.0532 299 ILE C CB 4920 C CG1 . ILE B 304 ? 0.4975 0.4755 0.6210 0.0245 -0.0013 -0.0477 299 ILE C CG1 4921 C CG2 . ILE B 304 ? 0.5037 0.4743 0.6398 0.0245 -0.0027 -0.0514 299 ILE C CG2 4922 C CD1 . ILE B 304 ? 0.5049 0.4810 0.6304 0.0251 -0.0013 -0.0445 299 ILE C CD1 4923 N N . GLY B 305 ? 0.4955 0.4719 0.6319 0.0244 -0.0036 -0.0621 300 GLY C N 4924 C CA . GLY B 305 ? 0.5335 0.5092 0.6761 0.0249 -0.0048 -0.0675 300 GLY C CA 4925 C C . GLY B 305 ? 0.5146 0.4928 0.6550 0.0237 -0.0048 -0.0695 300 GLY C C 4926 O O . GLY B 305 ? 0.4899 0.4688 0.6246 0.0223 -0.0038 -0.0658 300 GLY C O 4927 N N . GLU B 306 ? 0.6119 0.5914 0.7567 0.0247 -0.0059 -0.0755 301 GLU C N 4928 C CA . GLU B 306 ? 0.6120 0.5945 0.7557 0.0238 -0.0061 -0.0784 301 GLU C CA 4929 C C . GLU B 306 ? 0.5619 0.5519 0.7016 0.0262 -0.0060 -0.0830 301 GLU C C 4930 O O . GLU B 306 ? 0.5401 0.5322 0.6835 0.0284 -0.0070 -0.0885 301 GLU C O 4931 C CB . GLU B 306 ? 0.6435 0.6228 0.7952 0.0232 -0.0078 -0.0824 301 GLU C CB 4932 C CG . GLU B 306 ? 0.7781 0.7501 0.9352 0.0210 -0.0083 -0.0782 301 GLU C CG 4933 C CD . GLU B 306 ? 0.8738 0.8423 1.0398 0.0205 -0.0104 -0.0826 301 GLU C CD 4934 O OE1 . GLU B 306 ? 0.8913 0.8621 1.0583 0.0195 -0.0110 -0.0859 301 GLU C OE1 4935 O OE2 . GLU B 306 ? 0.7724 0.7362 0.9440 0.0214 -0.0115 -0.0829 301 GLU C OE2 4936 N N . CYS B 307 ? 0.5056 0.4994 0.6377 0.0258 -0.0048 -0.0805 302 CYS C N 4937 C CA . CYS B 307 ? 0.5382 0.5394 0.6654 0.0278 -0.0044 -0.0831 302 CYS C CA 4938 C C . CYS B 307 ? 0.5551 0.5607 0.6782 0.0274 -0.0043 -0.0848 302 CYS C C 4939 O O . CYS B 307 ? 0.4756 0.4783 0.5982 0.0254 -0.0042 -0.0828 302 CYS C O 4940 C CB . CYS B 307 ? 0.5302 0.5324 0.6515 0.0278 -0.0033 -0.0779 302 CYS C CB 4941 S SG . CYS B 307 ? 0.6058 0.6034 0.7315 0.0283 -0.0034 -0.0756 302 CYS C SG 4942 N N . PRO B 308 ? 0.5358 0.5488 0.6559 0.0294 -0.0042 -0.0884 303 PRO C N 4943 C CA . PRO B 308 ? 0.5407 0.5582 0.6555 0.0292 -0.0039 -0.0889 303 PRO C CA 4944 C C . PRO B 308 ? 0.4974 0.5134 0.6049 0.0276 -0.0029 -0.0824 303 PRO C C 4945 O O . PRO B 308 ? 0.5619 0.5745 0.6681 0.0269 -0.0025 -0.0780 303 PRO C O 4946 C CB . PRO B 308 ? 0.5744 0.6007 0.6874 0.0319 -0.0039 -0.0933 303 PRO C CB 4947 C CG . PRO B 308 ? 0.5879 0.6138 0.7072 0.0337 -0.0047 -0.0970 303 PRO C CG 4948 C CD . PRO B 308 ? 0.5929 0.6108 0.7149 0.0322 -0.0045 -0.0925 303 PRO C CD 4949 N N . LYS B 309 ? 0.4901 0.5088 0.5927 0.0273 -0.0028 -0.0821 304 LYS C N 4950 C CA . LYS B 309 ? 0.5114 0.5283 0.6069 0.0260 -0.0022 -0.0765 304 LYS C CA 4951 C C . LYS B 309 ? 0.5108 0.5323 0.6007 0.0269 -0.0019 -0.0747 304 LYS C C 4952 O O . LYS B 309 ? 0.5150 0.5435 0.6037 0.0285 -0.0019 -0.0781 304 LYS C O 4953 C CB . LYS B 309 ? 0.5363 0.5545 0.6289 0.0256 -0.0024 -0.0772 304 LYS C CB 4954 C CG . LYS B 309 ? 0.6131 0.6272 0.7111 0.0243 -0.0028 -0.0782 304 LYS C CG 4955 C CD . LYS B 309 ? 0.7073 0.7144 0.8071 0.0227 -0.0025 -0.0734 304 LYS C CD 4956 C CE . LYS B 309 ? 0.6889 0.6922 0.7935 0.0210 -0.0028 -0.0730 304 LYS C CE 4957 N NZ . LYS B 309 ? 0.7060 0.7089 0.8192 0.0210 -0.0036 -0.0776 304 LYS C NZ 4958 N N . TYR B 310 ? 0.4513 0.4693 0.5377 0.0258 -0.0016 -0.0693 305 TYR C N 4959 C CA . TYR B 310 ? 0.4353 0.4573 0.5169 0.0262 -0.0014 -0.0669 305 TYR C CA 4960 C C . TYR B 310 ? 0.4035 0.4282 0.4779 0.0260 -0.0016 -0.0652 305 TYR C C 4961 O O . TYR B 310 ? 0.4209 0.4411 0.4922 0.0249 -0.0019 -0.0627 305 TYR C O 4962 C CB . TYR B 310 ? 0.4291 0.4460 0.5097 0.0249 -0.0012 -0.0617 305 TYR C CB 4963 C CG . TYR B 310 ? 0.4138 0.4346 0.4902 0.0248 -0.0011 -0.0587 305 TYR C CG 4964 C CD1 . TYR B 310 ? 0.4492 0.4771 0.5275 0.0263 -0.0008 -0.0614 305 TYR C CD1 4965 C CD2 . TYR B 310 ? 0.4278 0.4452 0.4984 0.0231 -0.0015 -0.0532 305 TYR C CD2 4966 C CE1 . TYR B 310 ? 0.4421 0.4741 0.5167 0.0259 -0.0008 -0.0581 305 TYR C CE1 4967 C CE2 . TYR B 310 ? 0.4055 0.4261 0.4724 0.0226 -0.0016 -0.0501 305 TYR C CE2 4968 C CZ . TYR B 310 ? 0.4364 0.4646 0.5052 0.0238 -0.0012 -0.0523 305 TYR C CZ 4969 O OH . TYR B 310 ? 0.4108 0.4426 0.4759 0.0228 -0.0013 -0.0485 305 TYR C OH 4970 N N . VAL B 311 ? 0.4214 0.4534 0.4932 0.0270 -0.0015 -0.0664 306 VAL C N 4971 C CA . VAL B 311 ? 0.4577 0.4929 0.5226 0.0269 -0.0018 -0.0644 306 VAL C CA 4972 C C . VAL B 311 ? 0.5035 0.5442 0.5645 0.0268 -0.0018 -0.0617 306 VAL C C 4973 O O . VAL B 311 ? 0.5361 0.5806 0.6000 0.0275 -0.0014 -0.0626 306 VAL C O 4974 C CB . VAL B 311 ? 0.4720 0.5126 0.5373 0.0284 -0.0019 -0.0693 306 VAL C CB 4975 C CG1 . VAL B 311 ? 0.4826 0.5185 0.5518 0.0282 -0.0021 -0.0719 306 VAL C CG1 4976 C CG2 . VAL B 311 ? 0.5154 0.5642 0.5844 0.0304 -0.0016 -0.0744 306 VAL C CG2 4977 N N . LYS B 312 ? 0.4955 0.5367 0.5498 0.0261 -0.0024 -0.0583 307 LYS C N 4978 C CA . LYS B 312 ? 0.5185 0.5654 0.5687 0.0257 -0.0025 -0.0553 307 LYS C CA 4979 C C . LYS B 312 ? 0.5734 0.6298 0.6226 0.0275 -0.0023 -0.0587 307 LYS C C 4980 O O . LYS B 312 ? 0.7516 0.8086 0.7960 0.0275 -0.0029 -0.0575 307 LYS C O 4981 C CB . LYS B 312 ? 0.5650 0.6060 0.6086 0.0237 -0.0036 -0.0492 307 LYS C CB 4982 C CG . LYS B 312 ? 0.6595 0.7057 0.6982 0.0228 -0.0041 -0.0452 307 LYS C CG 4983 C CD . LYS B 312 ? 0.7318 0.7708 0.7650 0.0205 -0.0056 -0.0390 307 LYS C CD 4984 C CE . LYS B 312 ? 0.8318 0.8754 0.8628 0.0188 -0.0060 -0.0347 307 LYS C CE 4985 N NZ . LYS B 312 ? 0.9113 0.9506 0.9356 0.0169 -0.0078 -0.0291 307 LYS C NZ 4986 N N . SER B 313 ? 0.6021 0.6659 0.6559 0.0294 -0.0016 -0.0634 308 SER C N 4987 C CA . SER B 313 ? 0.6200 0.6943 0.6730 0.0314 -0.0014 -0.0670 308 SER C CA 4988 C C . SER B 313 ? 0.6764 0.7593 0.7331 0.0330 -0.0007 -0.0695 308 SER C C 4989 O O . SER B 313 ? 0.6137 0.6939 0.6751 0.0332 -0.0005 -0.0707 308 SER C O 4990 C CB . SER B 313 ? 0.6192 0.6947 0.6755 0.0332 -0.0014 -0.0732 308 SER C CB 4991 O OG . SER B 313 ? 0.8002 0.8674 0.8552 0.0321 -0.0019 -0.0722 308 SER C OG 4992 N N . ASN B 314 ? 0.7309 0.8245 0.7855 0.0345 -0.0005 -0.0707 309 ASN C N 4993 C CA . ASN B 314 ? 0.7259 0.8298 0.7840 0.0368 0.0000 -0.0743 309 ASN C CA 4994 C C . ASN B 314 ? 0.6766 0.7852 0.7393 0.0399 0.0000 -0.0824 309 ASN C C 4995 O O . ASN B 314 ? 0.6660 0.7809 0.7328 0.0423 0.0002 -0.0867 309 ASN C O 4996 C CB . ASN B 314 ? 0.7117 0.8260 0.7649 0.0367 0.0002 -0.0708 309 ASN C CB 4997 C CG . ASN B 314 ? 0.7877 0.8974 0.8361 0.0334 -0.0001 -0.0626 309 ASN C CG 4998 O OD1 . ASN B 314 ? 0.7938 0.9051 0.8367 0.0321 -0.0006 -0.0584 309 ASN C OD1 4999 N ND2 . ASN B 314 ? 0.7360 0.8392 0.7865 0.0319 -0.0001 -0.0602 309 ASN C ND2 5000 N N . LYS B 315 ? 0.6789 0.7840 0.7410 0.0400 -0.0004 -0.0846 310 LYS C N 5001 C CA . LYS B 315 ? 0.6957 0.8087 0.7595 0.0427 -0.0006 -0.0912 310 LYS C CA 5002 C C . LYS B 315 ? 0.6514 0.7576 0.7150 0.0420 -0.0011 -0.0929 310 LYS C C 5003 O O . LYS B 315 ? 0.6222 0.7254 0.6806 0.0404 -0.0013 -0.0885 310 LYS C O 5004 C CB . LYS B 315 ? 0.7460 0.8700 0.8042 0.0434 -0.0003 -0.0890 310 LYS C CB 5005 C CG . LYS B 315 ? 0.8405 0.9778 0.9005 0.0470 -0.0002 -0.0950 310 LYS C CG 5006 C CD . LYS B 315 ? 0.9105 1.0583 0.9643 0.0472 0.0000 -0.0914 310 LYS C CD 5007 C CE . LYS B 315 ? 0.9638 1.1085 1.0128 0.0462 -0.0003 -0.0894 310 LYS C CE 5008 N NZ . LYS B 315 ? 0.9708 1.1243 1.0136 0.0460 -0.0002 -0.0848 310 LYS C NZ 5009 N N . LEU B 316 ? 0.5942 0.6984 0.6638 0.0433 -0.0016 -0.0992 311 LEU C N 5010 C CA . LEU B 316 ? 0.5688 0.6699 0.6387 0.0430 -0.0021 -0.1017 311 LEU C CA 5011 C C . LEU B 316 ? 0.5096 0.6187 0.5834 0.0459 -0.0027 -0.1099 311 LEU C C 5012 O O . LEU B 316 ? 0.4991 0.6054 0.5796 0.0466 -0.0033 -0.1151 311 LEU C O 5013 C CB . LEU B 316 ? 0.5099 0.5990 0.5833 0.0409 -0.0024 -0.1008 311 LEU C CB 5014 C CG . LEU B 316 ? 0.4850 0.5657 0.5544 0.0381 -0.0021 -0.0932 311 LEU C CG 5015 C CD1 . LEU B 316 ? 0.4741 0.5447 0.5482 0.0366 -0.0024 -0.0933 311 LEU C CD1 5016 C CD2 . LEU B 316 ? 0.4792 0.5597 0.5417 0.0373 -0.0023 -0.0894 311 LEU C CD2 5017 N N . VAL B 317 ? 0.4491 0.5682 0.5190 0.0476 -0.0026 -0.1110 312 VAL C N 5018 C CA . VAL B 317 ? 0.4911 0.6199 0.5642 0.0509 -0.0031 -0.1188 312 VAL C CA 5019 C C . VAL B 317 ? 0.4842 0.6142 0.5571 0.0513 -0.0038 -0.1225 312 VAL C C 5020 O O . VAL B 317 ? 0.4560 0.5888 0.5231 0.0509 -0.0035 -0.1193 312 VAL C O 5021 C CB . VAL B 317 ? 0.5596 0.7014 0.6291 0.0531 -0.0026 -0.1186 312 VAL C CB 5022 C CG1 . VAL B 317 ? 0.5760 0.7277 0.6495 0.0569 -0.0032 -0.1273 312 VAL C CG1 5023 C CG2 . VAL B 317 ? 0.6224 0.7639 0.6918 0.0526 -0.0019 -0.1144 312 VAL C CG2 5024 N N . LEU B 318 ? 0.5005 0.6277 0.5800 0.0518 -0.0048 -0.1288 313 LEU C N 5025 C CA . LEU B 318 ? 0.5351 0.6644 0.6156 0.0524 -0.0056 -0.1334 313 LEU C CA 5026 C C . LEU B 318 ? 0.5848 0.7270 0.6659 0.0561 -0.0062 -0.1402 313 LEU C C 5027 O O . LEU B 318 ? 0.6042 0.7501 0.6896 0.0583 -0.0067 -0.1451 313 LEU C O 5028 C CB . LEU B 318 ? 0.4914 0.6119 0.5793 0.0510 -0.0067 -0.1374 313 LEU C CB 5029 C CG . LEU B 318 ? 0.4973 0.6059 0.5851 0.0475 -0.0064 -0.1318 313 LEU C CG 5030 C CD1 . LEU B 318 ? 0.4899 0.5912 0.5859 0.0463 -0.0076 -0.1357 313 LEU C CD1 5031 C CD2 . LEU B 318 ? 0.5160 0.6243 0.5983 0.0463 -0.0061 -0.1282 313 LEU C CD2 5032 N N . ALA B 319 ? 0.5847 0.7336 0.6616 0.0569 -0.0062 -0.1407 314 ALA C N 5033 C CA . ALA B 319 ? 0.6152 0.7757 0.6934 0.0603 -0.0069 -0.1481 314 ALA C CA 5034 C C . ALA B 319 ? 0.6335 0.7906 0.7196 0.0606 -0.0086 -0.1560 314 ALA C C 5035 O O . ALA B 319 ? 0.6349 0.7831 0.7233 0.0581 -0.0091 -0.1555 314 ALA C O 5036 C CB . ALA B 319 ? 0.5720 0.7396 0.6441 0.0609 -0.0066 -0.1465 314 ALA C CB 5037 N N . THR B 320 ? 0.6294 0.7934 0.7195 0.0638 -0.0096 -0.1632 315 THR C N 5038 C CA . THR B 320 ? 0.7331 0.8959 0.8304 0.0647 -0.0116 -0.1718 315 THR C CA 5039 C C . THR B 320 ? 0.7300 0.9060 0.8263 0.0681 -0.0125 -0.1784 315 THR C C 5040 O O . THR B 320 ? 0.6864 0.8623 0.7861 0.0680 -0.0140 -0.1838 315 THR C O 5041 C CB . THR B 320 ? 0.8098 0.9681 0.9140 0.0657 -0.0128 -0.1760 315 THR C CB 5042 O OG1 . THR B 320 ? 0.8326 0.9982 0.9342 0.0683 -0.0118 -0.1748 315 THR C OG1 5043 C CG2 . THR B 320 ? 0.8107 0.9544 0.9179 0.0618 -0.0126 -0.1712 315 THR C CG2 5044 N N . GLY B 321 ? 0.6877 0.8754 0.7791 0.0710 -0.0115 -0.1777 316 GLY C N 5045 C CA . GLY B 321 ? 0.6853 0.8869 0.7752 0.0747 -0.0122 -0.1837 316 GLY C CA 5046 C C . GLY B 321 ? 0.6773 0.8851 0.7598 0.0743 -0.0111 -0.1791 316 GLY C C 5047 O O . GLY B 321 ? 0.7364 0.9363 0.8162 0.0711 -0.0104 -0.1731 316 GLY C O 5048 N N . LEU B 322 ? 0.6740 0.8964 0.7534 0.0779 -0.0110 -0.1820 317 LEU C N 5049 C CA . LEU B 322 ? 0.6995 0.9299 0.7723 0.0783 -0.0103 -0.1790 317 LEU C CA 5050 C C . LEU B 322 ? 0.6252 0.8617 0.6909 0.0785 -0.0084 -0.1711 317 LEU C C 5051 O O . LEU B 322 ? 0.7475 0.9858 0.8139 0.0793 -0.0079 -0.1699 317 LEU C O 5052 C CB . LEU B 322 ? 0.7751 1.0188 0.8494 0.0824 -0.0116 -0.1881 317 LEU C CB 5053 C CG . LEU B 322 ? 0.8132 1.0515 0.8956 0.0824 -0.0139 -0.1971 317 LEU C CG 5054 C CD1 . LEU B 322 ? 0.8932 1.1333 0.9819 0.0852 -0.0154 -0.2048 317 LEU C CD1 5055 C CD2 . LEU B 322 ? 0.8446 1.0914 0.9262 0.0841 -0.0150 -0.2022 317 LEU C CD2 5056 N N . ARG B 323 ? 0.5930 0.8337 0.6522 0.0781 -0.0077 -0.1659 318 ARG C N 5057 C CA . ARG B 323 ? 0.6907 0.9409 0.7433 0.0790 -0.0063 -0.1594 318 ARG C CA 5058 C C . ARG B 323 ? 0.7584 1.0247 0.8117 0.0834 -0.0064 -0.1650 318 ARG C C 5059 O O . ARG B 323 ? 0.8104 1.0843 0.8664 0.0864 -0.0076 -0.1732 318 ARG C O 5060 C CB . ARG B 323 ? 0.6803 0.9345 0.7258 0.0786 -0.0058 -0.1540 318 ARG C CB 5061 C CG . ARG B 323 ? 0.6739 0.9161 0.7184 0.0756 -0.0061 -0.1510 318 ARG C CG 5062 C CD . ARG B 323 ? 0.6964 0.9431 0.7333 0.0756 -0.0057 -0.1449 318 ARG C CD 5063 N NE . ARG B 323 ? 0.7211 0.9546 0.7565 0.0725 -0.0059 -0.1406 318 ARG C NE 5064 C CZ . ARG B 323 ? 0.7559 0.9810 0.7867 0.0698 -0.0053 -0.1319 318 ARG C CZ 5065 N NH1 . ARG B 323 ? 0.7859 1.0145 0.8131 0.0695 -0.0045 -0.1259 318 ARG C NH1 5066 N NH2 . ARG B 323 ? 0.7445 0.9582 0.7744 0.0675 -0.0057 -0.1290 318 ARG C NH2 5067 N N . ASN B 324 ? 0.8465 1.1187 0.8971 0.0838 -0.0052 -0.1601 319 ASN C N 5068 C CA . ASN B 324 ? 0.8556 1.1431 0.9071 0.0880 -0.0051 -0.1646 319 ASN C CA 5069 C C . ASN B 324 ? 0.8697 1.1706 0.9141 0.0888 -0.0038 -0.1577 319 ASN C C 5070 O O . ASN B 324 ? 0.8491 1.1525 0.8886 0.0882 -0.0036 -0.1540 319 ASN C O 5071 C CB . ASN B 324 ? 0.8438 1.1264 0.8995 0.0878 -0.0049 -0.1650 319 ASN C CB 5072 C CG . ASN B 324 ? 0.8636 1.1585 0.9233 0.0928 -0.0057 -0.1738 319 ASN C CG 5073 O OD1 . ASN B 324 ? 0.9743 1.2777 1.0356 0.0962 -0.0069 -0.1818 319 ASN C OD1 5074 N ND2 . ASN B 324 ? 0.7876 1.0831 0.8491 0.0933 -0.0052 -0.1726 319 ASN C ND2 5075 N N . SER C 5 ? 1.0237 1.6037 1.3002 -0.1159 -0.0296 -0.3285 0 SER E N 5076 C CA . SER C 5 ? 1.0540 1.6365 1.3222 -0.1072 -0.0306 -0.3225 0 SER E CA 5077 C C . SER C 5 ? 1.1151 1.6821 1.3783 -0.1034 -0.0292 -0.3117 0 SER E C 5078 O O . SER C 5 ? 1.1519 1.7004 1.4160 -0.1055 -0.0277 -0.3098 0 SER E O 5079 C CB . SER C 5 ? 0.9996 1.5794 1.2661 -0.1053 -0.0316 -0.3270 0 SER E CB 5080 O OG . SER C 5 ? 0.9264 1.5116 1.1853 -0.0976 -0.0327 -0.3219 0 SER E OG 5081 N N . ASP C 6 ? 1.0490 1.6240 1.3070 -0.0976 -0.0297 -0.3049 1 ASP E N 5082 C CA . ASP C 6 ? 1.0863 1.6498 1.3403 -0.0946 -0.0284 -0.2950 1 ASP E CA 5083 C C . ASP C 6 ? 1.1521 1.6972 1.4003 -0.0907 -0.0277 -0.2888 1 ASP E C 5084 O O . ASP C 6 ? 1.2620 1.8088 1.5060 -0.0865 -0.0289 -0.2890 1 ASP E O 5085 C CB . ASP C 6 ? 1.0064 1.5844 1.2561 -0.0892 -0.0294 -0.2902 1 ASP E CB 5086 C CG . ASP C 6 ? 0.9746 1.5694 1.2300 -0.0932 -0.0296 -0.2949 1 ASP E CG 5087 O OD1 . ASP C 6 ? 0.8321 1.4254 1.0948 -0.1007 -0.0287 -0.3008 1 ASP E OD1 5088 O OD2 . ASP C 6 ? 0.7778 1.3874 1.0303 -0.0887 -0.0307 -0.2925 1 ASP E OD2 5089 N N . GLN C 7 ? 1.1605 1.6892 1.4088 -0.0921 -0.0259 -0.2832 2 GLN E N 5090 C CA . GLN C 7 ? 1.0756 1.5855 1.3194 -0.0894 -0.0250 -0.2774 2 GLN E CA 5091 C C . GLN C 7 ? 1.0342 1.5337 1.2744 -0.0869 -0.0237 -0.2678 2 GLN E C 5092 O O . GLN C 7 ? 0.9762 1.4745 1.2201 -0.0903 -0.0225 -0.2667 2 GLN E O 5093 C CB . GLN C 7 ? 1.0766 1.5720 1.3255 -0.0950 -0.0238 -0.2817 2 GLN E CB 5094 C CG . GLN C 7 ? 1.0636 1.5577 1.3121 -0.0944 -0.0247 -0.2872 2 GLN E CG 5095 C CD . GLN C 7 ? 1.1310 1.6077 1.3834 -0.0989 -0.0234 -0.2897 2 GLN E CD 5096 O OE1 . GLN C 7 ? 1.1501 1.6110 1.3997 -0.0973 -0.0222 -0.2836 2 GLN E OE1 5097 N NE2 . GLN C 7 ? 1.0684 1.5477 1.3273 -0.1045 -0.0236 -0.2985 2 GLN E NE2 5098 N N . ILE C 8 ? 0.9840 1.4756 1.2170 -0.0811 -0.0240 -0.2611 3 ILE E N 5099 C CA . ILE C 8 ? 0.9130 1.3911 1.1424 -0.0791 -0.0227 -0.2523 3 ILE E CA 5100 C C . ILE C 8 ? 0.9080 1.3675 1.1353 -0.0788 -0.0217 -0.2496 3 ILE E C 5101 O O . ILE C 8 ? 0.9186 1.3773 1.1429 -0.0764 -0.0227 -0.2508 3 ILE E O 5102 C CB . ILE C 8 ? 0.7673 1.2522 0.9897 -0.0723 -0.0237 -0.2454 3 ILE E CB 5103 C CG1 . ILE C 8 ? 0.7848 1.2584 1.0054 -0.0715 -0.0222 -0.2379 3 ILE E CG1 5104 C CG2 . ILE C 8 ? 0.7256 1.2103 0.9408 -0.0666 -0.0252 -0.2426 3 ILE E CG2 5105 C CD1 . ILE C 8 ? 0.7869 1.2679 1.0016 -0.0656 -0.0232 -0.2319 3 ILE E CD1 5106 N N . CYS C 9 ? 0.9212 1.3665 1.1502 -0.0815 -0.0199 -0.2461 4 CYS E N 5107 C CA . CYS C 9 ? 1.0275 1.4550 1.2549 -0.0814 -0.0188 -0.2432 4 CYS E CA 5108 C C . CYS C 9 ? 1.0414 1.4586 1.2633 -0.0778 -0.0180 -0.2337 4 CYS E C 5109 O O . CYS C 9 ? 1.1478 1.5683 1.3695 -0.0774 -0.0176 -0.2302 4 CYS E O 5110 C CB . CYS C 9 ? 1.0550 1.4725 1.2895 -0.0881 -0.0173 -0.2476 4 CYS E CB 5111 S SG . CYS C 9 ? 1.1192 1.5462 1.3605 -0.0931 -0.0182 -0.2593 4 CYS E SG 5112 N N . ILE C 10 ? 0.9579 1.3627 1.1754 -0.0752 -0.0178 -0.2297 5 ILE E N 5113 C CA . ILE C 10 ? 0.7994 1.1918 1.0122 -0.0725 -0.0168 -0.2212 5 ILE E CA 5114 C C . ILE C 10 ? 0.7302 1.1062 0.9463 -0.0763 -0.0150 -0.2208 5 ILE E C 5115 O O . ILE C 10 ? 0.7112 1.0822 0.9293 -0.0780 -0.0149 -0.2248 5 ILE E O 5116 C CB . ILE C 10 ? 0.8258 1.2167 1.0304 -0.0664 -0.0181 -0.2161 5 ILE E CB 5117 C CG1 . ILE C 10 ? 0.7942 1.1982 0.9943 -0.0620 -0.0197 -0.2135 5 ILE E CG1 5118 C CG2 . ILE C 10 ? 0.9334 1.3079 1.1339 -0.0648 -0.0170 -0.2086 5 ILE E CG2 5119 C CD1 . ILE C 10 ? 0.8120 1.2327 1.0136 -0.0617 -0.0213 -0.2199 5 ILE E CD1 5120 N N . GLY C 11 ? 0.7675 1.1354 0.9840 -0.0775 -0.0135 -0.2158 6 GLY E N 5121 C CA . GLY C 11 ? 0.7576 1.1103 0.9777 -0.0815 -0.0116 -0.2151 6 GLY E CA 5122 C C . GLY C 11 ? 0.7334 1.0757 0.9507 -0.0803 -0.0102 -0.2072 6 GLY E C 5123 O O . GLY C 11 ? 0.5892 0.9346 0.8010 -0.0758 -0.0107 -0.2017 6 GLY E O 5124 N N . TYR C 12 ? 0.7329 1.0629 0.9540 -0.0843 -0.0084 -0.2065 7 TYR E N 5125 C CA . TYR C 12 ? 0.7463 1.0653 0.9648 -0.0834 -0.0070 -0.1991 7 TYR E CA 5126 C C . TYR C 12 ? 0.7514 1.0629 0.9761 -0.0892 -0.0050 -0.1996 7 TYR E C 5127 O O . TYR C 12 ? 0.8311 1.1422 1.0617 -0.0940 -0.0047 -0.2056 7 TYR E O 5128 C CB . TYR C 12 ? 0.7796 1.0866 0.9926 -0.0797 -0.0071 -0.1947 7 TYR E CB 5129 C CG . TYR C 12 ? 0.7622 1.0605 0.9780 -0.0820 -0.0067 -0.1987 7 TYR E CG 5130 C CD1 . TYR C 12 ? 0.7298 1.0340 0.9453 -0.0807 -0.0082 -0.2039 7 TYR E CD1 5131 C CD2 . TYR C 12 ? 0.8294 1.1135 1.0479 -0.0849 -0.0050 -0.1971 7 TYR E CD2 5132 C CE1 . TYR C 12 ? 0.7439 1.0404 0.9618 -0.0824 -0.0080 -0.2077 7 TYR E CE1 5133 C CE2 . TYR C 12 ? 0.8481 1.1240 1.0690 -0.0865 -0.0048 -0.2006 7 TYR E CE2 5134 C CZ . TYR C 12 ? 0.7954 1.0776 1.0160 -0.0851 -0.0063 -0.2061 7 TYR E CZ 5135 O OH . TYR C 12 ? 0.8071 1.0812 1.0300 -0.0863 -0.0061 -0.2098 7 TYR E OH 5136 N N . HIS C 13 ? 0.7469 1.0518 0.9697 -0.0885 -0.0038 -0.1931 8 HIS E N 5137 C CA . HIS C 13 ? 0.7319 1.0309 0.9599 -0.0937 -0.0018 -0.1923 8 HIS E CA 5138 C C . HIS C 13 ? 0.6910 0.9765 0.9227 -0.0976 -0.0008 -0.1942 8 HIS E C 5139 O O . HIS C 13 ? 0.7061 0.9829 0.9348 -0.0950 -0.0011 -0.1934 8 HIS E O 5140 C CB . HIS C 13 ? 0.7825 1.0766 1.0063 -0.0911 -0.0008 -0.1843 8 HIS E CB 5141 C CG . HIS C 13 ? 0.9022 1.1909 1.1307 -0.0960 0.0011 -0.1824 8 HIS E CG 5142 N ND1 . HIS C 13 ? 0.9153 1.2142 1.1482 -0.0996 0.0017 -0.1841 8 HIS E ND1 5143 C CD2 . HIS C 13 ? 1.0057 1.2802 1.2349 -0.0979 0.0028 -0.1785 8 HIS E CD2 5144 C CE1 . HIS C 13 ? 0.9874 1.2785 1.2235 -0.1036 0.0036 -0.1813 8 HIS E CE1 5145 N NE2 . HIS C 13 ? 0.9881 1.2643 1.2220 -0.1026 0.0043 -0.1779 8 HIS E NE2 5146 N N . ALA C 14 ? 0.6270 0.9105 0.8651 -0.1037 0.0004 -0.1963 9 ALA E N 5147 C CA . ALA C 14 ? 0.6594 0.9283 0.9011 -0.1076 0.0017 -0.1970 9 ALA E CA 5148 C C . ALA C 14 ? 0.6683 0.9340 0.9148 -0.1131 0.0036 -0.1950 9 ALA E C 5149 O O . ALA C 14 ? 0.6917 0.9685 0.9400 -0.1149 0.0037 -0.1953 9 ALA E O 5150 C CB . ALA C 14 ? 0.6321 0.9018 0.8777 -0.1101 0.0008 -0.2051 9 ALA E CB 5151 N N . ASN C 15 ? 0.6735 0.9243 0.9218 -0.1158 0.0050 -0.1928 10 ASN E N 5152 C CA . ASN C 15 ? 0.7216 0.9681 0.9741 -0.1211 0.0068 -0.1902 10 ASN E CA 5153 C C . ASN C 15 ? 0.7711 1.0017 1.0270 -0.1250 0.0079 -0.1908 10 ASN E C 5154 O O . ASN C 15 ? 0.8121 1.0372 1.0678 -0.1239 0.0070 -0.1946 10 ASN E O 5155 C CB . ASN C 15 ? 0.7576 1.0044 1.0060 -0.1182 0.0078 -0.1823 10 ASN E CB 5156 C CG . ASN C 15 ? 0.8218 1.0564 1.0644 -0.1132 0.0081 -0.1764 10 ASN E CG 5157 O OD1 . ASN C 15 ? 0.8622 1.0866 1.1044 -0.1125 0.0079 -0.1776 10 ASN E OD1 5158 N ND2 . ASN C 15 ? 0.8392 1.0749 1.0772 -0.1097 0.0086 -0.1701 10 ASN E ND2 5159 N N . ASN C 16 ? 0.8510 1.0746 1.1100 -0.1295 0.0097 -0.1873 11 ASN E N 5160 C CA . ASN C 16 ? 0.9749 1.1828 1.2372 -0.1333 0.0106 -0.1877 11 ASN E CA 5161 C C . ASN C 16 ? 0.9980 1.1927 1.2565 -0.1304 0.0120 -0.1798 11 ASN E C 5162 O O . ASN C 16 ? 0.9221 1.1046 1.1832 -0.1340 0.0133 -0.1777 11 ASN E O 5163 C CB . ASN C 16 ? 1.0875 1.2950 1.3572 -0.1417 0.0115 -0.1911 11 ASN E CB 5164 C CG . ASN C 16 ? 1.1027 1.3214 1.3744 -0.1449 0.0124 -0.1885 11 ASN E CG 5165 O OD1 . ASN C 16 ? 1.2170 1.4375 1.4849 -0.1418 0.0132 -0.1820 11 ASN E OD1 5166 N ND2 . ASN C 16 ? 1.0517 1.2778 1.3292 -0.1513 0.0123 -0.1937 11 ASN E ND2 5167 N N . SER C 17 ? 1.0178 1.2149 1.2699 -0.1239 0.0115 -0.1756 12 SER E N 5168 C CA . SER C 17 ? 0.9278 1.1127 1.1754 -0.1201 0.0123 -0.1692 12 SER E CA 5169 C C . SER C 17 ? 0.8258 0.9990 1.0736 -0.1193 0.0118 -0.1718 12 SER E C 5170 O O . SER C 17 ? 0.7333 0.9103 0.9810 -0.1177 0.0103 -0.1775 12 SER E O 5171 C CB . SER C 17 ? 0.8862 1.0768 1.1266 -0.1133 0.0115 -0.1650 12 SER E CB 5172 O OG . SER C 17 ? 0.7551 0.9352 0.9910 -0.1090 0.0114 -0.1616 12 SER E OG 5173 N N . THR C 18 ? 0.8823 1.0417 1.1303 -0.1200 0.0131 -0.1675 13 THR E N 5174 C CA . THR C 18 ? 0.9375 1.0847 1.1848 -0.1182 0.0129 -0.1687 13 THR E CA 5175 C C . THR C 18 ? 0.9071 1.0486 1.1478 -0.1120 0.0129 -0.1627 13 THR E C 5176 O O . THR C 18 ? 0.9608 1.0932 1.2004 -0.1098 0.0126 -0.1634 13 THR E O 5177 C CB . THR C 18 ? 0.9753 1.1095 1.2274 -0.1233 0.0142 -0.1682 13 THR E CB 5178 O OG1 . THR C 18 ? 0.9202 1.0538 1.1732 -0.1262 0.0159 -0.1623 13 THR E OG1 5179 C CG2 . THR C 18 ? 0.9829 1.1184 1.2411 -0.1285 0.0135 -0.1763 13 THR E CG2 5180 N N . GLU C 19 ? 0.8507 0.9975 1.0871 -0.1093 0.0132 -0.1572 14 GLU E N 5181 C CA . GLU C 19 ? 0.8497 0.9928 1.0796 -0.1036 0.0131 -0.1516 14 GLU E CA 5182 C C . GLU C 19 ? 0.8014 0.9438 1.0285 -0.0997 0.0116 -0.1551 14 GLU E C 5183 O O . GLU C 19 ? 0.8359 0.9875 1.0634 -0.0991 0.0101 -0.1605 14 GLU E O 5184 C CB . GLU C 19 ? 0.9332 1.0862 1.1586 -0.1007 0.0128 -0.1478 14 GLU E CB 5185 C CG . GLU C 19 ? 1.0942 1.2475 1.3205 -0.1032 0.0144 -0.1428 14 GLU E CG 5186 C CD . GLU C 19 ? 1.3103 1.4511 1.5351 -0.1027 0.0160 -0.1363 14 GLU E CD 5187 O OE1 . GLU C 19 ? 1.3793 1.5151 1.5987 -0.0981 0.0156 -0.1326 14 GLU E OE1 5188 O OE2 . GLU C 19 ? 1.4471 1.5834 1.6761 -0.1073 0.0175 -0.1346 14 GLU E OE2 5189 N N . GLN C 20 ? 0.8210 0.9531 1.0454 -0.0969 0.0119 -0.1517 15 GLN E N 5190 C CA . GLN C 20 ? 0.7573 0.8880 0.9788 -0.0929 0.0106 -0.1542 15 GLN E CA 5191 C C . GLN C 20 ? 0.7031 0.8323 0.9175 -0.0878 0.0105 -0.1479 15 GLN E C 5192 O O . GLN C 20 ? 0.6116 0.7370 0.8239 -0.0875 0.0116 -0.1417 15 GLN E O 5193 C CB . GLN C 20 ? 0.7624 0.8814 0.9872 -0.0942 0.0111 -0.1565 15 GLN E CB 5194 C CG . GLN C 20 ? 0.9141 1.0356 1.1444 -0.0976 0.0104 -0.1647 15 GLN E CG 5195 C CD . GLN C 20 ? 0.9978 1.1067 1.2312 -0.0986 0.0107 -0.1671 15 GLN E CD 5196 O OE1 . GLN C 20 ? 1.0528 1.1579 1.2837 -0.0947 0.0101 -0.1678 15 GLN E OE1 5197 N NE2 . GLN C 20 ? 1.0319 1.1342 1.2707 -0.1037 0.0117 -0.1682 15 GLN E NE2 5198 N N . VAL C 21 ? 0.6878 0.8202 0.8986 -0.0840 0.0090 -0.1498 16 VAL E N 5199 C CA . VAL C 21 ? 0.6056 0.7397 0.8094 -0.0794 0.0084 -0.1449 16 VAL E CA 5200 C C . VAL C 21 ? 0.6264 0.7593 0.8282 -0.0764 0.0073 -0.1474 16 VAL E C 5201 O O . VAL C 21 ? 0.6340 0.7705 0.8390 -0.0772 0.0065 -0.1540 16 VAL E O 5202 C CB . VAL C 21 ? 0.5854 0.7319 0.7867 -0.0784 0.0074 -0.1449 16 VAL E CB 5203 C CG1 . VAL C 21 ? 0.5477 0.7010 0.7441 -0.0744 0.0055 -0.1463 16 VAL E CG1 5204 C CG2 . VAL C 21 ? 0.5968 0.7427 0.7953 -0.0781 0.0082 -0.1385 16 VAL E CG2 5205 N N . ASP C 22 ? 0.5646 0.6925 0.7614 -0.0730 0.0073 -0.1425 17 ASP E N 5206 C CA . ASP C 22 ? 0.5494 0.6779 0.7438 -0.0699 0.0062 -0.1447 17 ASP E CA 5207 C C . ASP C 22 ? 0.5257 0.6631 0.7140 -0.0667 0.0048 -0.1428 17 ASP E C 5208 O O . ASP C 22 ? 0.4941 0.6337 0.6789 -0.0662 0.0048 -0.1382 17 ASP E O 5209 C CB . ASP C 22 ? 0.6317 0.7492 0.8249 -0.0683 0.0071 -0.1411 17 ASP E CB 5210 C CG . ASP C 22 ? 0.7352 0.8435 0.9344 -0.0710 0.0082 -0.1438 17 ASP E CG 5211 O OD1 . ASP C 22 ? 0.8999 1.0098 1.1043 -0.0744 0.0083 -0.1485 17 ASP E OD1 5212 O OD2 . ASP C 22 ? 0.9390 1.0381 1.1375 -0.0696 0.0089 -0.1410 17 ASP E OD2 5213 N N . THR C 23 ? 0.4987 0.6407 0.6854 -0.0646 0.0035 -0.1462 18 THR E N 5214 C CA . THR C 23 ? 0.5441 0.6943 0.7250 -0.0616 0.0019 -0.1450 18 THR E CA 5215 C C . THR C 23 ? 0.6018 0.7483 0.7796 -0.0588 0.0016 -0.1438 18 THR E C 5216 O O . THR C 23 ? 0.6031 0.7428 0.7842 -0.0591 0.0023 -0.1457 18 THR E O 5217 C CB . THR C 23 ? 0.5861 0.7477 0.7694 -0.0623 0.0006 -0.1517 18 THR E CB 5218 O OG1 . THR C 23 ? 0.6565 0.8238 0.8402 -0.0637 0.0006 -0.1511 18 THR E OG1 5219 C CG2 . THR C 23 ? 0.5488 0.7184 0.7276 -0.0593 -0.0009 -0.1529 18 THR E CG2 5220 N N . ILE C 24 ? 0.5951 0.7461 0.7667 -0.0560 0.0004 -0.1407 19 ILE E N 5221 C CA . ILE C 24 ? 0.6565 0.8053 0.8253 -0.0536 0.0000 -0.1399 19 ILE E CA 5222 C C . ILE C 24 ? 0.6906 0.8439 0.8628 -0.0532 -0.0005 -0.1471 19 ILE E C 5223 O O . ILE C 24 ? 0.7422 0.8914 0.9146 -0.0517 -0.0003 -0.1478 19 ILE E O 5224 C CB . ILE C 24 ? 0.7039 0.8565 0.8651 -0.0511 -0.0010 -0.1347 19 ILE E CB 5225 C CG1 . ILE C 24 ? 0.7484 0.8949 0.9065 -0.0493 -0.0007 -0.1310 19 ILE E CG1 5226 C CG2 . ILE C 24 ? 0.7442 0.9083 0.9033 -0.0499 -0.0028 -0.1381 19 ILE E CG2 5227 C CD1 . ILE C 24 ? 0.8170 0.9642 0.9676 -0.0476 -0.0015 -0.1246 19 ILE E CD1 5228 N N . MET C 25 ? 0.7040 0.8659 0.8788 -0.0542 -0.0013 -0.1526 20 MET E N 5229 C CA . MET C 25 ? 0.6805 0.8470 0.8589 -0.0541 -0.0020 -0.1601 20 MET E CA 5230 C C . MET C 25 ? 0.6107 0.7738 0.7964 -0.0570 -0.0012 -0.1659 20 MET E C 5231 O O . MET C 25 ? 0.6354 0.8003 0.8241 -0.0567 -0.0017 -0.1721 20 MET E O 5232 C CB . MET C 25 ? 0.6714 0.8512 0.8473 -0.0530 -0.0037 -0.1628 20 MET E CB 5233 C CG . MET C 25 ? 0.6537 0.8368 0.8225 -0.0501 -0.0046 -0.1578 20 MET E CG 5234 S SD . MET C 25 ? 0.7056 0.9032 0.8722 -0.0483 -0.0066 -0.1625 20 MET E SD 5235 C CE . MET C 25 ? 0.7149 0.9202 0.8827 -0.0501 -0.0072 -0.1639 20 MET E CE 5236 N N . GLU C 26 ? 0.6205 0.7787 0.8088 -0.0598 -0.0001 -0.1641 21 GLU E N 5237 C CA . GLU C 26 ? 0.6104 0.7651 0.8056 -0.0632 0.0005 -0.1693 21 GLU E CA 5238 C C . GLU C 26 ? 0.6150 0.7585 0.8124 -0.0655 0.0022 -0.1649 21 GLU E C 5239 O O . GLU C 26 ? 0.6432 0.7858 0.8377 -0.0657 0.0028 -0.1590 21 GLU E O 5240 C CB . GLU C 26 ? 0.6713 0.8363 0.8688 -0.0654 -0.0001 -0.1734 21 GLU E CB 5241 C CG . GLU C 26 ? 0.7173 0.8948 0.9133 -0.0636 -0.0019 -0.1783 21 GLU E CG 5242 C CD . GLU C 26 ? 0.8149 1.0031 1.0128 -0.0657 -0.0026 -0.1818 21 GLU E CD 5243 O OE1 . GLU C 26 ? 0.7111 0.8986 0.9150 -0.0692 -0.0022 -0.1867 21 GLU E OE1 5244 O OE2 . GLU C 26 ? 0.8269 1.0243 1.0204 -0.0639 -0.0037 -0.1797 21 GLU E OE2 5245 N N . LYS C 27 ? 0.6249 0.7601 0.8274 -0.0675 0.0031 -0.1681 22 LYS E N 5246 C CA . LYS C 27 ? 0.6271 0.7519 0.8325 -0.0703 0.0047 -0.1647 22 LYS E CA 5247 C C . LYS C 27 ? 0.6947 0.8204 0.9062 -0.0751 0.0051 -0.1690 22 LYS E C 5248 O O . LYS C 27 ? 0.7339 0.8661 0.9484 -0.0763 0.0042 -0.1759 22 LYS E O 5249 C CB . LYS C 27 ? 0.6904 0.8038 0.8971 -0.0692 0.0054 -0.1643 22 LYS E CB 5250 C CG . LYS C 27 ? 0.7815 0.8938 0.9825 -0.0648 0.0051 -0.1600 22 LYS E CG 5251 C CD . LYS C 27 ? 0.8707 0.9704 1.0730 -0.0640 0.0062 -0.1577 22 LYS E CD 5252 C CE . LYS C 27 ? 0.8721 0.9713 1.0695 -0.0596 0.0058 -0.1547 22 LYS E CE 5253 N NZ . LYS C 27 ? 0.9309 1.0200 1.1307 -0.0584 0.0064 -0.1560 22 LYS E NZ 5254 N N . ASN C 28 ? 0.7473 0.8667 0.9605 -0.0779 0.0066 -0.1648 23 ASN E N 5255 C CA . ASN C 28 ? 0.7928 0.9110 1.0121 -0.0831 0.0072 -0.1683 23 ASN E CA 5256 C C . ASN C 28 ? 0.7709 0.9025 0.9917 -0.0847 0.0061 -0.1734 23 ASN E C 5257 O O . ASN C 28 ? 0.7723 0.9058 0.9980 -0.0876 0.0057 -0.1800 23 ASN E O 5258 C CB . ASN C 28 ? 0.8157 0.9236 1.0397 -0.0847 0.0075 -0.1726 23 ASN E CB 5259 C CG . ASN C 28 ? 0.9723 1.0665 1.1959 -0.0841 0.0089 -0.1669 23 ASN E CG 5260 O OD1 . ASN C 28 ? 1.0651 1.1579 1.2847 -0.0824 0.0097 -0.1598 23 ASN E OD1 5261 N ND2 . ASN C 28 ? 1.1253 1.2091 1.3528 -0.0853 0.0092 -0.1701 23 ASN E ND2 5262 N N . VAL C 29 ? 0.6851 0.8258 0.9015 -0.0827 0.0055 -0.1701 24 VAL E N 5263 C CA . VAL C 29 ? 0.6215 0.7754 0.8385 -0.0837 0.0045 -0.1737 24 VAL E CA 5264 C C . VAL C 29 ? 0.6522 0.8082 0.8717 -0.0874 0.0055 -0.1715 24 VAL E C 5265 O O . VAL C 29 ? 0.7668 0.9215 0.9831 -0.0864 0.0062 -0.1649 24 VAL E O 5266 C CB . VAL C 29 ? 0.6046 0.7675 0.8151 -0.0792 0.0032 -0.1712 24 VAL E CB 5267 C CG1 . VAL C 29 ? 0.5892 0.7657 0.8000 -0.0800 0.0022 -0.1742 24 VAL E CG1 5268 C CG2 . VAL C 29 ? 0.6028 0.7657 0.8108 -0.0757 0.0021 -0.1737 24 VAL E CG2 5269 N N . THR C 30 ? 0.6879 0.8480 0.9130 -0.0916 0.0054 -0.1771 25 THR E N 5270 C CA . THR C 30 ? 0.6913 0.8543 0.9194 -0.0957 0.0064 -0.1756 25 THR E CA 5271 C C . THR C 30 ? 0.6348 0.8112 0.8595 -0.0936 0.0055 -0.1743 25 THR E C 5272 O O . THR C 30 ? 0.6571 0.8432 0.8803 -0.0915 0.0040 -0.1783 25 THR E O 5273 C CB . THR C 30 ? 0.7388 0.9026 0.9742 -0.1013 0.0065 -0.1824 25 THR E CB 5274 O OG1 . THR C 30 ? 0.7333 0.8845 0.9713 -0.1025 0.0070 -0.1844 25 THR E OG1 5275 C CG2 . THR C 30 ? 0.7676 0.9327 1.0064 -0.1060 0.0078 -0.1800 25 THR E CG2 5276 N N . VAL C 31 ? 0.5698 0.7467 0.7932 -0.0941 0.0065 -0.1687 26 VAL E N 5277 C CA . VAL C 31 ? 0.5598 0.7484 0.7797 -0.0917 0.0057 -0.1670 26 VAL E CA 5278 C C . VAL C 31 ? 0.5707 0.7644 0.7941 -0.0955 0.0067 -0.1661 26 VAL E C 5279 O O . VAL C 31 ? 0.6572 0.8445 0.8851 -0.1000 0.0081 -0.1658 26 VAL E O 5280 C CB . VAL C 31 ? 0.5728 0.7587 0.7852 -0.0864 0.0055 -0.1600 26 VAL E CB 5281 C CG1 . VAL C 31 ? 0.5750 0.7578 0.7838 -0.0829 0.0044 -0.1610 26 VAL E CG1 5282 C CG2 . VAL C 31 ? 0.5432 0.7186 0.7549 -0.0872 0.0073 -0.1534 26 VAL E CG2 5283 N N . THR C 32 ? 0.6149 0.8201 0.8355 -0.0934 0.0058 -0.1655 27 THR E N 5284 C CA . THR C 32 ? 0.7059 0.9201 0.9296 -0.0962 0.0063 -0.1659 27 THR E CA 5285 C C . THR C 32 ? 0.7862 0.9954 1.0083 -0.0961 0.0079 -0.1587 27 THR E C 5286 O O . THR C 32 ? 0.6623 0.8715 0.8888 -0.1006 0.0092 -0.1583 27 THR E O 5287 C CB . THR C 32 ? 0.7207 0.9495 0.9416 -0.0930 0.0045 -0.1683 27 THR E CB 5288 O OG1 . THR C 32 ? 0.9605 1.1980 1.1868 -0.0967 0.0038 -0.1757 27 THR E OG1 5289 C CG2 . THR C 32 ? 0.7823 1.0183 1.0002 -0.0909 0.0045 -0.1640 27 THR E CG2 5290 N N . HIS C 33 ? 0.8226 1.0277 1.0380 -0.0911 0.0076 -0.1532 28 HIS E N 5291 C CA . HIS C 33 ? 0.8268 1.0266 1.0394 -0.0899 0.0088 -0.1462 28 HIS E CA 5292 C C . HIS C 33 ? 0.7770 0.9658 0.9842 -0.0861 0.0088 -0.1418 28 HIS E C 5293 O O . HIS C 33 ? 0.6814 0.8702 0.8854 -0.0831 0.0074 -0.1433 28 HIS E O 5294 C CB . HIS C 33 ? 0.8858 1.0961 1.0946 -0.0868 0.0082 -0.1438 28 HIS E CB 5295 C CG . HIS C 33 ? 1.0072 1.2308 1.2203 -0.0895 0.0079 -0.1483 28 HIS E CG 5296 N ND1 . HIS C 33 ? 0.9801 1.2157 1.1912 -0.0867 0.0061 -0.1514 28 HIS E ND1 5297 C CD2 . HIS C 33 ? 1.0334 1.2606 1.2528 -0.0949 0.0091 -0.1502 28 HIS E CD2 5298 C CE1 . HIS C 33 ? 0.9534 1.1996 1.1693 -0.0901 0.0062 -0.1551 28 HIS E CE1 5299 N NE2 . HIS C 33 ? 1.0029 1.2443 1.2240 -0.0952 0.0081 -0.1545 28 HIS E NE2 5300 N N . ALA C 34 ? 0.7534 0.9333 0.9596 -0.0864 0.0103 -0.1362 29 ALA E N 5301 C CA . ALA C 34 ? 0.6688 0.8381 0.8702 -0.0832 0.0104 -0.1317 29 ALA E CA 5302 C C . ALA C 34 ? 0.6762 0.8406 0.8751 -0.0825 0.0117 -0.1250 29 ALA E C 5303 O O . ALA C 34 ? 0.5691 0.7354 0.7717 -0.0858 0.0130 -0.1240 29 ALA E O 5304 C CB . ALA C 34 ? 0.6469 0.8063 0.8517 -0.0855 0.0110 -0.1337 29 ALA E CB 5305 N N . GLN C 35 ? 0.6512 0.8097 0.8441 -0.0785 0.0113 -0.1205 30 GLN E N 5306 C CA . GLN C 35 ? 0.6661 0.8195 0.8559 -0.0773 0.0124 -0.1140 30 GLN E CA 5307 C C . GLN C 35 ? 0.6705 0.8118 0.8574 -0.0758 0.0129 -0.1103 30 GLN E C 5308 O O . GLN C 35 ? 0.5975 0.7370 0.7801 -0.0726 0.0116 -0.1102 30 GLN E O 5309 C CB . GLN C 35 ? 0.7252 0.8854 0.9090 -0.0731 0.0113 -0.1117 30 GLN E CB 5310 C CG . GLN C 35 ? 0.8452 1.0078 1.0290 -0.0735 0.0124 -0.1080 30 GLN E CG 5311 C CD . GLN C 35 ? 0.9384 1.1055 1.1155 -0.0687 0.0112 -0.1052 30 GLN E CD 5312 O OE1 . GLN C 35 ? 1.0080 1.1838 1.1833 -0.0666 0.0096 -0.1079 30 GLN E OE1 5313 N NE2 . GLN C 35 ? 1.0295 1.1906 1.2025 -0.0667 0.0118 -0.0997 30 GLN E NE2 5314 N N . ASP C 36 ? 0.6622 0.7961 0.8516 -0.0782 0.0148 -0.1070 31 ASP E N 5315 C CA . ASP C 36 ? 0.6796 0.8022 0.8667 -0.0771 0.0154 -0.1029 31 ASP E CA 5316 C C . ASP C 36 ? 0.6269 0.7481 0.8077 -0.0736 0.0154 -0.0970 31 ASP E C 5317 O O . ASP C 36 ? 0.5910 0.7153 0.7717 -0.0741 0.0162 -0.0945 31 ASP E O 5318 C CB . ASP C 36 ? 0.6802 0.7952 0.8728 -0.0812 0.0174 -0.1019 31 ASP E CB 5319 C CG . ASP C 36 ? 0.7616 0.8654 0.9531 -0.0801 0.0178 -0.0999 31 ASP E CG 5320 O OD1 . ASP C 36 ? 0.6724 0.7735 0.8582 -0.0763 0.0171 -0.0968 31 ASP E OD1 5321 O OD2 . ASP C 36 ? 0.9209 1.0187 1.1174 -0.0832 0.0187 -0.1016 31 ASP E OD2 5322 N N . ILE C 37 ? 0.5875 0.7045 0.7628 -0.0700 0.0144 -0.0950 32 ILE E N 5323 C CA . ILE C 37 ? 0.5604 0.6755 0.7290 -0.0666 0.0141 -0.0896 32 ILE E CA 5324 C C . ILE C 37 ? 0.5836 0.6886 0.7512 -0.0665 0.0154 -0.0847 32 ILE E C 5325 O O . ILE C 37 ? 0.6576 0.7598 0.8194 -0.0637 0.0151 -0.0805 32 ILE E O 5326 C CB . ILE C 37 ? 0.5033 0.6213 0.6655 -0.0625 0.0120 -0.0898 32 ILE E CB 5327 C CG1 . ILE C 37 ? 0.4956 0.6093 0.6574 -0.0620 0.0113 -0.0916 32 ILE E CG1 5328 C CG2 . ILE C 37 ? 0.5217 0.6502 0.6840 -0.0619 0.0107 -0.0934 32 ILE E CG2 5329 C CD1 . ILE C 37 ? 0.5538 0.6697 0.7089 -0.0583 0.0093 -0.0910 32 ILE E CD1 5330 N N . LEU C 38 ? 0.5620 0.6615 0.7349 -0.0697 0.0169 -0.0854 33 LEU E N 5331 C CA . LEU C 38 ? 0.5367 0.6268 0.7094 -0.0700 0.0182 -0.0810 33 LEU E CA 5332 C C . LEU C 38 ? 0.6008 0.6905 0.7767 -0.0728 0.0201 -0.0783 33 LEU E C 5333 O O . LEU C 38 ? 0.6937 0.7854 0.8754 -0.0765 0.0209 -0.0809 33 LEU E O 5334 C CB . LEU C 38 ? 0.5044 0.5880 0.6809 -0.0714 0.0185 -0.0834 33 LEU E CB 5335 C CG . LEU C 38 ? 0.5219 0.5954 0.6980 -0.0712 0.0198 -0.0790 33 LEU E CG 5336 C CD1 . LEU C 38 ? 0.5323 0.6035 0.7014 -0.0673 0.0191 -0.0746 33 LEU E CD1 5337 C CD2 . LEU C 38 ? 0.5234 0.5911 0.7035 -0.0723 0.0199 -0.0822 33 LEU E CD2 5338 N N . GLU C 39 ? 0.6416 0.7290 0.8134 -0.0710 0.0206 -0.0729 34 GLU E N 5339 C CA . GLU C 39 ? 0.5598 0.6463 0.7340 -0.0733 0.0225 -0.0694 34 GLU E CA 5340 C C . GLU C 39 ? 0.5653 0.6424 0.7431 -0.0757 0.0240 -0.0675 34 GLU E C 5341 O O . GLU C 39 ? 0.5118 0.5819 0.6868 -0.0737 0.0239 -0.0650 34 GLU E O 5342 C CB . GLU C 39 ? 0.5763 0.6637 0.7444 -0.0703 0.0225 -0.0645 34 GLU E CB 5343 C CG . GLU C 39 ? 0.6241 0.7126 0.7943 -0.0724 0.0243 -0.0611 34 GLU E CG 5344 C CD . GLU C 39 ? 0.6041 0.7007 0.7797 -0.0758 0.0248 -0.0644 34 GLU E CD 5345 O OE1 . GLU C 39 ? 0.5780 0.6724 0.7595 -0.0801 0.0264 -0.0646 34 GLU E OE1 5346 O OE2 . GLU C 39 ? 0.5692 0.6743 0.7431 -0.0742 0.0236 -0.0669 34 GLU E OE2 5347 N N . LYS C 40 ? 0.6206 0.6976 0.8046 -0.0801 0.0253 -0.0688 35 LYS E N 5348 C CA . LYS C 40 ? 0.6221 0.6901 0.8102 -0.0828 0.0268 -0.0673 35 LYS E CA 5349 C C . LYS C 40 ? 0.5542 0.6208 0.7445 -0.0856 0.0288 -0.0626 35 LYS E C 5350 O O . LYS C 40 ? 0.5390 0.5976 0.7320 -0.0877 0.0300 -0.0604 35 LYS E O 5351 C CB . LYS C 40 ? 0.6984 0.7660 0.8925 -0.0863 0.0266 -0.0730 35 LYS E CB 5352 C CG . LYS C 40 ? 0.8018 0.8667 0.9951 -0.0841 0.0251 -0.0771 35 LYS E CG 5353 C CD . LYS C 40 ? 0.8013 0.8703 0.9995 -0.0869 0.0244 -0.0838 35 LYS E CD 5354 C CE . LYS C 40 ? 0.8324 0.9129 1.0284 -0.0854 0.0231 -0.0863 35 LYS E CE 5355 N NZ . LYS C 40 ? 0.8841 0.9702 1.0829 -0.0865 0.0218 -0.0930 35 LYS E NZ 5356 N N . THR C 41 ? 0.5361 0.6105 0.7250 -0.0856 0.0291 -0.0611 36 THR E N 5357 C CA . THR C 41 ? 0.5598 0.6347 0.7513 -0.0888 0.0310 -0.0573 36 THR E CA 5358 C C . THR C 41 ? 0.5359 0.6119 0.7222 -0.0857 0.0315 -0.0518 36 THR E C 5359 O O . THR C 41 ? 0.4996 0.5788 0.6802 -0.0815 0.0302 -0.0517 36 THR E O 5360 C CB . THR C 41 ? 0.5533 0.6382 0.7489 -0.0922 0.0314 -0.0600 36 THR E CB 5361 O OG1 . THR C 41 ? 0.5709 0.6647 0.7619 -0.0889 0.0306 -0.0595 36 THR E OG1 5362 C CG2 . THR C 41 ? 0.5678 0.6545 0.7674 -0.0944 0.0303 -0.0665 36 THR E CG2 5363 N N . HIS C 42 ? 0.5687 0.6420 0.7569 -0.0882 0.0334 -0.0474 37 HIS E N 5364 C CA . HIS C 42 ? 0.5683 0.6430 0.7525 -0.0862 0.0341 -0.0421 37 HIS E CA 5365 C C . HIS C 42 ? 0.5579 0.6352 0.7464 -0.0905 0.0362 -0.0392 37 HIS E C 5366 O O . HIS C 42 ? 0.5763 0.6507 0.7706 -0.0953 0.0372 -0.0401 37 HIS E O 5367 C CB . HIS C 42 ? 0.6006 0.6657 0.7813 -0.0835 0.0342 -0.0383 37 HIS E CB 5368 C CG . HIS C 42 ? 0.5785 0.6345 0.7636 -0.0866 0.0354 -0.0370 37 HIS E CG 5369 N ND1 . HIS C 42 ? 0.5662 0.6194 0.7536 -0.0894 0.0374 -0.0322 37 HIS E ND1 5370 C CD2 . HIS C 42 ? 0.5796 0.6286 0.7671 -0.0873 0.0349 -0.0398 37 HIS E CD2 5371 C CE1 . HIS C 42 ? 0.6107 0.6548 0.8016 -0.0915 0.0379 -0.0319 37 HIS E CE1 5372 N NE2 . HIS C 42 ? 0.6325 0.6739 0.8236 -0.0901 0.0364 -0.0366 37 HIS E NE2 5373 N N . ASN C 43 ? 0.5562 0.6382 0.7414 -0.0889 0.0369 -0.0353 38 ASN E N 5374 C CA . ASN C 43 ? 0.5838 0.6707 0.7723 -0.0925 0.0388 -0.0324 38 ASN E CA 5375 C C . ASN C 43 ? 0.5878 0.6669 0.7781 -0.0950 0.0407 -0.0268 38 ASN E C 5376 O O . ASN C 43 ? 0.5394 0.6226 0.7318 -0.0978 0.0424 -0.0236 38 ASN E O 5377 C CB . ASN C 43 ? 0.5757 0.6721 0.7599 -0.0894 0.0387 -0.0310 38 ASN E CB 5378 C CG . ASN C 43 ? 0.6029 0.6953 0.7815 -0.0856 0.0389 -0.0260 38 ASN E CG 5379 O OD1 . ASN C 43 ? 0.6247 0.7076 0.8025 -0.0853 0.0392 -0.0234 38 ASN E OD1 5380 N ND2 . ASN C 43 ? 0.6024 0.7021 0.7768 -0.0825 0.0386 -0.0249 38 ASN E ND2 5381 N N . GLY C 44 ? 0.6098 0.6782 0.7990 -0.0937 0.0405 -0.0256 39 GLY E N 5382 C CA . GLY C 44 ? 0.5984 0.6587 0.7894 -0.0958 0.0421 -0.0205 39 GLY E CA 5383 C C . GLY C 44 ? 0.6068 0.6684 0.7940 -0.0939 0.0433 -0.0143 39 GLY E C 5384 O O . GLY C 44 ? 0.6575 0.7134 0.8461 -0.0958 0.0448 -0.0096 39 GLY E O 5385 N N . LYS C 45 ? 0.6131 0.6819 0.7951 -0.0901 0.0425 -0.0142 40 LYS E N 5386 C CA . LYS C 45 ? 0.6521 0.7240 0.8308 -0.0885 0.0436 -0.0089 40 LYS E CA 5387 C C . LYS C 45 ? 0.6116 0.6825 0.7829 -0.0827 0.0423 -0.0079 40 LYS E C 5388 O O . LYS C 45 ? 0.6084 0.6785 0.7767 -0.0796 0.0404 -0.0116 40 LYS E O 5389 C CB . LYS C 45 ? 0.7933 0.8769 0.9736 -0.0904 0.0444 -0.0092 40 LYS E CB 5390 C CG . LYS C 45 ? 0.9381 1.0224 1.1257 -0.0969 0.0461 -0.0087 40 LYS E CG 5391 C CD . LYS C 45 ? 1.1844 1.2814 1.3740 -0.0991 0.0470 -0.0089 40 LYS E CD 5392 C CE . LYS C 45 ? 1.3566 1.4607 1.5478 -0.0993 0.0456 -0.0153 40 LYS E CE 5393 N NZ . LYS C 45 ? 1.4146 1.5322 1.6068 -0.1003 0.0463 -0.0157 40 LYS E NZ 5394 N N . LEU C 46 ? 0.5813 0.6522 0.7495 -0.0813 0.0433 -0.0027 41 LEU E N 5395 C CA . LEU C 46 ? 0.5160 0.5877 0.6769 -0.0760 0.0422 -0.0016 41 LEU E CA 5396 C C . LEU C 46 ? 0.4340 0.5161 0.5923 -0.0743 0.0420 -0.0022 41 LEU E C 5397 O O . LEU C 46 ? 0.5227 0.6108 0.6830 -0.0763 0.0436 0.0003 41 LEU E O 5398 C CB . LEU C 46 ? 0.5474 0.6140 0.7059 -0.0750 0.0432 0.0040 41 LEU E CB 5399 C CG . LEU C 46 ? 0.5960 0.6518 0.7557 -0.0755 0.0434 0.0060 41 LEU E CG 5400 C CD1 . LEU C 46 ? 0.6143 0.6680 0.7709 -0.0740 0.0445 0.0119 41 LEU E CD1 5401 C CD2 . LEU C 46 ? 0.6090 0.6598 0.7662 -0.0728 0.0414 0.0023 41 LEU E CD2 5402 N N . CYS C 47 ? 0.4640 0.5482 0.6175 -0.0703 0.0400 -0.0053 42 CYS E N 5403 C CA . CYS C 47 ? 0.4725 0.5661 0.6232 -0.0680 0.0394 -0.0069 42 CYS E CA 5404 C C . CYS C 47 ? 0.4816 0.5747 0.6246 -0.0628 0.0381 -0.0058 42 CYS E C 5405 O O . CYS C 47 ? 0.4770 0.5626 0.6164 -0.0608 0.0372 -0.0046 42 CYS E O 5406 C CB . CYS C 47 ? 0.5703 0.6674 0.7223 -0.0678 0.0378 -0.0127 42 CYS E CB 5407 S SG . CYS C 47 ? 0.6016 0.6998 0.7627 -0.0739 0.0389 -0.0154 42 CYS E SG 5408 N N . ASP C 48 ? 0.4920 0.5937 0.6324 -0.0606 0.0378 -0.0064 43 ASP E N 5409 C CA . ASP C 48 ? 0.4576 0.5597 0.5904 -0.0553 0.0361 -0.0067 43 ASP E CA 5410 C C . ASP C 48 ? 0.4738 0.5718 0.6039 -0.0532 0.0337 -0.0107 43 ASP E C 5411 O O . ASP C 48 ? 0.4499 0.5489 0.5840 -0.0552 0.0333 -0.0141 43 ASP E O 5412 C CB . ASP C 48 ? 0.4866 0.5993 0.6177 -0.0531 0.0360 -0.0079 43 ASP E CB 5413 C CG . ASP C 48 ? 0.4697 0.5888 0.6035 -0.0551 0.0384 -0.0041 43 ASP E CG 5414 O OD1 . ASP C 48 ? 0.4150 0.5298 0.5513 -0.0581 0.0401 -0.0003 43 ASP E OD1 5415 O OD2 . ASP C 48 ? 0.5116 0.6404 0.6447 -0.0537 0.0386 -0.0050 43 ASP E OD2 5416 N N . LEU C 49 ? 0.4548 0.5489 0.5780 -0.0492 0.0320 -0.0103 44 LEU E N 5417 C CA . LEU C 49 ? 0.4894 0.5797 0.6092 -0.0470 0.0296 -0.0135 44 LEU E CA 5418 C C . LEU C 49 ? 0.4801 0.5749 0.5939 -0.0427 0.0279 -0.0152 44 LEU E C 5419 O O . LEU C 49 ? 0.4695 0.5629 0.5778 -0.0398 0.0275 -0.0131 44 LEU E O 5420 C CB . LEU C 49 ? 0.5526 0.6337 0.6686 -0.0461 0.0290 -0.0113 44 LEU E CB 5421 C CG . LEU C 49 ? 0.5475 0.6221 0.6648 -0.0473 0.0281 -0.0129 44 LEU E CG 5422 C CD1 . LEU C 49 ? 0.5558 0.6239 0.6664 -0.0446 0.0266 -0.0113 44 LEU E CD1 5423 C CD2 . LEU C 49 ? 0.5138 0.5912 0.6327 -0.0474 0.0267 -0.0178 44 LEU E CD2 5424 N N . ASN C 50 ? 0.4782 0.5782 0.5929 -0.0419 0.0268 -0.0192 45 ASN E N 5425 C CA . ASN C 50 ? 0.4988 0.6033 0.6080 -0.0375 0.0251 -0.0210 45 ASN E CA 5426 C C . ASN C 50 ? 0.4315 0.5419 0.5391 -0.0358 0.0262 -0.0188 45 ASN E C 5427 O O . ASN C 50 ? 0.3768 0.4863 0.4778 -0.0317 0.0249 -0.0181 45 ASN E O 5428 C CB . ASN C 50 ? 0.4852 0.5825 0.5870 -0.0340 0.0225 -0.0214 45 ASN E CB 5429 C CG . ASN C 50 ? 0.5499 0.6426 0.6532 -0.0355 0.0214 -0.0236 45 ASN E CG 5430 O OD1 . ASN C 50 ? 0.6107 0.7075 0.7173 -0.0365 0.0210 -0.0269 45 ASN E OD1 5431 N ND2 . ASN C 50 ? 0.6228 0.7073 0.7234 -0.0357 0.0209 -0.0219 45 ASN E ND2 5432 N N . GLY C 51 ? 0.4269 0.5431 0.5406 -0.0391 0.0285 -0.0175 46 GLY E N 5433 C CA . GLY C 51 ? 0.4699 0.5932 0.5829 -0.0380 0.0298 -0.0155 46 GLY E CA 5434 C C . GLY C 51 ? 0.5085 0.6280 0.6199 -0.0384 0.0311 -0.0109 46 GLY E C 5435 O O . GLY C 51 ? 0.5708 0.6969 0.6827 -0.0381 0.0326 -0.0090 46 GLY E O 5436 N N . VAL C 52 ? 0.5786 0.6884 0.6880 -0.0388 0.0307 -0.0090 47 VAL E N 5437 C CA . VAL C 52 ? 0.5358 0.6429 0.6441 -0.0393 0.0322 -0.0044 47 VAL E CA 5438 C C . VAL C 52 ? 0.5087 0.6110 0.6226 -0.0440 0.0341 -0.0015 47 VAL E C 5439 O O . VAL C 52 ? 0.5271 0.6231 0.6431 -0.0458 0.0336 -0.0026 47 VAL E O 5440 C CB . VAL C 52 ? 0.5683 0.6707 0.6682 -0.0349 0.0305 -0.0034 47 VAL E CB 5441 C CG1 . VAL C 52 ? 0.5449 0.6452 0.6393 -0.0312 0.0276 -0.0072 47 VAL E CG1 5442 C CG2 . VAL C 52 ? 0.6044 0.6987 0.7034 -0.0363 0.0310 0.0000 47 VAL E CG2 5443 N N . LYS C 53 ? 0.5001 0.6059 0.6164 -0.0458 0.0363 0.0021 48 LYS E N 5444 C CA . LYS C 53 ? 0.5973 0.6998 0.7194 -0.0504 0.0384 0.0053 48 LYS E CA 5445 C C . LYS C 53 ? 0.5817 0.6742 0.7014 -0.0500 0.0380 0.0078 48 LYS E C 5446 O O . LYS C 53 ? 0.5845 0.6746 0.6981 -0.0467 0.0370 0.0087 48 LYS E O 5447 C CB . LYS C 53 ? 0.6502 0.7601 0.7748 -0.0521 0.0408 0.0090 48 LYS E CB 5448 C CG . LYS C 53 ? 0.7178 0.8258 0.8493 -0.0575 0.0431 0.0121 48 LYS E CG 5449 C CD . LYS C 53 ? 0.8255 0.9410 0.9591 -0.0593 0.0455 0.0162 48 LYS E CD 5450 C CE . LYS C 53 ? 0.8722 0.9820 1.0091 -0.0628 0.0474 0.0214 48 LYS E CE 5451 N NZ . LYS C 53 ? 0.9189 1.0337 1.0625 -0.0679 0.0497 0.0238 48 LYS E NZ 5452 N N . PRO C 54 ? 0.5752 0.6619 0.6998 -0.0535 0.0389 0.0087 49 PRO E N 5453 C CA . PRO C 54 ? 0.5801 0.6585 0.7029 -0.0532 0.0390 0.0117 49 PRO E CA 5454 C C . PRO C 54 ? 0.5434 0.6228 0.6660 -0.0537 0.0409 0.0171 49 PRO E C 5455 O O . PRO C 54 ? 0.5677 0.6538 0.6931 -0.0554 0.0425 0.0188 49 PRO E O 5456 C CB . PRO C 54 ? 0.5536 0.6263 0.6823 -0.0566 0.0394 0.0108 49 PRO E CB 5457 C CG . PRO C 54 ? 0.5786 0.6573 0.7133 -0.0600 0.0407 0.0094 49 PRO E CG 5458 C CD . PRO C 54 ? 0.5672 0.6544 0.6989 -0.0576 0.0398 0.0068 49 PRO E CD 5459 N N . LEU C 55 ? 0.5199 0.5931 0.6393 -0.0524 0.0406 0.0198 50 LEU E N 5460 C CA . LEU C 55 ? 0.5158 0.5886 0.6354 -0.0531 0.0423 0.0252 50 LEU E CA 5461 C C . LEU C 55 ? 0.5836 0.6502 0.7089 -0.0565 0.0436 0.0270 50 LEU E C 5462 O O . LEU C 55 ? 0.5682 0.6275 0.6932 -0.0561 0.0426 0.0261 50 LEU E O 5463 C CB . LEU C 55 ? 0.5563 0.6255 0.6691 -0.0496 0.0412 0.0268 50 LEU E CB 5464 C CG . LEU C 55 ? 0.5422 0.6108 0.6546 -0.0499 0.0428 0.0325 50 LEU E CG 5465 C CD1 . LEU C 55 ? 0.5371 0.6142 0.6507 -0.0507 0.0445 0.0349 50 LEU E CD1 5466 C CD2 . LEU C 55 ? 0.5447 0.6105 0.6501 -0.0464 0.0413 0.0334 50 LEU E CD2 5467 N N . ILE C 56 ? 0.6483 0.7178 0.7789 -0.0601 0.0457 0.0296 51 ILE E N 5468 C CA . ILE C 56 ? 0.6426 0.7059 0.7791 -0.0637 0.0469 0.0313 51 ILE E CA 5469 C C . ILE C 56 ? 0.5803 0.6413 0.7167 -0.0641 0.0485 0.0374 51 ILE E C 5470 O O . ILE C 56 ? 0.5220 0.5888 0.6590 -0.0653 0.0501 0.0408 51 ILE E O 5471 C CB . ILE C 56 ? 0.6903 0.7577 0.8332 -0.0679 0.0481 0.0298 51 ILE E CB 5472 C CG1 . ILE C 56 ? 0.7060 0.7756 0.8489 -0.0672 0.0463 0.0235 51 ILE E CG1 5473 C CG2 . ILE C 56 ? 0.7065 0.7665 0.8552 -0.0718 0.0493 0.0316 51 ILE E CG2 5474 C CD1 . ILE C 56 ? 0.6936 0.7675 0.8427 -0.0713 0.0472 0.0212 51 ILE E CD1 5475 N N . LEU C 57 ? 0.5823 0.6352 0.7179 -0.0632 0.0481 0.0390 52 LEU E N 5476 C CA . LEU C 57 ? 0.6673 0.7181 0.8012 -0.0625 0.0493 0.0448 52 LEU E CA 5477 C C . LEU C 57 ? 0.7200 0.7668 0.8595 -0.0660 0.0513 0.0490 52 LEU E C 5478 O O . LEU C 57 ? 0.8484 0.8954 0.9870 -0.0659 0.0526 0.0544 52 LEU E O 5479 C CB . LEU C 57 ? 0.6084 0.6539 0.7375 -0.0589 0.0478 0.0448 52 LEU E CB 5480 C CG . LEU C 57 ? 0.5877 0.6377 0.7100 -0.0553 0.0461 0.0427 52 LEU E CG 5481 C CD1 . LEU C 57 ? 0.5680 0.6127 0.6858 -0.0524 0.0446 0.0428 52 LEU E CD1 5482 C CD2 . LEU C 57 ? 0.6026 0.6599 0.7223 -0.0545 0.0472 0.0460 52 LEU E CD2 5483 N N . LYS C 58 ? 0.7470 0.7901 0.8920 -0.0692 0.0515 0.0467 53 LYS E N 5484 C CA . LYS C 58 ? 0.8767 0.9162 1.0274 -0.0733 0.0534 0.0506 53 LYS E CA 5485 C C . LYS C 58 ? 0.8514 0.8817 1.0018 -0.0722 0.0537 0.0544 53 LYS E C 5486 O O . LYS C 58 ? 0.9350 0.9587 1.0851 -0.0706 0.0523 0.0517 53 LYS E O 5487 C CB . LYS C 58 ? 1.0002 1.0479 1.1518 -0.0756 0.0554 0.0547 53 LYS E CB 5488 C CG . LYS C 58 ? 1.0953 1.1531 1.2466 -0.0760 0.0551 0.0510 53 LYS E CG 5489 C CD . LYS C 58 ? 1.1844 1.2489 1.3403 -0.0806 0.0571 0.0534 53 LYS E CD 5490 C CE . LYS C 58 ? 1.2767 1.3487 1.4300 -0.0799 0.0586 0.0587 53 LYS E CE 5491 N NZ . LYS C 58 ? 1.2004 1.2748 1.3588 -0.0851 0.0610 0.0633 53 LYS E NZ 5492 N N . ASP C 59 ? 0.7822 0.8126 0.9325 -0.0727 0.0553 0.0607 54 ASP E N 5493 C CA . ASP C 59 ? 0.7618 0.7840 0.9116 -0.0712 0.0555 0.0647 54 ASP E CA 5494 C C . ASP C 59 ? 0.6946 0.7182 0.8379 -0.0664 0.0545 0.0662 54 ASP E C 5495 O O . ASP C 59 ? 0.6133 0.6323 0.7557 -0.0649 0.0549 0.0704 54 ASP E O 5496 C CB . ASP C 59 ? 0.8350 0.8556 0.9885 -0.0746 0.0577 0.0710 54 ASP E CB 5497 C CG . ASP C 59 ? 0.9659 0.9966 1.1179 -0.0756 0.0592 0.0748 54 ASP E CG 5498 O OD1 . ASP C 59 ? 1.0182 1.0571 1.1663 -0.0735 0.0584 0.0723 54 ASP E OD1 5499 O OD2 . ASP C 59 ? 1.2515 1.2819 1.4062 -0.0785 0.0610 0.0803 54 ASP E OD2 5500 N N . CYS C 60 ? 0.6222 0.6524 0.7610 -0.0641 0.0533 0.0631 55 CYS E N 5501 C CA . CYS C 60 ? 0.6510 0.6826 0.7834 -0.0599 0.0523 0.0640 55 CYS E CA 5502 C C . CYS C 60 ? 0.5767 0.6058 0.7061 -0.0573 0.0500 0.0587 55 CYS E C 5503 O O . CYS C 60 ? 0.5251 0.5549 0.6557 -0.0580 0.0490 0.0536 55 CYS E O 5504 C CB . CYS C 60 ? 0.6786 0.7194 0.8069 -0.0588 0.0526 0.0653 55 CYS E CB 5505 S SG . CYS C 60 ? 0.8607 0.9054 0.9918 -0.0615 0.0554 0.0724 55 CYS E SG 5506 N N . SER C 61 ? 0.5115 0.5378 0.6371 -0.0543 0.0491 0.0602 56 SER E N 5507 C CA . SER C 61 ? 0.4803 0.5056 0.6017 -0.0516 0.0469 0.0559 56 SER E CA 5508 C C . SER C 61 ? 0.4406 0.4729 0.5563 -0.0497 0.0460 0.0547 56 SER E C 5509 O O . SER C 61 ? 0.4193 0.4569 0.5337 -0.0499 0.0471 0.0579 56 SER E O 5510 C CB . SER C 61 ? 0.4473 0.4677 0.5668 -0.0493 0.0464 0.0582 56 SER E CB 5511 O OG . SER C 61 ? 0.4221 0.4463 0.5376 -0.0476 0.0469 0.0625 56 SER E OG 5512 N N . VAL C 62 ? 0.4331 0.4653 0.5450 -0.0479 0.0439 0.0502 57 VAL E N 5513 C CA . VAL C 62 ? 0.4078 0.4455 0.5136 -0.0458 0.0427 0.0489 57 VAL E CA 5514 C C . VAL C 62 ? 0.4323 0.4716 0.5341 -0.0440 0.0431 0.0535 57 VAL E C 5515 O O . VAL C 62 ? 0.5246 0.5694 0.6230 -0.0431 0.0433 0.0545 57 VAL E O 5516 C CB . VAL C 62 ? 0.3887 0.4244 0.4908 -0.0441 0.0402 0.0440 57 VAL E CB 5517 C CG1 . VAL C 62 ? 0.3962 0.4358 0.4912 -0.0418 0.0387 0.0430 57 VAL E CG1 5518 C CG2 . VAL C 62 ? 0.3800 0.4153 0.4857 -0.0458 0.0397 0.0394 57 VAL E CG2 5519 N N . ALA C 63 ? 0.4434 0.4783 0.5456 -0.0434 0.0433 0.0561 58 ALA E N 5520 C CA . ALA C 63 ? 0.4621 0.4989 0.5603 -0.0416 0.0436 0.0605 58 ALA E CA 5521 C C . ALA C 63 ? 0.4412 0.4821 0.5412 -0.0427 0.0458 0.0654 58 ALA E C 5522 O O . ALA C 63 ? 0.4078 0.4540 0.5037 -0.0413 0.0460 0.0674 58 ALA E O 5523 C CB . ALA C 63 ? 0.4360 0.4677 0.5343 -0.0405 0.0432 0.0623 58 ALA E CB 5524 N N . GLY C 64 ? 0.4463 0.4849 0.5525 -0.0452 0.0475 0.0672 59 GLY E N 5525 C CA . GLY C 64 ? 0.4717 0.5138 0.5802 -0.0468 0.0497 0.0722 59 GLY E CA 5526 C C . GLY C 64 ? 0.4745 0.5246 0.5818 -0.0474 0.0501 0.0709 59 GLY E C 5527 O O . GLY C 64 ? 0.4815 0.5374 0.5867 -0.0468 0.0511 0.0742 59 GLY E O 5528 N N . TRP C 65 ? 0.4538 0.5044 0.5622 -0.0482 0.0492 0.0657 60 TRP E N 5529 C CA . TRP C 65 ? 0.4731 0.5313 0.5797 -0.0480 0.0491 0.0634 60 TRP E CA 5530 C C . TRP C 65 ? 0.4897 0.5520 0.5889 -0.0445 0.0477 0.0628 60 TRP E C 5531 O O . TRP C 65 ? 0.5089 0.5782 0.6062 -0.0439 0.0486 0.0646 60 TRP E O 5532 C CB . TRP C 65 ? 0.5117 0.5689 0.6205 -0.0490 0.0480 0.0577 60 TRP E CB 5533 C CG . TRP C 65 ? 0.5499 0.6139 0.6560 -0.0480 0.0473 0.0546 60 TRP E CG 5534 C CD1 . TRP C 65 ? 0.5941 0.6658 0.7017 -0.0491 0.0488 0.0558 60 TRP E CD1 5535 C CD2 . TRP C 65 ? 0.5872 0.6515 0.6885 -0.0454 0.0450 0.0496 60 TRP E CD2 5536 N NE1 . TRP C 65 ? 0.6423 0.7192 0.7462 -0.0470 0.0475 0.0517 60 TRP E NE1 5537 C CE2 . TRP C 65 ? 0.5839 0.6559 0.6837 -0.0447 0.0451 0.0480 60 TRP E CE2 5538 C CE3 . TRP C 65 ? 0.6164 0.6752 0.7142 -0.0436 0.0428 0.0465 60 TRP E CE3 5539 C CZ2 . TRP C 65 ? 0.6145 0.6882 0.7098 -0.0421 0.0430 0.0433 60 TRP E CZ2 5540 C CZ3 . TRP C 65 ? 0.6220 0.6824 0.7152 -0.0414 0.0407 0.0421 60 TRP E CZ3 5541 C CH2 . TRP C 65 ? 0.6576 0.7250 0.7494 -0.0405 0.0408 0.0406 60 TRP E CH2 5542 N N . LEU C 66 ? 0.4750 0.5332 0.5701 -0.0424 0.0457 0.0603 61 LEU E N 5543 C CA . LEU C 66 ? 0.5093 0.5705 0.5972 -0.0394 0.0441 0.0591 61 LEU E CA 5544 C C . LEU C 66 ? 0.4744 0.5389 0.5597 -0.0383 0.0451 0.0640 61 LEU E C 5545 O O . LEU C 66 ? 0.4193 0.4899 0.5006 -0.0367 0.0450 0.0642 61 LEU E O 5546 C CB . LEU C 66 ? 0.5681 0.6237 0.6522 -0.0378 0.0418 0.0561 61 LEU E CB 5547 C CG . LEU C 66 ? 0.5886 0.6426 0.6705 -0.0371 0.0396 0.0504 61 LEU E CG 5548 C CD1 . LEU C 66 ? 0.6209 0.6703 0.6983 -0.0356 0.0376 0.0493 61 LEU E CD1 5549 C CD2 . LEU C 66 ? 0.5994 0.6591 0.6774 -0.0356 0.0389 0.0481 61 LEU E CD2 5550 N N . LEU C 67 ? 0.4418 0.5024 0.5291 -0.0388 0.0459 0.0678 62 LEU E N 5551 C CA . LEU C 67 ? 0.4596 0.5234 0.5447 -0.0377 0.0470 0.0730 62 LEU E CA 5552 C C . LEU C 67 ? 0.4749 0.5444 0.5632 -0.0394 0.0495 0.0774 62 LEU E C 5553 O O . LEU C 67 ? 0.5205 0.5950 0.6062 -0.0383 0.0503 0.0811 62 LEU E O 5554 C CB . LEU C 67 ? 0.4601 0.5181 0.5462 -0.0375 0.0470 0.0759 62 LEU E CB 5555 C CG . LEU C 67 ? 0.4534 0.5076 0.5352 -0.0356 0.0446 0.0727 62 LEU E CG 5556 C CD1 . LEU C 67 ? 0.4475 0.4957 0.5318 -0.0356 0.0447 0.0748 62 LEU E CD1 5557 C CD2 . LEU C 67 ? 0.4708 0.5295 0.5456 -0.0333 0.0435 0.0731 62 LEU E CD2 5558 N N . GLY C 68 ? 0.4872 0.5565 0.5810 -0.0421 0.0506 0.0768 63 GLY E N 5559 C CA . GLY C 68 ? 0.5247 0.5994 0.6221 -0.0442 0.0530 0.0809 63 GLY E CA 5560 C C . GLY C 68 ? 0.4948 0.5660 0.5962 -0.0460 0.0549 0.0870 63 GLY E C 5561 O O . GLY C 68 ? 0.4736 0.5501 0.5751 -0.0465 0.0566 0.0919 63 GLY E O 5562 N N . ASN C 69 ? 0.4854 0.5480 0.5900 -0.0468 0.0545 0.0866 64 ASN E N 5563 C CA . ASN C 69 ? 0.5333 0.5911 0.6430 -0.0490 0.0562 0.0916 64 ASN E CA 5564 C C . ASN C 69 ? 0.5804 0.6432 0.6941 -0.0524 0.0585 0.0948 64 ASN E C 5565 O O . ASN C 69 ? 0.5661 0.6316 0.6822 -0.0544 0.0586 0.0914 64 ASN E O 5566 C CB . ASN C 69 ? 0.5192 0.5677 0.6329 -0.0502 0.0555 0.0887 64 ASN E CB 5567 C CG . ASN C 69 ? 0.5050 0.5469 0.6236 -0.0522 0.0571 0.0936 64 ASN E CG 5568 O OD1 . ASN C 69 ? 0.4858 0.5302 0.6070 -0.0544 0.0590 0.0984 64 ASN E OD1 5569 N ND2 . ASN C 69 ? 0.5083 0.5419 0.6283 -0.0513 0.0561 0.0923 64 ASN E ND2 5570 N N . PRO C 70 ? 0.5950 0.6600 0.7093 -0.0530 0.0603 0.1014 65 PRO E N 5571 C CA . PRO C 70 ? 0.6660 0.7379 0.7831 -0.0561 0.0623 0.1042 65 PRO E CA 5572 C C . PRO C 70 ? 0.6683 0.7361 0.7923 -0.0606 0.0633 0.1037 65 PRO E C 5573 O O . PRO C 70 ? 0.6781 0.7523 0.8043 -0.0633 0.0645 0.1042 65 PRO E O 5574 C CB . PRO C 70 ? 0.6204 0.6953 0.7364 -0.0557 0.0639 0.1117 65 PRO E CB 5575 C CG . PRO C 70 ? 0.6792 0.7469 0.7932 -0.0529 0.0629 0.1130 65 PRO E CG 5576 C CD . PRO C 70 ? 0.6319 0.6955 0.7434 -0.0507 0.0604 0.1062 65 PRO E CD 5577 N N . MET C 71 ? 0.7599 0.8174 0.8869 -0.0614 0.0626 0.1023 66 MET E N 5578 C CA . MET C 71 ? 0.8196 0.8732 0.9527 -0.0655 0.0631 0.1002 66 MET E CA 5579 C C . MET C 71 ? 0.8562 0.9126 0.9892 -0.0656 0.0617 0.0928 66 MET E C 5580 O O . MET C 71 ? 0.7758 0.8295 0.9134 -0.0687 0.0619 0.0902 66 MET E O 5581 C CB . MET C 71 ? 0.9527 0.9943 1.0894 -0.0663 0.0630 0.1012 66 MET E CB 5582 C CG . MET C 71 ? 1.0989 1.1371 1.2412 -0.0710 0.0650 0.1062 66 MET E CG 5583 S SD . MET C 71 ? 1.1795 1.2208 1.3207 -0.0711 0.0671 0.1158 66 MET E SD 5584 C CE . MET C 71 ? 1.2203 1.2481 1.3619 -0.0688 0.0664 0.1182 66 MET E CE 5585 N N . CYS C 72 ? 0.9609 1.0226 1.0885 -0.0621 0.0603 0.0895 67 CYS E N 5586 C CA . CYS C 72 ? 1.0098 1.0749 1.1368 -0.0617 0.0590 0.0828 67 CYS E CA 5587 C C . CYS C 72 ? 1.1095 1.1864 1.2349 -0.0619 0.0598 0.0829 67 CYS E C 5588 O O . CYS C 72 ? 0.8945 0.9761 1.0165 -0.0596 0.0584 0.0783 67 CYS E O 5589 C CB . CYS C 72 ? 0.9332 0.9943 1.0554 -0.0578 0.0565 0.0783 67 CYS E CB 5590 S SG . CYS C 72 ? 0.7980 0.8465 0.9220 -0.0573 0.0554 0.0777 67 CYS E SG 5591 N N . ASP C 73 ? 1.4651 1.5465 1.5933 -0.0647 0.0620 0.0882 68 ASP E N 5592 C CA . ASP C 73 ? 1.7356 1.8292 1.8624 -0.0648 0.0630 0.0892 68 ASP E CA 5593 C C . ASP C 73 ? 1.8917 1.9914 2.0210 -0.0666 0.0630 0.0845 68 ASP E C 5594 O O . ASP C 73 ? 1.9782 2.0878 2.1085 -0.0681 0.0644 0.0862 68 ASP E O 5595 C CB . ASP C 73 ? 1.7310 1.8278 1.8603 -0.0676 0.0656 0.0968 68 ASP E CB 5596 C CG . ASP C 73 ? 1.6734 1.7787 1.7976 -0.0647 0.0661 0.1002 68 ASP E CG 5597 O OD1 . ASP C 73 ? 1.6035 1.7053 1.7236 -0.0615 0.0653 0.1017 68 ASP E OD1 5598 O OD2 . ASP C 73 ? 1.5594 1.6754 1.6837 -0.0657 0.0674 0.1015 68 ASP E OD2 5599 N N . GLU C 74 ? 1.9034 1.9983 2.0336 -0.0663 0.0613 0.0787 69 GLU E N 5600 C CA . GLU C 74 ? 1.9070 2.0063 2.0406 -0.0686 0.0612 0.0745 69 GLU E CA 5601 C C . GLU C 74 ? 2.0296 2.1337 2.1584 -0.0646 0.0592 0.0685 69 GLU E C 5602 O O . GLU C 74 ? 2.0580 2.1621 2.1886 -0.0652 0.0583 0.0635 69 GLU E O 5603 C CB . GLU C 74 ? 1.8209 1.9107 1.9599 -0.0719 0.0610 0.0727 69 GLU E CB 5604 C CG . GLU C 74 ? 1.7693 1.8500 1.9106 -0.0736 0.0620 0.0780 69 GLU E CG 5605 C CD . GLU C 74 ? 1.6443 1.7151 1.7906 -0.0764 0.0617 0.0760 69 GLU E CD 5606 O OE1 . GLU C 74 ? 1.4681 1.5408 1.6190 -0.0802 0.0621 0.0738 69 GLU E OE1 5607 O OE2 . GLU C 74 ? 1.4744 1.5357 1.6199 -0.0749 0.0609 0.0766 69 GLU E OE2 5608 N N . PHE C 75 ? 2.0884 2.1970 2.2111 -0.0605 0.0586 0.0691 70 PHE E N 5609 C CA . PHE C 75 ? 2.1372 2.2480 2.2542 -0.0561 0.0564 0.0637 70 PHE E CA 5610 C C . PHE C 75 ? 2.1094 2.2301 2.2272 -0.0561 0.0564 0.0601 70 PHE E C 5611 O O . PHE C 75 ? 2.1405 2.2700 2.2548 -0.0536 0.0565 0.0601 70 PHE E O 5612 C CB . PHE C 75 ? 2.0871 2.1992 2.1972 -0.0518 0.0556 0.0653 70 PHE E CB 5613 C CG . PHE C 75 ? 2.1482 2.2575 2.2519 -0.0474 0.0528 0.0601 70 PHE E CG 5614 C CD1 . PHE C 75 ? 2.0462 2.1461 2.1473 -0.0459 0.0512 0.0594 70 PHE E CD1 5615 C CD2 . PHE C 75 ? 2.1649 2.2813 2.2649 -0.0446 0.0518 0.0562 70 PHE E CD2 5616 C CE1 . PHE C 75 ? 1.8291 1.9264 1.9242 -0.0423 0.0487 0.0550 70 PHE E CE1 5617 C CE2 . PHE C 75 ? 2.0963 2.2094 2.1903 -0.0406 0.0492 0.0518 70 PHE E CE2 5618 C CZ . PHE C 75 ? 1.8936 1.9972 1.9851 -0.0398 0.0476 0.0513 70 PHE E CZ 5619 N N . ILE C 76 ? 1.9734 2.0930 2.0960 -0.0588 0.0563 0.0569 71 ILE E N 5620 C CA . ILE C 76 ? 1.7653 1.8926 1.8879 -0.0579 0.0555 0.0520 71 ILE E CA 5621 C C . ILE C 76 ? 1.7054 1.8289 1.8211 -0.0527 0.0528 0.0477 71 ILE E C 5622 O O . ILE C 76 ? 1.5772 1.6910 1.6914 -0.0518 0.0515 0.0468 71 ILE E O 5623 C CB . ILE C 76 ? 1.6266 1.7526 1.7559 -0.0621 0.0559 0.0495 71 ILE E CB 5624 C CG1 . ILE C 76 ? 1.4911 1.6212 1.6268 -0.0677 0.0586 0.0540 71 ILE E CG1 5625 C CG2 . ILE C 76 ? 1.4743 1.6065 1.6026 -0.0602 0.0544 0.0435 71 ILE E CG2 5626 C CD1 . ILE C 76 ? 1.4295 1.5728 1.5677 -0.0693 0.0598 0.0534 71 ILE E CD1 5627 N N . ARG C 77 ? 1.5638 1.6953 1.6754 -0.0492 0.0520 0.0452 72 ARG E N 5628 C CA . ARG C 77 ? 1.4178 1.5469 1.5218 -0.0440 0.0498 0.0426 72 ARG E CA 5629 C C . ARG C 77 ? 1.3185 1.4449 1.4209 -0.0420 0.0474 0.0365 72 ARG E C 5630 O O . ARG C 77 ? 1.3852 1.5182 1.4848 -0.0391 0.0464 0.0331 72 ARG E O 5631 C CB . ARG C 77 ? 1.3567 1.4959 1.4569 -0.0412 0.0503 0.0437 72 ARG E CB 5632 C CG . ARG C 77 ? 1.3890 1.5266 1.4811 -0.0360 0.0482 0.0418 72 ARG E CG 5633 C CD . ARG C 77 ? 1.4858 1.6335 1.5745 -0.0324 0.0478 0.0390 72 ARG E CD 5634 N NE . ARG C 77 ? 1.5867 1.7343 1.6676 -0.0277 0.0462 0.0381 72 ARG E NE 5635 C CZ . ARG C 77 ? 1.5883 1.7324 1.6631 -0.0234 0.0435 0.0334 72 ARG E CZ 5636 N NH1 . ARG C 77 ? 1.6317 1.7722 1.7071 -0.0230 0.0419 0.0291 72 ARG E NH1 5637 N NH2 . ARG C 77 ? 1.5529 1.6970 1.6209 -0.0196 0.0423 0.0331 72 ARG E NH2 5638 N N . VAL C 78 ? 1.0307 1.1477 1.1347 -0.0434 0.0464 0.0350 73 VAL E N 5639 C CA . VAL C 78 ? 0.8852 0.9994 0.9878 -0.0417 0.0441 0.0294 73 VAL E CA 5640 C C . VAL C 78 ? 0.7891 0.8997 0.8834 -0.0369 0.0416 0.0273 73 VAL E C 5641 O O . VAL C 78 ? 0.8440 0.9472 0.9355 -0.0364 0.0409 0.0289 73 VAL E O 5642 C CB . VAL C 78 ? 0.7345 0.8403 0.8415 -0.0448 0.0438 0.0283 73 VAL E CB 5643 N N . PRO C 79 ? 0.6970 0.8129 0.7872 -0.0333 0.0403 0.0239 74 PRO E N 5644 C CA . PRO C 79 ? 0.6532 0.7649 0.7354 -0.0288 0.0378 0.0218 74 PRO E CA 5645 C C . PRO C 79 ? 0.6853 0.7888 0.7653 -0.0279 0.0352 0.0180 74 PRO E C 5646 O O . PRO C 79 ? 0.7020 0.8002 0.7753 -0.0249 0.0331 0.0168 74 PRO E O 5647 C CB . PRO C 79 ? 0.6140 0.7348 0.6930 -0.0252 0.0373 0.0195 74 PRO E CB 5648 C CG . PRO C 79 ? 0.6300 0.7579 0.7153 -0.0275 0.0386 0.0182 74 PRO E CG 5649 C CD . PRO C 79 ? 0.6683 0.7946 0.7609 -0.0329 0.0409 0.0219 74 PRO E CD 5650 N N . GLU C 80 ? 0.5926 0.6952 0.6777 -0.0304 0.0354 0.0161 75 GLU E N 5651 C CA . GLU C 80 ? 0.5868 0.6819 0.6705 -0.0301 0.0332 0.0130 75 GLU E CA 5652 C C . GLU C 80 ? 0.5280 0.6211 0.6190 -0.0343 0.0344 0.0129 75 GLU E C 5653 O O . GLU C 80 ? 0.5178 0.6164 0.6147 -0.0371 0.0364 0.0141 75 GLU E O 5654 C CB . GLU C 80 ? 0.5956 0.6926 0.6751 -0.0265 0.0309 0.0084 75 GLU E CB 5655 C CG . GLU C 80 ? 0.7283 0.8332 0.8123 -0.0271 0.0316 0.0058 75 GLU E CG 5656 C CD . GLU C 80 ? 0.8996 1.0043 0.9799 -0.0238 0.0289 0.0010 75 GLU E CD 5657 O OE1 . GLU C 80 ? 0.7585 0.8714 0.8405 -0.0227 0.0291 -0.0011 75 GLU E OE1 5658 O OE2 . GLU C 80 ? 0.8570 0.9538 0.9329 -0.0223 0.0267 -0.0004 75 GLU E OE2 5659 N N . TRP C 81 ? 0.5153 0.6006 0.6059 -0.0349 0.0330 0.0116 76 TRP E N 5660 C CA . TRP C 81 ? 0.4505 0.5332 0.5477 -0.0386 0.0338 0.0109 76 TRP E CA 5661 C C . TRP C 81 ? 0.4494 0.5257 0.5444 -0.0378 0.0316 0.0078 76 TRP E C 5662 O O . TRP C 81 ? 0.4342 0.5068 0.5227 -0.0349 0.0296 0.0071 76 TRP E O 5663 C CB . TRP C 81 ? 0.4747 0.5542 0.5761 -0.0418 0.0359 0.0152 76 TRP E CB 5664 C CG . TRP C 81 ? 0.4852 0.5579 0.5824 -0.0406 0.0353 0.0178 76 TRP E CG 5665 C CD1 . TRP C 81 ? 0.4438 0.5091 0.5404 -0.0408 0.0341 0.0171 76 TRP E CD1 5666 C CD2 . TRP C 81 ? 0.4676 0.5411 0.5609 -0.0390 0.0358 0.0213 76 TRP E CD2 5667 N NE1 . TRP C 81 ? 0.4339 0.4955 0.5265 -0.0396 0.0339 0.0200 76 TRP E NE1 5668 C CE2 . TRP C 81 ? 0.4332 0.4996 0.5236 -0.0384 0.0348 0.0226 76 TRP E CE2 5669 C CE3 . TRP C 81 ? 0.4586 0.5388 0.5506 -0.0380 0.0369 0.0234 76 TRP E CE3 5670 C CZ2 . TRP C 81 ? 0.4316 0.4972 0.5177 -0.0370 0.0350 0.0259 76 TRP E CZ2 5671 C CZ3 . TRP C 81 ? 0.5037 0.5829 0.5913 -0.0364 0.0370 0.0267 76 TRP E CZ3 5672 C CH2 . TRP C 81 ? 0.4572 0.5292 0.5420 -0.0360 0.0361 0.0278 76 TRP E CH2 5673 N N . SER C 82 ? 0.4077 0.4832 0.5080 -0.0403 0.0318 0.0057 77 SER E N 5674 C CA . SER C 82 ? 0.3796 0.4508 0.4783 -0.0396 0.0297 0.0023 77 SER E CA 5675 C C . SER C 82 ? 0.4027 0.4665 0.5034 -0.0416 0.0299 0.0035 77 SER E C 5676 O O . SER C 82 ? 0.4162 0.4753 0.5140 -0.0405 0.0280 0.0017 77 SER E O 5677 C CB . SER C 82 ? 0.3789 0.4548 0.4819 -0.0408 0.0296 -0.0014 77 SER E CB 5678 O OG . SER C 82 ? 0.3988 0.4769 0.5093 -0.0447 0.0319 -0.0003 77 SER E OG 5679 N N . TYR C 83 ? 0.3739 0.4370 0.4801 -0.0445 0.0321 0.0063 78 TYR E N 5680 C CA . TYR C 83 ? 0.3876 0.4438 0.4957 -0.0460 0.0324 0.0079 78 TYR E CA 5681 C C . TYR C 83 ? 0.4038 0.4597 0.5154 -0.0480 0.0348 0.0125 78 TYR E C 5682 O O . TYR C 83 ? 0.4050 0.4664 0.5183 -0.0488 0.0362 0.0140 78 TYR E O 5683 C CB . TYR C 83 ? 0.3799 0.4338 0.4926 -0.0480 0.0320 0.0045 78 TYR E CB 5684 C CG . TYR C 83 ? 0.4297 0.4874 0.5494 -0.0512 0.0335 0.0031 78 TYR E CG 5685 C CD1 . TYR C 83 ? 0.4414 0.5060 0.5617 -0.0510 0.0332 0.0002 78 TYR E CD1 5686 C CD2 . TYR C 83 ? 0.4588 0.5131 0.5846 -0.0544 0.0350 0.0043 78 TYR E CD2 5687 C CE1 . TYR C 83 ? 0.4109 0.4795 0.5378 -0.0543 0.0345 -0.0010 78 TYR E CE1 5688 C CE2 . TYR C 83 ? 0.4480 0.5052 0.5801 -0.0577 0.0363 0.0030 78 TYR E CE2 5689 C CZ . TYR C 83 ? 0.4290 0.4938 0.5618 -0.0578 0.0361 0.0003 78 TYR E CZ 5690 O OH . TYR C 83 ? 0.5033 0.5713 0.6427 -0.0616 0.0374 -0.0009 78 TYR E OH 5691 N N . ILE C 84 ? 0.3986 0.4485 0.5107 -0.0485 0.0352 0.0150 79 ILE E N 5692 C CA . ILE C 84 ? 0.4209 0.4696 0.5363 -0.0504 0.0374 0.0196 79 ILE E CA 5693 C C . ILE C 84 ? 0.4606 0.5048 0.5827 -0.0534 0.0383 0.0192 79 ILE E C 5694 O O . ILE C 84 ? 0.4537 0.4934 0.5760 -0.0530 0.0371 0.0166 79 ILE E O 5695 C CB . ILE C 84 ? 0.4618 0.5070 0.5729 -0.0485 0.0372 0.0233 79 ILE E CB 5696 C CG1 . ILE C 84 ? 0.5022 0.5513 0.6066 -0.0456 0.0363 0.0237 79 ILE E CG1 5697 C CG2 . ILE C 84 ? 0.4433 0.4869 0.5582 -0.0504 0.0395 0.0283 79 ILE E CG2 5698 C CD1 . ILE C 84 ? 0.5146 0.5614 0.6146 -0.0439 0.0362 0.0274 79 ILE E CD1 5699 N N . VAL C 85 ? 0.4608 0.5062 0.5881 -0.0563 0.0404 0.0217 80 VAL E N 5700 C CA . VAL C 85 ? 0.4474 0.4877 0.5810 -0.0594 0.0415 0.0217 80 VAL E CA 5701 C C . VAL C 85 ? 0.4535 0.4899 0.5881 -0.0600 0.0431 0.0273 80 VAL E C 5702 O O . VAL C 85 ? 0.5413 0.5816 0.6758 -0.0607 0.0445 0.0310 80 VAL E O 5703 C CB . VAL C 85 ? 0.4880 0.5325 0.6272 -0.0629 0.0426 0.0201 80 VAL E CB 5704 C CG1 . VAL C 85 ? 0.4906 0.5292 0.6363 -0.0664 0.0436 0.0204 80 VAL E CG1 5705 C CG2 . VAL C 85 ? 0.5084 0.5576 0.6468 -0.0622 0.0410 0.0146 80 VAL E CG2 5706 N N . GLU C 86 ? 0.4310 0.4602 0.5664 -0.0596 0.0428 0.0278 81 GLU E N 5707 C CA . GLU C 86 ? 0.4632 0.4876 0.6001 -0.0599 0.0441 0.0328 81 GLU E CA 5708 C C . GLU C 86 ? 0.5147 0.5329 0.6580 -0.0628 0.0448 0.0318 81 GLU E C 5709 O O . GLU C 86 ? 0.5447 0.5610 0.6896 -0.0630 0.0436 0.0270 81 GLU E O 5710 C CB . GLU C 86 ? 0.4886 0.5092 0.6206 -0.0565 0.0429 0.0338 81 GLU E CB 5711 C CG . GLU C 86 ? 0.5078 0.5310 0.6350 -0.0544 0.0433 0.0384 81 GLU E CG 5712 C CD . GLU C 86 ? 0.5347 0.5545 0.6575 -0.0513 0.0420 0.0392 81 GLU E CD 5713 O OE1 . GLU C 86 ? 0.5300 0.5455 0.6533 -0.0506 0.0409 0.0366 81 GLU E OE1 5714 O OE2 . GLU C 86 ? 0.6036 0.6255 0.7223 -0.0496 0.0422 0.0427 81 GLU E OE2 5715 N N . ARG C 87 ? 0.5292 0.5438 0.6757 -0.0647 0.0465 0.0363 82 ARG E N 5716 C CA . ARG C 87 ? 0.6274 0.6341 0.7792 -0.0667 0.0470 0.0358 82 ARG E CA 5717 C C . ARG C 87 ? 0.6267 0.6272 0.7766 -0.0635 0.0458 0.0354 82 ARG E C 5718 O O . ARG C 87 ? 0.6794 0.6813 0.8241 -0.0602 0.0451 0.0370 82 ARG E O 5719 C CB . ARG C 87 ? 0.6979 0.7023 0.8534 -0.0696 0.0491 0.0413 82 ARG E CB 5720 C CG . ARG C 87 ? 0.7707 0.7811 0.9295 -0.0735 0.0502 0.0407 82 ARG E CG 5721 C CD . ARG C 87 ? 0.9366 0.9454 1.0991 -0.0770 0.0524 0.0463 82 ARG E CD 5722 N NE . ARG C 87 ? 1.0594 1.0747 1.2253 -0.0811 0.0533 0.0452 82 ARG E NE 5723 C CZ . ARG C 87 ? 1.0937 1.1105 1.2627 -0.0849 0.0553 0.0496 82 ARG E CZ 5724 N NH1 . ARG C 87 ? 1.1066 1.1189 1.2755 -0.0850 0.0565 0.0559 82 ARG E NH1 5725 N NH2 . ARG C 87 ? 1.0969 1.1205 1.2690 -0.0887 0.0560 0.0480 82 ARG E NH2 5726 N N . ALA C 88 ? 0.6684 0.6623 0.8222 -0.0644 0.0455 0.0329 83 ALA E N 5727 C CA . ALA C 88 ? 0.7239 0.7122 0.8762 -0.0612 0.0444 0.0321 83 ALA E CA 5728 C C . ALA C 88 ? 0.6707 0.6567 0.8203 -0.0589 0.0451 0.0381 83 ALA E C 5729 O O . ALA C 88 ? 0.6492 0.6354 0.7947 -0.0556 0.0441 0.0383 83 ALA E O 5730 C CB . ALA C 88 ? 0.7435 0.7246 0.9010 -0.0627 0.0443 0.0291 83 ALA E CB 5731 N N . ASN C 89 ? 0.6925 0.6767 0.8446 -0.0610 0.0469 0.0431 84 ASN E N 5732 C CA . ASN C 89 ? 0.7294 0.7120 0.8793 -0.0591 0.0478 0.0493 84 ASN E CA 5733 C C . ASN C 89 ? 0.7305 0.7179 0.8802 -0.0611 0.0495 0.0540 84 ASN E C 5734 O O . ASN C 89 ? 0.8044 0.7887 0.9581 -0.0640 0.0510 0.0574 84 ASN E O 5735 C CB . ASN C 89 ? 0.7295 0.7028 0.8829 -0.0589 0.0484 0.0514 84 ASN E CB 5736 C CG . ASN C 89 ? 0.7863 0.7555 0.9391 -0.0559 0.0467 0.0474 84 ASN E CG 5737 O OD1 . ASN C 89 ? 0.8506 0.8215 0.9990 -0.0523 0.0458 0.0480 84 ASN E OD1 5738 N ND2 . ASN C 89 ? 0.7843 0.7490 0.9413 -0.0575 0.0462 0.0428 84 ASN E ND2 5739 N N . PRO C 90 ? 0.7011 0.6963 0.8460 -0.0596 0.0491 0.0544 85 PRO E N 5740 C CA . PRO C 90 ? 0.7123 0.7128 0.8566 -0.0611 0.0507 0.0590 85 PRO E CA 5741 C C . PRO C 90 ? 0.7096 0.7060 0.8541 -0.0603 0.0519 0.0655 85 PRO E C 5742 O O . PRO C 90 ? 0.7404 0.7333 0.8824 -0.0571 0.0512 0.0665 85 PRO E O 5743 C CB . PRO C 90 ? 0.7109 0.7191 0.8491 -0.0585 0.0497 0.0578 85 PRO E CB 5744 C CG . PRO C 90 ? 0.7178 0.7250 0.8542 -0.0567 0.0475 0.0518 85 PRO E CG 5745 C CD . PRO C 90 ? 0.6660 0.6649 0.8057 -0.0565 0.0472 0.0508 85 PRO E CD 5746 N N . ALA C 91 ? 0.7519 0.7492 0.8990 -0.0633 0.0538 0.0700 86 ALA E N 5747 C CA . ALA C 91 ? 0.8027 0.7964 0.9502 -0.0629 0.0552 0.0768 86 ALA E CA 5748 C C . ALA C 91 ? 0.7270 0.7275 0.8689 -0.0601 0.0554 0.0806 86 ALA E C 5749 O O . ALA C 91 ? 0.7536 0.7516 0.8939 -0.0580 0.0557 0.0852 86 ALA E O 5750 C CB . ALA C 91 ? 0.8691 0.8616 1.0215 -0.0676 0.0571 0.0804 86 ALA E CB 5751 N N . ASN C 92 ? 0.6328 0.6420 0.7719 -0.0602 0.0551 0.0787 87 ASN E N 5752 C CA . ASN C 92 ? 0.6827 0.6987 0.8165 -0.0578 0.0553 0.0820 87 ASN E CA 5753 C C . ASN C 92 ? 0.6655 0.6845 0.7936 -0.0541 0.0533 0.0779 87 ASN E C 5754 O O . ASN C 92 ? 0.6514 0.6741 0.7782 -0.0542 0.0522 0.0729 87 ASN E O 5755 C CB . ASN C 92 ? 0.6473 0.6716 0.7818 -0.0603 0.0568 0.0839 87 ASN E CB 5756 C CG . ASN C 92 ? 0.6732 0.6948 0.8132 -0.0644 0.0588 0.0881 87 ASN E CG 5757 O OD1 . ASN C 92 ? 0.6558 0.6798 0.7993 -0.0679 0.0595 0.0863 87 ASN E OD1 5758 N ND2 . ASN C 92 ? 0.6111 0.6280 0.7518 -0.0641 0.0598 0.0940 87 ASN E ND2 5759 N N . ASP C 93 ? 0.6558 0.6732 0.7806 -0.0510 0.0527 0.0802 88 ASP E N 5760 C CA . ASP C 93 ? 0.6576 0.6761 0.7772 -0.0479 0.0506 0.0767 88 ASP E CA 5761 C C . ASP C 93 ? 0.6137 0.6364 0.7283 -0.0453 0.0507 0.0810 88 ASP E C 5762 O O . ASP C 93 ? 0.6023 0.6317 0.7147 -0.0455 0.0515 0.0828 88 ASP E O 5763 C CB . ASP C 93 ? 0.6827 0.6939 0.8042 -0.0470 0.0494 0.0735 88 ASP E CB 5764 C CG . ASP C 93 ? 0.6975 0.7098 0.8139 -0.0441 0.0472 0.0699 88 ASP E CG 5765 O OD1 . ASP C 93 ? 0.6846 0.7010 0.7981 -0.0440 0.0461 0.0659 88 ASP E OD1 5766 O OD2 . ASP C 93 ? 0.8853 0.8944 1.0006 -0.0418 0.0467 0.0712 88 ASP E OD2 5767 N N . LEU C 94 ? 0.5647 0.5843 0.6773 -0.0427 0.0500 0.0825 89 LEU E N 5768 C CA . LEU C 94 ? 0.5646 0.5887 0.6725 -0.0404 0.0502 0.0865 89 LEU E CA 5769 C C . LEU C 94 ? 0.5815 0.6035 0.6922 -0.0408 0.0521 0.0931 89 LEU E C 5770 O O . LEU C 94 ? 0.6575 0.6739 0.7698 -0.0394 0.0520 0.0950 89 LEU E O 5771 C CB . LEU C 94 ? 0.6012 0.6246 0.7049 -0.0374 0.0483 0.0847 89 LEU E CB 5772 C CG . LEU C 94 ? 0.5714 0.5966 0.6715 -0.0370 0.0462 0.0786 89 LEU E CG 5773 C CD1 . LEU C 94 ? 0.5798 0.6033 0.6768 -0.0346 0.0445 0.0771 89 LEU E CD1 5774 C CD2 . LEU C 94 ? 0.5625 0.5948 0.6582 -0.0368 0.0460 0.0782 89 LEU E CD2 5775 N N . CYS C 95 ? 0.5827 0.6093 0.6943 -0.0426 0.0537 0.0966 90 CYS E N 5776 C CA . CYS C 95 ? 0.5735 0.5983 0.6882 -0.0437 0.0557 0.1032 90 CYS E CA 5777 C C . CYS C 95 ? 0.5028 0.5276 0.6142 -0.0403 0.0555 0.1074 90 CYS E C 5778 O O . CYS C 95 ? 0.5362 0.5550 0.6499 -0.0396 0.0560 0.1106 90 CYS E O 5779 C CB . CYS C 95 ? 0.5474 0.5789 0.6629 -0.0462 0.0575 0.1061 90 CYS E CB 5780 S SG . CYS C 95 ? 0.6062 0.6493 0.7151 -0.0444 0.0571 0.1058 90 CYS E SG 5781 N N . TYR C 96 ? 0.5267 0.5583 0.6325 -0.0382 0.0547 0.1069 91 TYR E N 5782 C CA . TYR C 96 ? 0.5551 0.5873 0.6572 -0.0349 0.0540 0.1096 91 TYR E CA 5783 C C . TYR C 96 ? 0.5588 0.5871 0.6597 -0.0332 0.0519 0.1043 91 TYR E C 5784 O O . TYR C 96 ? 0.5208 0.5512 0.6193 -0.0334 0.0505 0.0990 91 TYR E O 5785 C CB . TYR C 96 ? 0.5536 0.5950 0.6502 -0.0334 0.0539 0.1113 91 TYR E CB 5786 C CG . TYR C 96 ? 0.5802 0.6228 0.6742 -0.0306 0.0540 0.1160 91 TYR E CG 5787 C CD1 . TYR C 96 ? 0.5899 0.6350 0.6846 -0.0305 0.0558 0.1228 91 TYR E CD1 5788 C CD2 . TYR C 96 ? 0.6106 0.6520 0.7016 -0.0280 0.0522 0.1137 91 TYR E CD2 5789 C CE1 . TYR C 96 ? 0.6317 0.6783 0.7241 -0.0277 0.0558 0.1272 91 TYR E CE1 5790 C CE2 . TYR C 96 ? 0.6366 0.6798 0.7254 -0.0253 0.0521 0.1179 91 TYR E CE2 5791 C CZ . TYR C 96 ? 0.6298 0.6754 0.7192 -0.0250 0.0539 0.1245 91 TYR E CZ 5792 O OH . TYR C 96 ? 0.6346 0.6823 0.7216 -0.0221 0.0537 0.1285 91 TYR E OH 5793 N N . PRO C 97 ? 0.5939 0.6165 0.6965 -0.0315 0.0516 0.1057 92 PRO E N 5794 C CA . PRO C 97 ? 0.5580 0.5765 0.6604 -0.0303 0.0498 0.1004 92 PRO E CA 5795 C C . PRO C 97 ? 0.5518 0.5753 0.6483 -0.0283 0.0479 0.0977 92 PRO E C 5796 O O . PRO C 97 ? 0.4931 0.5224 0.5855 -0.0269 0.0480 0.1007 92 PRO E O 5797 C CB . PRO C 97 ? 0.5854 0.5976 0.6907 -0.0285 0.0502 0.1036 92 PRO E CB 5798 C CG . PRO C 97 ? 0.5888 0.6042 0.6929 -0.0274 0.0516 0.1106 92 PRO E CG 5799 C CD . PRO C 97 ? 0.5973 0.6173 0.7017 -0.0302 0.0530 0.1121 92 PRO E CD 5800 N N . GLY C 98 ? 0.5087 0.5302 0.6047 -0.0283 0.0462 0.0920 93 GLY E N 5801 C CA . GLY C 98 ? 0.5065 0.5320 0.5969 -0.0269 0.0442 0.0890 93 GLY E CA 5802 C C . GLY C 98 ? 0.5160 0.5400 0.6060 -0.0279 0.0426 0.0825 93 GLY E C 5803 O O . GLY C 98 ? 0.4848 0.5035 0.5788 -0.0284 0.0424 0.0800 93 GLY E O 5804 N N . ASN C 99 ? 0.4729 0.5013 0.5580 -0.0283 0.0413 0.0797 94 ASN E N 5805 C CA . ASN C 99 ? 0.4986 0.5258 0.5825 -0.0292 0.0396 0.0737 94 ASN E CA 5806 C C . ASN C 99 ? 0.4588 0.4900 0.5392 -0.0302 0.0390 0.0715 94 ASN E C 5807 O O . ASN C 99 ? 0.4145 0.4501 0.4916 -0.0297 0.0394 0.0740 94 ASN E O 5808 C CB . ASN C 99 ? 0.5260 0.5537 0.6063 -0.0278 0.0376 0.0716 94 ASN E CB 5809 C CG . ASN C 99 ? 0.5286 0.5529 0.6120 -0.0263 0.0378 0.0731 94 ASN E CG 5810 O OD1 . ASN C 99 ? 0.5354 0.5616 0.6172 -0.0244 0.0380 0.0766 94 ASN E OD1 5811 N ND2 . ASN C 99 ? 0.4917 0.5112 0.5797 -0.0269 0.0379 0.0703 94 ASN E ND2 5812 N N . LEU C 100 ? 0.4177 0.4472 0.4984 -0.0314 0.0379 0.0665 95 LEU E N 5813 C CA . LEU C 100 ? 0.4075 0.4399 0.4839 -0.0318 0.0367 0.0634 95 LEU E CA 5814 C C . LEU C 100 ? 0.4277 0.4585 0.5010 -0.0315 0.0344 0.0592 95 LEU E C 5815 O O . LEU C 100 ? 0.3540 0.3812 0.4303 -0.0321 0.0339 0.0563 95 LEU E O 5816 C CB . LEU C 100 ? 0.4162 0.4482 0.4960 -0.0334 0.0374 0.0611 95 LEU E CB 5817 C CG . LEU C 100 ? 0.4649 0.5014 0.5418 -0.0336 0.0374 0.0603 95 LEU E CG 5818 C CD1 . LEU C 100 ? 0.5084 0.5443 0.5889 -0.0352 0.0377 0.0570 95 LEU E CD1 5819 C CD2 . LEU C 100 ? 0.4897 0.5280 0.5596 -0.0324 0.0353 0.0580 95 LEU E CD2 5820 N N . ASN C 101 ? 0.4172 0.4506 0.4842 -0.0307 0.0329 0.0589 96 ASN E N 5821 C CA . ASN C 101 ? 0.3977 0.4300 0.4611 -0.0306 0.0306 0.0555 96 ASN E CA 5822 C C . ASN C 101 ? 0.4052 0.4355 0.4684 -0.0317 0.0294 0.0506 96 ASN E C 5823 O O . ASN C 101 ? 0.3728 0.4042 0.4357 -0.0321 0.0297 0.0495 96 ASN E O 5824 C CB . ASN C 101 ? 0.4152 0.4507 0.4717 -0.0299 0.0292 0.0562 96 ASN E CB 5825 C CG . ASN C 101 ? 0.4600 0.4946 0.5130 -0.0301 0.0271 0.0541 96 ASN E CG 5826 O OD1 . ASN C 101 ? 0.4459 0.4795 0.5013 -0.0298 0.0272 0.0548 96 ASN E OD1 5827 N ND2 . ASN C 101 ? 0.4440 0.4789 0.4912 -0.0306 0.0250 0.0513 96 ASN E ND2 5828 N N . ASP C 102 ? 0.3952 0.4232 0.4586 -0.0321 0.0280 0.0477 97 ASP E N 5829 C CA . ASP C 102 ? 0.4125 0.4388 0.4756 -0.0330 0.0267 0.0431 97 ASP E CA 5830 C C . ASP C 102 ? 0.3802 0.4060 0.4483 -0.0337 0.0282 0.0422 97 ASP E C 5831 O O . ASP C 102 ? 0.3712 0.3974 0.4379 -0.0341 0.0275 0.0394 97 ASP E O 5832 C CB . ASP C 102 ? 0.4774 0.5048 0.5334 -0.0329 0.0246 0.0411 97 ASP E CB 5833 C CG . ASP C 102 ? 0.4974 0.5245 0.5486 -0.0331 0.0226 0.0404 97 ASP E CG 5834 O OD1 . ASP C 102 ? 0.6219 0.6478 0.6754 -0.0333 0.0223 0.0398 97 ASP E OD1 5835 O OD2 . ASP C 102 ? 0.5937 0.6218 0.6388 -0.0329 0.0212 0.0405 97 ASP E OD2 5836 N N . TYR C 103 ? 0.3582 0.3828 0.4320 -0.0340 0.0301 0.0445 98 TYR E N 5837 C CA . TYR C 103 ? 0.3634 0.3880 0.4422 -0.0351 0.0318 0.0445 98 TYR E CA 5838 C C . TYR C 103 ? 0.3667 0.3900 0.4473 -0.0361 0.0309 0.0397 98 TYR E C 5839 O O . TYR C 103 ? 0.3459 0.3710 0.4271 -0.0367 0.0312 0.0382 98 TYR E O 5840 C CB . TYR C 103 ? 0.3862 0.4087 0.4709 -0.0354 0.0338 0.0476 98 TYR E CB 5841 C CG . TYR C 103 ? 0.4095 0.4318 0.4996 -0.0370 0.0357 0.0482 98 TYR E CG 5842 C CD1 . TYR C 103 ? 0.4256 0.4516 0.5146 -0.0376 0.0363 0.0484 98 TYR E CD1 5843 C CD2 . TYR C 103 ? 0.4337 0.4521 0.5300 -0.0380 0.0370 0.0490 98 TYR E CD2 5844 C CE1 . TYR C 103 ? 0.4125 0.4392 0.5067 -0.0394 0.0381 0.0493 98 TYR E CE1 5845 C CE2 . TYR C 103 ? 0.4448 0.4629 0.5461 -0.0399 0.0387 0.0498 98 TYR E CE2 5846 C CZ . TYR C 103 ? 0.4556 0.4781 0.5558 -0.0407 0.0393 0.0501 98 TYR E CZ 5847 O OH . TYR C 103 ? 0.4661 0.4888 0.5715 -0.0429 0.0410 0.0509 98 TYR E OH 5848 N N . GLU C 104 ? 0.3445 0.3653 0.4256 -0.0361 0.0297 0.0372 99 GLU E N 5849 C CA . GLU C 104 ? 0.3520 0.3717 0.4355 -0.0371 0.0290 0.0327 99 GLU E CA 5850 C C . GLU C 104 ? 0.3397 0.3612 0.4181 -0.0369 0.0272 0.0298 99 GLU E C 5851 O O . GLU C 104 ? 0.3108 0.3329 0.3909 -0.0376 0.0271 0.0270 99 GLU E O 5852 C CB . GLU C 104 ? 0.3852 0.4024 0.4707 -0.0371 0.0282 0.0307 99 GLU E CB 5853 C CG . GLU C 104 ? 0.4611 0.4757 0.5521 -0.0370 0.0299 0.0330 99 GLU E CG 5854 C CD . GLU C 104 ? 0.4830 0.4977 0.5719 -0.0355 0.0303 0.0373 99 GLU E CD 5855 O OE1 . GLU C 104 ? 0.5102 0.5272 0.5935 -0.0347 0.0291 0.0381 99 GLU E OE1 5856 O OE2 . GLU C 104 ? 0.7120 0.7247 0.8049 -0.0352 0.0318 0.0401 99 GLU E OE2 5857 N N . GLU C 105 ? 0.3266 0.3489 0.3986 -0.0360 0.0257 0.0305 100 GLU E N 5858 C CA . GLU C 105 ? 0.3239 0.3470 0.3903 -0.0356 0.0238 0.0279 100 GLU E CA 5859 C C . GLU C 105 ? 0.3146 0.3403 0.3805 -0.0351 0.0248 0.0287 100 GLU E C 5860 O O . GLU C 105 ? 0.2831 0.3096 0.3477 -0.0349 0.0240 0.0260 100 GLU E O 5861 C CB . GLU C 105 ? 0.3482 0.3709 0.4078 -0.0350 0.0219 0.0286 100 GLU E CB 5862 C CG . GLU C 105 ? 0.3418 0.3628 0.4008 -0.0355 0.0204 0.0267 100 GLU E CG 5863 C CD . GLU C 105 ? 0.3417 0.3617 0.3993 -0.0360 0.0187 0.0225 100 GLU E CD 5864 O OE1 . GLU C 105 ? 0.3529 0.3729 0.4062 -0.0356 0.0175 0.0211 100 GLU E OE1 5865 O OE2 . GLU C 105 ? 0.3043 0.3236 0.3653 -0.0366 0.0185 0.0206 100 GLU E OE2 5866 N N . LEU C 106 ? 0.3264 0.3537 0.3934 -0.0349 0.0265 0.0325 101 LEU E N 5867 C CA . LEU C 106 ? 0.3386 0.3693 0.4059 -0.0346 0.0277 0.0335 101 LEU E CA 5868 C C . LEU C 106 ? 0.3519 0.3834 0.4248 -0.0357 0.0288 0.0316 101 LEU E C 5869 O O . LEU C 106 ? 0.3836 0.4179 0.4556 -0.0353 0.0286 0.0298 101 LEU E O 5870 C CB . LEU C 106 ? 0.3712 0.4038 0.4395 -0.0343 0.0295 0.0384 101 LEU E CB 5871 C CG . LEU C 106 ? 0.3565 0.3935 0.4254 -0.0341 0.0310 0.0400 101 LEU E CG 5872 C CD1 . LEU C 106 ? 0.3889 0.4279 0.4514 -0.0325 0.0294 0.0379 101 LEU E CD1 5873 C CD2 . LEU C 106 ? 0.3678 0.4066 0.4373 -0.0338 0.0327 0.0451 101 LEU E CD2 5874 N N . LYS C 107 ? 0.3635 0.3930 0.4425 -0.0371 0.0300 0.0319 102 LYS E N 5875 C CA . LYS C 107 ? 0.3953 0.4257 0.4800 -0.0387 0.0311 0.0302 102 LYS E CA 5876 C C . LYS C 107 ? 0.4183 0.4489 0.5014 -0.0384 0.0293 0.0254 102 LYS E C 5877 O O . LYS C 107 ? 0.4048 0.4382 0.4899 -0.0390 0.0296 0.0235 102 LYS E O 5878 C CB . LYS C 107 ? 0.4461 0.4731 0.5372 -0.0402 0.0323 0.0310 102 LYS E CB 5879 C CG . LYS C 107 ? 0.4759 0.5030 0.5697 -0.0406 0.0345 0.0360 102 LYS E CG 5880 C CD . LYS C 107 ? 0.5232 0.5468 0.6238 -0.0424 0.0359 0.0365 102 LYS E CD 5881 C CE . LYS C 107 ? 0.5769 0.5961 0.6780 -0.0416 0.0352 0.0364 102 LYS E CE 5882 N NZ . LYS C 107 ? 0.6528 0.6682 0.7608 -0.0432 0.0365 0.0361 102 LYS E NZ 5883 N N . HIS C 108 ? 0.4212 0.4491 0.5007 -0.0378 0.0273 0.0236 103 HIS E N 5884 C CA . HIS C 108 ? 0.4284 0.4563 0.5058 -0.0375 0.0254 0.0193 103 HIS E CA 5885 C C . HIS C 108 ? 0.3850 0.4153 0.4571 -0.0359 0.0242 0.0183 103 HIS E C 5886 O O . HIS C 108 ? 0.4121 0.4443 0.4846 -0.0357 0.0237 0.0153 103 HIS E O 5887 C CB . HIS C 108 ? 0.3932 0.4181 0.4677 -0.0372 0.0235 0.0180 103 HIS E CB 5888 C CG . HIS C 108 ? 0.3883 0.4130 0.4625 -0.0374 0.0219 0.0137 103 HIS E CG 5889 N ND1 . HIS C 108 ? 0.4144 0.4389 0.4824 -0.0364 0.0197 0.0118 103 HIS E ND1 5890 C CD2 . HIS C 108 ? 0.3606 0.3854 0.4399 -0.0385 0.0222 0.0110 103 HIS E CD2 5891 C CE1 . HIS C 108 ? 0.3642 0.3888 0.4335 -0.0367 0.0187 0.0084 103 HIS E CE1 5892 N NE2 . HIS C 108 ? 0.3667 0.3918 0.4428 -0.0381 0.0202 0.0077 103 HIS E NE2 5893 N N . LEU C 109 ? 0.3811 0.4116 0.4483 -0.0348 0.0239 0.0207 104 LEU E N 5894 C CA . LEU C 109 ? 0.4280 0.4608 0.4902 -0.0330 0.0231 0.0201 104 LEU E CA 5895 C C . LEU C 109 ? 0.4320 0.4695 0.4981 -0.0331 0.0249 0.0202 104 LEU E C 5896 O O . LEU C 109 ? 0.4658 0.5058 0.5302 -0.0319 0.0241 0.0176 104 LEU E O 5897 C CB . LEU C 109 ? 0.4527 0.4854 0.5101 -0.0321 0.0230 0.0231 104 LEU E CB 5898 C CG . LEU C 109 ? 0.4842 0.5170 0.5338 -0.0301 0.0211 0.0222 104 LEU E CG 5899 C CD1 . LEU C 109 ? 0.4806 0.5168 0.5289 -0.0291 0.0224 0.0253 104 LEU E CD1 5900 C CD2 . LEU C 109 ? 0.5309 0.5642 0.5783 -0.0288 0.0197 0.0185 104 LEU E CD2 5901 N N . LEU C 110 ? 0.4227 0.4618 0.4941 -0.0345 0.0273 0.0232 105 LEU E N 5902 C CA . LEU C 110 ? 0.4694 0.5136 0.5447 -0.0350 0.0292 0.0238 105 LEU E CA 5903 C C . LEU C 110 ? 0.4209 0.4661 0.5023 -0.0368 0.0298 0.0212 105 LEU E C 5904 O O . LEU C 110 ? 0.4492 0.4990 0.5340 -0.0376 0.0312 0.0213 105 LEU E O 5905 C CB . LEU C 110 ? 0.4733 0.5188 0.5518 -0.0361 0.0316 0.0285 105 LEU E CB 5906 C CG . LEU C 110 ? 0.4696 0.5158 0.5428 -0.0345 0.0314 0.0315 105 LEU E CG 5907 C CD1 . LEU C 110 ? 0.5057 0.5524 0.5823 -0.0356 0.0336 0.0363 105 LEU E CD1 5908 C CD2 . LEU C 110 ? 0.4644 0.5154 0.5335 -0.0325 0.0310 0.0306 105 LEU E CD2 5909 N N . SER C 111 ? 0.3920 0.4336 0.4745 -0.0375 0.0286 0.0185 106 SER E N 5910 C CA . SER C 111 ? 0.3775 0.4199 0.4660 -0.0394 0.0293 0.0161 106 SER E CA 5911 C C . SER C 111 ? 0.4001 0.4479 0.4884 -0.0387 0.0290 0.0134 106 SER E C 5912 O O . SER C 111 ? 0.4308 0.4822 0.5244 -0.0404 0.0305 0.0130 106 SER E O 5913 C CB . SER C 111 ? 0.3495 0.3877 0.4383 -0.0398 0.0279 0.0135 106 SER E CB 5914 O OG . SER C 111 ? 0.3841 0.4220 0.4672 -0.0379 0.0254 0.0106 106 SER E OG 5915 N N . ARG C 112 ? 0.4233 0.4715 0.5053 -0.0361 0.0270 0.0115 107 ARG E N 5916 C CA . ARG C 112 ? 0.4281 0.4815 0.5087 -0.0346 0.0265 0.0091 107 ARG E CA 5917 C C . ARG C 112 ? 0.4306 0.4852 0.5043 -0.0316 0.0255 0.0100 107 ARG E C 5918 O O . ARG C 112 ? 0.4712 0.5215 0.5389 -0.0300 0.0236 0.0098 107 ARG E O 5919 C CB . ARG C 112 ? 0.4689 0.5215 0.5487 -0.0340 0.0245 0.0048 107 ARG E CB 5920 C CG . ARG C 112 ? 0.4896 0.5474 0.5672 -0.0318 0.0237 0.0022 107 ARG E CG 5921 C CD . ARG C 112 ? 0.5696 0.6256 0.6442 -0.0304 0.0212 -0.0015 107 ARG E CD 5922 N NE . ARG C 112 ? 0.7716 0.8311 0.8517 -0.0318 0.0216 -0.0043 107 ARG E NE 5923 C CZ . ARG C 112 ? 1.0042 1.0622 1.0836 -0.0316 0.0199 -0.0074 107 ARG E CZ 5924 N NH1 . ARG C 112 ? 0.8866 0.9393 0.9601 -0.0301 0.0176 -0.0079 107 ARG E NH1 5925 N NH2 . ARG C 112 ? 1.1940 1.2560 1.2787 -0.0330 0.0204 -0.0100 107 ARG E NH2 5926 N N . ILE C 113 ? 0.4396 0.5003 0.5140 -0.0308 0.0267 0.0106 108 ILE E N 5927 C CA . ILE C 113 ? 0.4631 0.5259 0.5319 -0.0281 0.0263 0.0118 108 ILE E CA 5928 C C . ILE C 113 ? 0.5180 0.5876 0.5863 -0.0261 0.0262 0.0094 108 ILE E C 5929 O O . ILE C 113 ? 0.5782 0.6535 0.6522 -0.0277 0.0279 0.0092 108 ILE E O 5930 C CB . ILE C 113 ? 0.4380 0.5021 0.5085 -0.0293 0.0285 0.0165 108 ILE E CB 5931 C CG1 . ILE C 113 ? 0.4888 0.5463 0.5580 -0.0303 0.0281 0.0186 108 ILE E CG1 5932 C CG2 . ILE C 113 ? 0.4896 0.5575 0.5549 -0.0266 0.0283 0.0175 108 ILE E CG2 5933 C CD1 . ILE C 113 ? 0.4696 0.5227 0.5307 -0.0280 0.0257 0.0179 108 ILE E CD1 5934 N N . ASN C 114 ? 0.5385 0.6074 0.5997 -0.0225 0.0241 0.0076 109 ASN E N 5935 C CA . ASN C 114 ? 0.5263 0.6009 0.5859 -0.0198 0.0234 0.0048 109 ASN E CA 5936 C C . ASN C 114 ? 0.5355 0.6170 0.5946 -0.0185 0.0250 0.0068 109 ASN E C 5937 O O . ASN C 114 ? 0.5004 0.5896 0.5620 -0.0177 0.0259 0.0056 109 ASN E O 5938 C CB . ASN C 114 ? 0.5789 0.6486 0.6308 -0.0164 0.0202 0.0018 109 ASN E CB 5939 C CG . ASN C 114 ? 0.6451 0.7201 0.6943 -0.0126 0.0192 -0.0011 109 ASN E CG 5940 O OD1 . ASN C 114 ? 0.6345 0.7093 0.6774 -0.0091 0.0180 -0.0016 109 ASN E OD1 5941 N ND2 . ASN C 114 ? 0.6756 0.7556 0.7296 -0.0132 0.0197 -0.0032 109 ASN E ND2 5942 N N . HIS C 115 ? 0.4819 0.5613 0.5379 -0.0182 0.0253 0.0097 110 HIS E N 5943 C CA . HIS C 115 ? 0.4892 0.5754 0.5451 -0.0173 0.0270 0.0121 110 HIS E CA 5944 C C . HIS C 115 ? 0.5306 0.6144 0.5873 -0.0194 0.0284 0.0165 110 HIS E C 5945 O O . HIS C 115 ? 0.5496 0.6266 0.6020 -0.0190 0.0270 0.0169 110 HIS E O 5946 C CB . HIS C 115 ? 0.4991 0.5870 0.5474 -0.0126 0.0252 0.0100 110 HIS E CB 5947 C CG . HIS C 115 ? 0.5823 0.6780 0.6305 -0.0115 0.0270 0.0122 110 HIS E CG 5948 N ND1 . HIS C 115 ? 0.6804 0.7859 0.7333 -0.0119 0.0290 0.0125 110 HIS E ND1 5949 C CD2 . HIS C 115 ? 0.6709 0.7666 0.7149 -0.0102 0.0271 0.0143 110 HIS E CD2 5950 C CE1 . HIS C 115 ? 0.7264 0.8377 0.7779 -0.0107 0.0302 0.0147 110 HIS E CE1 5951 N NE2 . HIS C 115 ? 0.6872 0.7927 0.7332 -0.0096 0.0291 0.0158 110 HIS E NE2 5952 N N . PHE C 116 ? 0.5200 0.6097 0.5817 -0.0214 0.0312 0.0198 111 PHE E N 5953 C CA . PHE C 116 ? 0.5435 0.6314 0.6066 -0.0234 0.0327 0.0244 111 PHE E CA 5954 C C . PHE C 116 ? 0.5581 0.6546 0.6221 -0.0230 0.0348 0.0272 111 PHE E C 5955 O O . PHE C 116 ? 0.6722 0.7755 0.7410 -0.0244 0.0365 0.0274 111 PHE E O 5956 C CB . PHE C 116 ? 0.5498 0.6344 0.6200 -0.0275 0.0342 0.0262 111 PHE E CB 5957 C CG . PHE C 116 ? 0.5137 0.5941 0.5846 -0.0292 0.0352 0.0304 111 PHE E CG 5958 C CD1 . PHE C 116 ? 0.5531 0.6265 0.6195 -0.0283 0.0334 0.0302 111 PHE E CD1 5959 C CD2 . PHE C 116 ? 0.5899 0.6733 0.6659 -0.0317 0.0378 0.0348 111 PHE E CD2 5960 C CE1 . PHE C 116 ? 0.5583 0.6284 0.6255 -0.0296 0.0343 0.0341 111 PHE E CE1 5961 C CE2 . PHE C 116 ? 0.5687 0.6483 0.6454 -0.0329 0.0387 0.0389 111 PHE E CE2 5962 C CZ . PHE C 116 ? 0.5518 0.6249 0.6241 -0.0318 0.0369 0.0384 111 PHE E CZ 5963 N N . GLU C 117 ? 0.5536 0.6503 0.6128 -0.0213 0.0346 0.0292 112 GLU E N 5964 C CA . GLU C 117 ? 0.5431 0.6485 0.6026 -0.0207 0.0365 0.0319 112 GLU E CA 5965 C C . GLU C 117 ? 0.5630 0.6671 0.6208 -0.0212 0.0373 0.0362 112 GLU E C 5966 O O . GLU C 117 ? 0.5174 0.6173 0.5691 -0.0191 0.0355 0.0355 112 GLU E O 5967 C CB . GLU C 117 ? 0.5898 0.7002 0.6436 -0.0164 0.0350 0.0285 112 GLU E CB 5968 C CG . GLU C 117 ? 0.6459 0.7671 0.7004 -0.0156 0.0371 0.0308 112 GLU E CG 5969 C CD . GLU C 117 ? 0.6500 0.7762 0.6983 -0.0107 0.0355 0.0272 112 GLU E CD 5970 O OE1 . GLU C 117 ? 0.7634 0.8847 0.8072 -0.0080 0.0329 0.0228 112 GLU E OE1 5971 O OE2 . GLU C 117 ? 0.7115 0.8466 0.7594 -0.0095 0.0369 0.0289 112 GLU E OE2 5972 N N . LYS C 118 ? 0.5672 0.6751 0.6304 -0.0240 0.0400 0.0408 113 LYS E N 5973 C CA . LYS C 118 ? 0.6457 0.7543 0.7078 -0.0244 0.0411 0.0455 113 LYS E CA 5974 C C . LYS C 118 ? 0.6019 0.7182 0.6589 -0.0213 0.0412 0.0458 113 LYS E C 5975 O O . LYS C 118 ? 0.6337 0.7584 0.6920 -0.0206 0.0422 0.0454 113 LYS E O 5976 C CB . LYS C 118 ? 0.6604 0.7709 0.7299 -0.0283 0.0440 0.0505 113 LYS E CB 5977 C CG . LYS C 118 ? 0.7371 0.8472 0.8057 -0.0288 0.0452 0.0558 113 LYS E CG 5978 C CD . LYS C 118 ? 0.7916 0.8981 0.8667 -0.0326 0.0472 0.0604 113 LYS E CD 5979 C CE . LYS C 118 ? 0.8220 0.9356 0.9029 -0.0354 0.0499 0.0637 113 LYS E CE 5980 N NZ . LYS C 118 ? 0.8411 0.9606 0.9208 -0.0350 0.0515 0.0689 113 LYS E NZ 5981 N N . ILE C 119 ? 0.6592 0.7727 0.7104 -0.0193 0.0399 0.0462 114 ILE E N 5982 C CA . ILE C 119 ? 0.6240 0.7441 0.6701 -0.0164 0.0398 0.0464 114 ILE E CA 5983 C C . ILE C 119 ? 0.6293 0.7489 0.6738 -0.0169 0.0405 0.0509 114 ILE E C 5984 O O . ILE C 119 ? 0.6573 0.7699 0.7023 -0.0184 0.0401 0.0524 114 ILE E O 5985 C CB . ILE C 119 ? 0.6646 0.7818 0.7029 -0.0124 0.0367 0.0410 114 ILE E CB 5986 C CG1 . ILE C 119 ? 0.6707 0.7773 0.7053 -0.0126 0.0343 0.0397 114 ILE E CG1 5987 C CG2 . ILE C 119 ? 0.7504 0.8692 0.7895 -0.0111 0.0358 0.0366 114 ILE E CG2 5988 C CD1 . ILE C 119 ? 0.6883 0.7923 0.7143 -0.0089 0.0314 0.0355 114 ILE E CD1 5989 N N . LEU C 120 ? 0.6632 0.7914 0.7060 -0.0155 0.0417 0.0530 115 LEU E N 5990 C CA . LEU C 120 ? 0.6242 0.7535 0.6650 -0.0155 0.0423 0.0571 115 LEU E CA 5991 C C . LEU C 120 ? 0.6292 0.7544 0.6618 -0.0125 0.0395 0.0536 115 LEU E C 5992 O O . LEU C 120 ? 0.5474 0.6754 0.5754 -0.0094 0.0380 0.0495 115 LEU E O 5993 C CB . LEU C 120 ? 0.6918 0.8326 0.7336 -0.0151 0.0447 0.0605 115 LEU E CB 5994 C CG . LEU C 120 ? 0.6850 0.8292 0.7257 -0.0154 0.0459 0.0658 115 LEU E CG 5995 C CD1 . LEU C 120 ? 0.6348 0.7733 0.6804 -0.0188 0.0472 0.0707 115 LEU E CD1 5996 C CD2 . LEU C 120 ? 0.7358 0.8923 0.7778 -0.0150 0.0482 0.0687 115 LEU E CD2 5997 N N . ILE C 121 ? 0.6026 0.7216 0.6335 -0.0133 0.0386 0.0552 116 ILE E N 5998 C CA . ILE C 121 ? 0.5970 0.7124 0.6201 -0.0110 0.0360 0.0523 116 ILE E CA 5999 C C . ILE C 121 ? 0.5824 0.7014 0.6024 -0.0105 0.0364 0.0557 116 ILE E C 6000 O O . ILE C 121 ? 0.5692 0.6890 0.5824 -0.0080 0.0346 0.0533 116 ILE E O 6001 C CB . ILE C 121 ? 0.6178 0.7224 0.6397 -0.0120 0.0337 0.0497 116 ILE E CB 6002 C CG1 . ILE C 121 ? 0.6283 0.7289 0.6548 -0.0150 0.0349 0.0539 116 ILE E CG1 6003 C CG2 . ILE C 121 ? 0.6144 0.7158 0.6380 -0.0120 0.0329 0.0457 116 ILE E CG2 6004 C CD1 . ILE C 121 ? 0.6367 0.7284 0.6601 -0.0156 0.0326 0.0520 116 ILE E CD1 6005 N N . ILE C 122 ? 0.5875 0.7088 0.6123 -0.0126 0.0388 0.0613 117 ILE E N 6006 C CA . ILE C 122 ? 0.6568 0.7829 0.6791 -0.0121 0.0395 0.0652 117 ILE E CA 6007 C C . ILE C 122 ? 0.6260 0.7602 0.6538 -0.0134 0.0428 0.0709 117 ILE E C 6008 O O . ILE C 122 ? 0.5866 0.7184 0.6196 -0.0159 0.0444 0.0753 117 ILE E O 6009 C CB . ILE C 122 ? 0.6510 0.7706 0.6728 -0.0134 0.0387 0.0670 117 ILE E CB 6010 C CG1 . ILE C 122 ? 0.7202 0.8319 0.7366 -0.0125 0.0354 0.0617 117 ILE E CG1 6011 C CG2 . ILE C 122 ? 0.6539 0.7793 0.6733 -0.0127 0.0395 0.0712 117 ILE E CG2 6012 C CD1 . ILE C 122 ? 0.7248 0.8301 0.7409 -0.0141 0.0345 0.0631 117 ILE E CD1 6013 N N . PRO C 123 ? 0.6326 0.7765 0.6588 -0.0116 0.0437 0.0709 118 PRO E N 6014 C CA . PRO C 123 ? 0.6287 0.7805 0.6601 -0.0132 0.0468 0.0764 118 PRO E CA 6015 C C . PRO C 123 ? 0.5977 0.7506 0.6302 -0.0144 0.0482 0.0827 118 PRO E C 6016 O O . PRO C 123 ? 0.5605 0.7130 0.5881 -0.0129 0.0469 0.0825 118 PRO E O 6017 C CB . PRO C 123 ? 0.6642 0.8268 0.6925 -0.0105 0.0471 0.0746 118 PRO E CB 6018 C CG . PRO C 123 ? 0.6513 0.8103 0.6735 -0.0075 0.0441 0.0676 118 PRO E CG 6019 C CD . PRO C 123 ? 0.6221 0.7699 0.6418 -0.0081 0.0419 0.0659 118 PRO E CD 6020 N N . LYS C 124 ? 0.6029 0.7572 0.6420 -0.0172 0.0508 0.0881 119 LYS E N 6021 C CA . LYS C 124 ? 0.6295 0.7853 0.6702 -0.0182 0.0524 0.0948 119 LYS E CA 6022 C C . LYS C 124 ? 0.6368 0.8022 0.6726 -0.0159 0.0527 0.0967 119 LYS E C 6023 O O . LYS C 124 ? 0.6631 0.8282 0.6967 -0.0154 0.0525 0.0995 119 LYS E O 6024 C CB . LYS C 124 ? 0.6613 0.8196 0.7091 -0.0213 0.0554 0.1003 119 LYS E CB 6025 C CG . LYS C 124 ? 0.7456 0.8940 0.7991 -0.0241 0.0557 0.1019 119 LYS E CG 6026 C CD . LYS C 124 ? 0.8217 0.9722 0.8807 -0.0268 0.0586 0.1093 119 LYS E CD 6027 C CE . LYS C 124 ? 0.9280 1.0684 0.9929 -0.0296 0.0589 0.1104 119 LYS E CE 6028 N NZ . LYS C 124 ? 0.9890 1.1288 1.0578 -0.0314 0.0611 0.1180 119 LYS E NZ 6029 N N . SER C 125 ? 0.6928 0.8674 0.7271 -0.0145 0.0532 0.0950 120 SER E N 6030 C CA . SER C 125 ? 0.7074 0.8927 0.7376 -0.0124 0.0538 0.0969 120 SER E CA 6031 C C . SER C 125 ? 0.6893 0.8731 0.7118 -0.0093 0.0511 0.0925 120 SER E C 6032 O O . SER C 125 ? 0.7622 0.9538 0.7807 -0.0075 0.0512 0.0938 120 SER E O 6033 C CB . SER C 125 ? 0.7283 0.9240 0.7592 -0.0116 0.0551 0.0957 120 SER E CB 6034 O OG . SER C 125 ? 0.6880 0.8811 0.7165 -0.0098 0.0531 0.0886 120 SER E OG 6035 N N . SER C 126 ? 0.7002 0.8738 0.7206 -0.0091 0.0486 0.0876 121 SER E N 6036 C CA . SER C 126 ? 0.6872 0.8581 0.7003 -0.0068 0.0458 0.0834 121 SER E CA 6037 C C . SER C 126 ? 0.6459 0.8147 0.6579 -0.0074 0.0457 0.0873 121 SER E C 6038 O O . SER C 126 ? 0.7269 0.8963 0.7328 -0.0057 0.0438 0.0851 121 SER E O 6039 C CB . SER C 126 ? 0.6465 0.8073 0.6576 -0.0065 0.0431 0.0770 121 SER E CB 6040 O OG . SER C 126 ? 0.6874 0.8387 0.7020 -0.0090 0.0429 0.0784 121 SER E OG 6041 N N . TRP C 127 ? 0.6545 0.8206 0.6722 -0.0099 0.0474 0.0928 122 TRP E N 6042 C CA . TRP C 127 ? 0.7428 0.9068 0.7599 -0.0103 0.0473 0.0966 122 TRP E CA 6043 C C . TRP C 127 ? 0.7581 0.9328 0.7743 -0.0094 0.0491 0.1021 122 TRP E C 6044 O O . TRP C 127 ? 0.8716 1.0490 0.8927 -0.0108 0.0516 0.1084 122 TRP E O 6045 C CB . TRP C 127 ? 0.6860 0.8419 0.7094 -0.0129 0.0483 0.1000 122 TRP E CB 6046 C CG . TRP C 127 ? 0.6931 0.8390 0.7177 -0.0139 0.0466 0.0950 122 TRP E CG 6047 C CD1 . TRP C 127 ? 0.6574 0.7997 0.6870 -0.0155 0.0475 0.0940 122 TRP E CD1 6048 C CD2 . TRP C 127 ? 0.6995 0.8380 0.7202 -0.0135 0.0439 0.0906 122 TRP E CD2 6049 N NE1 . TRP C 127 ? 0.6923 0.8256 0.7213 -0.0159 0.0454 0.0892 122 TRP E NE1 6050 C CE2 . TRP C 127 ? 0.6825 0.8133 0.7061 -0.0148 0.0432 0.0871 122 TRP E CE2 6051 C CE3 . TRP C 127 ? 0.6827 0.8206 0.6977 -0.0124 0.0419 0.0893 122 TRP E CE3 6052 C CZ2 . TRP C 127 ? 0.6145 0.7371 0.6354 -0.0149 0.0406 0.0827 122 TRP E CZ2 6053 C CZ3 . TRP C 127 ? 0.6293 0.7589 0.6417 -0.0128 0.0393 0.0847 122 TRP E CZ3 6054 C CH2 . TRP C 127 ? 0.5878 0.7099 0.6032 -0.0140 0.0388 0.0816 122 TRP E CH2 6055 N N . THR C 128 ? 0.7244 0.9050 0.7341 -0.0070 0.0478 0.0997 123 THR E N 6056 C CA . THR C 128 ? 0.7407 0.9328 0.7490 -0.0059 0.0494 0.1043 123 THR E CA 6057 C C . THR C 128 ? 0.7131 0.9053 0.7217 -0.0063 0.0499 0.1098 123 THR E C 6058 O O . THR C 128 ? 0.6692 0.8691 0.6796 -0.0063 0.0521 0.1159 123 THR E O 6059 C CB . THR C 128 ? 0.7659 0.9655 0.7670 -0.0029 0.0479 0.0996 123 THR E CB 6060 O OG1 . THR C 128 ? 0.7250 0.9197 0.7203 -0.0020 0.0450 0.0956 123 THR E OG1 6061 C CG2 . THR C 128 ? 0.7016 0.9027 0.7019 -0.0017 0.0475 0.0943 123 THR E CG2 6062 N N . ASN C 129 ? 0.7475 0.9317 0.7544 -0.0066 0.0479 0.1077 124 ASN E N 6063 C CA . ASN C 129 ? 0.7063 0.8909 0.7127 -0.0066 0.0479 0.1122 124 ASN E CA 6064 C C . ASN C 129 ? 0.6667 0.8436 0.6791 -0.0085 0.0489 0.1163 124 ASN E C 6065 O O . ASN C 129 ? 0.6593 0.8356 0.6713 -0.0082 0.0487 0.1195 124 ASN E O 6066 C CB . ASN C 129 ? 0.7502 0.9330 0.7500 -0.0055 0.0450 0.1074 124 ASN E CB 6067 C CG . ASN C 129 ? 0.8143 1.0051 0.8077 -0.0034 0.0439 0.1037 124 ASN E CG 6068 O OD1 . ASN C 129 ? 0.9066 1.1073 0.8999 -0.0023 0.0456 0.1067 124 ASN E OD1 6069 N ND2 . ASN C 129 ? 0.8462 1.0327 0.8341 -0.0028 0.0410 0.0971 124 ASN E ND2 6070 N N . HIS C 130 ? 0.6174 0.7887 0.6352 -0.0102 0.0500 0.1162 125 HIS E N 6071 C CA . HIS C 130 ? 0.5881 0.7515 0.6118 -0.0120 0.0510 0.1199 125 HIS E CA 6072 C C . HIS C 130 ? 0.6375 0.8020 0.6675 -0.0137 0.0537 0.1239 125 HIS E C 6073 O O . HIS C 130 ? 0.6749 0.8442 0.7048 -0.0138 0.0544 0.1223 125 HIS E O 6074 C CB . HIS C 130 ? 0.5328 0.6855 0.5569 -0.0129 0.0490 0.1146 125 HIS E CB 6075 C CG . HIS C 130 ? 0.4925 0.6436 0.5106 -0.0117 0.0462 0.1105 125 HIS E CG 6076 N ND1 . HIS C 130 ? 0.4870 0.6403 0.4992 -0.0106 0.0442 0.1047 125 HIS E ND1 6077 C CD2 . HIS C 130 ? 0.4814 0.6291 0.4985 -0.0116 0.0451 0.1113 125 HIS E CD2 6078 C CE1 . HIS C 130 ? 0.4953 0.6463 0.5029 -0.0102 0.0420 0.1023 125 HIS E CE1 6079 N NE2 . HIS C 130 ? 0.4834 0.6314 0.4940 -0.0109 0.0425 0.1062 125 HIS E NE2 6080 N N . GLU C 131 ? 0.6684 0.8286 0.7035 -0.0149 0.0552 0.1294 126 GLU E N 6081 C CA . GLU C 131 ? 0.7352 0.8954 0.7764 -0.0171 0.0578 0.1339 126 GLU E CA 6082 C C . GLU C 131 ? 0.7543 0.9060 0.7992 -0.0190 0.0573 0.1293 126 GLU E C 6083 O O . GLU C 131 ? 0.7940 0.9367 0.8397 -0.0192 0.0558 0.1268 126 GLU E O 6084 C CB . GLU C 131 ? 0.8218 0.9787 0.8669 -0.0176 0.0592 0.1410 126 GLU E CB 6085 C CG . GLU C 131 ? 0.9864 1.1499 1.0342 -0.0183 0.0619 0.1488 126 GLU E CG 6086 C CD . GLU C 131 ? 1.0396 1.2108 1.0881 -0.0196 0.0634 0.1486 126 GLU E CD 6087 O OE1 . GLU C 131 ? 1.0234 1.1906 1.0761 -0.0219 0.0640 0.1468 126 GLU E OE1 6088 O OE2 . GLU C 131 ? 0.9906 1.1724 1.0354 -0.0181 0.0639 0.1502 126 GLU E OE2 6089 N N . THR C 132 ? 0.7026 0.8575 0.7499 -0.0204 0.0585 0.1285 127 THR E N 6090 C CA . THR C 132 ? 0.6949 0.8429 0.7456 -0.0222 0.0581 0.1241 127 THR E CA 6091 C C . THR C 132 ? 0.7172 0.8629 0.7751 -0.0253 0.0604 0.1283 127 THR E C 6092 O O . THR C 132 ? 0.6128 0.7535 0.6741 -0.0271 0.0602 0.1250 127 THR E O 6093 C CB . THR C 132 ? 0.6933 0.8465 0.7410 -0.0213 0.0572 0.1183 127 THR E CB 6094 O OG1 . THR C 132 ? 0.6857 0.8492 0.7343 -0.0217 0.0593 0.1216 127 THR E OG1 6095 C CG2 . THR C 132 ? 0.6408 0.7957 0.6811 -0.0184 0.0547 0.1136 127 THR E CG2 6096 N N . SER C 133 ? 0.7351 0.8845 0.7953 -0.0260 0.0625 0.1357 128 SER E N 6097 C CA . SER C 133 ? 0.7028 0.8509 0.7693 -0.0293 0.0649 0.1402 128 SER E CA 6098 C C . SER C 133 ? 0.7185 0.8585 0.7890 -0.0303 0.0657 0.1457 128 SER E C 6099 O O . SER C 133 ? 0.6878 0.8251 0.7637 -0.0333 0.0675 0.1497 128 SER E O 6100 C CB . SER C 133 ? 0.7211 0.8812 0.7874 -0.0298 0.0669 0.1447 128 SER E CB 6101 O OG . SER C 133 ? 0.7837 0.9478 0.8477 -0.0282 0.0676 0.1506 128 SER E OG 6102 N N . LEU C 134 ? 0.6819 0.8179 0.7497 -0.0280 0.0643 0.1458 129 LEU E N 6103 C CA . LEU C 134 ? 0.6590 0.7876 0.7298 -0.0281 0.0648 0.1509 129 LEU E CA 6104 C C . LEU C 134 ? 0.6486 0.7654 0.7217 -0.0283 0.0634 0.1470 129 LEU E C 6105 O O . LEU C 134 ? 0.6828 0.7929 0.7585 -0.0281 0.0637 0.1506 129 LEU E O 6106 C CB . LEU C 134 ? 0.7264 0.8597 0.7928 -0.0251 0.0645 0.1546 129 LEU E CB 6107 C CG . LEU C 134 ? 0.8708 1.0116 0.9375 -0.0251 0.0667 0.1628 129 LEU E CG 6108 C CD1 . LEU C 134 ? 0.9025 1.0512 0.9707 -0.0274 0.0686 0.1644 129 LEU E CD1 6109 C CD2 . LEU C 134 ? 0.8669 1.0152 0.9278 -0.0218 0.0659 0.1643 129 LEU E CD2 6110 N N . GLY C 135 ? 0.5883 0.7028 0.6601 -0.0283 0.0616 0.1397 130 GLY E N 6111 C CA . GLY C 135 ? 0.6040 0.7084 0.6776 -0.0285 0.0601 0.1356 130 GLY E CA 6112 C C . GLY C 135 ? 0.6091 0.7070 0.6888 -0.0316 0.0611 0.1349 130 GLY E C 6113 O O . GLY C 135 ? 0.6990 0.7956 0.7793 -0.0327 0.0602 0.1292 130 GLY E O 6114 N N . VAL C 136 ? 0.6047 0.6986 0.6890 -0.0331 0.0628 0.1407 131 VAL E N 6115 C CA . VAL C 136 ? 0.5964 0.6839 0.6870 -0.0365 0.0639 0.1408 131 VAL E CA 6116 C C . VAL C 136 ? 0.5796 0.6577 0.6734 -0.0362 0.0641 0.1443 131 VAL E C 6117 O O . VAL C 136 ? 0.5375 0.6160 0.6290 -0.0337 0.0640 0.1480 131 VAL E O 6118 C CB . VAL C 136 ? 0.6530 0.7464 0.7464 -0.0395 0.0662 0.1451 131 VAL E CB 6119 C CG1 . VAL C 136 ? 0.6780 0.7810 0.7686 -0.0396 0.0660 0.1411 131 VAL E CG1 6120 C CG2 . VAL C 136 ? 0.6144 0.7115 0.7073 -0.0389 0.0679 0.1535 131 VAL E CG2 6121 N N . SER C 137 ? 0.5792 0.6488 0.6781 -0.0387 0.0644 0.1430 132 SER E N 6122 C CA . SER C 137 ? 0.6319 0.6915 0.7338 -0.0380 0.0642 0.1451 132 SER E CA 6123 C C . SER C 137 ? 0.6817 0.7340 0.7898 -0.0418 0.0654 0.1462 132 SER E C 6124 O O . SER C 137 ? 0.7214 0.7749 0.8317 -0.0446 0.0656 0.1424 132 SER E O 6125 C CB . SER C 137 ? 0.6157 0.6703 0.7158 -0.0357 0.0619 0.1389 132 SER E CB 6126 O OG . SER C 137 ? 0.6633 0.7081 0.7666 -0.0350 0.0616 0.1401 132 SER E OG 6127 N N . ALA C 138 ? 0.6970 0.7420 0.8080 -0.0417 0.0662 0.1514 133 ALA E N 6128 C CA . ALA C 138 ? 0.7266 0.7626 0.8436 -0.0452 0.0671 0.1523 133 ALA E CA 6129 C C . ALA C 138 ? 0.6799 0.7092 0.7989 -0.0455 0.0655 0.1448 133 ALA E C 6130 O O . ALA C 138 ? 0.6571 0.6807 0.7808 -0.0489 0.0660 0.1435 133 ALA E O 6131 C CB . ALA C 138 ? 0.7093 0.7375 0.8284 -0.0444 0.0679 0.1590 133 ALA E CB 6132 N N . ALA C 139 ? 0.6804 0.7104 0.7958 -0.0422 0.0636 0.1399 134 ALA E N 6133 C CA . ALA C 139 ? 0.6709 0.6954 0.7878 -0.0425 0.0620 0.1325 134 ALA E CA 6134 C C . ALA C 139 ? 0.6343 0.6635 0.7518 -0.0453 0.0619 0.1274 134 ALA E C 6135 O O . ALA C 139 ? 0.6431 0.6678 0.7630 -0.0466 0.0610 0.1220 134 ALA E O 6136 C CB . ALA C 139 ? 0.6522 0.6768 0.7649 -0.0385 0.0599 0.1289 134 ALA E CB 6137 N N . CYS C 140 ? 0.6022 0.6410 0.7174 -0.0461 0.0628 0.1292 135 CYS E N 6138 C CA . CYS C 140 ? 0.5820 0.6266 0.6973 -0.0483 0.0627 0.1246 135 CYS E CA 6139 C C . CYS C 140 ? 0.5964 0.6467 0.7141 -0.0517 0.0649 0.1291 135 CYS E C 6140 O O . CYS C 140 ? 0.6045 0.6647 0.7189 -0.0512 0.0654 0.1301 135 CYS E O 6141 C CB . CYS C 140 ? 0.5839 0.6360 0.6930 -0.0453 0.0612 0.1209 135 CYS E CB 6142 S SG . CYS C 140 ? 0.6554 0.7021 0.7613 -0.0419 0.0585 0.1151 135 CYS E SG 6143 N N . PRO C 141 ? 0.6084 0.6527 0.7318 -0.0552 0.0662 0.1318 136 PRO E N 6144 C CA . PRO C 141 ? 0.6126 0.6622 0.7383 -0.0587 0.0684 0.1370 136 PRO E CA 6145 C C . PRO C 141 ? 0.6068 0.6634 0.7335 -0.0613 0.0687 0.1327 136 PRO E C 6146 O O . PRO C 141 ? 0.6143 0.6682 0.7420 -0.0616 0.0673 0.1262 136 PRO E O 6147 C CB . PRO C 141 ? 0.6250 0.6644 0.7562 -0.0618 0.0695 0.1407 136 PRO E CB 6148 C CG . PRO C 141 ? 0.6303 0.6599 0.7632 -0.0608 0.0677 0.1349 136 PRO E CG 6149 C CD . PRO C 141 ? 0.6577 0.6899 0.7851 -0.0560 0.0658 0.1310 136 PRO E CD 6150 N N . TYR C 142 ? 0.6444 0.7107 0.7707 -0.0630 0.0703 0.1364 137 TYR E N 6151 C CA . TYR C 142 ? 0.7061 0.7793 0.8348 -0.0664 0.0711 0.1340 137 TYR E CA 6152 C C . TYR C 142 ? 0.7454 0.8208 0.8782 -0.0709 0.0735 0.1409 137 TYR E C 6153 O O . TYR C 142 ? 0.6235 0.7036 0.7544 -0.0703 0.0748 0.1473 137 TYR E O 6154 C CB . TYR C 142 ? 0.7047 0.7899 0.8286 -0.0640 0.0706 0.1311 137 TYR E CB 6155 C CG . TYR C 142 ? 0.7902 0.8832 0.9163 -0.0669 0.0713 0.1282 137 TYR E CG 6156 C CD1 . TYR C 142 ? 0.8332 0.9218 0.9631 -0.0692 0.0706 0.1228 137 TYR E CD1 6157 C CD2 . TYR C 142 ? 0.8438 0.9493 0.9680 -0.0670 0.0725 0.1304 137 TYR E CD2 6158 C CE1 . TYR C 142 ? 0.8562 0.9529 0.9881 -0.0718 0.0711 0.1200 137 TYR E CE1 6159 C CE2 . TYR C 142 ? 0.8985 1.0123 1.0247 -0.0694 0.0731 0.1276 137 TYR E CE2 6160 C CZ . TYR C 142 ? 0.9172 1.0266 1.0472 -0.0718 0.0724 0.1225 137 TYR E CZ 6161 O OH . TYR C 142 ? 0.9366 1.0555 1.0685 -0.0740 0.0730 0.1199 137 TYR E OH 6162 N N . GLN C 143 ? 0.7930 0.8651 0.9312 -0.0756 0.0742 0.1397 138 GLN E N 6163 C CA . GLN C 143 ? 0.7573 0.8306 0.8997 -0.0807 0.0764 0.1460 138 GLN E CA 6164 C C . GLN C 143 ? 0.7338 0.7990 0.8764 -0.0801 0.0771 0.1533 138 GLN E C 6165 O O . GLN C 143 ? 0.7376 0.8071 0.8805 -0.0819 0.0789 0.1604 138 GLN E O 6166 C CB . GLN C 143 ? 0.8158 0.9041 0.9567 -0.0817 0.0779 0.1483 138 GLN E CB 6167 C CG . GLN C 143 ? 0.8972 0.9929 1.0394 -0.0833 0.0775 0.1419 138 GLN E CG 6168 C CD . GLN C 143 ? 0.9907 1.1022 1.1303 -0.0829 0.0786 0.1427 138 GLN E CD 6169 O OE1 . GLN C 143 ? 1.0219 1.1396 1.1572 -0.0799 0.0790 0.1462 138 GLN E OE1 6170 N NE2 . GLN C 143 ? 1.0426 1.1613 1.1848 -0.0858 0.0790 0.1393 138 GLN E NE2 6171 N N . GLY C 144 ? 0.7536 0.8076 0.8957 -0.0773 0.0756 0.1514 139 GLY E N 6172 C CA . GLY C 144 ? 0.7932 0.8388 0.9352 -0.0759 0.0760 0.1577 139 GLY E CA 6173 C C . GLY C 144 ? 0.8203 0.8709 0.9569 -0.0712 0.0759 0.1618 139 GLY E C 6174 O O . GLY C 144 ? 0.9191 0.9620 1.0550 -0.0687 0.0756 0.1653 139 GLY E O 6175 N N . THR C 145 ? 0.7897 0.8531 0.9224 -0.0697 0.0761 0.1611 140 THR E N 6176 C CA . THR C 145 ? 0.7928 0.8631 0.9199 -0.0653 0.0760 0.1641 140 THR E CA 6177 C C . THR C 145 ? 0.7514 0.8212 0.8737 -0.0600 0.0736 0.1578 140 THR E C 6178 O O . THR C 145 ? 0.6796 0.7496 0.8015 -0.0597 0.0722 0.1506 140 THR E O 6179 C CB . THR C 145 ? 0.7951 0.8800 0.9205 -0.0666 0.0776 0.1672 140 THR E CB 6180 O OG1 . THR C 145 ? 0.8532 0.9459 0.9727 -0.0620 0.0771 0.1677 140 THR E OG1 6181 C CG2 . THR C 145 ? 0.8108 0.9032 0.9373 -0.0688 0.0776 0.1615 140 THR E CG2 6182 N N . PRO C 146 ? 0.6869 0.7561 0.8053 -0.0560 0.0730 0.1607 141 PRO E N 6183 C CA . PRO C 146 ? 0.6769 0.7460 0.7910 -0.0517 0.0708 0.1548 141 PRO E CA 6184 C C . PRO C 146 ? 0.6865 0.7654 0.7968 -0.0506 0.0699 0.1491 141 PRO E C 6185 O O . PRO C 146 ? 0.6585 0.7477 0.7668 -0.0509 0.0710 0.1512 141 PRO E O 6186 C CB . PRO C 146 ? 0.6511 0.7213 0.7614 -0.0479 0.0707 0.1599 141 PRO E CB 6187 C CG . PRO C 146 ? 0.7041 0.7690 0.8183 -0.0501 0.0725 0.1676 141 PRO E CG 6188 C CD . PRO C 146 ? 0.6984 0.7673 0.8162 -0.0550 0.0743 0.1690 141 PRO E CD 6189 N N . SER C 147 ? 0.7277 0.8030 0.8367 -0.0491 0.0679 0.1418 142 SER E N 6190 C CA . SER C 147 ? 0.6607 0.7436 0.7660 -0.0479 0.0667 0.1358 142 SER E CA 6191 C C . SER C 147 ? 0.6491 0.7277 0.7508 -0.0446 0.0642 0.1299 142 SER E C 6192 O O . SER C 147 ? 0.6311 0.7048 0.7314 -0.0423 0.0634 0.1315 142 SER E O 6193 C CB . SER C 147 ? 0.6409 0.7255 0.7500 -0.0514 0.0673 0.1326 142 SER E CB 6194 O OG . SER C 147 ? 0.5758 0.6691 0.6812 -0.0502 0.0665 0.1280 142 SER E OG 6195 N N . PHE C 148 ? 0.5954 0.6762 0.6954 -0.0444 0.0628 0.1233 143 PHE E N 6196 C CA . PHE C 148 ? 0.6404 0.7181 0.7366 -0.0416 0.0604 0.1178 143 PHE E CA 6197 C C . PHE C 148 ? 0.6184 0.6976 0.7140 -0.0421 0.0592 0.1108 143 PHE E C 6198 O O . PHE C 148 ? 0.5974 0.6825 0.6943 -0.0438 0.0601 0.1103 143 PHE E O 6199 C CB . PHE C 148 ? 0.6236 0.7072 0.7135 -0.0382 0.0597 0.1191 143 PHE E CB 6200 C CG . PHE C 148 ? 0.6173 0.6968 0.7034 -0.0356 0.0573 0.1151 143 PHE E CG 6201 C CD1 . PHE C 148 ? 0.6054 0.6772 0.6930 -0.0348 0.0569 0.1167 143 PHE E CD1 6202 C CD2 . PHE C 148 ? 0.5786 0.6617 0.6593 -0.0338 0.0554 0.1099 143 PHE E CD2 6203 C CE1 . PHE C 148 ? 0.5899 0.6590 0.6740 -0.0325 0.0547 0.1132 143 PHE E CE1 6204 C CE2 . PHE C 148 ? 0.5605 0.6400 0.6376 -0.0317 0.0532 0.1066 143 PHE E CE2 6205 C CZ . PHE C 148 ? 0.5713 0.6442 0.6502 -0.0312 0.0529 0.1082 143 PHE E CZ 6206 N N . PHE C 149 ? 0.5625 0.6367 0.6558 -0.0404 0.0570 0.1057 144 PHE E N 6207 C CA . PHE C 149 ? 0.5325 0.6076 0.6242 -0.0402 0.0554 0.0989 144 PHE E CA 6208 C C . PHE C 149 ? 0.5338 0.6186 0.6218 -0.0393 0.0556 0.0983 144 PHE E C 6209 O O . PHE C 149 ? 0.5369 0.6264 0.6203 -0.0371 0.0554 0.1002 144 PHE E O 6210 C CB . PHE C 149 ? 0.4989 0.5698 0.5864 -0.0377 0.0529 0.0946 144 PHE E CB 6211 C CG . PHE C 149 ? 0.4888 0.5507 0.5793 -0.0380 0.0524 0.0944 144 PHE E CG 6212 C CD1 . PHE C 149 ? 0.4845 0.5408 0.5793 -0.0399 0.0521 0.0908 144 PHE E CD1 6213 C CD2 . PHE C 149 ? 0.4901 0.5495 0.5789 -0.0362 0.0520 0.0974 144 PHE E CD2 6214 C CE1 . PHE C 149 ? 0.4679 0.5162 0.5651 -0.0398 0.0514 0.0901 144 PHE E CE1 6215 C CE2 . PHE C 149 ? 0.4865 0.5381 0.5777 -0.0360 0.0514 0.0968 144 PHE E CE2 6216 C CZ . PHE C 149 ? 0.4634 0.5094 0.5588 -0.0378 0.0511 0.0931 144 PHE E CZ 6217 N N . ARG C 150 ? 0.5457 0.6339 0.6355 -0.0407 0.0559 0.0952 145 ARG E N 6218 C CA . ARG C 150 ? 0.6132 0.7114 0.7002 -0.0399 0.0563 0.0948 145 ARG E CA 6219 C C . ARG C 150 ? 0.5672 0.6679 0.6476 -0.0366 0.0540 0.0894 145 ARG E C 6220 O O . ARG C 150 ? 0.6628 0.7717 0.7399 -0.0352 0.0542 0.0893 145 ARG E O 6221 C CB . ARG C 150 ? 0.7141 0.8160 0.8061 -0.0429 0.0578 0.0943 145 ARG E CB 6222 C CG . ARG C 150 ? 0.8607 0.9614 0.9586 -0.0463 0.0603 0.1005 145 ARG E CG 6223 C CD . ARG C 150 ? 1.0440 1.1447 1.1482 -0.0503 0.0615 0.0998 145 ARG E CD 6224 N NE . ARG C 150 ? 1.2679 1.3793 1.3730 -0.0516 0.0630 0.1009 145 ARG E NE 6225 C CZ . ARG C 150 ? 1.4298 1.5463 1.5380 -0.0544 0.0654 0.1067 145 ARG E CZ 6226 N NH1 . ARG C 150 ? 1.3688 1.4800 1.4798 -0.0563 0.0667 0.1127 145 ARG E NH1 6227 N NH2 . ARG C 150 ? 1.4941 1.6215 1.6026 -0.0552 0.0665 0.1067 145 ARG E NH2 6228 N N . ASN C 151 ? 0.4982 0.5920 0.5766 -0.0355 0.0518 0.0850 146 ASN E N 6229 C CA . ASN C 151 ? 0.4818 0.5767 0.5540 -0.0328 0.0494 0.0797 146 ASN E CA 6230 C C . ASN C 151 ? 0.4942 0.5877 0.5604 -0.0304 0.0479 0.0801 146 ASN E C 6231 O O . ASN C 151 ? 0.5309 0.6257 0.5914 -0.0282 0.0460 0.0763 146 ASN E O 6232 C CB . ASN C 151 ? 0.4850 0.5741 0.5583 -0.0333 0.0478 0.0743 146 ASN E CB 6233 C CG . ASN C 151 ? 0.5131 0.6044 0.5917 -0.0356 0.0491 0.0731 146 ASN E CG 6234 O OD1 . ASN C 151 ? 0.5082 0.5942 0.5907 -0.0373 0.0488 0.0709 146 ASN E OD1 6235 N ND2 . ASN C 151 ? 0.5166 0.6166 0.5953 -0.0356 0.0504 0.0744 146 ASN E ND2 6236 N N . VAL C 152 ? 0.4758 0.5675 0.5432 -0.0307 0.0488 0.0849 147 VAL E N 6237 C CA . VAL C 152 ? 0.4982 0.5900 0.5605 -0.0287 0.0477 0.0860 147 VAL E CA 6238 C C . VAL C 152 ? 0.5287 0.6254 0.5920 -0.0287 0.0498 0.0926 147 VAL E C 6239 O O . VAL C 152 ? 0.5735 0.6716 0.6419 -0.0306 0.0519 0.0962 147 VAL E O 6240 C CB . VAL C 152 ? 0.5379 0.6214 0.6007 -0.0287 0.0463 0.0849 147 VAL E CB 6241 C CG1 . VAL C 152 ? 0.5463 0.6253 0.6071 -0.0286 0.0441 0.0785 147 VAL E CG1 6242 C CG2 . VAL C 152 ? 0.5440 0.6227 0.6135 -0.0308 0.0480 0.0885 147 VAL E CG2 6243 N N . VAL C 153 ? 0.6057 0.7052 0.6641 -0.0267 0.0491 0.0942 148 VAL E N 6244 C CA . VAL C 153 ? 0.5734 0.6791 0.6317 -0.0262 0.0509 0.1003 148 VAL E CA 6245 C C . VAL C 153 ? 0.5588 0.6617 0.6156 -0.0252 0.0504 0.1033 148 VAL E C 6246 O O . VAL C 153 ? 0.5086 0.6108 0.5604 -0.0236 0.0483 0.1004 148 VAL E O 6247 C CB . VAL C 153 ? 0.6163 0.7312 0.6691 -0.0243 0.0506 0.0996 148 VAL E CB 6248 C CG1 . VAL C 153 ? 0.6611 0.7829 0.7147 -0.0242 0.0528 0.1063 148 VAL E CG1 6249 C CG2 . VAL C 153 ? 0.7177 0.8364 0.7710 -0.0247 0.0509 0.0962 148 VAL E CG2 6250 N N . TRP C 154 ? 0.5644 0.6664 0.6255 -0.0261 0.0523 0.1092 149 TRP E N 6251 C CA . TRP C 154 ? 0.5636 0.6635 0.6239 -0.0248 0.0521 0.1127 149 TRP E CA 6252 C C . TRP C 154 ? 0.5689 0.6774 0.6252 -0.0231 0.0526 0.1166 149 TRP E C 6253 O O . TRP C 154 ? 0.5589 0.6713 0.6175 -0.0236 0.0547 0.1221 149 TRP E O 6254 C CB . TRP C 154 ? 0.5307 0.6248 0.5973 -0.0263 0.0537 0.1172 149 TRP E CB 6255 C CG . TRP C 154 ? 0.4739 0.5653 0.5405 -0.0249 0.0536 0.1209 149 TRP E CG 6256 C CD1 . TRP C 154 ? 0.4850 0.5786 0.5468 -0.0226 0.0522 0.1206 149 TRP E CD1 6257 C CD2 . TRP C 154 ? 0.4769 0.5622 0.5487 -0.0255 0.0549 0.1252 149 TRP E CD2 6258 N NE1 . TRP C 154 ? 0.5068 0.5966 0.5704 -0.0216 0.0525 0.1245 149 TRP E NE1 6259 C CE2 . TRP C 154 ? 0.5281 0.6126 0.5979 -0.0232 0.0542 0.1275 149 TRP E CE2 6260 C CE3 . TRP C 154 ? 0.5201 0.6003 0.5979 -0.0279 0.0565 0.1272 149 TRP E CE3 6261 C CZ2 . TRP C 154 ? 0.5186 0.5973 0.5922 -0.0227 0.0550 0.1318 149 TRP E CZ2 6262 C CZ3 . TRP C 154 ? 0.5170 0.5909 0.5987 -0.0276 0.0573 0.1315 149 TRP E CZ3 6263 C CH2 . TRP C 154 ? 0.4881 0.5613 0.5676 -0.0249 0.0565 0.1337 149 TRP E CH2 6264 N N . LEU C 155 ? 0.5808 0.6924 0.6309 -0.0213 0.0507 0.1133 150 LEU E N 6265 C CA . LEU C 155 ? 0.5420 0.6622 0.5876 -0.0196 0.0509 0.1159 150 LEU E CA 6266 C C . LEU C 155 ? 0.6134 0.7342 0.6595 -0.0186 0.0516 0.1217 150 LEU E C 6267 O O . LEU C 155 ? 0.6060 0.7210 0.6526 -0.0182 0.0506 0.1214 150 LEU E O 6268 C CB . LEU C 155 ? 0.5226 0.6448 0.5612 -0.0181 0.0484 0.1103 150 LEU E CB 6269 C CG . LEU C 155 ? 0.5409 0.6637 0.5777 -0.0183 0.0474 0.1045 150 LEU E CG 6270 C CD1 . LEU C 155 ? 0.5706 0.6933 0.6004 -0.0168 0.0446 0.0993 150 LEU E CD1 6271 C CD2 . LEU C 155 ? 0.5580 0.6893 0.5951 -0.0181 0.0492 0.1063 150 LEU E CD2 6272 N N . ILE C 156 ? 0.6248 0.7535 0.6703 -0.0179 0.0533 0.1269 151 ILE E N 6273 C CA . ILE C 156 ? 0.6188 0.7495 0.6645 -0.0167 0.0541 0.1331 151 ILE E CA 6274 C C . ILE C 156 ? 0.5950 0.7354 0.6346 -0.0147 0.0536 0.1339 151 ILE E C 6275 O O . ILE C 156 ? 0.6041 0.7507 0.6405 -0.0144 0.0533 0.1311 151 ILE E O 6276 C CB . ILE C 156 ? 0.6304 0.7606 0.6820 -0.0181 0.0569 0.1398 151 ILE E CB 6277 C CG1 . ILE C 156 ? 0.6082 0.7277 0.6655 -0.0200 0.0571 0.1388 151 ILE E CG1 6278 C CG2 . ILE C 156 ? 0.6513 0.7847 0.7029 -0.0166 0.0580 0.1471 151 ILE E CG2 6279 C CD1 . ILE C 156 ? 0.6005 0.7126 0.6583 -0.0189 0.0558 0.1383 151 ILE E CD1 6280 N N . LYS C 157 ? 0.6380 0.7804 0.6761 -0.0131 0.0534 0.1375 152 LYS E N 6281 C CA . LYS C 157 ? 0.7463 0.8989 0.7791 -0.0112 0.0531 0.1391 152 LYS E CA 6282 C C . LYS C 157 ? 0.7719 0.9332 0.8051 -0.0113 0.0553 0.1432 152 LYS E C 6283 O O . LYS C 157 ? 0.8151 0.9750 0.8533 -0.0127 0.0574 0.1475 152 LYS E O 6284 C CB . LYS C 157 ? 0.7488 0.9026 0.7808 -0.0095 0.0530 0.1436 152 LYS E CB 6285 C CG . LYS C 157 ? 0.7786 0.9334 0.8149 -0.0092 0.0555 0.1519 152 LYS E CG 6286 C CD . LYS C 157 ? 0.8277 0.9835 0.8630 -0.0071 0.0551 0.1559 152 LYS E CD 6287 C CE . LYS C 157 ? 0.8305 0.9871 0.8698 -0.0066 0.0575 0.1645 152 LYS E CE 6288 N NZ . LYS C 157 ? 0.8566 1.0121 0.8959 -0.0042 0.0570 0.1682 152 LYS E NZ 6289 N N . LYS C 158 ? 0.8030 0.9735 0.8308 -0.0099 0.0547 0.1417 153 LYS E N 6290 C CA . LYS C 158 ? 0.8603 1.0408 0.8878 -0.0098 0.0566 0.1452 153 LYS E CA 6291 C C . LYS C 158 ? 0.8588 1.0488 0.8817 -0.0076 0.0565 0.1485 153 LYS E C 6292 O O . LYS C 158 ? 0.7675 0.9586 0.7856 -0.0062 0.0544 0.1449 153 LYS E O 6293 C CB . LYS C 158 ? 0.8587 1.0422 0.8837 -0.0100 0.0559 0.1392 153 LYS E CB 6294 C CG . LYS C 158 ? 0.8650 1.0585 0.8907 -0.0101 0.0581 0.1426 153 LYS E CG 6295 C CD . LYS C 158 ? 0.8622 1.0596 0.8848 -0.0097 0.0572 0.1361 153 LYS E CD 6296 C CE . LYS C 158 ? 0.8958 1.1052 0.9184 -0.0094 0.0593 0.1395 153 LYS E CE 6297 N NZ . LYS C 158 ? 0.8552 1.0678 0.8761 -0.0090 0.0588 0.1336 153 LYS E NZ 6298 N N . ASN C 159 ? 0.9156 1.1129 0.9403 -0.0074 0.0589 0.1555 154 ASN E N 6299 C CA . ASN C 159 ? 0.8942 1.0998 0.9160 -0.0054 0.0592 0.1603 154 ASN E CA 6300 C C . ASN C 159 ? 0.8877 1.0854 0.9107 -0.0049 0.0581 0.1615 154 ASN E C 6301 O O . ASN C 159 ? 1.0147 1.2032 1.0430 -0.0062 0.0589 0.1634 154 ASN E O 6302 C CB . ASN C 159 ? 0.9256 1.1408 0.9405 -0.0037 0.0577 0.1560 154 ASN E CB 6303 C CG . ASN C 159 ? 0.9306 1.1520 0.9452 -0.0043 0.0587 0.1538 154 ASN E CG 6304 O OD1 . ASN C 159 ? 1.1263 1.3475 1.1374 -0.0040 0.0570 0.1467 154 ASN E OD1 6305 N ND2 . ASN C 159 ? 0.8658 1.0918 0.8843 -0.0052 0.0614 0.1600 154 ASN E ND2 6306 N N . ASP C 160 ? 0.7944 0.9949 0.8130 -0.0031 0.0564 0.1601 155 ASP E N 6307 C CA . ASP C 160 ? 0.8599 1.0520 0.8804 -0.0028 0.0554 0.1606 155 ASP E CA 6308 C C . ASP C 160 ? 0.8744 1.0628 0.8910 -0.0029 0.0525 0.1527 155 ASP E C 6309 O O . ASP C 160 ? 0.8130 1.0015 0.8274 -0.0018 0.0510 0.1522 155 ASP E O 6310 C CB . ASP C 160 ? 0.8923 1.0893 0.9127 -0.0007 0.0562 0.1676 155 ASP E CB 6311 C CG . ASP C 160 ? 0.9579 1.1459 0.9815 -0.0001 0.0557 0.1692 155 ASP E CG 6312 O OD1 . ASP C 160 ? 0.9590 1.1507 0.9806 0.0019 0.0550 0.1718 155 ASP E OD1 6313 O OD2 . ASP C 160 ? 0.9271 1.1048 0.9551 -0.0016 0.0559 0.1677 155 ASP E OD2 6314 N N . ALA C 161 ? 0.8077 0.9928 0.8235 -0.0044 0.0517 0.1465 156 ALA E N 6315 C CA . ALA C 161 ? 0.7694 0.9508 0.7811 -0.0047 0.0489 0.1389 156 ALA E CA 6316 C C . ALA C 161 ? 0.7386 0.9106 0.7526 -0.0065 0.0482 0.1335 156 ALA E C 6317 O O . ALA C 161 ? 0.7431 0.9137 0.7606 -0.0076 0.0497 0.1341 156 ALA E O 6318 C CB . ALA C 161 ? 0.7064 0.8967 0.7114 -0.0037 0.0476 0.1355 156 ALA E CB 6319 N N . TYR C 162 ? 0.6812 0.8471 0.6930 -0.0071 0.0458 0.1283 157 TYR E N 6320 C CA . TYR C 162 ? 0.5931 0.7506 0.6058 -0.0086 0.0446 0.1223 157 TYR E CA 6321 C C . TYR C 162 ? 0.5612 0.7193 0.5670 -0.0085 0.0417 0.1161 157 TYR E C 6322 O O . TYR C 162 ? 0.5032 0.6578 0.5075 -0.0089 0.0400 0.1144 157 TYR E O 6323 C CB . TYR C 162 ? 0.5212 0.6693 0.5390 -0.0096 0.0448 0.1231 157 TYR E CB 6324 C CG . TYR C 162 ? 0.5453 0.6851 0.5655 -0.0113 0.0442 0.1183 157 TYR E CG 6325 C CD1 . TYR C 162 ? 0.5417 0.6780 0.5577 -0.0119 0.0417 0.1114 157 TYR E CD1 6326 C CD2 . TYR C 162 ? 0.5526 0.6875 0.5791 -0.0123 0.0461 0.1206 157 TYR E CD2 6327 C CE1 . TYR C 162 ? 0.5061 0.6350 0.5243 -0.0133 0.0411 0.1071 157 TYR E CE1 6328 C CE2 . TYR C 162 ? 0.5788 0.7065 0.6076 -0.0139 0.0455 0.1161 157 TYR E CE2 6329 C CZ . TYR C 162 ? 0.5429 0.6677 0.5675 -0.0142 0.0431 0.1094 157 TYR E CZ 6330 O OH . TYR C 162 ? 0.5144 0.6325 0.5413 -0.0156 0.0425 0.1051 157 TYR E OH 6331 N N . PRO C 163 ? 0.5642 0.7277 0.5656 -0.0079 0.0411 0.1131 158 PRO E N 6332 C CA . PRO C 163 ? 0.5921 0.7545 0.5870 -0.0080 0.0382 0.1066 158 PRO E CA 6333 C C . PRO C 163 ? 0.6094 0.7615 0.6049 -0.0096 0.0366 0.1011 158 PRO E C 6334 O O . PRO C 163 ? 0.6263 0.7734 0.6266 -0.0103 0.0377 0.1012 158 PRO E O 6335 C CB . PRO C 163 ? 0.6103 0.7798 0.6013 -0.0068 0.0383 0.1046 158 PRO E CB 6336 C CG . PRO C 163 ? 0.5998 0.7720 0.5962 -0.0066 0.0412 0.1086 158 PRO E CG 6337 C CD . PRO C 163 ? 0.5803 0.7498 0.5828 -0.0073 0.0431 0.1149 158 PRO E CD 6338 N N . THR C 164 ? 0.5996 0.7489 0.5900 -0.0102 0.0338 0.0965 159 THR E N 6339 C CA . THR C 164 ? 0.6033 0.7431 0.5937 -0.0118 0.0320 0.0918 159 THR E CA 6340 C C . THR C 164 ? 0.6351 0.7721 0.6246 -0.0116 0.0316 0.0874 159 THR E C 6341 O O . THR C 164 ? 0.6915 0.8321 0.6758 -0.0106 0.0306 0.0843 159 THR E O 6342 C CB . THR C 164 ? 0.5915 0.7301 0.5760 -0.0126 0.0291 0.0883 159 THR E CB 6343 O OG1 . THR C 164 ? 0.5861 0.7277 0.5723 -0.0127 0.0296 0.0927 159 THR E OG1 6344 C CG2 . THR C 164 ? 0.6209 0.7498 0.6048 -0.0144 0.0271 0.0833 159 THR E CG2 6345 N N . ILE C 165 ? 0.6176 0.7481 0.6120 -0.0125 0.0324 0.0868 160 ILE E N 6346 C CA . ILE C 165 ? 0.5474 0.6748 0.5416 -0.0124 0.0321 0.0827 160 ILE E CA 6347 C C . ILE C 165 ? 0.5485 0.6692 0.5376 -0.0131 0.0289 0.0763 160 ILE E C 6348 O O . ILE C 165 ? 0.5123 0.6277 0.5012 -0.0146 0.0275 0.0755 160 ILE E O 6349 C CB . ILE C 165 ? 0.5758 0.6988 0.5774 -0.0133 0.0339 0.0845 160 ILE E CB 6350 C CG1 . ILE C 165 ? 0.5762 0.7056 0.5826 -0.0128 0.0371 0.0906 160 ILE E CG1 6351 C CG2 . ILE C 165 ? 0.5453 0.6642 0.5467 -0.0134 0.0332 0.0795 160 ILE E CG2 6352 C CD1 . ILE C 165 ? 0.5894 0.7143 0.6034 -0.0141 0.0390 0.0939 160 ILE E CD1 6353 N N . LYS C 166 ? 0.5281 0.6492 0.5125 -0.0120 0.0276 0.0718 161 LYS E N 6354 C CA . LYS C 166 ? 0.5609 0.6746 0.5405 -0.0125 0.0246 0.0657 161 LYS E CA 6355 C C . LYS C 166 ? 0.5843 0.6975 0.5638 -0.0111 0.0247 0.0624 161 LYS E C 6356 O O . LYS C 166 ? 0.5261 0.6446 0.5019 -0.0091 0.0246 0.0610 161 LYS E O 6357 C CB . LYS C 166 ? 0.6055 0.7201 0.5773 -0.0124 0.0220 0.0626 161 LYS E CB 6358 C CG . LYS C 166 ? 0.6801 0.7961 0.6511 -0.0139 0.0215 0.0653 161 LYS E CG 6359 C CD . LYS C 166 ? 0.7587 0.8756 0.7218 -0.0142 0.0188 0.0620 161 LYS E CD 6360 C CE . LYS C 166 ? 0.9142 1.0362 0.8771 -0.0151 0.0190 0.0658 161 LYS E CE 6361 N NZ . LYS C 166 ? 0.9727 1.0925 0.9291 -0.0169 0.0159 0.0625 161 LYS E NZ 6362 N N . ILE C 167 ? 0.5955 0.7027 0.5788 -0.0118 0.0249 0.0610 162 ILE E N 6363 C CA . ILE C 167 ? 0.6430 0.7502 0.6265 -0.0103 0.0251 0.0579 162 ILE E CA 6364 C C . ILE C 167 ? 0.6126 0.7105 0.5948 -0.0111 0.0229 0.0533 162 ILE E C 6365 O O . ILE C 167 ? 0.5638 0.6559 0.5469 -0.0131 0.0220 0.0534 162 ILE E O 6366 C CB . ILE C 167 ? 0.5898 0.7017 0.5805 -0.0102 0.0283 0.0617 162 ILE E CB 6367 C CG1 . ILE C 167 ? 0.5586 0.6651 0.5557 -0.0125 0.0293 0.0642 162 ILE E CG1 6368 C CG2 . ILE C 167 ? 0.6442 0.7658 0.6358 -0.0093 0.0305 0.0666 162 ILE E CG2 6369 C CD1 . ILE C 167 ? 0.5758 0.6842 0.5796 -0.0128 0.0319 0.0662 162 ILE E CD1 6370 N N . SER C 168 ? 0.5969 0.6939 0.5769 -0.0093 0.0221 0.0493 163 SER E N 6371 C CA . SER C 168 ? 0.6300 0.7188 0.6094 -0.0097 0.0203 0.0453 163 SER E CA 6372 C C . SER C 168 ? 0.6057 0.6966 0.5877 -0.0079 0.0214 0.0436 163 SER E C 6373 O O . SER C 168 ? 0.5604 0.6589 0.5423 -0.0059 0.0227 0.0443 163 SER E O 6374 C CB . SER C 168 ? 0.6624 0.7450 0.6337 -0.0096 0.0167 0.0407 163 SER E CB 6375 O OG . SER C 168 ? 0.6726 0.7579 0.6383 -0.0068 0.0157 0.0376 163 SER E OG 6376 N N . TYR C 169 ? 0.5942 0.6794 0.5790 -0.0088 0.0209 0.0417 164 TYR E N 6377 C CA . TYR C 169 ? 0.5578 0.6446 0.5450 -0.0072 0.0216 0.0397 164 TYR E CA 6378 C C . TYR C 169 ? 0.5362 0.6145 0.5195 -0.0066 0.0187 0.0345 164 TYR E C 6379 O O . TYR C 169 ? 0.4950 0.5663 0.4790 -0.0087 0.0176 0.0340 164 TYR E O 6380 C CB . TYR C 169 ? 0.5622 0.6512 0.5583 -0.0090 0.0245 0.0432 164 TYR E CB 6381 C CG . TYR C 169 ? 0.6135 0.7037 0.6119 -0.0077 0.0249 0.0406 164 TYR E CG 6382 C CD1 . TYR C 169 ? 0.6671 0.7659 0.6662 -0.0056 0.0265 0.0409 164 TYR E CD1 6383 C CD2 . TYR C 169 ? 0.6163 0.6997 0.6159 -0.0084 0.0237 0.0377 164 TYR E CD2 6384 C CE1 . TYR C 169 ? 0.6477 0.7483 0.6487 -0.0043 0.0267 0.0383 164 TYR E CE1 6385 C CE2 . TYR C 169 ? 0.6749 0.7598 0.6763 -0.0070 0.0239 0.0350 164 TYR E CE2 6386 C CZ . TYR C 169 ? 0.6977 0.7912 0.6999 -0.0050 0.0254 0.0354 164 TYR E CZ 6387 O OH . TYR C 169 ? 0.8516 0.9472 0.8558 -0.0037 0.0256 0.0327 164 TYR E OH 6388 N N . ASN C 170 ? 0.5204 0.5997 0.4994 -0.0036 0.0175 0.0307 165 ASN E N 6389 C CA . ASN C 170 ? 0.5905 0.6622 0.5653 -0.0024 0.0148 0.0257 165 ASN E CA 6390 C C . ASN C 170 ? 0.5712 0.6441 0.5511 -0.0017 0.0159 0.0247 165 ASN E C 6391 O O . ASN C 170 ? 0.5732 0.6539 0.5560 0.0000 0.0178 0.0253 165 ASN E O 6392 C CB . ASN C 170 ? 0.5622 0.6340 0.5289 0.0008 0.0126 0.0218 165 ASN E CB 6393 C CG . ASN C 170 ? 0.6389 0.7019 0.6002 0.0023 0.0094 0.0168 165 ASN E CG 6394 O OD1 . ASN C 170 ? 0.7441 0.8046 0.7081 0.0026 0.0093 0.0153 165 ASN E OD1 6395 N ND2 . ASN C 170 ? 0.6802 0.7385 0.6337 0.0031 0.0066 0.0141 165 ASN E ND2 6396 N N . ASN C 171 ? 0.5895 0.6553 0.5708 -0.0032 0.0148 0.0233 166 ASN E N 6397 C CA . ASN C 171 ? 0.6021 0.6690 0.5879 -0.0025 0.0156 0.0219 166 ASN E CA 6398 C C . ASN C 171 ? 0.6171 0.6836 0.5977 0.0014 0.0137 0.0171 166 ASN E C 6399 O O . ASN C 171 ? 0.5341 0.5932 0.5109 0.0022 0.0111 0.0136 166 ASN E O 6400 C CB . ASN C 171 ? 0.5431 0.6034 0.5325 -0.0053 0.0152 0.0219 166 ASN E CB 6401 C CG . ASN C 171 ? 0.5218 0.5839 0.5162 -0.0048 0.0161 0.0205 166 ASN E CG 6402 O OD1 . ASN C 171 ? 0.5509 0.6199 0.5469 -0.0026 0.0174 0.0200 166 ASN E OD1 6403 N ND2 . ASN C 171 ? 0.5296 0.5862 0.5265 -0.0067 0.0154 0.0199 166 ASN E ND2 6404 N N . THR C 172 ? 0.6422 0.7171 0.6229 0.0041 0.0150 0.0169 167 THR E N 6405 C CA . THR C 172 ? 0.6555 0.7311 0.6316 0.0085 0.0133 0.0124 167 THR E CA 6406 C C . THR C 172 ? 0.6538 0.7318 0.6346 0.0093 0.0141 0.0109 167 THR E C 6407 O O . THR C 172 ? 0.6488 0.7282 0.6265 0.0131 0.0129 0.0073 167 THR E O 6408 C CB . THR C 172 ? 0.6107 0.6955 0.5847 0.0114 0.0143 0.0125 167 THR E CB 6409 O OG1 . THR C 172 ? 0.5594 0.6538 0.5409 0.0099 0.0179 0.0165 167 THR E OG1 6410 C CG2 . THR C 172 ? 0.6375 0.7204 0.6060 0.0111 0.0133 0.0132 167 THR E CG2 6411 N N . ASN C 173 ? 0.6576 0.7361 0.6458 0.0059 0.0160 0.0136 168 ASN E N 6412 C CA . ASN C 173 ? 0.6006 0.6810 0.5934 0.0062 0.0166 0.0122 168 ASN E CA 6413 C C . ASN C 173 ? 0.6197 0.6901 0.6086 0.0068 0.0136 0.0086 168 ASN E C 6414 O O . ASN C 173 ? 0.7245 0.7868 0.7079 0.0063 0.0113 0.0078 168 ASN E O 6415 C CB . ASN C 173 ? 0.5961 0.6799 0.5980 0.0022 0.0196 0.0162 168 ASN E CB 6416 C CG . ASN C 173 ? 0.6377 0.7301 0.6431 0.0011 0.0226 0.0206 168 ASN E CG 6417 O OD1 . ASN C 173 ? 0.7405 0.8419 0.7483 0.0024 0.0243 0.0210 168 ASN E OD1 6418 N ND2 . ASN C 173 ? 0.6647 0.7548 0.6707 -0.0015 0.0232 0.0242 168 ASN E ND2 6419 N N . GLN C 174 ? 0.6644 0.7357 0.6561 0.0078 0.0135 0.0065 169 GLN E N 6420 C CA . GLN C 174 ? 0.7675 0.8302 0.7559 0.0085 0.0107 0.0032 169 GLN E CA 6421 C C . GLN C 174 ? 0.6623 0.7210 0.6562 0.0043 0.0113 0.0049 169 GLN E C 6422 O O . GLN C 174 ? 0.6323 0.6839 0.6241 0.0041 0.0093 0.0029 169 GLN E O 6423 C CB . GLN C 174 ? 0.8490 0.9151 0.8366 0.0125 0.0099 -0.0004 169 GLN E CB 6424 C CG . GLN C 174 ? 0.9048 0.9674 0.8834 0.0174 0.0070 -0.0043 169 GLN E CG 6425 C CD . GLN C 174 ? 1.0874 1.1528 1.0619 0.0188 0.0072 -0.0035 169 GLN E CD 6426 O OE1 . GLN C 174 ? 1.2538 1.3284 1.2325 0.0181 0.0100 -0.0009 169 GLN E OE1 6427 N NE2 . GLN C 174 ? 1.0942 1.1515 1.0602 0.0206 0.0042 -0.0058 169 GLN E NE2 6428 N N . GLU C 175 ? 0.6061 0.6693 0.6067 0.0010 0.0142 0.0088 170 GLU E N 6429 C CA . GLU C 175 ? 0.5601 0.6205 0.5665 -0.0028 0.0151 0.0105 170 GLU E CA 6430 C C . GLU C 175 ? 0.5285 0.5855 0.5352 -0.0058 0.0156 0.0138 170 GLU E C 6431 O O . GLU C 175 ? 0.5236 0.5835 0.5288 -0.0056 0.0165 0.0161 170 GLU E O 6432 C CB . GLU C 175 ? 0.6316 0.6999 0.6464 -0.0042 0.0181 0.0121 170 GLU E CB 6433 C CG . GLU C 175 ? 0.7515 0.8221 0.7676 -0.0023 0.0175 0.0087 170 GLU E CG 6434 C CD . GLU C 175 ? 0.8822 0.9634 0.9025 -0.0012 0.0198 0.0091 170 GLU E CD 6435 O OE1 . GLU C 175 ? 1.1649 1.2509 1.1814 0.0017 0.0198 0.0086 170 GLU E OE1 6436 O OE2 . GLU C 175 ? 0.8777 0.9626 0.9049 -0.0034 0.0215 0.0097 170 GLU E OE2 6437 N N . ASP C 176 ? 0.4994 0.5505 0.5079 -0.0085 0.0150 0.0141 171 ASP E N 6438 C CA . ASP C 176 ? 0.4818 0.5309 0.4924 -0.0116 0.0159 0.0176 171 ASP E CA 6439 C C . ASP C 176 ? 0.4585 0.5146 0.4752 -0.0129 0.0192 0.0215 171 ASP E C 6440 O O . ASP C 176 ? 0.4232 0.4844 0.4452 -0.0130 0.0210 0.0217 171 ASP E O 6441 C CB . ASP C 176 ? 0.4655 0.5097 0.4796 -0.0142 0.0156 0.0173 171 ASP E CB 6442 C CG . ASP C 176 ? 0.4849 0.5214 0.4929 -0.0139 0.0123 0.0145 171 ASP E CG 6443 O OD1 . ASP C 176 ? 0.4861 0.5197 0.4868 -0.0120 0.0102 0.0130 171 ASP E OD1 6444 O OD2 . ASP C 176 ? 0.5254 0.5585 0.5358 -0.0156 0.0118 0.0136 171 ASP E OD2 6445 N N . LEU C 177 ? 0.4608 0.5166 0.4771 -0.0143 0.0199 0.0248 172 LEU E N 6446 C CA . LEU C 177 ? 0.4314 0.4929 0.4533 -0.0157 0.0229 0.0290 172 LEU E CA 6447 C C . LEU C 177 ? 0.4317 0.4897 0.4577 -0.0187 0.0237 0.0319 172 LEU E C 6448 O O . LEU C 177 ? 0.4733 0.5267 0.4957 -0.0193 0.0222 0.0321 172 LEU E O 6449 C CB . LEU C 177 ? 0.4983 0.5635 0.5156 -0.0140 0.0230 0.0305 172 LEU E CB 6450 C CG . LEU C 177 ? 0.5522 0.6264 0.5719 -0.0130 0.0254 0.0328 172 LEU E CG 6451 C CD1 . LEU C 177 ? 0.5558 0.6344 0.5776 -0.0115 0.0258 0.0302 172 LEU E CD1 6452 C CD2 . LEU C 177 ? 0.5637 0.6400 0.5767 -0.0108 0.0244 0.0327 172 LEU E CD2 6453 N N . LEU C 178 ? 0.3997 0.4597 0.4332 -0.0207 0.0260 0.0340 173 LEU E N 6454 C CA . LEU C 178 ? 0.3927 0.4500 0.4303 -0.0231 0.0271 0.0371 173 LEU E CA 6455 C C . LEU C 178 ? 0.4296 0.4914 0.4680 -0.0231 0.0290 0.0417 173 LEU E C 6456 O O . LEU C 178 ? 0.4999 0.5673 0.5417 -0.0232 0.0312 0.0437 173 LEU E O 6457 C CB . LEU C 178 ? 0.3676 0.4245 0.4128 -0.0251 0.0287 0.0371 173 LEU E CB 6458 C CG . LEU C 178 ? 0.3598 0.4149 0.4106 -0.0274 0.0304 0.0407 173 LEU E CG 6459 C CD1 . LEU C 178 ? 0.3838 0.4334 0.4322 -0.0278 0.0288 0.0404 173 LEU E CD1 6460 C CD2 . LEU C 178 ? 0.3711 0.4259 0.4291 -0.0293 0.0317 0.0399 173 LEU E CD2 6461 N N . ILE C 179 ? 0.4173 0.4769 0.4525 -0.0232 0.0283 0.0435 174 ILE E N 6462 C CA . ILE C 179 ? 0.4155 0.4792 0.4510 -0.0232 0.0299 0.0480 174 ILE E CA 6463 C C . ILE C 179 ? 0.4060 0.4669 0.4454 -0.0249 0.0309 0.0513 174 ILE E C 6464 O O . ILE C 179 ? 0.6050 0.6608 0.6435 -0.0256 0.0294 0.0498 174 ILE E O 6465 C CB . ILE C 179 ? 0.3949 0.4599 0.4227 -0.0213 0.0282 0.0473 174 ILE E CB 6466 C CG1 . ILE C 179 ? 0.4007 0.4677 0.4243 -0.0192 0.0271 0.0435 174 ILE E CG1 6467 C CG2 . ILE C 179 ? 0.3851 0.4553 0.4131 -0.0211 0.0300 0.0520 174 ILE E CG2 6468 C CD1 . ILE C 179 ? 0.4276 0.4954 0.4433 -0.0172 0.0253 0.0424 174 ILE E CD1 6469 N N . LEU C 180 ? 0.4510 0.5155 0.4944 -0.0255 0.0333 0.0558 175 LEU E N 6470 C CA . LEU C 180 ? 0.4732 0.5356 0.5206 -0.0267 0.0345 0.0597 175 LEU E CA 6471 C C . LEU C 180 ? 0.4599 0.5269 0.5061 -0.0259 0.0358 0.0645 175 LEU E C 6472 O O . LEU C 180 ? 0.4562 0.5289 0.5016 -0.0252 0.0369 0.0660 175 LEU E O 6473 C CB . LEU C 180 ? 0.4248 0.4862 0.4801 -0.0285 0.0366 0.0612 175 LEU E CB 6474 C CG . LEU C 180 ? 0.4516 0.5090 0.5089 -0.0294 0.0356 0.0566 175 LEU E CG 6475 C CD1 . LEU C 180 ? 0.4545 0.5159 0.5143 -0.0297 0.0367 0.0554 175 LEU E CD1 6476 C CD2 . LEU C 180 ? 0.4214 0.4740 0.4844 -0.0310 0.0363 0.0574 175 LEU E CD2 6477 N N . TRP C 181 ? 0.4421 0.5067 0.4882 -0.0261 0.0355 0.0668 176 TRP E N 6478 C CA . TRP C 181 ? 0.4527 0.5212 0.4978 -0.0253 0.0366 0.0716 176 TRP E CA 6479 C C . TRP C 181 ? 0.4404 0.5050 0.4888 -0.0258 0.0369 0.0740 176 TRP E C 6480 O O . TRP C 181 ? 0.4866 0.5460 0.5374 -0.0267 0.0362 0.0715 176 TRP E O 6481 C CB . TRP C 181 ? 0.4655 0.5367 0.5032 -0.0239 0.0347 0.0703 176 TRP E CB 6482 C CG . TRP C 181 ? 0.5044 0.5708 0.5387 -0.0242 0.0323 0.0672 176 TRP E CG 6483 C CD1 . TRP C 181 ? 0.5062 0.5715 0.5397 -0.0243 0.0317 0.0689 176 TRP E CD1 6484 C CD2 . TRP C 181 ? 0.5079 0.5701 0.5394 -0.0245 0.0301 0.0619 176 TRP E CD2 6485 N NE1 . TRP C 181 ? 0.5369 0.5980 0.5672 -0.0249 0.0293 0.0650 176 TRP E NE1 6486 C CE2 . TRP C 181 ? 0.5076 0.5665 0.5365 -0.0251 0.0282 0.0608 176 TRP E CE2 6487 C CE3 . TRP C 181 ? 0.5019 0.5633 0.5327 -0.0243 0.0295 0.0582 176 TRP E CE3 6488 C CZ2 . TRP C 181 ? 0.5607 0.6150 0.5864 -0.0257 0.0259 0.0563 176 TRP E CZ2 6489 C CZ3 . TRP C 181 ? 0.5906 0.6472 0.6181 -0.0246 0.0271 0.0536 176 TRP E CZ3 6490 C CH2 . TRP C 181 ? 0.5997 0.6527 0.6247 -0.0255 0.0253 0.0528 176 TRP E CH2 6491 N N . GLY C 182 ? 0.4235 0.4910 0.4722 -0.0251 0.0380 0.0788 177 GLY E N 6492 C CA . GLY C 182 ? 0.3946 0.4587 0.4467 -0.0252 0.0386 0.0816 177 GLY E CA 6493 C C . GLY C 182 ? 0.4058 0.4736 0.4552 -0.0238 0.0387 0.0855 177 GLY E C 6494 O O . GLY C 182 ? 0.3982 0.4716 0.4433 -0.0229 0.0385 0.0865 177 GLY E O 6495 N N . VAL C 183 ? 0.4231 0.4880 0.4748 -0.0234 0.0387 0.0873 178 VAL E N 6496 C CA . VAL C 183 ? 0.4287 0.4969 0.4787 -0.0219 0.0389 0.0914 178 VAL E CA 6497 C C . VAL C 183 ? 0.4741 0.5401 0.5301 -0.0215 0.0410 0.0962 178 VAL E C 6498 O O . VAL C 183 ? 0.5198 0.5799 0.5805 -0.0223 0.0413 0.0951 178 VAL E O 6499 C CB . VAL C 183 ? 0.4246 0.4922 0.4711 -0.0214 0.0367 0.0892 178 VAL E CB 6500 C CG1 . VAL C 183 ? 0.4485 0.5098 0.4987 -0.0219 0.0362 0.0868 178 VAL E CG1 6501 C CG2 . VAL C 183 ? 0.4150 0.4870 0.4598 -0.0197 0.0370 0.0936 178 VAL E CG2 6502 N N . HIS C 184 ? 0.5167 0.5872 0.5723 -0.0203 0.0423 0.1015 179 HIS E N 6503 C CA . HIS C 184 ? 0.5490 0.6175 0.6096 -0.0196 0.0443 0.1069 179 HIS E CA 6504 C C . HIS C 184 ? 0.5331 0.6018 0.5928 -0.0176 0.0436 0.1089 179 HIS E C 6505 O O . HIS C 184 ? 0.5141 0.5885 0.5692 -0.0163 0.0429 0.1102 179 HIS E O 6506 C CB . HIS C 184 ? 0.5572 0.6309 0.6184 -0.0195 0.0463 0.1122 179 HIS E CB 6507 C CG . HIS C 184 ? 0.5575 0.6288 0.6231 -0.0188 0.0482 0.1182 179 HIS E CG 6508 N ND1 . HIS C 184 ? 0.5875 0.6641 0.6518 -0.0172 0.0493 0.1241 179 HIS E ND1 6509 C CD2 . HIS C 184 ? 0.5787 0.6427 0.6498 -0.0193 0.0491 0.1193 179 HIS E CD2 6510 C CE1 . HIS C 184 ? 0.5966 0.6688 0.6655 -0.0167 0.0508 0.1288 179 HIS E CE1 6511 N NE2 . HIS C 184 ? 0.6030 0.6674 0.6762 -0.0180 0.0506 0.1259 179 HIS E NE2 6512 N N . HIS C 185 ? 0.5461 0.6086 0.6099 -0.0172 0.0437 0.1088 180 HIS E N 6513 C CA . HIS C 185 ? 0.5701 0.6325 0.6341 -0.0149 0.0433 0.1112 180 HIS E CA 6514 C C . HIS C 185 ? 0.5363 0.5986 0.6034 -0.0135 0.0454 0.1180 180 HIS E C 6515 O O . HIS C 185 ? 0.5301 0.5865 0.6024 -0.0141 0.0468 0.1196 180 HIS E O 6516 C CB . HIS C 185 ? 0.5935 0.6493 0.6607 -0.0149 0.0424 0.1077 180 HIS E CB 6517 C CG . HIS C 185 ? 0.5512 0.6063 0.6157 -0.0164 0.0404 0.1013 180 HIS E CG 6518 N ND1 . HIS C 185 ? 0.5132 0.5730 0.5722 -0.0161 0.0386 0.0991 180 HIS E ND1 6519 C CD2 . HIS C 185 ? 0.5668 0.6173 0.6333 -0.0183 0.0400 0.0967 180 HIS E CD2 6520 C CE1 . HIS C 185 ? 0.5328 0.5905 0.5903 -0.0178 0.0370 0.0937 180 HIS E CE1 6521 N NE2 . HIS C 185 ? 0.5624 0.6146 0.6245 -0.0190 0.0378 0.0921 180 HIS E NE2 6522 N N . SER C 186 ? 0.5609 0.6298 0.6247 -0.0117 0.0456 0.1220 181 SER E N 6523 C CA . SER C 186 ? 0.5501 0.6201 0.6161 -0.0102 0.0475 0.1290 181 SER E CA 6524 C C . SER C 186 ? 0.5638 0.6300 0.6320 -0.0075 0.0472 0.1309 181 SER E C 6525 O O . SER C 186 ? 0.5286 0.5933 0.5961 -0.0069 0.0456 0.1269 181 SER E O 6526 C CB . SER C 186 ? 0.5476 0.6269 0.6088 -0.0092 0.0476 0.1322 181 SER E CB 6527 O OG . SER C 186 ? 0.5444 0.6287 0.6008 -0.0080 0.0457 0.1298 181 SER E OG 6528 N N . ASN C 187 ? 0.6348 0.6996 0.7058 -0.0059 0.0489 0.1372 182 ASN E N 6529 C CA . ASN C 187 ? 0.6473 0.7068 0.7212 -0.0031 0.0489 0.1395 182 ASN E CA 6530 C C . ASN C 187 ? 0.6052 0.6707 0.6762 0.0005 0.0483 0.1429 182 ASN E C 6531 O O . ASN C 187 ? 0.5881 0.6507 0.6604 0.0030 0.0476 0.1426 182 ASN E O 6532 C CB . ASN C 187 ? 0.7047 0.7573 0.7838 -0.0034 0.0509 0.1441 182 ASN E CB 6533 C CG . ASN C 187 ? 0.7396 0.7860 0.8222 -0.0070 0.0514 0.1404 182 ASN E CG 6534 O OD1 . ASN C 187 ? 0.8779 0.9211 0.9611 -0.0079 0.0501 0.1344 182 ASN E OD1 6535 N ND2 . ASN C 187 ? 0.7560 0.8011 0.8409 -0.0091 0.0532 0.1440 182 ASN E ND2 6536 N N . ASN C 188 ? 0.6078 0.6819 0.6747 0.0008 0.0485 0.1457 183 ASN E N 6537 C CA . ASN C 188 ? 0.6226 0.7038 0.6864 0.0041 0.0480 0.1491 183 ASN E CA 6538 C C . ASN C 188 ? 0.6790 0.7702 0.7379 0.0035 0.0480 0.1505 183 ASN E C 6539 O O . ASN C 188 ? 0.7457 0.8379 0.8040 0.0009 0.0488 0.1499 183 ASN E O 6540 C CB . ASN C 188 ? 0.7048 0.7828 0.7718 0.0073 0.0494 0.1559 183 ASN E CB 6541 C CG . ASN C 188 ? 0.7298 0.8055 0.7993 0.0058 0.0516 0.1610 183 ASN E CG 6542 O OD1 . ASN C 188 ? 0.7271 0.8098 0.7938 0.0049 0.0524 0.1638 183 ASN E OD1 6543 N ND2 . ASN C 188 ? 0.7168 0.7825 0.7913 0.0054 0.0525 0.1621 183 ASN E ND2 6544 N N . ALA C 189 ? 0.6721 0.7709 0.7274 0.0060 0.0472 0.1525 184 ALA E N 6545 C CA . ALA C 189 ? 0.6990 0.8081 0.7491 0.0057 0.0470 0.1535 184 ALA E CA 6546 C C . ALA C 189 ? 0.7076 0.8192 0.7582 0.0051 0.0490 0.1587 184 ALA E C 6547 O O . ALA C 189 ? 0.7166 0.8340 0.7640 0.0033 0.0490 0.1573 184 ALA E O 6548 C CB . ALA C 189 ? 0.6874 0.8042 0.7345 0.0088 0.0460 0.1557 184 ALA E CB 6549 N N . ALA C 190 ? 0.7177 0.8251 0.7723 0.0066 0.0508 0.1647 185 ALA E N 6550 C CA . ALA C 190 ? 0.7888 0.8988 0.8442 0.0060 0.0528 0.1704 185 ALA E CA 6551 C C . ALA C 190 ? 0.7599 0.8668 0.8168 0.0021 0.0536 0.1675 185 ALA E C 6552 O O . ALA C 190 ? 0.8358 0.9493 0.8904 0.0008 0.0543 0.1685 185 ALA E O 6553 C CB . ALA C 190 ? 0.8026 0.9074 0.8620 0.0082 0.0544 0.1775 185 ALA E CB 6554 N N . GLU C 191 ? 0.7031 0.8005 0.7638 0.0005 0.0534 0.1638 186 GLU E N 6555 C CA . GLU C 191 ? 0.6730 0.7673 0.7355 -0.0030 0.0540 0.1606 186 GLU E CA 6556 C C . GLU C 191 ? 0.6494 0.7500 0.7071 -0.0045 0.0526 0.1548 186 GLU E C 6557 O O . GLU C 191 ? 0.6295 0.7336 0.6863 -0.0064 0.0534 0.1543 186 GLU E O 6558 C CB . GLU C 191 ? 0.7625 0.8459 0.8298 -0.0042 0.0538 0.1572 186 GLU E CB 6559 C CG . GLU C 191 ? 0.8720 0.9520 0.9413 -0.0078 0.0543 0.1534 186 GLU E CG 6560 C CD . GLU C 191 ? 0.9800 1.0493 1.0544 -0.0089 0.0542 0.1506 186 GLU E CD 6561 O OE1 . GLU C 191 ? 1.0626 1.1256 1.1411 -0.0084 0.0555 0.1551 186 GLU E OE1 6562 O OE2 . GLU C 191 ? 1.0285 1.0954 1.1025 -0.0102 0.0528 0.1440 186 GLU E OE2 6563 N N . GLN C 192 ? 0.5837 0.6859 0.6381 -0.0034 0.0505 0.1506 187 GLN E N 6564 C CA . GLN C 192 ? 0.5525 0.6599 0.6018 -0.0046 0.0488 0.1450 187 GLN E CA 6565 C C . GLN C 192 ? 0.5856 0.7030 0.6307 -0.0043 0.0493 0.1475 187 GLN E C 6566 O O . GLN C 192 ? 0.6067 0.7266 0.6497 -0.0062 0.0492 0.1444 187 GLN E O 6567 C CB . GLN C 192 ? 0.5708 0.6789 0.6173 -0.0035 0.0466 0.1413 187 GLN E CB 6568 C CG . GLN C 192 ? 0.5425 0.6545 0.5835 -0.0050 0.0445 0.1352 187 GLN E CG 6569 C CD . GLN C 192 ? 0.5683 0.6747 0.6102 -0.0078 0.0440 0.1296 187 GLN E CD 6570 O OE1 . GLN C 192 ? 0.5627 0.6613 0.6094 -0.0086 0.0447 0.1287 187 GLN E OE1 6571 N NE2 . GLN C 192 ? 0.5133 0.6237 0.5505 -0.0090 0.0429 0.1258 187 GLN E NE2 6572 N N . THR C 193 ? 0.6209 0.7442 0.6646 -0.0019 0.0499 0.1529 188 THR E N 6573 C CA . THR C 193 ? 0.6639 0.7974 0.7036 -0.0015 0.0504 0.1556 188 THR E CA 6574 C C . THR C 193 ? 0.5992 0.7328 0.6418 -0.0027 0.0527 0.1594 188 THR E C 6575 O O . THR C 193 ? 0.6162 0.7562 0.6563 -0.0037 0.0532 0.1589 188 THR E O 6576 C CB . THR C 193 ? 0.6925 0.8336 0.7297 0.0014 0.0503 0.1604 188 THR E CB 6577 O OG1 . THR C 193 ? 0.8224 0.9592 0.8640 0.0033 0.0518 0.1665 188 THR E OG1 6578 C CG2 . THR C 193 ? 0.7356 0.8781 0.7694 0.0022 0.0479 0.1561 188 THR E CG2 6579 N N . ASN C 194 ? 0.6516 0.7780 0.6997 -0.0029 0.0542 0.1631 189 ASN E N 6580 C CA . ASN C 194 ? 0.7270 0.8531 0.7781 -0.0046 0.0565 0.1670 189 ASN E CA 6581 C C . ASN C 194 ? 0.7418 0.8676 0.7930 -0.0075 0.0565 0.1619 189 ASN E C 6582 O O . ASN C 194 ? 0.8250 0.9561 0.8761 -0.0087 0.0579 0.1643 189 ASN E O 6583 C CB . ASN C 194 ? 0.8148 0.9312 0.8720 -0.0049 0.0577 0.1706 189 ASN E CB 6584 C CG . ASN C 194 ? 0.9112 1.0297 0.9704 -0.0046 0.0600 0.1788 189 ASN E CG 6585 O OD1 . ASN C 194 ? 1.0318 1.1514 1.0909 -0.0019 0.0603 0.1842 189 ASN E OD1 6586 N ND2 . ASN C 194 ? 0.8987 1.0186 0.9596 -0.0074 0.0615 0.1799 189 ASN E ND2 6587 N N . LEU C 195 ? 0.7027 0.8224 0.7542 -0.0087 0.0549 0.1552 190 LEU E N 6588 C CA . LEU C 195 ? 0.6726 0.7910 0.7242 -0.0112 0.0546 0.1498 190 LEU E CA 6589 C C . LEU C 195 ? 0.6191 0.7439 0.6646 -0.0110 0.0529 0.1444 190 LEU E C 6590 O O . LEU C 195 ? 0.5941 0.7224 0.6384 -0.0122 0.0532 0.1423 190 LEU E O 6591 C CB . LEU C 195 ? 0.6824 0.7905 0.7375 -0.0125 0.0538 0.1452 190 LEU E CB 6592 C CG . LEU C 195 ? 0.6710 0.7711 0.7325 -0.0133 0.0554 0.1491 190 LEU E CG 6593 C CD1 . LEU C 195 ? 0.6374 0.7286 0.7015 -0.0142 0.0541 0.1436 190 LEU E CD1 6594 C CD2 . LEU C 195 ? 0.6679 0.7692 0.7327 -0.0156 0.0576 0.1523 190 LEU E CD2 6595 N N . TYR C 196 ? 0.5957 0.7220 0.6373 -0.0094 0.0510 0.1424 191 TYR E N 6596 C CA . TYR C 196 ? 0.6294 0.7595 0.6652 -0.0096 0.0488 0.1364 191 TYR E CA 6597 C C . TYR C 196 ? 0.6492 0.7878 0.6795 -0.0078 0.0478 0.1375 191 TYR E C 6598 O O . TYR C 196 ? 0.6564 0.7981 0.6815 -0.0080 0.0460 0.1327 191 TYR E O 6599 C CB . TYR C 196 ? 0.6074 0.7298 0.6432 -0.0105 0.0467 0.1303 191 TYR E CB 6600 C CG . TYR C 196 ? 0.5335 0.6472 0.5748 -0.0122 0.0475 0.1287 191 TYR E CG 6601 C CD1 . TYR C 196 ? 0.5358 0.6490 0.5782 -0.0139 0.0482 0.1265 191 TYR E CD1 6602 C CD2 . TYR C 196 ? 0.5328 0.6392 0.5782 -0.0120 0.0475 0.1294 191 TYR E CD2 6603 C CE1 . TYR C 196 ? 0.5542 0.6600 0.6016 -0.0156 0.0488 0.1250 191 TYR E CE1 6604 C CE2 . TYR C 196 ? 0.5525 0.6510 0.6029 -0.0137 0.0481 0.1277 191 TYR E CE2 6605 C CZ . TYR C 196 ? 0.5243 0.6227 0.5757 -0.0156 0.0488 0.1256 191 TYR E CZ 6606 O OH . TYR C 196 ? 0.4904 0.5818 0.5467 -0.0174 0.0493 0.1238 191 TYR E OH 6607 N N . LYS C 197 ? 0.6571 0.7992 0.6884 -0.0059 0.0489 0.1438 192 LYS E N 6608 C CA . LYS C 197 ? 0.7109 0.8618 0.7374 -0.0041 0.0481 0.1456 192 LYS E CA 6609 C C . LYS C 197 ? 0.6980 0.8476 0.7215 -0.0038 0.0457 0.1414 192 LYS E C 6610 O O . LYS C 197 ? 0.7432 0.8943 0.7670 -0.0020 0.0455 0.1445 192 LYS E O 6611 C CB . LYS C 197 ? 0.8328 0.9922 0.8547 -0.0043 0.0480 0.1439 192 LYS E CB 6612 C CG . LYS C 197 ? 0.8564 1.0257 0.8729 -0.0026 0.0472 0.1453 192 LYS E CG 6613 C CD . LYS C 197 ? 0.9369 1.1117 0.9555 -0.0007 0.0492 0.1535 192 LYS E CD 6614 C CE . LYS C 197 ? 0.9856 1.1720 0.9988 0.0009 0.0487 0.1551 192 LYS E CE 6615 N NZ . LYS C 197 ? 1.0637 1.2532 1.0786 0.0032 0.0497 0.1621 192 LYS E NZ 6616 N N . ASN C 198 ? 0.6845 0.8311 0.7052 -0.0055 0.0438 0.1345 193 ASN E N 6617 C CA . ASN C 198 ? 0.6464 0.7920 0.6638 -0.0058 0.0413 0.1302 193 ASN E CA 6618 C C . ASN C 198 ? 0.6167 0.7549 0.6385 -0.0056 0.0412 0.1305 193 ASN E C 6619 O O . ASN C 198 ? 0.6745 0.8052 0.7006 -0.0066 0.0419 0.1296 193 ASN E O 6620 C CB . ASN C 198 ? 0.6129 0.7563 0.6264 -0.0078 0.0394 0.1230 193 ASN E CB 6621 C CG . ASN C 198 ? 0.6558 0.8059 0.6653 -0.0077 0.0395 0.1223 193 ASN E CG 6622 O OD1 . ASN C 198 ? 0.7042 0.8628 0.7110 -0.0063 0.0399 0.1254 193 ASN E OD1 6623 N ND2 . ASN C 198 ? 0.6033 0.7503 0.6124 -0.0089 0.0394 0.1183 193 ASN E ND2 6624 N N . PRO C 199 ? 0.6705 0.8113 0.6914 -0.0041 0.0403 0.1321 194 PRO E N 6625 C CA . PRO C 199 ? 0.6810 0.8154 0.7061 -0.0034 0.0403 0.1326 194 PRO E CA 6626 C C . PRO C 199 ? 0.6591 0.7874 0.6837 -0.0054 0.0383 0.1261 194 PRO E C 6627 O O . PRO C 199 ? 0.6010 0.7220 0.6299 -0.0055 0.0386 0.1254 194 PRO E O 6628 C CB . PRO C 199 ? 0.6274 0.7686 0.6509 -0.0010 0.0399 0.1363 194 PRO E CB 6629 C CG . PRO C 199 ? 0.6503 0.8002 0.6675 -0.0016 0.0386 0.1345 194 PRO E CG 6630 C CD . PRO C 199 ? 0.6884 0.8390 0.7048 -0.0027 0.0397 0.1343 194 PRO E CD 6631 N N . THR C 200 ? 0.6358 0.7673 0.6549 -0.0069 0.0362 0.1215 195 THR E N 6632 C CA . THR C 200 ? 0.6927 0.8195 0.7102 -0.0089 0.0341 0.1157 195 THR E CA 6633 C C . THR C 200 ? 0.6598 0.7832 0.6751 -0.0112 0.0334 0.1109 195 THR E C 6634 O O . THR C 200 ? 0.5854 0.7132 0.5956 -0.0118 0.0324 0.1091 195 THR E O 6635 C CB . THR C 200 ? 0.7294 0.8624 0.7420 -0.0091 0.0320 0.1143 195 THR E CB 6636 O OG1 . THR C 200 ? 0.7592 0.8951 0.7743 -0.0067 0.0326 0.1186 195 THR E OG1 6637 C CG2 . THR C 200 ? 0.7720 0.9007 0.7821 -0.0117 0.0296 0.1082 195 THR E CG2 6638 N N . THR C 201 ? 0.5954 0.7109 0.6145 -0.0122 0.0338 0.1088 196 THR E N 6639 C CA . THR C 201 ? 0.5718 0.6844 0.5896 -0.0137 0.0336 0.1050 196 THR E CA 6640 C C . THR C 201 ? 0.5583 0.6638 0.5760 -0.0157 0.0319 0.0994 196 THR E C 6641 O O . THR C 201 ? 0.4906 0.5931 0.5101 -0.0159 0.0312 0.0986 196 THR E O 6642 C CB . THR C 201 ? 0.5819 0.6929 0.6045 -0.0132 0.0361 0.1081 196 THR E CB 6643 O OG1 . THR C 201 ? 0.5365 0.6410 0.5652 -0.0131 0.0372 0.1093 196 THR E OG1 6644 C CG2 . THR C 201 ? 0.5950 0.7134 0.6175 -0.0114 0.0379 0.1140 196 THR E CG2 6645 N N . TYR C 202 ? 0.5258 0.6293 0.5412 -0.0169 0.0312 0.0955 197 TYR E N 6646 C CA . TYR C 202 ? 0.5060 0.6030 0.5204 -0.0188 0.0295 0.0901 197 TYR E CA 6647 C C . TYR C 202 ? 0.5079 0.6026 0.5222 -0.0192 0.0299 0.0875 197 TYR E C 6648 O O . TYR C 202 ? 0.4702 0.5692 0.4838 -0.0183 0.0311 0.0893 197 TYR E O 6649 C CB . TYR C 202 ? 0.5178 0.6161 0.5258 -0.0201 0.0267 0.0865 197 TYR E CB 6650 C CG . TYR C 202 ? 0.5283 0.6308 0.5303 -0.0200 0.0258 0.0852 197 TYR E CG 6651 C CD1 . TYR C 202 ? 0.5513 0.6617 0.5511 -0.0188 0.0263 0.0885 197 TYR E CD1 6652 C CD2 . TYR C 202 ? 0.5261 0.6252 0.5248 -0.0210 0.0245 0.0805 197 TYR E CD2 6653 C CE1 . TYR C 202 ? 0.5391 0.6537 0.5334 -0.0187 0.0255 0.0870 197 TYR E CE1 6654 C CE2 . TYR C 202 ? 0.5194 0.6222 0.5125 -0.0207 0.0236 0.0790 197 TYR E CE2 6655 C CZ . TYR C 202 ? 0.5555 0.6663 0.5465 -0.0196 0.0241 0.0822 197 TYR E CZ 6656 O OH . TYR C 202 ? 0.6051 0.7202 0.5905 -0.0191 0.0233 0.0806 197 TYR E OH 6657 N N . ILE C 203 ? 0.4848 0.5731 0.4999 -0.0206 0.0288 0.0833 198 ILE E N 6658 C CA . ILE C 203 ? 0.4816 0.5675 0.4952 -0.0211 0.0284 0.0797 198 ILE E CA 6659 C C . ILE C 203 ? 0.4468 0.5281 0.4559 -0.0226 0.0256 0.0743 198 ILE E C 6660 O O . ILE C 203 ? 0.4371 0.5143 0.4478 -0.0236 0.0248 0.0730 198 ILE E O 6661 C CB . ILE C 203 ? 0.4935 0.5756 0.5134 -0.0212 0.0302 0.0801 198 ILE E CB 6662 C CG1 . ILE C 203 ? 0.5102 0.5959 0.5347 -0.0201 0.0330 0.0857 198 ILE E CG1 6663 C CG2 . ILE C 203 ? 0.4557 0.5360 0.4739 -0.0215 0.0297 0.0760 198 ILE E CG2 6664 C CD1 . ILE C 203 ? 0.5393 0.6201 0.5710 -0.0207 0.0347 0.0868 198 ILE E CD1 6665 N N . SER C 204 ? 0.4297 0.5115 0.4332 -0.0226 0.0241 0.0711 199 SER E N 6666 C CA . SER C 204 ? 0.4547 0.5314 0.4537 -0.0240 0.0214 0.0659 199 SER E CA 6667 C C . SER C 204 ? 0.4501 0.5235 0.4492 -0.0236 0.0214 0.0627 199 SER E C 6668 O O . SER C 204 ? 0.5117 0.5887 0.5103 -0.0222 0.0224 0.0633 199 SER E O 6669 C CB . SER C 204 ? 0.4427 0.5218 0.4342 -0.0245 0.0192 0.0643 199 SER E CB 6670 O OG . SER C 204 ? 0.5058 0.5881 0.4970 -0.0251 0.0190 0.0669 199 SER E OG 6671 N N . VAL C 205 ? 0.4484 0.5156 0.4477 -0.0247 0.0200 0.0593 200 VAL E N 6672 C CA . VAL C 205 ? 0.4356 0.4995 0.4348 -0.0242 0.0198 0.0560 200 VAL E CA 6673 C C . VAL C 205 ? 0.4549 0.5131 0.4487 -0.0254 0.0168 0.0514 200 VAL E C 6674 O O . VAL C 205 ? 0.4662 0.5211 0.4602 -0.0271 0.0156 0.0507 200 VAL E O 6675 C CB . VAL C 205 ? 0.4434 0.5054 0.4500 -0.0244 0.0217 0.0569 200 VAL E CB 6676 C CG1 . VAL C 205 ? 0.5287 0.5895 0.5359 -0.0235 0.0219 0.0543 200 VAL E CG1 6677 C CG2 . VAL C 205 ? 0.4337 0.5003 0.4458 -0.0237 0.0245 0.0622 200 VAL E CG2 6678 N N . GLY C 206 ? 0.4257 0.4830 0.4146 -0.0244 0.0154 0.0482 201 GLY E N 6679 C CA . GLY C 206 ? 0.4212 0.4725 0.4041 -0.0253 0.0123 0.0439 201 GLY E CA 6680 C C . GLY C 206 ? 0.4041 0.4524 0.3856 -0.0237 0.0118 0.0404 201 GLY E C 6681 O O . GLY C 206 ? 0.4175 0.4698 0.3992 -0.0216 0.0130 0.0406 201 GLY E O 6682 N N . THR C 207 ? 0.3699 0.4117 0.3501 -0.0246 0.0099 0.0372 202 THR E N 6683 C CA . THR C 207 ? 0.3957 0.4339 0.3731 -0.0230 0.0086 0.0334 202 THR E CA 6684 C C . THR C 207 ? 0.4210 0.4520 0.3914 -0.0244 0.0052 0.0301 202 THR E C 6685 O O . THR C 207 ? 0.4355 0.4660 0.4020 -0.0261 0.0038 0.0307 202 THR E O 6686 C CB . THR C 207 ? 0.4161 0.4534 0.3998 -0.0225 0.0101 0.0329 202 THR E CB 6687 O OG1 . THR C 207 ? 0.4689 0.5014 0.4542 -0.0247 0.0092 0.0323 202 THR E OG1 6688 C CG2 . THR C 207 ? 0.4170 0.4606 0.4080 -0.0221 0.0135 0.0367 202 THR E CG2 6689 N N . SER C 208 ? 0.4167 0.4425 0.3854 -0.0237 0.0037 0.0268 203 SER E N 6690 C CA . SER C 208 ? 0.4365 0.4550 0.3990 -0.0252 0.0005 0.0241 203 SER E CA 6691 C C . SER C 208 ? 0.4551 0.4713 0.4204 -0.0283 0.0002 0.0253 203 SER E C 6692 O O . SER C 208 ? 0.4575 0.4693 0.4179 -0.0306 -0.0021 0.0243 203 SER E O 6693 C CB . SER C 208 ? 0.4591 0.4723 0.4180 -0.0232 -0.0012 0.0202 203 SER E CB 6694 O OG . SER C 208 ? 0.4495 0.4626 0.4142 -0.0227 0.0000 0.0200 203 SER E OG 6695 N N . THR C 209 ? 0.4514 0.4710 0.4245 -0.0284 0.0027 0.0274 204 THR E N 6696 C CA . THR C 209 ? 0.4630 0.4814 0.4395 -0.0309 0.0028 0.0284 204 THR E CA 6697 C C . THR C 209 ? 0.5023 0.5263 0.4841 -0.0316 0.0051 0.0322 204 THR E C 6698 O O . THR C 209 ? 0.5192 0.5431 0.5017 -0.0338 0.0046 0.0333 204 THR E O 6699 C CB . THR C 209 ? 0.4635 0.4799 0.4448 -0.0305 0.0034 0.0270 204 THR E CB 6700 O OG1 . THR C 209 ? 0.4264 0.4469 0.4134 -0.0283 0.0061 0.0279 204 THR E OG1 6701 C CG2 . THR C 209 ? 0.4296 0.4397 0.4053 -0.0300 0.0007 0.0233 204 THR E CG2 6702 N N . LEU C 210 ? 0.4885 0.5175 0.4740 -0.0298 0.0075 0.0344 205 LEU E N 6703 C CA . LEU C 210 ? 0.4452 0.4791 0.4364 -0.0301 0.0099 0.0383 205 LEU E CA 6704 C C . LEU C 210 ? 0.4080 0.4452 0.3955 -0.0307 0.0095 0.0403 205 LEU E C 6705 O O . LEU C 210 ? 0.3705 0.4087 0.3529 -0.0299 0.0086 0.0395 205 LEU E O 6706 C CB . LEU C 210 ? 0.4655 0.5033 0.4623 -0.0282 0.0127 0.0401 205 LEU E CB 6707 C CG . LEU C 210 ? 0.4764 0.5184 0.4796 -0.0283 0.0154 0.0443 205 LEU E CG 6708 C CD1 . LEU C 210 ? 0.4921 0.5313 0.5004 -0.0295 0.0158 0.0441 205 LEU E CD1 6709 C CD2 . LEU C 210 ? 0.4632 0.5093 0.4705 -0.0266 0.0179 0.0462 205 LEU E CD2 6710 N N . ASN C 211 ? 0.3820 0.4215 0.3723 -0.0319 0.0101 0.0429 206 ASN E N 6711 C CA . ASN C 211 ? 0.4005 0.4444 0.3879 -0.0324 0.0099 0.0452 206 ASN E CA 6712 C C . ASN C 211 ? 0.4092 0.4574 0.4026 -0.0322 0.0121 0.0491 206 ASN E C 6713 O O . ASN C 211 ? 0.4469 0.4950 0.4412 -0.0336 0.0115 0.0497 206 ASN E O 6714 C CB . ASN C 211 ? 0.4273 0.4683 0.4087 -0.0350 0.0069 0.0432 206 ASN E CB 6715 C CG . ASN C 211 ? 0.4162 0.4616 0.3936 -0.0358 0.0063 0.0449 206 ASN E CG 6716 O OD1 . ASN C 211 ? 0.4413 0.4916 0.4191 -0.0342 0.0077 0.0471 206 ASN E OD1 6717 N ND2 . ASN C 211 ? 0.4186 0.4625 0.3919 -0.0384 0.0040 0.0439 206 ASN E ND2 6718 N N . GLN C 212 ? 0.3818 0.4335 0.3794 -0.0303 0.0146 0.0519 207 GLN E N 6719 C CA . GLN C 212 ? 0.3893 0.4436 0.3935 -0.0297 0.0169 0.0555 207 GLN E CA 6720 C C . GLN C 212 ? 0.3984 0.4588 0.4024 -0.0287 0.0181 0.0595 207 GLN E C 6721 O O . GLN C 212 ? 0.4299 0.4933 0.4304 -0.0278 0.0181 0.0598 207 GLN E O 6722 C CB . GLN C 212 ? 0.4099 0.4630 0.4200 -0.0286 0.0191 0.0559 207 GLN E CB 6723 C CG . GLN C 212 ? 0.4258 0.4805 0.4431 -0.0279 0.0215 0.0596 207 GLN E CG 6724 C CD . GLN C 212 ? 0.4377 0.4907 0.4602 -0.0274 0.0234 0.0596 207 GLN E CD 6725 O OE1 . GLN C 212 ? 0.4750 0.5312 0.4994 -0.0263 0.0252 0.0622 207 GLN E OE1 6726 N NE2 . GLN C 212 ? 0.4545 0.5030 0.4793 -0.0282 0.0228 0.0566 207 GLN E NE2 6727 N N . ARG C 213 ? 0.4479 0.5105 0.4556 -0.0285 0.0191 0.0624 208 ARG E N 6728 C CA . ARG C 213 ? 0.4817 0.5503 0.4902 -0.0272 0.0205 0.0669 208 ARG E CA 6729 C C . ARG C 213 ? 0.4633 0.5323 0.4788 -0.0260 0.0228 0.0704 208 ARG E C 6730 O O . ARG C 213 ? 0.5042 0.5711 0.5222 -0.0265 0.0225 0.0700 208 ARG E O 6731 C CB . ARG C 213 ? 0.5168 0.5888 0.5204 -0.0281 0.0188 0.0670 208 ARG E CB 6732 C CG . ARG C 213 ? 0.5934 0.6723 0.5965 -0.0267 0.0199 0.0712 208 ARG E CG 6733 C CD . ARG C 213 ? 0.6568 0.7393 0.6567 -0.0277 0.0184 0.0716 208 ARG E CD 6734 N NE . ARG C 213 ? 0.7293 0.8188 0.7300 -0.0260 0.0197 0.0760 208 ARG E NE 6735 C CZ . ARG C 213 ? 0.7200 0.8141 0.7170 -0.0253 0.0197 0.0771 208 ARG E CZ 6736 N NH1 . ARG C 213 ? 0.6957 0.7881 0.6881 -0.0261 0.0185 0.0739 208 ARG E NH1 6737 N NH2 . ARG C 213 ? 0.7525 0.8533 0.7505 -0.0237 0.0210 0.0815 208 ARG E NH2 6738 N N . LEU C 214 ? 0.4404 0.5118 0.4590 -0.0245 0.0251 0.0738 209 LEU E N 6739 C CA . LEU C 214 ? 0.4589 0.5296 0.4842 -0.0234 0.0272 0.0773 209 LEU E CA 6740 C C . LEU C 214 ? 0.4832 0.5597 0.5084 -0.0218 0.0283 0.0822 209 LEU E C 6741 O O . LEU C 214 ? 0.4390 0.5203 0.4608 -0.0212 0.0285 0.0836 209 LEU E O 6742 C CB . LEU C 214 ? 0.4340 0.5023 0.4637 -0.0231 0.0292 0.0778 209 LEU E CB 6743 C CG . LEU C 214 ? 0.4294 0.4929 0.4591 -0.0245 0.0282 0.0730 209 LEU E CG 6744 C CD1 . LEU C 214 ? 0.4076 0.4708 0.4411 -0.0242 0.0302 0.0738 209 LEU E CD1 6745 C CD2 . LEU C 214 ? 0.4625 0.5212 0.4952 -0.0253 0.0275 0.0709 209 LEU E CD2 6746 N N . VAL C 215 ? 0.4864 0.5626 0.5155 -0.0208 0.0291 0.0847 210 VAL E N 6747 C CA . VAL C 215 ? 0.5209 0.6023 0.5507 -0.0189 0.0302 0.0897 210 VAL E CA 6748 C C . VAL C 215 ? 0.5045 0.5828 0.5411 -0.0174 0.0324 0.0932 210 VAL E C 6749 O O . VAL C 215 ? 0.5301 0.6036 0.5702 -0.0176 0.0323 0.0916 210 VAL E O 6750 C CB . VAL C 215 ? 0.5463 0.6309 0.5731 -0.0188 0.0284 0.0892 210 VAL E CB 6751 C CG1 . VAL C 215 ? 0.5744 0.6649 0.6018 -0.0166 0.0295 0.0944 210 VAL E CG1 6752 C CG2 . VAL C 215 ? 0.5559 0.6428 0.5757 -0.0207 0.0261 0.0857 210 VAL E CG2 6753 N N . PRO C 216 ? 0.5475 0.6287 0.5858 -0.0160 0.0343 0.0981 211 PRO E N 6754 C CA . PRO C 216 ? 0.5486 0.6265 0.5931 -0.0147 0.0363 0.1018 211 PRO E CA 6755 C C . PRO C 216 ? 0.5383 0.6157 0.5845 -0.0129 0.0360 0.1033 211 PRO E C 6756 O O . PRO C 216 ? 0.4827 0.5655 0.5253 -0.0120 0.0348 0.1039 211 PRO E O 6757 C CB . PRO C 216 ? 0.5310 0.6135 0.5754 -0.0136 0.0381 0.1071 211 PRO E CB 6758 C CG . PRO C 216 ? 0.5455 0.6322 0.5847 -0.0148 0.0373 0.1047 211 PRO E CG 6759 C CD . PRO C 216 ? 0.5579 0.6454 0.5925 -0.0156 0.0347 0.1003 211 PRO E CD 6760 N N . LYS C 217 ? 0.5289 0.6004 0.5808 -0.0123 0.0370 0.1038 212 LYS E N 6761 C CA . LYS C 217 ? 0.5769 0.6470 0.6314 -0.0101 0.0369 0.1052 212 LYS E CA 6762 C C . LYS C 217 ? 0.5518 0.6209 0.6101 -0.0081 0.0391 0.1112 212 LYS E C 6763 O O . LYS C 217 ? 0.5516 0.6147 0.6146 -0.0085 0.0405 0.1121 212 LYS E O 6764 C CB . LYS C 217 ? 0.5742 0.6378 0.6320 -0.0109 0.0363 0.1009 212 LYS E CB 6765 C CG . LYS C 217 ? 0.6629 0.7279 0.7167 -0.0127 0.0340 0.0955 212 LYS E CG 6766 C CD . LYS C 217 ? 0.6767 0.7359 0.7339 -0.0134 0.0334 0.0914 212 LYS E CD 6767 C CE . LYS C 217 ? 0.7563 0.8124 0.8126 -0.0162 0.0328 0.0870 212 LYS E CE 6768 N NZ . LYS C 217 ? 0.7631 0.8134 0.8234 -0.0168 0.0325 0.0834 212 LYS E NZ 6769 N N . ILE C 218 ? 0.5587 0.6339 0.6147 -0.0059 0.0392 0.1153 213 ILE E N 6770 C CA . ILE C 218 ? 0.5760 0.6513 0.6345 -0.0038 0.0412 0.1216 213 ILE E CA 6771 C C . ILE C 218 ? 0.5747 0.6468 0.6365 -0.0009 0.0412 0.1232 213 ILE E C 6772 O O . ILE C 218 ? 0.5508 0.6280 0.6103 0.0011 0.0401 0.1237 213 ILE E O 6773 C CB . ILE C 218 ? 0.6275 0.7118 0.6817 -0.0028 0.0413 0.1254 213 ILE E CB 6774 C CG1 . ILE C 218 ? 0.5988 0.6859 0.6498 -0.0054 0.0413 0.1235 213 ILE E CG1 6775 C CG2 . ILE C 218 ? 0.6810 0.7656 0.7378 -0.0002 0.0432 0.1325 213 ILE E CG2 6776 C CD1 . ILE C 218 ? 0.6210 0.7173 0.6672 -0.0046 0.0411 0.1262 213 ILE E CD1 6777 N N . ALA C 219 ? 0.5550 0.6190 0.6222 -0.0007 0.0424 0.1239 214 ALA E N 6778 C CA . ALA C 219 ? 0.5535 0.6128 0.6241 0.0019 0.0422 0.1241 214 ALA E CA 6779 C C . ALA C 219 ? 0.5730 0.6235 0.6492 0.0022 0.0439 0.1268 214 ALA E C 6780 O O . ALA C 219 ? 0.6823 0.7299 0.7601 -0.0003 0.0451 0.1274 214 ALA E O 6781 C CB . ALA C 219 ? 0.5098 0.5674 0.5802 0.0008 0.0404 0.1176 214 ALA E CB 6782 N N . THR C 220 ? 0.5879 0.6338 0.6672 0.0052 0.0439 0.1278 215 THR E N 6783 C CA . THR C 220 ? 0.6207 0.6570 0.7055 0.0056 0.0453 0.1300 215 THR E CA 6784 C C . THR C 220 ? 0.6004 0.6292 0.6886 0.0034 0.0449 0.1243 215 THR E C 6785 O O . THR C 220 ? 0.6193 0.6482 0.7072 0.0042 0.0434 0.1196 215 THR E O 6786 C CB . THR C 220 ? 0.5951 0.6293 0.6815 0.0104 0.0455 0.1338 215 THR E CB 6787 O OG1 . THR C 220 ? 0.5630 0.6045 0.6462 0.0125 0.0459 0.1394 215 THR E OG1 6788 C CG2 . THR C 220 ? 0.6048 0.6284 0.6964 0.0108 0.0468 0.1366 215 THR E CG2 6789 N N . ARG C 221 ? 0.5857 0.6084 0.6772 0.0007 0.0462 0.1249 216 ARG E N 6790 C CA . ARG C 221 ? 0.5712 0.5870 0.6664 -0.0018 0.0461 0.1198 216 ARG E CA 6791 C C . ARG C 221 ? 0.6074 0.6139 0.7077 -0.0023 0.0477 0.1229 216 ARG E C 6792 O O . ARG C 221 ? 0.5870 0.5929 0.6879 -0.0015 0.0490 0.1291 216 ARG E O 6793 C CB . ARG C 221 ? 0.5562 0.5754 0.6495 -0.0058 0.0459 0.1162 216 ARG E CB 6794 C CG . ARG C 221 ? 0.5637 0.5905 0.6518 -0.0060 0.0440 0.1122 216 ARG E CG 6795 C CD . ARG C 221 ? 0.5854 0.6157 0.6710 -0.0095 0.0439 0.1097 216 ARG E CD 6796 N NE . ARG C 221 ? 0.5930 0.6284 0.6763 -0.0096 0.0450 0.1147 216 ARG E NE 6797 C CZ . ARG C 221 ? 0.5834 0.6268 0.6616 -0.0089 0.0444 0.1157 216 ARG E CZ 6798 N NH1 . ARG C 221 ? 0.6079 0.6552 0.6822 -0.0086 0.0425 0.1120 216 ARG E NH1 6799 N NH2 . ARG C 221 ? 0.6691 0.7167 0.7458 -0.0090 0.0456 0.1204 216 ARG E NH2 6800 N N . SER C 222 ? 0.6239 0.6231 0.7281 -0.0038 0.0475 0.1186 217 SER E N 6801 C CA . SER C 222 ? 0.6259 0.6157 0.7352 -0.0049 0.0488 0.1209 217 SER E CA 6802 C C . SER C 222 ? 0.6779 0.6685 0.7879 -0.0093 0.0503 0.1228 217 SER E C 6803 O O . SER C 222 ? 0.7248 0.7224 0.8318 -0.0113 0.0500 0.1208 217 SER E O 6804 C CB . SER C 222 ? 0.6063 0.5888 0.7193 -0.0052 0.0480 0.1153 217 SER E CB 6805 O OG . SER C 222 ? 0.6698 0.6523 0.7820 -0.0008 0.0468 0.1140 217 SER E OG 6806 N N . GLN C 223 ? 0.7175 0.7011 0.8314 -0.0107 0.0518 0.1267 218 GLN E N 6807 C CA . GLN C 223 ? 0.7551 0.7399 0.8702 -0.0150 0.0533 0.1287 218 GLN E CA 6808 C C . GLN C 223 ? 0.6875 0.6692 0.8054 -0.0186 0.0530 0.1225 218 GLN E C 6809 O O . GLN C 223 ? 0.6531 0.6270 0.7744 -0.0185 0.0525 0.1194 218 GLN E O 6810 C CB . GLN C 223 ? 0.8305 0.8088 0.9491 -0.0159 0.0551 0.1353 218 GLN E CB 6811 C CG . GLN C 223 ? 0.9526 0.9329 1.0691 -0.0125 0.0558 0.1426 218 GLN E CG 6812 C CD . GLN C 223 ? 1.0727 1.0510 1.1911 -0.0149 0.0578 0.1495 218 GLN E CD 6813 O OE1 . GLN C 223 ? 1.1561 1.1272 1.2786 -0.0184 0.0587 0.1495 218 GLN E OE1 6814 N NE2 . GLN C 223 ? 1.1482 1.1330 1.2633 -0.0133 0.0585 0.1556 218 GLN E NE2 6815 N N . VAL C 224 ? 0.6538 0.6416 0.7701 -0.0218 0.0533 0.1209 219 VAL E N 6816 C CA . VAL C 224 ? 0.6153 0.6009 0.7346 -0.0257 0.0533 0.1161 219 VAL E CA 6817 C C . VAL C 224 ? 0.6568 0.6468 0.7762 -0.0291 0.0549 0.1194 219 VAL E C 6818 O O . VAL C 224 ? 0.5930 0.5912 0.7084 -0.0285 0.0552 0.1218 219 VAL E O 6819 C CB . VAL C 224 ? 0.6222 0.6120 0.7389 -0.0257 0.0515 0.1089 219 VAL E CB 6820 C CG1 . VAL C 224 ? 0.5905 0.5782 0.7103 -0.0295 0.0516 0.1041 219 VAL E CG1 6821 C CG2 . VAL C 224 ? 0.6054 0.5922 0.7215 -0.0222 0.0499 0.1058 219 VAL E CG2 6822 N N . ASN C 225 ? 0.7153 0.7002 0.8395 -0.0327 0.0560 0.1194 220 ASN E N 6823 C CA . ASN C 225 ? 0.6831 0.6715 0.8083 -0.0363 0.0578 0.1234 220 ASN E CA 6824 C C . ASN C 225 ? 0.6590 0.6514 0.7817 -0.0346 0.0590 0.1310 220 ASN E C 6825 O O . ASN C 225 ? 0.6660 0.6665 0.7866 -0.0358 0.0598 0.1332 220 ASN E O 6826 C CB . ASN C 225 ? 0.6845 0.6811 0.8078 -0.0385 0.0576 0.1192 220 ASN E CB 6827 C CG . ASN C 225 ? 0.6765 0.6702 0.8017 -0.0399 0.0563 0.1115 220 ASN E CG 6828 O OD1 . ASN C 225 ? 0.6514 0.6508 0.7736 -0.0398 0.0551 0.1066 220 ASN E OD1 6829 N ND2 . ASN C 225 ? 0.6771 0.6620 0.8071 -0.0413 0.0564 0.1103 220 ASN E ND2 6830 N N . GLY C 226 ? 0.6711 0.6581 0.7942 -0.0315 0.0589 0.1348 221 GLY E N 6831 C CA . GLY C 226 ? 0.6191 0.6092 0.7401 -0.0296 0.0600 0.1424 221 GLY E CA 6832 C C . GLY C 226 ? 0.6686 0.6678 0.7839 -0.0261 0.0591 0.1428 221 GLY E C 6833 O O . GLY C 226 ? 0.7119 0.7147 0.8250 -0.0242 0.0599 0.1490 221 GLY E O 6834 N N . GLN C 227 ? 0.6493 0.6521 0.7618 -0.0250 0.0574 0.1364 222 GLN E N 6835 C CA . GLN C 227 ? 0.6854 0.6974 0.7921 -0.0224 0.0565 0.1362 222 GLN E CA 6836 C C . GLN C 227 ? 0.6393 0.6504 0.7440 -0.0190 0.0546 0.1326 222 GLN E C 6837 O O . GLN C 227 ? 0.5920 0.5983 0.6986 -0.0193 0.0535 0.1271 222 GLN E O 6838 C CB . GLN C 227 ? 0.7080 0.7274 0.8123 -0.0248 0.0561 0.1320 222 GLN E CB 6839 C CG . GLN C 227 ? 0.7105 0.7325 0.8165 -0.0283 0.0580 0.1349 222 GLN E CG 6840 C CD . GLN C 227 ? 0.6942 0.7208 0.7988 -0.0274 0.0595 0.1427 222 GLN E CD 6841 O OE1 . GLN C 227 ? 0.6331 0.6576 0.7409 -0.0297 0.0612 0.1474 222 GLN E OE1 6842 N NE2 . GLN C 227 ? 0.7119 0.7450 0.8117 -0.0244 0.0588 0.1440 222 GLN E NE2 6843 N N . ARG C 228 ? 0.6409 0.6578 0.7415 -0.0158 0.0541 0.1353 223 ARG E N 6844 C CA . ARG C 228 ? 0.6410 0.6593 0.7389 -0.0127 0.0522 0.1320 223 ARG E CA 6845 C C . ARG C 228 ? 0.5933 0.6199 0.6863 -0.0133 0.0508 0.1276 223 ARG E C 6846 O O . ARG C 228 ? 0.5740 0.6016 0.6648 -0.0119 0.0491 0.1234 223 ARG E O 6847 C CB . ARG C 228 ? 0.6424 0.6617 0.7392 -0.0086 0.0524 0.1374 223 ARG E CB 6848 C CG . ARG C 228 ? 0.7228 0.7327 0.8243 -0.0076 0.0534 0.1414 223 ARG E CG 6849 C CD . ARG C 228 ? 0.7625 0.7731 0.8629 -0.0034 0.0537 0.1476 223 ARG E CD 6850 N NE . ARG C 228 ? 0.8695 0.8741 0.9716 -0.0003 0.0526 0.1450 223 ARG E NE 6851 C CZ . ARG C 228 ? 0.8729 0.8672 0.9794 0.0005 0.0530 0.1462 223 ARG E CZ 6852 N NH1 . ARG C 228 ? 0.8273 0.8154 0.9369 -0.0014 0.0546 0.1507 223 ARG E NH1 6853 N NH2 . ARG C 228 ? 0.9580 0.9483 1.0654 0.0036 0.0517 0.1427 223 ARG E NH2 6854 N N . GLY C 229 ? 0.5734 0.6058 0.6643 -0.0153 0.0516 0.1287 224 GLY E N 6855 C CA . GLY C 229 ? 0.5539 0.5931 0.6401 -0.0161 0.0503 0.1244 224 GLY E CA 6856 C C . GLY C 229 ? 0.5610 0.5967 0.6484 -0.0185 0.0493 0.1176 224 GLY E C 6857 O O . GLY C 229 ? 0.5278 0.5566 0.6201 -0.0200 0.0499 0.1162 224 GLY E O 6858 N N . ARG C 230 ? 0.5289 0.5694 0.6119 -0.0188 0.0477 0.1132 225 ARG E N 6859 C CA . ARG C 230 ? 0.5081 0.5461 0.5917 -0.0208 0.0466 0.1069 225 ARG E CA 6860 C C . ARG C 230 ? 0.4821 0.5263 0.5610 -0.0218 0.0459 0.1044 225 ARG E C 6861 O O . ARG C 230 ? 0.4534 0.5038 0.5277 -0.0206 0.0456 0.1064 225 ARG E O 6862 C CB . ARG C 230 ? 0.4740 0.5092 0.5569 -0.0195 0.0448 0.1027 225 ARG E CB 6863 C CG . ARG C 230 ? 0.5015 0.5303 0.5889 -0.0180 0.0452 0.1040 225 ARG E CG 6864 C CD . ARG C 230 ? 0.4840 0.5059 0.5770 -0.0202 0.0460 0.1021 225 ARG E CD 6865 N NE . ARG C 230 ? 0.5489 0.5642 0.6457 -0.0185 0.0461 0.1029 225 ARG E NE 6866 C CZ . ARG C 230 ? 0.6092 0.6205 0.7091 -0.0174 0.0476 0.1081 225 ARG E CZ 6867 N NH1 . ARG C 230 ? 0.6109 0.6245 0.7107 -0.0181 0.0492 0.1135 225 ARG E NH1 6868 N NH2 . ARG C 230 ? 0.6690 0.6739 0.7721 -0.0155 0.0474 0.1079 225 ARG E NH2 6869 N N . MET C 231 ? 0.4822 0.5248 0.5621 -0.0240 0.0456 0.1001 226 MET E N 6870 C CA . MET C 231 ? 0.5097 0.5572 0.5851 -0.0248 0.0446 0.0969 226 MET E CA 6871 C C . MET C 231 ? 0.4669 0.5114 0.5414 -0.0256 0.0427 0.0904 226 MET E C 6872 O O . MET C 231 ? 0.4385 0.4786 0.5171 -0.0271 0.0430 0.0881 226 MET E O 6873 C CB . MET C 231 ? 0.5651 0.6154 0.6420 -0.0264 0.0463 0.0986 226 MET E CB 6874 C CG . MET C 231 ? 0.5543 0.6098 0.6299 -0.0254 0.0477 0.1047 226 MET E CG 6875 S SD . MET C 231 ? 0.6375 0.6978 0.7144 -0.0273 0.0496 0.1068 226 MET E SD 6876 C CE . MET C 231 ? 0.6641 0.7304 0.7391 -0.0255 0.0510 0.1142 226 MET E CE 6877 N N . ASP C 232 ? 0.4610 0.5083 0.5300 -0.0248 0.0408 0.0877 227 ASP E N 6878 C CA . ASP C 232 ? 0.4827 0.5277 0.5499 -0.0256 0.0388 0.0819 227 ASP E CA 6879 C C . ASP C 232 ? 0.4969 0.5452 0.5603 -0.0264 0.0381 0.0792 227 ASP E C 6880 O O . ASP C 232 ? 0.5225 0.5755 0.5809 -0.0257 0.0376 0.0801 227 ASP E O 6881 C CB . ASP C 232 ? 0.4830 0.5286 0.5466 -0.0244 0.0369 0.0808 227 ASP E CB 6882 C CG . ASP C 232 ? 0.5275 0.5697 0.5950 -0.0233 0.0373 0.0824 227 ASP E CG 6883 O OD1 . ASP C 232 ? 0.5793 0.6170 0.6524 -0.0237 0.0387 0.0831 227 ASP E OD1 6884 O OD2 . ASP C 232 ? 0.5102 0.5542 0.5751 -0.0220 0.0362 0.0827 227 ASP E OD2 6885 N N . PHE C 233 ? 0.4677 0.5135 0.5333 -0.0279 0.0380 0.0756 228 PHE E N 6886 C CA . PHE C 233 ? 0.4684 0.5168 0.5308 -0.0284 0.0374 0.0728 228 PHE E CA 6887 C C . PHE C 233 ? 0.4635 0.5098 0.5219 -0.0285 0.0348 0.0674 228 PHE E C 6888 O O . PHE C 233 ? 0.4854 0.5277 0.5456 -0.0289 0.0340 0.0654 228 PHE E O 6889 C CB . PHE C 233 ? 0.4471 0.4949 0.5144 -0.0298 0.0390 0.0726 228 PHE E CB 6890 C CG . PHE C 233 ? 0.4517 0.5028 0.5218 -0.0299 0.0414 0.0779 228 PHE E CG 6891 C CD1 . PHE C 233 ? 0.4701 0.5181 0.5458 -0.0306 0.0431 0.0815 228 PHE E CD1 6892 C CD2 . PHE C 233 ? 0.4408 0.4980 0.5074 -0.0293 0.0418 0.0794 228 PHE E CD2 6893 C CE1 . PHE C 233 ? 0.4665 0.5173 0.5443 -0.0308 0.0453 0.0868 228 PHE E CE1 6894 C CE2 . PHE C 233 ? 0.4444 0.5052 0.5134 -0.0295 0.0440 0.0845 228 PHE E CE2 6895 C CZ . PHE C 233 ? 0.4348 0.4924 0.5094 -0.0304 0.0458 0.0884 228 PHE E CZ 6896 N N . PHE C 234 ? 0.4071 0.4560 0.4603 -0.0282 0.0336 0.0653 229 PHE E N 6897 C CA . PHE C 234 ? 0.3976 0.4444 0.4460 -0.0283 0.0310 0.0606 229 PHE E CA 6898 C C . PHE C 234 ? 0.3957 0.4439 0.4418 -0.0282 0.0305 0.0576 229 PHE E C 6899 O O . PHE C 234 ? 0.3925 0.4445 0.4396 -0.0278 0.0321 0.0595 229 PHE E O 6900 C CB . PHE C 234 ? 0.4169 0.4654 0.4593 -0.0276 0.0294 0.0611 229 PHE E CB 6901 C CG . PHE C 234 ? 0.4025 0.4502 0.4467 -0.0275 0.0296 0.0635 229 PHE E CG 6902 C CD1 . PHE C 234 ? 0.4002 0.4506 0.4467 -0.0266 0.0314 0.0684 229 PHE E CD1 6903 C CD2 . PHE C 234 ? 0.4063 0.4509 0.4497 -0.0281 0.0279 0.0609 229 PHE E CD2 6904 C CE1 . PHE C 234 ? 0.4334 0.4832 0.4814 -0.0260 0.0315 0.0706 229 PHE E CE1 6905 C CE2 . PHE C 234 ? 0.3863 0.4309 0.4315 -0.0277 0.0280 0.0629 229 PHE E CE2 6906 C CZ . PHE C 234 ? 0.4098 0.4569 0.4573 -0.0265 0.0298 0.0677 229 PHE E CZ 6907 N N . TRP C 235 ? 0.3943 0.4396 0.4376 -0.0285 0.0285 0.0531 230 TRP E N 6908 C CA . TRP C 235 ? 0.3683 0.4146 0.4095 -0.0280 0.0279 0.0500 230 TRP E CA 6909 C C . TRP C 235 ? 0.3429 0.3867 0.3776 -0.0276 0.0250 0.0461 230 TRP E C 6910 O O . TRP C 235 ? 0.4056 0.4465 0.4380 -0.0283 0.0234 0.0454 230 TRP E O 6911 C CB . TRP C 235 ? 0.4011 0.4459 0.4482 -0.0289 0.0289 0.0484 230 TRP E CB 6912 C CG . TRP C 235 ? 0.3591 0.3992 0.4085 -0.0301 0.0280 0.0461 230 TRP E CG 6913 C CD1 . TRP C 235 ? 0.3887 0.4266 0.4424 -0.0309 0.0288 0.0478 230 TRP E CD1 6914 C CD2 . TRP C 235 ? 0.3531 0.3904 0.4007 -0.0303 0.0260 0.0416 230 TRP E CD2 6915 N NE1 . TRP C 235 ? 0.3770 0.4112 0.4315 -0.0316 0.0274 0.0444 230 TRP E NE1 6916 C CE2 . TRP C 235 ? 0.3502 0.3841 0.4011 -0.0314 0.0258 0.0407 230 TRP E CE2 6917 C CE3 . TRP C 235 ? 0.3427 0.3800 0.3859 -0.0294 0.0244 0.0381 230 TRP E CE3 6918 C CZ2 . TRP C 235 ? 0.3503 0.3814 0.4004 -0.0319 0.0241 0.0368 230 TRP E CZ2 6919 C CZ3 . TRP C 235 ? 0.3141 0.3480 0.3563 -0.0298 0.0226 0.0344 230 TRP E CZ3 6920 C CH2 . TRP C 235 ? 0.3538 0.3847 0.3994 -0.0312 0.0225 0.0338 230 TRP E CH2 6921 N N . THR C 236 ? 0.3276 0.3725 0.3590 -0.0265 0.0243 0.0437 231 THR E N 6922 C CA . THR C 236 ? 0.3364 0.3780 0.3615 -0.0261 0.0214 0.0397 231 THR E CA 6923 C C . THR C 236 ? 0.3420 0.3845 0.3663 -0.0247 0.0212 0.0367 231 THR E C 6924 O O . THR C 236 ? 0.3315 0.3784 0.3590 -0.0241 0.0231 0.0380 231 THR E O 6925 C CB . THR C 236 ? 0.3755 0.4175 0.3936 -0.0255 0.0199 0.0402 231 THR E CB 6926 O OG1 . THR C 236 ? 0.4046 0.4420 0.4168 -0.0257 0.0170 0.0366 231 THR E OG1 6927 C CG2 . THR C 236 ? 0.3945 0.4413 0.4103 -0.0236 0.0206 0.0409 231 THR E CG2 6928 N N . ILE C 237 ? 0.3990 0.4374 0.4191 -0.0244 0.0187 0.0329 232 ILE E N 6929 C CA . ILE C 237 ? 0.4274 0.4663 0.4454 -0.0226 0.0179 0.0297 232 ILE E CA 6930 C C . ILE C 237 ? 0.4535 0.4916 0.4634 -0.0209 0.0159 0.0284 232 ILE E C 6931 O O . ILE C 237 ? 0.4257 0.4589 0.4303 -0.0215 0.0135 0.0269 232 ILE E O 6932 C CB . ILE C 237 ? 0.4651 0.4996 0.4834 -0.0230 0.0163 0.0262 232 ILE E CB 6933 C CG1 . ILE C 237 ? 0.4417 0.4765 0.4678 -0.0249 0.0181 0.0271 232 ILE E CG1 6934 C CG2 . ILE C 237 ? 0.5193 0.5548 0.5354 -0.0207 0.0155 0.0230 232 ILE E CG2 6935 C CD1 . ILE C 237 ? 0.5125 0.5527 0.5449 -0.0248 0.0209 0.0289 232 ILE E CD1 6936 N N . LEU C 238 ? 0.4790 0.5220 0.4878 -0.0190 0.0169 0.0290 233 LEU E N 6937 C CA . LEU C 238 ? 0.4561 0.4989 0.4572 -0.0171 0.0151 0.0276 233 LEU E CA 6938 C C . LEU C 238 ? 0.4972 0.5380 0.4946 -0.0148 0.0133 0.0234 233 LEU E C 6939 O O . LEU C 238 ? 0.4599 0.5050 0.4607 -0.0133 0.0147 0.0228 233 LEU E O 6940 C CB . LEU C 238 ? 0.4257 0.4754 0.4274 -0.0160 0.0170 0.0304 233 LEU E CB 6941 C CG . LEU C 238 ? 0.4698 0.5198 0.4637 -0.0141 0.0152 0.0289 233 LEU E CG 6942 C CD1 . LEU C 238 ? 0.4485 0.4939 0.4378 -0.0158 0.0133 0.0293 233 LEU E CD1 6943 C CD2 . LEU C 238 ? 0.4762 0.5346 0.4713 -0.0128 0.0175 0.0317 233 LEU E CD2 6944 N N . LYS C 239 ? 0.4626 0.4969 0.4534 -0.0145 0.0102 0.0205 234 LYS E N 6945 C CA . LYS C 239 ? 0.5333 0.5642 0.5204 -0.0122 0.0082 0.0164 234 LYS E CA 6946 C C . LYS C 239 ? 0.5380 0.5726 0.5212 -0.0087 0.0080 0.0149 234 LYS E C 6947 O O . LYS C 239 ? 0.5116 0.5493 0.4927 -0.0084 0.0086 0.0165 234 LYS E O 6948 C CB . LYS C 239 ? 0.5775 0.5999 0.5580 -0.0129 0.0049 0.0141 234 LYS E CB 6949 C CG . LYS C 239 ? 0.6500 0.6687 0.6335 -0.0162 0.0046 0.0151 234 LYS E CG 6950 C CD . LYS C 239 ? 0.6689 0.6890 0.6587 -0.0163 0.0059 0.0145 234 LYS E CD 6951 C CE . LYS C 239 ? 0.7991 0.8134 0.7883 -0.0181 0.0041 0.0131 234 LYS E CE 6952 N NZ . LYS C 239 ? 0.9321 0.9486 0.9275 -0.0179 0.0053 0.0121 234 LYS E NZ 6953 N N . PRO C 240 ? 0.5667 0.6012 0.5487 -0.0060 0.0072 0.0117 235 PRO E N 6954 C CA . PRO C 240 ? 0.5551 0.5940 0.5339 -0.0023 0.0072 0.0101 235 PRO E CA 6955 C C . PRO C 240 ? 0.6032 0.6402 0.5746 -0.0010 0.0055 0.0094 235 PRO E C 6956 O O . PRO C 240 ? 0.8330 0.8769 0.8044 0.0005 0.0069 0.0103 235 PRO E O 6957 C CB . PRO C 240 ? 0.5295 0.5662 0.5069 0.0003 0.0056 0.0063 235 PRO E CB 6958 C CG . PRO C 240 ? 0.5270 0.5636 0.5112 -0.0021 0.0069 0.0073 235 PRO E CG 6959 C CD . PRO C 240 ? 0.5411 0.5732 0.5260 -0.0060 0.0067 0.0098 235 PRO E CD 6960 N N . ASN C 241 ? 0.5453 0.5744 0.5101 -0.0017 0.0026 0.0079 236 ASN E N 6961 C CA . ASN C 241 ? 0.6467 0.6774 0.6056 -0.0003 0.0020 0.0077 236 ASN E CA 6962 C C . ASN C 241 ? 0.6240 0.6551 0.5825 -0.0034 0.0024 0.0108 236 ASN E C 6963 O O . ASN C 241 ? 0.5601 0.5895 0.5123 -0.0029 0.0008 0.0099 236 ASN E O 6964 C CB . ASN C 241 ? 0.7235 0.7486 0.6738 0.0030 -0.0011 0.0033 236 ASN E CB 6965 C CG . ASN C 241 ? 0.8110 0.8429 0.7611 0.0075 -0.0003 0.0014 236 ASN E CG 6966 O OD1 . ASN C 241 ? 0.9245 0.9613 0.8723 0.0090 0.0002 0.0016 236 ASN E OD1 6967 N ND2 . ASN C 241 ? 0.8770 0.9106 0.8302 0.0095 0.0001 0.0000 236 ASN E ND2 6968 N N . ASP C 242 ? 0.5776 0.6110 0.5428 -0.0065 0.0045 0.0144 237 ASP E N 6969 C CA . ASP C 242 ? 0.5339 0.5673 0.4991 -0.0094 0.0048 0.0174 237 ASP E CA 6970 C C . ASP C 242 ? 0.5001 0.5427 0.4692 -0.0090 0.0077 0.0208 237 ASP E C 6971 O O . ASP C 242 ? 0.5730 0.6217 0.5458 -0.0071 0.0097 0.0213 237 ASP E O 6972 C CB . ASP C 242 ? 0.5428 0.5729 0.5127 -0.0128 0.0052 0.0190 237 ASP E CB 6973 C CG . ASP C 242 ? 0.5430 0.5710 0.5111 -0.0158 0.0044 0.0211 237 ASP E CG 6974 O OD1 . ASP C 242 ? 0.5572 0.5847 0.5193 -0.0158 0.0030 0.0207 237 ASP E OD1 6975 O OD2 . ASP C 242 ? 0.5410 0.5679 0.5137 -0.0183 0.0052 0.0229 237 ASP E OD2 6976 N N . ALA C 243 ? 0.4765 0.5205 0.4446 -0.0109 0.0079 0.0234 238 ALA E N 6977 C CA . ALA C 243 ? 0.4577 0.5101 0.4297 -0.0108 0.0107 0.0274 238 ALA E CA 6978 C C . ALA C 243 ? 0.4276 0.4801 0.4037 -0.0139 0.0119 0.0312 238 ALA E C 6979 O O . ALA C 243 ? 0.4986 0.5454 0.4726 -0.0160 0.0101 0.0306 238 ALA E O 6980 C CB . ALA C 243 ? 0.4692 0.5247 0.4350 -0.0092 0.0098 0.0266 238 ALA E CB 6981 N N . ILE C 244 ? 0.4194 0.4786 0.4017 -0.0141 0.0150 0.0353 239 ILE E N 6982 C CA . ILE C 244 ? 0.4079 0.4680 0.3947 -0.0165 0.0164 0.0394 239 ILE E CA 6983 C C . ILE C 244 ? 0.4557 0.5222 0.4409 -0.0160 0.0174 0.0425 239 ILE E C 6984 O O . ILE C 244 ? 0.4308 0.5033 0.4155 -0.0141 0.0186 0.0432 239 ILE E O 6985 C CB . ILE C 244 ? 0.4129 0.4750 0.4082 -0.0171 0.0191 0.0419 239 ILE E CB 6986 C CG1 . ILE C 244 ? 0.4053 0.4675 0.4052 -0.0193 0.0205 0.0459 239 ILE E CG1 6987 C CG2 . ILE C 244 ? 0.4440 0.5137 0.4423 -0.0154 0.0216 0.0437 239 ILE E CG2 6988 C CD1 . ILE C 244 ? 0.3966 0.4571 0.4040 -0.0204 0.0222 0.0469 239 ILE E CD1 6989 N N . HIS C 245 ? 0.4767 0.5423 0.4608 -0.0178 0.0168 0.0444 240 HIS E N 6990 C CA . HIS C 245 ? 0.4635 0.5350 0.4453 -0.0174 0.0173 0.0471 240 HIS E CA 6991 C C . HIS C 245 ? 0.4818 0.5564 0.4692 -0.0187 0.0194 0.0521 240 HIS E C 6992 O O . HIS C 245 ? 0.5135 0.5843 0.5020 -0.0205 0.0187 0.0526 240 HIS E O 6993 C CB . HIS C 245 ? 0.4402 0.5086 0.4142 -0.0182 0.0143 0.0445 240 HIS E CB 6994 C CG . HIS C 245 ? 0.4576 0.5212 0.4257 -0.0171 0.0118 0.0393 240 HIS E CG 6995 N ND1 . HIS C 245 ? 0.4696 0.5361 0.4326 -0.0148 0.0110 0.0373 240 HIS E ND1 6996 C CD2 . HIS C 245 ? 0.4896 0.5454 0.4559 -0.0177 0.0097 0.0357 240 HIS E CD2 6997 C CE1 . HIS C 245 ? 0.4494 0.5097 0.4075 -0.0139 0.0086 0.0326 240 HIS E CE1 6998 N NE2 . HIS C 245 ? 0.4977 0.5513 0.4576 -0.0157 0.0077 0.0317 240 HIS E NE2 6999 N N . PHE C 246 ? 0.4627 0.5443 0.4534 -0.0176 0.0220 0.0560 241 PHE E N 7000 C CA . PHE C 246 ? 0.4603 0.5450 0.4564 -0.0183 0.0242 0.0612 241 PHE E CA 7001 C C . PHE C 246 ? 0.4641 0.5548 0.4569 -0.0178 0.0242 0.0639 241 PHE E C 7002 O O . PHE C 246 ? 0.5063 0.6013 0.4947 -0.0163 0.0238 0.0628 241 PHE E O 7003 C CB . PHE C 246 ? 0.4360 0.5244 0.4381 -0.0176 0.0271 0.0642 241 PHE E CB 7004 C CG . PHE C 246 ? 0.4313 0.5148 0.4381 -0.0184 0.0275 0.0625 241 PHE E CG 7005 C CD1 . PHE C 246 ? 0.4489 0.5282 0.4608 -0.0200 0.0281 0.0641 241 PHE E CD1 7006 C CD2 . PHE C 246 ? 0.4229 0.5061 0.4292 -0.0175 0.0273 0.0593 241 PHE E CD2 7007 C CE1 . PHE C 246 ? 0.4273 0.5024 0.4438 -0.0208 0.0287 0.0626 241 PHE E CE1 7008 C CE2 . PHE C 246 ? 0.4392 0.5186 0.4502 -0.0183 0.0279 0.0579 241 PHE E CE2 7009 C CZ . PHE C 246 ? 0.4340 0.5092 0.4501 -0.0201 0.0285 0.0595 241 PHE E CZ 7010 N N . GLU C 247 ? 0.4667 0.5579 0.4614 -0.0188 0.0246 0.0672 242 GLU E N 7011 C CA . GLU C 247 ? 0.5037 0.6015 0.4963 -0.0182 0.0250 0.0705 242 GLU E CA 7012 C C . GLU C 247 ? 0.5002 0.5993 0.4986 -0.0185 0.0270 0.0757 242 GLU E C 7013 O O . GLU C 247 ? 0.4969 0.5911 0.4981 -0.0197 0.0266 0.0755 242 GLU E O 7014 C CB . GLU C 247 ? 0.5339 0.6308 0.5195 -0.0191 0.0221 0.0677 242 GLU E CB 7015 C CG . GLU C 247 ? 0.5936 0.6978 0.5772 -0.0186 0.0225 0.0712 242 GLU E CG 7016 C CD . GLU C 247 ? 0.6510 0.7550 0.6277 -0.0199 0.0196 0.0683 242 GLU E CD 7017 O OE1 . GLU C 247 ? 0.6530 0.7534 0.6242 -0.0203 0.0174 0.0635 242 GLU E OE1 7018 O OE2 . GLU C 247 ? 0.7077 0.8151 0.6842 -0.0205 0.0195 0.0709 242 GLU E OE2 7019 N N . SER C 248 ? 0.4772 0.5830 0.4776 -0.0172 0.0291 0.0804 243 SER E N 7020 C CA . SER C 248 ? 0.4895 0.5964 0.4952 -0.0171 0.0310 0.0857 243 SER E CA 7021 C C . SER C 248 ? 0.4777 0.5931 0.4830 -0.0157 0.0325 0.0907 243 SER E C 7022 O O . SER C 248 ? 0.5493 0.6699 0.5527 -0.0147 0.0332 0.0910 243 SER E O 7023 C CB . SER C 248 ? 0.4811 0.5844 0.4938 -0.0174 0.0331 0.0873 243 SER E CB 7024 O OG . SER C 248 ? 0.4823 0.5857 0.4999 -0.0172 0.0347 0.0923 243 SER E OG 7025 N N . ASN C 249 ? 0.4890 0.6058 0.4962 -0.0153 0.0331 0.0947 244 ASN E N 7026 C CA . ASN C 249 ? 0.5400 0.6645 0.5480 -0.0138 0.0349 0.1004 244 ASN E CA 7027 C C . ASN C 249 ? 0.5611 0.6841 0.5759 -0.0133 0.0373 0.1058 244 ASN E C 7028 O O . ASN C 249 ? 0.6028 0.7306 0.6185 -0.0121 0.0385 0.1109 244 ASN E O 7029 C CB . ASN C 249 ? 0.5405 0.6698 0.5441 -0.0134 0.0335 0.1011 244 ASN E CB 7030 C CG . ASN C 249 ? 0.5440 0.6696 0.5499 -0.0137 0.0329 0.1020 244 ASN E CG 7031 O OD1 . ASN C 249 ? 0.4882 0.6064 0.4974 -0.0148 0.0327 0.1000 244 ASN E OD1 7032 N ND2 . ASN C 249 ? 0.5992 0.7301 0.6031 -0.0129 0.0325 0.1045 244 ASN E ND2 7033 N N . GLY C 250 ? 0.5272 0.6434 0.5468 -0.0144 0.0380 0.1047 245 GLY E N 7034 C CA . GLY C 250 ? 0.4976 0.6113 0.5237 -0.0141 0.0403 0.1095 245 GLY E CA 7035 C C . GLY C 250 ? 0.4979 0.6030 0.5286 -0.0155 0.0403 0.1071 245 GLY E C 7036 O O . GLY C 250 ? 0.5749 0.6757 0.6038 -0.0164 0.0384 0.1021 245 GLY E O 7037 N N . ASN C 251 ? 0.5110 0.6134 0.5478 -0.0156 0.0425 0.1109 246 ASN E N 7038 C CA . ASN C 251 ? 0.4737 0.5677 0.5156 -0.0168 0.0426 0.1092 246 ASN E CA 7039 C C . ASN C 251 ? 0.5031 0.5935 0.5448 -0.0184 0.0417 0.1035 246 ASN E C 7040 O O . ASN C 251 ? 0.5315 0.6154 0.5759 -0.0194 0.0411 0.1006 246 ASN E O 7041 C CB . ASN C 251 ? 0.4383 0.5288 0.4802 -0.0162 0.0413 0.1083 246 ASN E CB 7042 C CG . ASN C 251 ? 0.4207 0.5152 0.4626 -0.0142 0.0420 0.1138 246 ASN E CG 7043 O OD1 . ASN C 251 ? 0.4286 0.5298 0.4659 -0.0133 0.0414 0.1148 246 ASN E OD1 7044 N ND2 . ASN C 251 ? 0.4163 0.5066 0.4631 -0.0134 0.0431 0.1171 246 ASN E ND2 7045 N N . PHE C 252 ? 0.5183 0.6131 0.5568 -0.0185 0.0417 0.1019 247 PHE E N 7046 C CA . PHE C 252 ? 0.5201 0.6125 0.5574 -0.0196 0.0405 0.0963 247 PHE E CA 7047 C C . PHE C 252 ? 0.5328 0.6247 0.5751 -0.0206 0.0426 0.0973 247 PHE E C 7048 O O . PHE C 252 ? 0.5008 0.5983 0.5442 -0.0204 0.0444 0.1013 247 PHE E O 7049 C CB . PHE C 252 ? 0.4633 0.5609 0.4936 -0.0187 0.0390 0.0936 247 PHE E CB 7050 C CG . PHE C 252 ? 0.4698 0.5654 0.4976 -0.0192 0.0377 0.0879 247 PHE E CG 7051 C CD1 . PHE C 252 ? 0.4652 0.5537 0.4947 -0.0203 0.0365 0.0838 247 PHE E CD1 7052 C CD2 . PHE C 252 ? 0.4541 0.5552 0.4774 -0.0182 0.0373 0.0863 247 PHE E CD2 7053 C CE1 . PHE C 252 ? 0.4565 0.5434 0.4833 -0.0205 0.0351 0.0786 247 PHE E CE1 7054 C CE2 . PHE C 252 ? 0.4517 0.5509 0.4725 -0.0181 0.0359 0.0810 247 PHE E CE2 7055 C CZ . PHE C 252 ? 0.4543 0.5463 0.4767 -0.0193 0.0348 0.0772 247 PHE E CZ 7056 N N . ILE C 253 ? 0.5010 0.5869 0.5466 -0.0220 0.0423 0.0940 248 ILE E N 7057 C CA . ILE C 253 ? 0.5016 0.5871 0.5515 -0.0233 0.0438 0.0940 248 ILE E CA 7058 C C . ILE C 253 ? 0.5059 0.5922 0.5522 -0.0232 0.0423 0.0882 248 ILE E C 7059 O O . ILE C 253 ? 0.5007 0.5819 0.5463 -0.0237 0.0406 0.0836 248 ILE E O 7060 C CB . ILE C 253 ? 0.5439 0.6223 0.6002 -0.0248 0.0446 0.0941 248 ILE E CB 7061 C CG1 . ILE C 253 ? 0.5439 0.6199 0.6027 -0.0243 0.0453 0.0987 248 ILE E CG1 7062 C CG2 . ILE C 253 ? 0.5128 0.5919 0.5741 -0.0265 0.0466 0.0953 248 ILE E CG2 7063 C CD1 . ILE C 253 ? 0.5695 0.6500 0.6301 -0.0239 0.0476 0.1053 248 ILE E CD1 7064 N N . ALA C 254 ? 0.4737 0.5667 0.5176 -0.0225 0.0429 0.0886 249 ALA E N 7065 C CA . ALA C 254 ? 0.4653 0.5600 0.5042 -0.0215 0.0411 0.0834 249 ALA E CA 7066 C C . ALA C 254 ? 0.4525 0.5460 0.4943 -0.0224 0.0415 0.0802 249 ALA E C 7067 O O . ALA C 254 ? 0.4305 0.5254 0.4779 -0.0238 0.0436 0.0828 249 ALA E O 7068 C CB . ALA C 254 ? 0.4643 0.5673 0.4988 -0.0199 0.0415 0.0848 249 ALA E CB 7069 N N . PRO C 255 ? 0.4594 0.5505 0.4974 -0.0218 0.0393 0.0745 250 PRO E N 7070 C CA . PRO C 255 ? 0.5141 0.6059 0.5543 -0.0221 0.0397 0.0717 250 PRO E CA 7071 C C . PRO C 255 ? 0.5021 0.6027 0.5426 -0.0214 0.0415 0.0739 250 PRO E C 7072 O O . PRO C 255 ? 0.4266 0.5324 0.4630 -0.0198 0.0414 0.0754 250 PRO E O 7073 C CB . PRO C 255 ? 0.4825 0.5713 0.5168 -0.0207 0.0368 0.0656 250 PRO E CB 7074 C CG . PRO C 255 ? 0.5113 0.5963 0.5414 -0.0205 0.0350 0.0654 250 PRO E CG 7075 C CD . PRO C 255 ? 0.4495 0.5385 0.4805 -0.0205 0.0365 0.0708 250 PRO E CD 7076 N N . GLU C 256 ? 0.5524 0.6549 0.5977 -0.0225 0.0430 0.0738 251 GLU E N 7077 C CA . GLU C 256 ? 0.5585 0.6698 0.6039 -0.0218 0.0444 0.0745 251 GLU E CA 7078 C C . GLU C 256 ? 0.5519 0.6628 0.5975 -0.0215 0.0434 0.0693 251 GLU E C 7079 O O . GLU C 256 ? 0.5244 0.6386 0.5650 -0.0190 0.0421 0.0656 251 GLU E O 7080 C CB . GLU C 256 ? 0.6408 0.7560 0.6924 -0.0240 0.0474 0.0806 251 GLU E CB 7081 C CG . GLU C 256 ? 0.7223 0.8480 0.7743 -0.0236 0.0492 0.0825 251 GLU E CG 7082 C CD . GLU C 256 ? 0.7714 0.9001 0.8297 -0.0263 0.0522 0.0887 251 GLU E CD 7083 O OE1 . GLU C 256 ? 0.9018 1.0248 0.9635 -0.0281 0.0530 0.0924 251 GLU E OE1 7084 O OE2 . GLU C 256 ? 0.8860 1.0230 0.9458 -0.0268 0.0538 0.0900 251 GLU E OE2 7085 N N . TYR C 257 ? 0.5079 0.6146 0.5591 -0.0237 0.0440 0.0687 252 TYR E N 7086 C CA . TYR C 257 ? 0.5664 0.6719 0.6180 -0.0234 0.0429 0.0636 252 TYR E CA 7087 C C . TYR C 257 ? 0.5820 0.6781 0.6318 -0.0234 0.0405 0.0597 252 TYR E C 7088 O O . TYR C 257 ? 0.5926 0.6832 0.6425 -0.0242 0.0400 0.0612 252 TYR E O 7089 C CB . TYR C 257 ? 0.5768 0.6840 0.6358 -0.0262 0.0451 0.0651 252 TYR E CB 7090 C CG . TYR C 257 ? 0.6285 0.7453 0.6897 -0.0267 0.0475 0.0685 252 TYR E CG 7091 C CD1 . TYR C 257 ? 0.6947 0.8187 0.7557 -0.0257 0.0476 0.0658 252 TYR E CD1 7092 C CD2 . TYR C 257 ? 0.6761 0.7953 0.7399 -0.0282 0.0496 0.0748 252 TYR E CD2 7093 C CE1 . TYR C 257 ? 0.6970 0.8310 0.7602 -0.0263 0.0499 0.0692 252 TYR E CE1 7094 C CE2 . TYR C 257 ? 0.6357 0.7641 0.7017 -0.0290 0.0519 0.0784 252 TYR E CE2 7095 C CZ . TYR C 257 ? 0.6788 0.8148 0.7445 -0.0282 0.0521 0.0756 252 TYR E CZ 7096 O OH . TYR C 257 ? 0.7057 0.8517 0.7736 -0.0291 0.0544 0.0794 252 TYR E OH 7097 N N . ALA C 258 ? 0.6334 0.7283 0.6816 -0.0224 0.0389 0.0546 253 ALA E N 7098 C CA . ALA C 258 ? 0.6365 0.7234 0.6825 -0.0222 0.0365 0.0506 253 ALA E CA 7099 C C . ALA C 258 ? 0.6041 0.6915 0.6522 -0.0221 0.0361 0.0467 253 ALA E C 7100 O O . ALA C 258 ? 0.6156 0.7099 0.6665 -0.0222 0.0377 0.0472 253 ALA E O 7101 C CB . ALA C 258 ? 0.6277 0.7128 0.6654 -0.0196 0.0340 0.0482 253 ALA E CB 7102 N N . TYR C 259 ? 0.5657 0.6468 0.6121 -0.0219 0.0340 0.0427 254 TYR E N 7103 C CA . TYR C 259 ? 0.5311 0.6131 0.5799 -0.0219 0.0337 0.0392 254 TYR E CA 7104 C C . TYR C 259 ? 0.5143 0.5931 0.5571 -0.0193 0.0307 0.0341 254 TYR E C 7105 O O . TYR C 259 ? 0.5590 0.6308 0.5986 -0.0193 0.0287 0.0326 254 TYR E O 7106 C CB . TYR C 259 ? 0.5490 0.6267 0.6041 -0.0249 0.0344 0.0396 254 TYR E CB 7107 C CG . TYR C 259 ? 0.5909 0.6703 0.6525 -0.0276 0.0372 0.0445 254 TYR E CG 7108 C CD1 . TYR C 259 ? 0.6421 0.7172 0.7044 -0.0288 0.0376 0.0479 254 TYR E CD1 7109 C CD2 . TYR C 259 ? 0.6066 0.6915 0.6736 -0.0292 0.0393 0.0458 254 TYR E CD2 7110 C CE1 . TYR C 259 ? 0.6615 0.7372 0.7295 -0.0311 0.0400 0.0524 254 TYR E CE1 7111 C CE2 . TYR C 259 ? 0.6455 0.7311 0.7183 -0.0320 0.0418 0.0504 254 TYR E CE2 7112 C CZ . TYR C 259 ? 0.6670 0.7477 0.7402 -0.0328 0.0421 0.0537 254 TYR E CZ 7113 O OH . TYR C 259 ? 0.6700 0.7509 0.7489 -0.0354 0.0445 0.0584 254 TYR E OH 7114 N N . LYS C 260 ? 0.5053 0.5892 0.5465 -0.0170 0.0304 0.0314 255 LYS E N 7115 C CA . LYS C 260 ? 0.4811 0.5616 0.5174 -0.0145 0.0277 0.0264 255 LYS E CA 7116 C C . LYS C 260 ? 0.4675 0.5440 0.5083 -0.0165 0.0274 0.0246 255 LYS E C 7117 O O . LYS C 260 ? 0.4652 0.5453 0.5128 -0.0186 0.0294 0.0256 255 LYS E O 7118 C CB . LYS C 260 ? 0.5102 0.5976 0.5444 -0.0114 0.0276 0.0240 255 LYS E CB 7119 C CG . LYS C 260 ? 0.6397 0.7322 0.6699 -0.0093 0.0281 0.0256 255 LYS E CG 7120 C CD . LYS C 260 ? 0.7170 0.8132 0.7417 -0.0049 0.0265 0.0218 255 LYS E CD 7121 C CE . LYS C 260 ? 0.7671 0.8717 0.7961 -0.0042 0.0280 0.0207 255 LYS E CE 7122 N NZ . LYS C 260 ? 0.8559 0.9620 0.8790 0.0004 0.0258 0.0161 255 LYS E NZ 7123 N N . ILE C 261 ? 0.4171 0.4863 0.4540 -0.0160 0.0249 0.0218 256 ILE E N 7124 C CA . ILE C 261 ? 0.4381 0.5033 0.4789 -0.0180 0.0245 0.0204 256 ILE E CA 7125 C C . ILE C 261 ? 0.4947 0.5560 0.5303 -0.0157 0.0216 0.0160 256 ILE E C 7126 O O . ILE C 261 ? 0.5495 0.6067 0.5780 -0.0138 0.0194 0.0148 256 ILE E O 7127 C CB . ILE C 261 ? 0.4939 0.5541 0.5367 -0.0207 0.0249 0.0231 256 ILE E CB 7128 C CG1 . ILE C 261 ? 0.5692 0.6250 0.6156 -0.0227 0.0245 0.0215 256 ILE E CG1 7129 C CG2 . ILE C 261 ? 0.6321 0.6872 0.6677 -0.0196 0.0228 0.0231 256 ILE E CG2 7130 C CD1 . ILE C 261 ? 0.6458 0.6974 0.6947 -0.0251 0.0251 0.0242 256 ILE E CD1 7131 N N . VAL C 262 ? 0.4948 0.5575 0.5337 -0.0158 0.0215 0.0134 257 VAL E N 7132 C CA . VAL C 262 ? 0.4788 0.5370 0.5135 -0.0140 0.0187 0.0095 257 VAL E CA 7133 C C . VAL C 262 ? 0.4734 0.5288 0.5129 -0.0167 0.0188 0.0086 257 VAL E C 7134 O O . VAL C 262 ? 0.5001 0.5599 0.5466 -0.0185 0.0208 0.0091 257 VAL E O 7135 C CB . VAL C 262 ? 0.4855 0.5486 0.5183 -0.0106 0.0181 0.0064 257 VAL E CB 7136 C CG1 . VAL C 262 ? 0.4737 0.5320 0.5028 -0.0089 0.0153 0.0027 257 VAL E CG1 7137 C CG2 . VAL C 262 ? 0.4707 0.5359 0.4977 -0.0075 0.0176 0.0066 257 VAL E CG2 7138 N N . LYS C 263 ? 0.5255 0.5739 0.5615 -0.0170 0.0166 0.0074 258 LYS E N 7139 C CA . LYS C 263 ? 0.5935 0.6390 0.6339 -0.0198 0.0168 0.0072 258 LYS E CA 7140 C C . LYS C 263 ? 0.6439 0.6895 0.6858 -0.0194 0.0156 0.0037 258 LYS E C 7141 O O . LYS C 263 ? 0.8982 0.9477 0.9469 -0.0211 0.0173 0.0032 258 LYS E O 7142 C CB . LYS C 263 ? 0.6168 0.6557 0.6537 -0.0210 0.0155 0.0085 258 LYS E CB 7143 C CG . LYS C 263 ? 0.6700 0.7084 0.7131 -0.0242 0.0173 0.0109 258 LYS E CG 7144 C CD . LYS C 263 ? 0.5992 0.6381 0.6483 -0.0259 0.0179 0.0091 258 LYS E CD 7145 C CE . LYS C 263 ? 0.5689 0.6046 0.6214 -0.0285 0.0185 0.0106 258 LYS E CE 7146 N NZ . LYS C 263 ? 0.5566 0.5937 0.6164 -0.0304 0.0197 0.0093 258 LYS E NZ 7147 N N . LYS C 264 ? 0.5799 0.6212 0.6157 -0.0175 0.0129 0.0013 259 LYS E N 7148 C CA . LYS C 264 ? 0.7129 0.7550 0.7499 -0.0168 0.0117 -0.0020 259 LYS E CA 7149 C C . LYS C 264 ? 0.6617 0.7025 0.7034 -0.0194 0.0118 -0.0030 259 LYS E C 7150 O O . LYS C 264 ? 0.8345 0.8724 0.8731 -0.0186 0.0096 -0.0053 259 LYS E O 7151 C CB . LYS C 264 ? 0.7329 0.7828 0.7735 -0.0154 0.0131 -0.0032 259 LYS E CB 7152 C CG . LYS C 264 ? 0.8367 0.8875 0.8741 -0.0123 0.0111 -0.0067 259 LYS E CG 7153 C CD . LYS C 264 ? 0.9074 0.9637 0.9426 -0.0088 0.0113 -0.0075 259 LYS E CD 7154 C CE . LYS C 264 ? 0.9514 1.0034 0.9789 -0.0065 0.0099 -0.0066 259 LYS E CE 7155 N NZ . LYS C 264 ? 0.9798 1.0381 1.0058 -0.0031 0.0105 -0.0072 259 LYS E NZ 7156 N N . GLY C 265 ? 0.6131 0.6562 0.6619 -0.0223 0.0141 -0.0015 260 GLY E N 7157 C CA . GLY C 265 ? 0.6034 0.6458 0.6574 -0.0249 0.0145 -0.0026 260 GLY E CA 7158 C C . GLY C 265 ? 0.5364 0.5774 0.5955 -0.0279 0.0164 0.0000 260 GLY E C 7159 O O . GLY C 265 ? 0.4727 0.5145 0.5328 -0.0284 0.0180 0.0029 260 GLY E O 7160 N N . ASP C 266 ? 0.6009 0.6402 0.6634 -0.0298 0.0163 -0.0011 261 ASP E N 7161 C CA . ASP C 266 ? 0.6323 0.6695 0.6993 -0.0323 0.0177 0.0008 261 ASP E CA 7162 C C . ASP C 266 ? 0.5172 0.5570 0.5923 -0.0346 0.0194 -0.0005 261 ASP E C 7163 O O . ASP C 266 ? 0.5585 0.6009 0.6355 -0.0345 0.0189 -0.0036 261 ASP E O 7164 C CB . ASP C 266 ? 0.7504 0.7828 0.8140 -0.0327 0.0159 0.0004 261 ASP E CB 7165 C CG . ASP C 266 ? 0.9287 0.9579 0.9853 -0.0315 0.0147 0.0026 261 ASP E CG 7166 O OD1 . ASP C 266 ? 0.8760 0.9046 0.9330 -0.0321 0.0160 0.0058 261 ASP E OD1 7167 O OD2 . ASP C 266 ? 0.9834 1.0105 1.0340 -0.0302 0.0123 0.0010 261 ASP E OD2 7168 N N . SER C 267 ? 0.4296 0.4685 0.5095 -0.0365 0.0214 0.0018 262 SER E N 7169 C CA . SER C 267 ? 0.4309 0.4712 0.5183 -0.0388 0.0230 0.0009 262 SER E CA 7170 C C . SER C 267 ? 0.4223 0.4585 0.5125 -0.0403 0.0240 0.0032 262 SER E C 7171 O O . SER C 267 ? 0.4569 0.4897 0.5435 -0.0396 0.0227 0.0036 262 SER E O 7172 C CB . SER C 267 ? 0.4550 0.5000 0.5459 -0.0395 0.0250 0.0021 262 SER E CB 7173 O OG . SER C 267 ? 0.4533 0.5003 0.5511 -0.0418 0.0261 0.0004 262 SER E OG 7174 N N . THR C 268 ? 0.4058 0.4422 0.5024 -0.0423 0.0262 0.0046 263 THR E N 7175 C CA . THR C 268 ? 0.4031 0.4355 0.5022 -0.0433 0.0272 0.0072 263 THR E CA 7176 C C . THR C 268 ? 0.4328 0.4659 0.5376 -0.0452 0.0297 0.0097 263 THR E C 7177 O O . THR C 268 ? 0.4517 0.4890 0.5582 -0.0459 0.0306 0.0095 263 THR E O 7178 C CB . THR C 268 ? 0.4111 0.4405 0.5127 -0.0440 0.0264 0.0045 263 THR E CB 7179 O OG1 . THR C 268 ? 0.4423 0.4678 0.5445 -0.0440 0.0271 0.0071 263 THR E OG1 7180 C CG2 . THR C 268 ? 0.4478 0.4784 0.5562 -0.0462 0.0274 0.0018 263 THR E CG2 7181 N N . ILE C 269 ? 0.4051 0.4343 0.5127 -0.0460 0.0308 0.0122 264 ILE E N 7182 C CA . ILE C 269 ? 0.4377 0.4667 0.5507 -0.0480 0.0332 0.0150 264 ILE E CA 7183 C C . ILE C 269 ? 0.4282 0.4551 0.5477 -0.0504 0.0337 0.0124 264 ILE E C 7184 O O . ILE C 269 ? 0.4561 0.4792 0.5766 -0.0501 0.0330 0.0107 264 ILE E O 7185 C CB . ILE C 269 ? 0.4857 0.5109 0.5982 -0.0475 0.0341 0.0196 264 ILE E CB 7186 C CG1 . ILE C 269 ? 0.4966 0.5234 0.6022 -0.0451 0.0333 0.0219 264 ILE E CG1 7187 C CG2 . ILE C 269 ? 0.4998 0.5243 0.6177 -0.0497 0.0365 0.0231 264 ILE E CG2 7188 C CD1 . ILE C 269 ? 0.5076 0.5396 0.6114 -0.0449 0.0339 0.0231 264 ILE E CD1 7189 N N . MET C 270 ? 0.4438 0.4736 0.5678 -0.0527 0.0350 0.0118 265 MET E N 7190 C CA . MET C 270 ? 0.4889 0.5169 0.6194 -0.0554 0.0356 0.0094 265 MET E CA 7191 C C . MET C 270 ? 0.4962 0.5200 0.6313 -0.0574 0.0377 0.0132 265 MET E C 7192 O O . MET C 270 ? 0.5548 0.5805 0.6902 -0.0581 0.0392 0.0172 265 MET E O 7193 C CB . MET C 270 ? 0.5063 0.5400 0.6392 -0.0570 0.0357 0.0062 265 MET E CB 7194 C CG . MET C 270 ? 0.5056 0.5378 0.6457 -0.0604 0.0365 0.0038 265 MET E CG 7195 S SD . MET C 270 ? 0.4902 0.5296 0.6330 -0.0622 0.0362 -0.0009 265 MET E SD 7196 C CE . MET C 270 ? 0.5135 0.5540 0.6510 -0.0589 0.0334 -0.0053 265 MET E CE 7197 N N . LYS C 271 ? 0.5047 0.5228 0.6435 -0.0582 0.0377 0.0120 266 LYS E N 7198 C CA . LYS C 271 ? 0.5347 0.5477 0.6782 -0.0602 0.0394 0.0152 266 LYS E CA 7199 C C . LYS C 271 ? 0.5329 0.5465 0.6826 -0.0639 0.0402 0.0124 266 LYS E C 7200 O O . LYS C 271 ? 0.4616 0.4742 0.6135 -0.0644 0.0392 0.0076 266 LYS E O 7201 C CB . LYS C 271 ? 0.5842 0.5903 0.7279 -0.0586 0.0389 0.0154 266 LYS E CB 7202 C CG . LYS C 271 ? 0.6240 0.6297 0.7619 -0.0551 0.0382 0.0181 266 LYS E CG 7203 C CD . LYS C 271 ? 0.6820 0.6894 0.8176 -0.0548 0.0395 0.0238 266 LYS E CD 7204 C CE . LYS C 271 ? 0.7173 0.7210 0.8505 -0.0524 0.0396 0.0279 266 LYS E CE 7205 N NZ . LYS C 271 ? 0.6497 0.6528 0.7839 -0.0532 0.0416 0.0339 266 LYS E NZ 7206 N N . SER C 272 ? 0.5284 0.5441 0.6810 -0.0667 0.0420 0.0154 267 SER E N 7207 C CA . SER C 272 ? 0.5052 0.5216 0.6638 -0.0708 0.0428 0.0132 267 SER E CA 7208 C C . SER C 272 ? 0.5269 0.5418 0.6891 -0.0740 0.0450 0.0182 267 SER E C 7209 O O . SER C 272 ? 0.5141 0.5315 0.6736 -0.0731 0.0460 0.0231 267 SER E O 7210 C CB . SER C 272 ? 0.5537 0.5790 0.7117 -0.0714 0.0423 0.0101 267 SER E CB 7211 O OG . SER C 272 ? 0.5269 0.5532 0.6908 -0.0755 0.0429 0.0072 267 SER E OG 7212 N N . GLU C 273 ? 0.6110 0.6222 0.7792 -0.0778 0.0458 0.0170 268 GLU E N 7213 C CA . GLU C 273 ? 0.6614 0.6706 0.8335 -0.0815 0.0479 0.0218 268 GLU E CA 7214 C C . GLU C 273 ? 0.7095 0.7267 0.8845 -0.0854 0.0488 0.0211 268 GLU E C 7215 O O . GLU C 273 ? 0.8681 0.8864 1.0457 -0.0887 0.0506 0.0254 268 GLU E O 7216 C CB . GLU C 273 ? 0.6571 0.6561 0.8339 -0.0836 0.0482 0.0217 268 GLU E CB 7217 C CG . GLU C 273 ? 0.6891 0.6804 0.8635 -0.0796 0.0472 0.0218 268 GLU E CG 7218 C CD . GLU C 273 ? 0.7536 0.7449 0.9232 -0.0763 0.0476 0.0274 268 GLU E CD 7219 O OE1 . GLU C 273 ? 0.8139 0.8038 0.9844 -0.0778 0.0492 0.0332 268 GLU E OE1 7220 O OE2 . GLU C 273 ? 0.8709 0.8635 1.0356 -0.0721 0.0462 0.0263 268 GLU E OE2 7221 N N . MET C 274 ? 0.6873 0.7112 0.8613 -0.0847 0.0476 0.0160 269 MET E N 7222 C CA . MET C 274 ? 0.6692 0.7017 0.8458 -0.0878 0.0482 0.0144 269 MET E CA 7223 C C . MET C 274 ? 0.6570 0.6986 0.8306 -0.0869 0.0490 0.0176 269 MET E C 7224 O O . MET C 274 ? 0.6599 0.7014 0.8292 -0.0841 0.0493 0.0217 269 MET E O 7225 C CB . MET C 274 ? 0.6372 0.6739 0.8136 -0.0869 0.0464 0.0077 269 MET E CB 7226 C CG . MET C 274 ? 0.7266 0.7559 0.9068 -0.0884 0.0457 0.0038 269 MET E CG 7227 S SD . MET C 274 ? 0.8537 0.8901 1.0352 -0.0888 0.0441 -0.0038 269 MET E SD 7228 C CE . MET C 274 ? 0.8051 0.8491 0.9790 -0.0835 0.0428 -0.0037 269 MET E CE 7229 N N . GLU C 275 ? 0.6482 0.6981 0.8245 -0.0897 0.0494 0.0154 270 GLU E N 7230 C CA . GLU C 275 ? 0.6355 0.6946 0.8112 -0.0907 0.0507 0.0184 270 GLU E CA 7231 C C . GLU C 275 ? 0.5950 0.6641 0.7677 -0.0881 0.0495 0.0144 270 GLU E C 7232 O O . GLU C 275 ? 0.5856 0.6555 0.7593 -0.0879 0.0481 0.0090 270 GLU E O 7233 C CB . GLU C 275 ? 0.6639 0.7244 0.8463 -0.0970 0.0525 0.0198 270 GLU E CB 7234 C CG . GLU C 275 ? 0.7671 0.8320 0.9493 -0.0985 0.0545 0.0261 270 GLU E CG 7235 C CD . GLU C 275 ? 0.7901 0.8457 0.9714 -0.0981 0.0554 0.0317 270 GLU E CD 7236 O OE1 . GLU C 275 ? 0.7625 0.8076 0.9455 -0.0983 0.0548 0.0307 270 GLU E OE1 7237 O OE2 . GLU C 275 ? 0.8147 0.8740 0.9935 -0.0971 0.0566 0.0370 270 GLU E OE2 7238 N N . TYR C 276 ? 0.5479 0.6247 0.7170 -0.0860 0.0501 0.0170 271 TYR E N 7239 C CA . TYR C 276 ? 0.5250 0.6119 0.6911 -0.0833 0.0490 0.0136 271 TYR E CA 7240 C C . TYR C 276 ? 0.5336 0.6279 0.7052 -0.0875 0.0496 0.0105 271 TYR E C 7241 O O . TYR C 276 ? 0.4913 0.5878 0.6678 -0.0923 0.0514 0.0133 271 TYR E O 7242 C CB . TYR C 276 ? 0.5120 0.6057 0.6735 -0.0805 0.0497 0.0173 271 TYR E CB 7243 C CG . TYR C 276 ? 0.5111 0.6140 0.6687 -0.0768 0.0484 0.0138 271 TYR E CG 7244 C CD1 . TYR C 276 ? 0.4959 0.5965 0.6495 -0.0729 0.0460 0.0094 271 TYR E CD1 7245 C CD2 . TYR C 276 ? 0.5280 0.6422 0.6858 -0.0772 0.0494 0.0148 271 TYR E CD2 7246 C CE1 . TYR C 276 ? 0.4975 0.6058 0.6473 -0.0693 0.0447 0.0063 271 TYR E CE1 7247 C CE2 . TYR C 276 ? 0.5259 0.6483 0.6799 -0.0733 0.0481 0.0115 271 TYR E CE2 7248 C CZ . TYR C 276 ? 0.5288 0.6478 0.6788 -0.0694 0.0457 0.0073 271 TYR E CZ 7249 O OH . TYR C 276 ? 0.6073 0.7336 0.7534 -0.0654 0.0443 0.0042 271 TYR E OH 7250 N N . GLY C 277 ? 0.5315 0.6301 0.7024 -0.0858 0.0479 0.0051 272 GLY E N 7251 C CA . GLY C 277 ? 0.5333 0.6396 0.7092 -0.0894 0.0481 0.0015 272 GLY E CA 7252 C C . GLY C 277 ? 0.5758 0.6947 0.7495 -0.0871 0.0476 -0.0008 272 GLY E C 7253 O O . GLY C 277 ? 0.5818 0.7072 0.7588 -0.0888 0.0472 -0.0049 272 GLY E O 7254 N N . HIS C 278 ? 0.5816 0.7042 0.7500 -0.0829 0.0475 0.0015 273 HIS E N 7255 C CA . HIS C 278 ? 0.6201 0.7550 0.7864 -0.0804 0.0472 -0.0001 273 HIS E CA 7256 C C . HIS C 278 ? 0.6054 0.7433 0.7709 -0.0783 0.0451 -0.0062 273 HIS E C 7257 O O . HIS C 278 ? 0.6551 0.8031 0.8230 -0.0792 0.0451 -0.0089 273 HIS E O 7258 C CB . HIS C 278 ? 0.6352 0.7799 0.8068 -0.0853 0.0494 0.0019 273 HIS E CB 7259 C CG . HIS C 278 ? 0.6367 0.7785 0.8095 -0.0879 0.0516 0.0082 273 HIS E CG 7260 N ND1 . HIS C 278 ? 0.6159 0.7618 0.7844 -0.0849 0.0523 0.0120 273 HIS E ND1 7261 C CD2 . HIS C 278 ? 0.6224 0.7570 0.7998 -0.0931 0.0531 0.0113 273 HIS E CD2 7262 C CE1 . HIS C 278 ? 0.6104 0.7520 0.7809 -0.0881 0.0542 0.0174 273 HIS E CE1 7263 N NE2 . HIS C 278 ? 0.6378 0.7723 0.8137 -0.0931 0.0546 0.0173 273 HIS E NE2 7264 N N . CYS C 279 ? 0.6236 0.7530 0.7859 -0.0754 0.0433 -0.0083 274 CYS E N 7265 C CA . CYS C 279 ? 0.6202 0.7504 0.7819 -0.0738 0.0412 -0.0139 274 CYS E CA 7266 C C . CYS C 279 ? 0.5700 0.6961 0.7239 -0.0676 0.0391 -0.0145 274 CYS E C 7267 O O . CYS C 279 ? 0.5214 0.6429 0.6711 -0.0654 0.0393 -0.0109 274 CYS E O 7268 C CB . CYS C 279 ? 0.6907 0.8129 0.8570 -0.0774 0.0411 -0.0159 274 CYS E CB 7269 S SG . CYS C 279 ? 0.8042 0.9122 0.9701 -0.0783 0.0418 -0.0116 274 CYS E SG 7270 N N . ASN C 280 ? 0.5352 0.6631 0.6874 -0.0652 0.0371 -0.0191 275 ASN E N 7271 C CA . ASN C 280 ? 0.5624 0.6858 0.7072 -0.0598 0.0349 -0.0200 275 ASN E CA 7272 C C . ASN C 280 ? 0.5514 0.6694 0.6969 -0.0600 0.0333 -0.0236 275 ASN E C 7273 O O . ASN C 280 ? 0.5455 0.6664 0.6963 -0.0631 0.0334 -0.0268 275 ASN E O 7274 C CB . ASN C 280 ? 0.5547 0.6869 0.6950 -0.0554 0.0338 -0.0214 275 ASN E CB 7275 C CG . ASN C 280 ? 0.5889 0.7161 0.7212 -0.0498 0.0314 -0.0221 275 ASN E CG 7276 O OD1 . ASN C 280 ? 0.5676 0.6869 0.6962 -0.0486 0.0313 -0.0193 275 ASN E OD1 7277 N ND2 . ASN C 280 ? 0.5749 0.7064 0.7044 -0.0466 0.0295 -0.0258 275 ASN E ND2 7278 N N . THR C 281 ? 0.5319 0.6420 0.6721 -0.0570 0.0318 -0.0232 276 THR E N 7279 C CA . THR C 281 ? 0.5138 0.6189 0.6537 -0.0567 0.0301 -0.0265 276 THR E CA 7280 C C . THR C 281 ? 0.5316 0.6319 0.6637 -0.0520 0.0279 -0.0266 276 THR E C 7281 O O . THR C 281 ? 0.5793 0.6780 0.7064 -0.0493 0.0277 -0.0237 276 THR E O 7282 C CB . THR C 281 ? 0.4962 0.5940 0.6410 -0.0606 0.0312 -0.0256 276 THR E CB 7283 O OG1 . THR C 281 ? 0.5102 0.6052 0.6558 -0.0608 0.0298 -0.0295 276 THR E OG1 7284 C CG2 . THR C 281 ? 0.5186 0.6082 0.6603 -0.0597 0.0318 -0.0212 276 THR E CG2 7285 N N . LYS C 282 ? 0.5869 0.6853 0.7182 -0.0513 0.0261 -0.0299 277 LYS E N 7286 C CA . LYS C 282 ? 0.5919 0.6846 0.7165 -0.0478 0.0240 -0.0301 277 LYS E CA 7287 C C . LYS C 282 ? 0.5424 0.6264 0.6677 -0.0493 0.0242 -0.0286 277 LYS E C 7288 O O . LYS C 282 ? 0.5344 0.6131 0.6542 -0.0469 0.0228 -0.0277 277 LYS E O 7289 C CB . LYS C 282 ? 0.6815 0.7765 0.8051 -0.0464 0.0219 -0.0344 277 LYS E CB 7290 C CG . LYS C 282 ? 0.8359 0.9377 0.9561 -0.0432 0.0204 -0.0366 277 LYS E CG 7291 C CD . LYS C 282 ? 0.9130 1.0137 1.0311 -0.0419 0.0181 -0.0400 277 LYS E CD 7292 C CE . LYS C 282 ? 1.0752 1.1812 1.2001 -0.0449 0.0185 -0.0438 277 LYS E CE 7293 N NZ . LYS C 282 ? 1.2142 1.3300 1.3397 -0.0436 0.0182 -0.0462 277 LYS E NZ 7294 N N . CYS C 283 ? 0.4864 0.5691 0.6184 -0.0532 0.0258 -0.0289 278 CYS E N 7295 C CA . CYS C 283 ? 0.4616 0.5368 0.5953 -0.0547 0.0259 -0.0286 278 CYS E CA 7296 C C . CYS C 283 ? 0.4364 0.5088 0.5758 -0.0583 0.0283 -0.0261 278 CYS E C 7297 O O . CYS C 283 ? 0.4649 0.5398 0.6104 -0.0616 0.0293 -0.0279 278 CYS E O 7298 C CB . CYS C 283 ? 0.4412 0.5173 0.5773 -0.0554 0.0247 -0.0334 278 CYS E CB 7299 S SG . CYS C 283 ? 0.4893 0.5569 0.6278 -0.0570 0.0248 -0.0337 278 CYS E SG 7300 N N . GLN C 284 ? 0.4521 0.5189 0.5895 -0.0577 0.0291 -0.0218 279 GLN E N 7301 C CA . GLN C 284 ? 0.4080 0.4710 0.5503 -0.0609 0.0312 -0.0188 279 GLN E CA 7302 C C . GLN C 284 ? 0.4292 0.4843 0.5729 -0.0615 0.0311 -0.0188 279 GLN E C 7303 O O . GLN C 284 ? 0.4206 0.4720 0.5596 -0.0588 0.0297 -0.0187 279 GLN E O 7304 C CB . GLN C 284 ? 0.4293 0.4919 0.5685 -0.0598 0.0323 -0.0138 279 GLN E CB 7305 C CG . GLN C 284 ? 0.4554 0.5156 0.5994 -0.0630 0.0347 -0.0101 279 GLN E CG 7306 C CD . GLN C 284 ? 0.4648 0.5307 0.6148 -0.0668 0.0361 -0.0111 279 GLN E CD 7307 O OE1 . GLN C 284 ? 0.4351 0.5091 0.5843 -0.0662 0.0361 -0.0120 279 GLN E OE1 7308 N NE2 . GLN C 284 ? 0.4708 0.5328 0.6268 -0.0705 0.0371 -0.0115 279 GLN E NE2 7309 N N . THR C 285 ? 0.4069 0.4592 0.5570 -0.0650 0.0325 -0.0192 280 THR E N 7310 C CA . THR C 285 ? 0.4107 0.4550 0.5626 -0.0655 0.0327 -0.0186 280 THR E CA 7311 C C . THR C 285 ? 0.4016 0.4421 0.5568 -0.0679 0.0349 -0.0141 280 THR E C 7312 O O . THR C 285 ? 0.3905 0.4351 0.5479 -0.0700 0.0362 -0.0124 280 THR E O 7313 C CB . THR C 285 ? 0.4261 0.4691 0.5825 -0.0673 0.0321 -0.0235 280 THR E CB 7314 O OG1 . THR C 285 ? 0.4985 0.5404 0.6616 -0.0714 0.0337 -0.0236 280 THR E OG1 7315 C CG2 . THR C 285 ? 0.4397 0.4893 0.5947 -0.0663 0.0305 -0.0282 280 THR E CG2 7316 N N . PRO C 286 ? 0.4391 0.4720 0.5945 -0.0674 0.0352 -0.0119 281 PRO E N 7317 C CA . PRO C 286 ? 0.4499 0.4790 0.6079 -0.0693 0.0372 -0.0071 281 PRO E CA 7318 C C . PRO C 286 ? 0.5003 0.5281 0.6653 -0.0738 0.0385 -0.0080 281 PRO E C 7319 O O . PRO C 286 ? 0.5341 0.5598 0.7013 -0.0759 0.0403 -0.0037 281 PRO E O 7320 C CB . PRO C 286 ? 0.4356 0.4569 0.5922 -0.0673 0.0369 -0.0052 281 PRO E CB 7321 C CG . PRO C 286 ? 0.4497 0.4720 0.6015 -0.0640 0.0348 -0.0082 281 PRO E CG 7322 C CD . PRO C 286 ? 0.4285 0.4564 0.5817 -0.0650 0.0338 -0.0134 281 PRO E CD 7323 N N . ILE C 287 ? 0.4857 0.5151 0.6541 -0.0755 0.0377 -0.0134 282 ILE E N 7324 C CA . ILE C 287 ? 0.5003 0.5294 0.6755 -0.0803 0.0389 -0.0147 282 ILE E CA 7325 C C . ILE C 287 ? 0.5381 0.5768 0.7149 -0.0825 0.0390 -0.0172 282 ILE E C 7326 O O . ILE C 287 ? 0.5246 0.5645 0.7071 -0.0869 0.0399 -0.0186 282 ILE E O 7327 C CB . ILE C 287 ? 0.5184 0.5412 0.6974 -0.0814 0.0383 -0.0188 282 ILE E CB 7328 C CG1 . ILE C 287 ? 0.4915 0.5183 0.6687 -0.0794 0.0362 -0.0247 282 ILE E CG1 7329 C CG2 . ILE C 287 ? 0.5162 0.5295 0.6944 -0.0797 0.0385 -0.0159 282 ILE E CG2 7330 C CD1 . ILE C 287 ? 0.4929 0.5152 0.6745 -0.0809 0.0356 -0.0295 282 ILE E CD1 7331 N N . GLY C 288 ? 0.5397 0.5854 0.7116 -0.0794 0.0380 -0.0178 283 GLY E N 7332 C CA . GLY C 288 ? 0.5209 0.5764 0.6936 -0.0805 0.0380 -0.0200 283 GLY E CA 7333 C C . GLY C 288 ? 0.5177 0.5788 0.6853 -0.0765 0.0360 -0.0229 283 GLY E C 7334 O O . GLY C 288 ? 0.5201 0.5774 0.6845 -0.0737 0.0345 -0.0247 283 GLY E O 7335 N N . ALA C 289 ? 0.4990 0.5691 0.6657 -0.0763 0.0360 -0.0235 284 ALA E N 7336 C CA . ALA C 289 ? 0.4930 0.5690 0.6549 -0.0725 0.0341 -0.0263 284 ALA E CA 7337 C C . ALA C 289 ? 0.4969 0.5763 0.6613 -0.0734 0.0328 -0.0322 284 ALA E C 7338 O O . ALA C 289 ? 0.6016 0.6823 0.7721 -0.0773 0.0336 -0.0344 284 ALA E O 7339 C CB . ALA C 289 ? 0.4609 0.5453 0.6209 -0.0717 0.0347 -0.0246 284 ALA E CB 7340 N N . ILE C 290 ? 0.5162 0.5972 0.6758 -0.0696 0.0308 -0.0345 285 ILE E N 7341 C CA . ILE C 290 ? 0.5587 0.6429 0.7196 -0.0696 0.0293 -0.0400 285 ILE E CA 7342 C C . ILE C 290 ? 0.5976 0.6911 0.7558 -0.0675 0.0283 -0.0415 285 ILE E C 7343 O O . ILE C 290 ? 0.5703 0.6647 0.7226 -0.0639 0.0277 -0.0392 285 ILE E O 7344 C CB . ILE C 290 ? 0.5287 0.6072 0.6856 -0.0667 0.0275 -0.0413 285 ILE E CB 7345 C CG1 . ILE C 290 ? 0.5480 0.6181 0.7082 -0.0687 0.0282 -0.0411 285 ILE E CG1 7346 C CG2 . ILE C 290 ? 0.5974 0.6811 0.7539 -0.0657 0.0256 -0.0465 285 ILE E CG2 7347 C CD1 . ILE C 290 ? 0.5249 0.5897 0.6808 -0.0657 0.0267 -0.0414 285 ILE E CD1 7348 N N . ASN C 291 ? 0.6182 0.7186 0.7805 -0.0694 0.0281 -0.0457 286 ASN E N 7349 C CA . ASN C 291 ? 0.6539 0.7642 0.8142 -0.0674 0.0272 -0.0475 286 ASN E CA 7350 C C . ASN C 291 ? 0.6232 0.7368 0.7847 -0.0672 0.0255 -0.0529 286 ASN E C 7351 O O . ASN C 291 ? 0.5804 0.6975 0.7479 -0.0710 0.0261 -0.0561 286 ASN E O 7352 C CB . ASN C 291 ? 0.7137 0.8309 0.8788 -0.0707 0.0291 -0.0465 286 ASN E CB 7353 C CG . ASN C 291 ? 0.8366 0.9651 1.0006 -0.0690 0.0285 -0.0486 286 ASN E CG 7354 O OD1 . ASN C 291 ? 0.8543 0.9851 1.0130 -0.0645 0.0266 -0.0499 286 ASN E OD1 7355 N ND2 . ASN C 291 ? 1.0621 1.1982 1.2315 -0.0727 0.0301 -0.0487 286 ASN E ND2 7356 N N . SER C 292 ? 0.5426 0.6549 0.6983 -0.0631 0.0235 -0.0538 287 SER E N 7357 C CA . SER C 292 ? 0.4792 0.5929 0.6355 -0.0629 0.0219 -0.0585 287 SER E CA 7358 C C . SER C 292 ? 0.5073 0.6220 0.6565 -0.0580 0.0195 -0.0590 287 SER E C 7359 O O . SER C 292 ? 0.5501 0.6608 0.6934 -0.0549 0.0190 -0.0556 287 SER E O 7360 C CB . SER C 292 ? 0.4478 0.5533 0.6065 -0.0648 0.0221 -0.0590 287 SER E CB 7361 O OG . SER C 292 ? 0.4359 0.5433 0.5954 -0.0647 0.0206 -0.0636 287 SER E OG 7362 N N . SER C 293 ? 0.5376 0.6578 0.6874 -0.0576 0.0181 -0.0634 288 SER E N 7363 C CA . SER C 293 ? 0.6015 0.7227 0.7451 -0.0534 0.0157 -0.0643 288 SER E CA 7364 C C . SER C 293 ? 0.6002 0.7175 0.7442 -0.0540 0.0147 -0.0668 288 SER E C 7365 O O . SER C 293 ? 0.6277 0.7452 0.7668 -0.0511 0.0128 -0.0675 288 SER E O 7366 C CB . SER C 293 ? 0.6773 0.8088 0.8208 -0.0519 0.0146 -0.0674 288 SER E CB 7367 O OG . SER C 293 ? 0.8565 0.9915 0.9972 -0.0497 0.0149 -0.0649 288 SER E OG 7368 N N . MET C 294 ? 0.5223 0.6361 0.6721 -0.0577 0.0161 -0.0680 289 MET E N 7369 C CA . MET C 294 ? 0.5226 0.6329 0.6732 -0.0583 0.0153 -0.0704 289 MET E CA 7370 C C . MET C 294 ? 0.5034 0.6062 0.6480 -0.0556 0.0144 -0.0672 289 MET E C 7371 O O . MET C 294 ? 0.4913 0.5893 0.6331 -0.0547 0.0151 -0.0628 289 MET E O 7372 C CB . MET C 294 ? 0.6391 0.7464 0.7971 -0.0626 0.0169 -0.0722 289 MET E CB 7373 C CG . MET C 294 ? 0.6726 0.7875 0.8370 -0.0659 0.0175 -0.0763 289 MET E CG 7374 S SD . MET C 294 ? 0.8082 0.9336 0.9708 -0.0637 0.0153 -0.0810 289 MET E SD 7375 C CE . MET C 294 ? 0.9542 1.0876 1.1253 -0.0685 0.0163 -0.0856 289 MET E CE 7376 N N . PRO C 295 ? 0.4969 0.5996 0.6393 -0.0542 0.0128 -0.0693 290 PRO E N 7377 C CA . PRO C 295 ? 0.4971 0.5937 0.6338 -0.0520 0.0118 -0.0667 290 PRO E CA 7378 C C . PRO C 295 ? 0.4675 0.5564 0.6064 -0.0535 0.0130 -0.0652 290 PRO E C 7379 O O . PRO C 295 ? 0.5527 0.6363 0.6869 -0.0518 0.0126 -0.0620 290 PRO E O 7380 C CB . PRO C 295 ? 0.5334 0.6341 0.6683 -0.0507 0.0098 -0.0702 290 PRO E CB 7381 C CG . PRO C 295 ? 0.5333 0.6394 0.6750 -0.0533 0.0103 -0.0751 290 PRO E CG 7382 C CD . PRO C 295 ? 0.5343 0.6434 0.6796 -0.0550 0.0118 -0.0746 290 PRO E CD 7383 N N . PHE C 296 ? 0.3980 0.4860 0.5438 -0.0566 0.0145 -0.0675 291 PHE E N 7384 C CA . PHE C 296 ? 0.4123 0.4928 0.5606 -0.0579 0.0156 -0.0662 291 PHE E CA 7385 C C . PHE C 296 ? 0.4349 0.5126 0.5887 -0.0610 0.0178 -0.0650 291 PHE E C 7386 O O . PHE C 296 ? 0.4435 0.5260 0.6010 -0.0630 0.0184 -0.0666 291 PHE E O 7387 C CB . PHE C 296 ? 0.4272 0.5080 0.5780 -0.0584 0.0148 -0.0706 291 PHE E CB 7388 C CG . PHE C 296 ? 0.3963 0.4804 0.5418 -0.0557 0.0127 -0.0717 291 PHE E CG 7389 C CD1 . PHE C 296 ? 0.3803 0.4604 0.5200 -0.0534 0.0120 -0.0683 291 PHE E CD1 7390 C CD2 . PHE C 296 ? 0.4105 0.5020 0.5566 -0.0556 0.0114 -0.0761 291 PHE E CD2 7391 C CE1 . PHE C 296 ? 0.3783 0.4614 0.5128 -0.0512 0.0100 -0.0690 291 PHE E CE1 7392 C CE2 . PHE C 296 ? 0.4169 0.5115 0.5579 -0.0531 0.0095 -0.0767 291 PHE E CE2 7393 C CZ . PHE C 296 ? 0.4166 0.5069 0.5518 -0.0511 0.0087 -0.0732 291 PHE E CZ 7394 N N . HIS C 297 ? 0.4697 0.5398 0.6242 -0.0614 0.0189 -0.0620 292 HIS E N 7395 C CA . HIS C 297 ? 0.4540 0.5204 0.6141 -0.0646 0.0210 -0.0608 292 HIS E CA 7396 C C . HIS C 297 ? 0.4506 0.5087 0.6125 -0.0649 0.0217 -0.0598 292 HIS E C 7397 O O . HIS C 297 ? 0.4906 0.5461 0.6488 -0.0624 0.0207 -0.0591 292 HIS E O 7398 C CB . HIS C 297 ? 0.4609 0.5275 0.6194 -0.0646 0.0222 -0.0560 292 HIS E CB 7399 C CG . HIS C 297 ? 0.5022 0.5629 0.6560 -0.0624 0.0224 -0.0509 292 HIS E CG 7400 N ND1 . HIS C 297 ? 0.5002 0.5543 0.6562 -0.0637 0.0241 -0.0476 292 HIS E ND1 7401 C CD2 . HIS C 297 ? 0.5187 0.5791 0.6657 -0.0592 0.0212 -0.0486 292 HIS E CD2 7402 C CE1 . HIS C 297 ? 0.5017 0.5522 0.6525 -0.0612 0.0239 -0.0435 292 HIS E CE1 7403 N NE2 . HIS C 297 ? 0.5299 0.5842 0.6753 -0.0586 0.0222 -0.0441 292 HIS E NE2 7404 N N . ASN C 298 ? 0.4496 0.5038 0.6173 -0.0680 0.0232 -0.0600 293 ASN E N 7405 C CA . ASN C 298 ? 0.4576 0.5035 0.6271 -0.0680 0.0239 -0.0590 293 ASN E CA 7406 C C . ASN C 298 ? 0.4901 0.5303 0.6618 -0.0699 0.0259 -0.0543 293 ASN E C 7407 O O . ASN C 298 ? 0.5099 0.5430 0.6848 -0.0709 0.0267 -0.0539 293 ASN E O 7408 C CB . ASN C 298 ? 0.4658 0.5107 0.6404 -0.0697 0.0235 -0.0646 293 ASN E CB 7409 C CG . ASN C 298 ? 0.4744 0.5203 0.6552 -0.0741 0.0246 -0.0666 293 ASN E CG 7410 O OD1 . ASN C 298 ? 0.4222 0.4710 0.6035 -0.0757 0.0256 -0.0641 293 ASN E OD1 7411 N ND2 . ASN C 298 ? 0.4740 0.5177 0.6596 -0.0759 0.0245 -0.0713 293 ASN E ND2 7412 N N . ILE C 299 ? 0.4971 0.5403 0.6669 -0.0701 0.0266 -0.0507 294 ILE E N 7413 C CA . ILE C 299 ? 0.5472 0.5865 0.7194 -0.0723 0.0285 -0.0463 294 ILE E CA 7414 C C . ILE C 299 ? 0.5733 0.6050 0.7431 -0.0704 0.0292 -0.0414 294 ILE E C 7415 O O . ILE C 299 ? 0.5909 0.6158 0.7643 -0.0721 0.0304 -0.0399 294 ILE E O 7416 C CB . ILE C 299 ? 0.5570 0.6030 0.7280 -0.0731 0.0291 -0.0442 294 ILE E CB 7417 C CG1 . ILE C 299 ? 0.6366 0.6893 0.8121 -0.0762 0.0291 -0.0485 294 ILE E CG1 7418 C CG2 . ILE C 299 ? 0.5741 0.6169 0.7469 -0.0751 0.0312 -0.0391 294 ILE E CG2 7419 C CD1 . ILE C 299 ? 0.7038 0.7650 0.8766 -0.0743 0.0275 -0.0520 294 ILE E CD1 7420 N N . HIS C 300 ? 0.5575 0.5900 0.7210 -0.0669 0.0283 -0.0390 295 HIS E N 7421 C CA . HIS C 300 ? 0.4842 0.5109 0.6449 -0.0650 0.0289 -0.0340 295 HIS E CA 7422 C C . HIS C 300 ? 0.5015 0.5304 0.6552 -0.0614 0.0274 -0.0330 295 HIS E C 7423 O O . HIS C 300 ? 0.5318 0.5666 0.6824 -0.0606 0.0264 -0.0341 295 HIS E O 7424 C CB . HIS C 300 ? 0.5196 0.5461 0.6808 -0.0665 0.0306 -0.0292 295 HIS E CB 7425 C CG . HIS C 300 ? 0.5398 0.5593 0.7005 -0.0659 0.0318 -0.0243 295 HIS E CG 7426 N ND1 . HIS C 300 ? 0.6006 0.6190 0.7557 -0.0627 0.0313 -0.0208 295 HIS E ND1 7427 C CD2 . HIS C 300 ? 0.5285 0.5420 0.6935 -0.0679 0.0333 -0.0220 295 HIS E CD2 7428 C CE1 . HIS C 300 ? 0.5432 0.5558 0.6992 -0.0627 0.0325 -0.0167 295 HIS E CE1 7429 N NE2 . HIS C 300 ? 0.5489 0.5582 0.7108 -0.0657 0.0338 -0.0172 295 HIS E NE2 7430 N N . PRO C 301 ? 0.4710 0.4952 0.6221 -0.0592 0.0271 -0.0308 296 PRO E N 7431 C CA . PRO C 301 ? 0.4753 0.5015 0.6195 -0.0562 0.0256 -0.0298 296 PRO E CA 7432 C C . PRO C 301 ? 0.4707 0.4977 0.6100 -0.0550 0.0259 -0.0249 296 PRO E C 7433 O O . PRO C 301 ? 0.5477 0.5776 0.6814 -0.0531 0.0245 -0.0247 296 PRO E O 7434 C CB . PRO C 301 ? 0.4533 0.4746 0.5970 -0.0545 0.0253 -0.0294 296 PRO E CB 7435 C CG . PRO C 301 ? 0.4417 0.4573 0.5907 -0.0561 0.0270 -0.0279 296 PRO E CG 7436 C CD . PRO C 301 ? 0.4709 0.4885 0.6251 -0.0593 0.0277 -0.0309 296 PRO E CD 7437 N N . LEU C 302 ? 0.4229 0.4473 0.5642 -0.0562 0.0277 -0.0210 297 LEU E N 7438 C CA . LEU C 302 ? 0.3999 0.4246 0.5367 -0.0549 0.0281 -0.0163 297 LEU E CA 7439 C C . LEU C 302 ? 0.4236 0.4538 0.5594 -0.0555 0.0283 -0.0161 297 LEU E C 7440 O O . LEU C 302 ? 0.3935 0.4242 0.5308 -0.0567 0.0299 -0.0130 297 LEU E O 7441 C CB . LEU C 302 ? 0.4262 0.4458 0.5650 -0.0554 0.0298 -0.0119 297 LEU E CB 7442 C CG . LEU C 302 ? 0.4659 0.4799 0.6065 -0.0547 0.0297 -0.0125 297 LEU E CG 7443 C CD1 . LEU C 302 ? 0.4782 0.4869 0.6203 -0.0547 0.0313 -0.0075 297 LEU E CD1 7444 C CD2 . LEU C 302 ? 0.4995 0.5143 0.6348 -0.0519 0.0278 -0.0134 297 LEU E CD2 7445 N N . THR C 303 ? 0.4162 0.4511 0.5495 -0.0545 0.0267 -0.0195 298 THR E N 7446 C CA . THR C 303 ? 0.4118 0.4528 0.5443 -0.0547 0.0266 -0.0203 298 THR E CA 7447 C C . THR C 303 ? 0.4107 0.4529 0.5364 -0.0521 0.0259 -0.0175 298 THR E C 7448 O O . THR C 303 ? 0.4760 0.5156 0.5966 -0.0501 0.0246 -0.0165 298 THR E O 7449 C CB . THR C 303 ? 0.4258 0.4713 0.5589 -0.0547 0.0251 -0.0255 298 THR E CB 7450 O OG1 . THR C 303 ? 0.4143 0.4590 0.5426 -0.0524 0.0231 -0.0269 298 THR E OG1 7451 C CG2 . THR C 303 ? 0.4596 0.5044 0.5997 -0.0576 0.0259 -0.0288 298 THR E CG2 7452 N N . ILE C 304 ? 0.4012 0.4477 0.5266 -0.0523 0.0266 -0.0164 299 ILE E N 7453 C CA . ILE C 304 ? 0.3885 0.4370 0.5074 -0.0496 0.0256 -0.0147 299 ILE E CA 7454 C C . ILE C 304 ? 0.4138 0.4688 0.5325 -0.0491 0.0249 -0.0177 299 ILE E C 7455 O O . ILE C 304 ? 0.4936 0.5530 0.6170 -0.0510 0.0263 -0.0183 299 ILE E O 7456 C CB . ILE C 304 ? 0.4000 0.4480 0.5183 -0.0496 0.0273 -0.0101 299 ILE E CB 7457 C CG1 . ILE C 304 ? 0.4001 0.4419 0.5191 -0.0501 0.0281 -0.0070 299 ILE E CG1 7458 C CG2 . ILE C 304 ? 0.3723 0.4223 0.4836 -0.0466 0.0262 -0.0088 299 ILE E CG2 7459 C CD1 . ILE C 304 ? 0.4333 0.4747 0.5523 -0.0504 0.0298 -0.0022 299 ILE E CD1 7460 N N . GLY C 305 ? 0.4493 0.5052 0.5623 -0.0464 0.0228 -0.0194 300 GLY E N 7461 C CA . GLY C 305 ? 0.4554 0.5173 0.5673 -0.0452 0.0217 -0.0222 300 GLY E CA 7462 C C . GLY C 305 ? 0.4598 0.5219 0.5699 -0.0442 0.0196 -0.0258 300 GLY E C 7463 O O . GLY C 305 ? 0.4342 0.4917 0.5419 -0.0438 0.0186 -0.0256 300 GLY E O 7464 N N . GLU C 306 ? 0.4549 0.5230 0.5661 -0.0438 0.0189 -0.0291 301 GLU E N 7465 C CA . GLU C 306 ? 0.5081 0.5774 0.6180 -0.0430 0.0170 -0.0326 301 GLU E CA 7466 C C . GLU C 306 ? 0.4533 0.5255 0.5705 -0.0460 0.0180 -0.0357 301 GLU E C 7467 O O . GLU C 306 ? 0.5110 0.5890 0.6320 -0.0470 0.0187 -0.0374 301 GLU E O 7468 C CB . GLU C 306 ? 0.5566 0.6312 0.6630 -0.0404 0.0155 -0.0345 301 GLU E CB 7469 C CG . GLU C 306 ? 0.6502 0.7228 0.7490 -0.0371 0.0143 -0.0321 301 GLU E CG 7470 C CD . GLU C 306 ? 0.8439 0.9222 0.9401 -0.0344 0.0129 -0.0343 301 GLU E CD 7471 O OE1 . GLU C 306 ? 0.6807 0.7608 0.7761 -0.0337 0.0112 -0.0373 301 GLU E OE1 7472 O OE2 . GLU C 306 ? 0.8015 0.8830 0.8970 -0.0331 0.0136 -0.0331 301 GLU E OE2 7473 N N . CYS C 307 ? 0.4358 0.5042 0.5548 -0.0472 0.0178 -0.0368 302 CYS E N 7474 C CA . CYS C 307 ? 0.4432 0.5128 0.5693 -0.0502 0.0188 -0.0396 302 CYS E CA 7475 C C . CYS C 307 ? 0.4123 0.4836 0.5384 -0.0499 0.0171 -0.0436 302 CYS E C 7476 O O . CYS C 307 ? 0.4183 0.4889 0.5387 -0.0475 0.0153 -0.0436 302 CYS E O 7477 C CB . CYS C 307 ? 0.4473 0.5107 0.5765 -0.0521 0.0204 -0.0372 302 CYS E CB 7478 S SG . CYS C 307 ? 0.5083 0.5704 0.6373 -0.0525 0.0224 -0.0321 302 CYS E SG 7479 N N . PRO C 308 ? 0.4796 0.5536 0.6120 -0.0524 0.0177 -0.0472 303 PRO E N 7480 C CA . PRO C 308 ? 0.4634 0.5387 0.5963 -0.0523 0.0163 -0.0512 303 PRO E CA 7481 C C . PRO C 308 ? 0.4332 0.5019 0.5649 -0.0521 0.0162 -0.0499 303 PRO E C 7482 O O . PRO C 308 ? 0.4478 0.5113 0.5794 -0.0524 0.0174 -0.0463 303 PRO E O 7483 C CB . PRO C 308 ? 0.4510 0.5300 0.5915 -0.0555 0.0173 -0.0550 303 PRO E CB 7484 C CG . PRO C 308 ? 0.4885 0.5706 0.6314 -0.0568 0.0188 -0.0535 303 PRO E CG 7485 C CD . PRO C 308 ? 0.4662 0.5437 0.6050 -0.0553 0.0195 -0.0482 303 PRO E CD 7486 N N . LYS C 309 ? 0.4357 0.5052 0.5669 -0.0516 0.0149 -0.0528 304 LYS E N 7487 C CA . LYS C 309 ? 0.4368 0.5012 0.5667 -0.0510 0.0146 -0.0518 304 LYS E CA 7488 C C . LYS C 309 ? 0.4766 0.5379 0.6131 -0.0534 0.0161 -0.0533 304 LYS E C 7489 O O . LYS C 309 ? 0.5260 0.5904 0.6678 -0.0552 0.0164 -0.0574 304 LYS E O 7490 C CB . LYS C 309 ? 0.4399 0.5074 0.5664 -0.0496 0.0125 -0.0545 304 LYS E CB 7491 C CG . LYS C 309 ? 0.4380 0.5073 0.5572 -0.0472 0.0107 -0.0527 304 LYS E CG 7492 C CD . LYS C 309 ? 0.4907 0.5546 0.6053 -0.0461 0.0110 -0.0476 304 LYS E CD 7493 C CE . LYS C 309 ? 0.5428 0.6069 0.6495 -0.0437 0.0091 -0.0456 304 LYS E CE 7494 N NZ . LYS C 309 ? 0.6576 0.7255 0.7634 -0.0427 0.0089 -0.0460 304 LYS E NZ 7495 N N . TYR C 310 ? 0.4381 0.4931 0.5745 -0.0533 0.0172 -0.0500 305 TYR E N 7496 C CA . TYR C 310 ? 0.4422 0.4929 0.5847 -0.0553 0.0187 -0.0507 305 TYR E CA 7497 C C . TYR C 310 ? 0.4635 0.5140 0.6078 -0.0550 0.0178 -0.0546 305 TYR E C 7498 O O . TYR C 310 ? 0.4026 0.4530 0.5425 -0.0529 0.0166 -0.0541 305 TYR E O 7499 C CB . TYR C 310 ? 0.4581 0.5025 0.5997 -0.0550 0.0200 -0.0457 305 TYR E CB 7500 C CG . TYR C 310 ? 0.4951 0.5341 0.6426 -0.0568 0.0216 -0.0457 305 TYR E CG 7501 C CD1 . TYR C 310 ? 0.5672 0.6062 0.7206 -0.0598 0.0229 -0.0470 305 TYR E CD1 7502 C CD2 . TYR C 310 ? 0.5509 0.5846 0.6978 -0.0555 0.0217 -0.0442 305 TYR E CD2 7503 C CE1 . TYR C 310 ? 0.5867 0.6196 0.7451 -0.0614 0.0243 -0.0468 305 TYR E CE1 7504 C CE2 . TYR C 310 ? 0.5485 0.5765 0.7003 -0.0567 0.0230 -0.0441 305 TYR E CE2 7505 C CZ . TYR C 310 ? 0.5378 0.5650 0.6953 -0.0597 0.0243 -0.0453 305 TYR E CZ 7506 O OH . TYR C 310 ? 0.5733 0.5940 0.7352 -0.0607 0.0254 -0.0452 305 TYR E OH 7507 N N . VAL C 311 ? 0.4814 0.5320 0.6318 -0.0571 0.0184 -0.0586 306 VAL E N 7508 C CA . VAL C 311 ? 0.4856 0.5362 0.6382 -0.0568 0.0177 -0.0628 306 VAL E CA 7509 C C . VAL C 311 ? 0.5007 0.5460 0.6598 -0.0587 0.0190 -0.0645 306 VAL E C 7510 O O . VAL C 311 ? 0.5485 0.5912 0.7113 -0.0611 0.0205 -0.0633 306 VAL E O 7511 C CB . VAL C 311 ? 0.5131 0.5712 0.6661 -0.0569 0.0162 -0.0679 306 VAL E CB 7512 C CG1 . VAL C 311 ? 0.5100 0.5728 0.6563 -0.0548 0.0147 -0.0664 306 VAL E CG1 7513 C CG2 . VAL C 311 ? 0.5389 0.6000 0.6971 -0.0598 0.0170 -0.0707 306 VAL E CG2 7514 N N . LYS C 312 ? 0.5434 0.5871 0.7036 -0.0577 0.0184 -0.0676 307 LYS E N 7515 C CA . LYS C 312 ? 0.6518 0.6902 0.8179 -0.0592 0.0193 -0.0701 307 LYS E CA 7516 C C . LYS C 312 ? 0.6616 0.7046 0.8320 -0.0610 0.0186 -0.0767 307 LYS E C 7517 O O . LYS C 312 ? 0.7982 0.8436 0.9685 -0.0596 0.0175 -0.0807 307 LYS E O 7518 C CB . LYS C 312 ? 0.7008 0.7349 0.8655 -0.0564 0.0190 -0.0694 307 LYS E CB 7519 C CG . LYS C 312 ? 0.8372 0.8647 1.0073 -0.0572 0.0198 -0.0717 307 LYS E CG 7520 C CD . LYS C 312 ? 0.9413 0.9628 1.1100 -0.0545 0.0201 -0.0689 307 LYS E CD 7521 C CE . LYS C 312 ? 1.0345 1.0471 1.2083 -0.0559 0.0216 -0.0682 307 LYS E CE 7522 N NZ . LYS C 312 ? 1.1135 1.1208 1.2876 -0.0530 0.0214 -0.0687 307 LYS E NZ 7523 N N . SER C 313 ? 0.6223 0.6676 0.7960 -0.0640 0.0193 -0.0778 308 SER E N 7524 C CA . SER C 313 ? 0.6875 0.7376 0.8656 -0.0661 0.0187 -0.0841 308 SER E CA 7525 C C . SER C 313 ? 0.6426 0.6909 0.8259 -0.0701 0.0201 -0.0842 308 SER E C 7526 O O . SER C 313 ? 0.6678 0.7144 0.8504 -0.0711 0.0213 -0.0794 308 SER E O 7527 C CB . SER C 313 ? 0.6862 0.7463 0.8615 -0.0655 0.0173 -0.0863 308 SER E CB 7528 O OG . SER C 313 ? 0.8070 0.8699 0.9765 -0.0622 0.0160 -0.0851 308 SER E OG 7529 N N . ASN C 314 ? 0.7092 0.7587 0.8977 -0.0726 0.0199 -0.0898 309 ASN E N 7530 C CA . ASN C 314 ? 0.7497 0.7989 0.9436 -0.0771 0.0211 -0.0907 309 ASN E CA 7531 C C . ASN C 314 ? 0.6613 0.7208 0.8555 -0.0786 0.0205 -0.0931 309 ASN E C 7532 O O . ASN C 314 ? 0.7724 0.8336 0.9698 -0.0820 0.0215 -0.0926 309 ASN E O 7533 C CB . ASN C 314 ? 0.8603 0.9043 1.0600 -0.0795 0.0212 -0.0956 309 ASN E CB 7534 C CG . ASN C 314 ? 1.0098 1.0438 1.2092 -0.0774 0.0215 -0.0940 309 ASN E CG 7535 O OD1 . ASN C 314 ? 1.1032 1.1357 1.3036 -0.0759 0.0206 -0.0984 309 ASN E OD1 7536 N ND2 . ASN C 314 ? 1.0999 1.1279 1.2977 -0.0770 0.0228 -0.0876 309 ASN E ND2 7537 N N . LYS C 315 ? 0.6307 0.6974 0.8212 -0.0758 0.0189 -0.0955 310 LYS E N 7538 C CA . LYS C 315 ? 0.6781 0.7544 0.8702 -0.0771 0.0179 -0.1004 310 LYS E CA 7539 C C . LYS C 315 ? 0.5761 0.6590 0.7623 -0.0732 0.0161 -0.1009 310 LYS E C 7540 O O . LYS C 315 ? 0.5653 0.6467 0.7498 -0.0708 0.0152 -0.1024 310 LYS E O 7541 C CB . LYS C 315 ? 0.7692 0.8441 0.9666 -0.0792 0.0175 -0.1068 310 LYS E CB 7542 C CG . LYS C 315 ? 0.9001 0.9812 1.1026 -0.0831 0.0175 -0.1116 310 LYS E CG 7543 C CD . LYS C 315 ? 0.9722 1.0520 1.1791 -0.0845 0.0168 -0.1185 310 LYS E CD 7544 C CE . LYS C 315 ? 1.0755 1.1616 1.2789 -0.0808 0.0150 -0.1220 310 LYS E CE 7545 N NZ . LYS C 315 ? 1.1113 1.1997 1.3186 -0.0819 0.0140 -0.1295 310 LYS E NZ 7546 N N . LEU C 316 ? 0.5279 0.6185 0.7115 -0.0725 0.0156 -0.0998 311 LEU E N 7547 C CA . LEU C 316 ? 0.5631 0.6609 0.7418 -0.0693 0.0137 -0.1012 311 LEU E CA 7548 C C . LEU C 316 ? 0.5693 0.6773 0.7497 -0.0706 0.0130 -0.1049 311 LEU E C 7549 O O . LEU C 316 ? 0.5697 0.6822 0.7480 -0.0702 0.0131 -0.1025 311 LEU E O 7550 C CB . LEU C 316 ? 0.5581 0.6545 0.7297 -0.0660 0.0134 -0.0953 311 LEU E CB 7551 C CG . LEU C 316 ? 0.5546 0.6427 0.7233 -0.0641 0.0137 -0.0916 311 LEU E CG 7552 C CD1 . LEU C 316 ? 0.5557 0.6434 0.7177 -0.0616 0.0133 -0.0860 311 LEU E CD1 7553 C CD2 . LEU C 316 ? 0.5577 0.6460 0.7252 -0.0623 0.0124 -0.0946 311 LEU E CD2 7554 N N . VAL C 317 ? 0.6046 0.7166 0.7890 -0.0721 0.0124 -0.1110 312 VAL E N 7555 C CA . VAL C 317 ? 0.5722 0.6938 0.7596 -0.0741 0.0119 -0.1150 312 VAL E CA 7556 C C . VAL C 317 ? 0.5664 0.6970 0.7504 -0.0714 0.0099 -0.1180 312 VAL E C 7557 O O . VAL C 317 ? 0.5211 0.6526 0.7054 -0.0706 0.0090 -0.1218 312 VAL E O 7558 C CB . VAL C 317 ? 0.6013 0.7219 0.7961 -0.0784 0.0126 -0.1202 312 VAL E CB 7559 C CG1 . VAL C 317 ? 0.5974 0.7283 0.7955 -0.0809 0.0124 -0.1239 312 VAL E CG1 7560 C CG2 . VAL C 317 ? 0.6127 0.7232 0.8107 -0.0811 0.0146 -0.1169 312 VAL E CG2 7561 N N . LEU C 318 ? 0.5409 0.6787 0.7218 -0.0700 0.0093 -0.1163 313 LEU E N 7562 C CA . LEU C 318 ? 0.5211 0.6684 0.6990 -0.0676 0.0074 -0.1189 313 LEU E CA 7563 C C . LEU C 318 ? 0.5832 0.7397 0.7663 -0.0703 0.0072 -0.1247 313 LEU E C 7564 O O . LEU C 318 ? 0.6722 0.8312 0.8589 -0.0729 0.0082 -0.1247 313 LEU E O 7565 C CB . LEU C 318 ? 0.4976 0.6481 0.6693 -0.0644 0.0067 -0.1144 313 LEU E CB 7566 C CG . LEU C 318 ? 0.4970 0.6403 0.6619 -0.0611 0.0063 -0.1089 313 LEU E CG 7567 C CD1 . LEU C 318 ? 0.5128 0.6584 0.6723 -0.0585 0.0058 -0.1046 313 LEU E CD1 7568 C CD2 . LEU C 318 ? 0.4753 0.6193 0.6369 -0.0589 0.0048 -0.1104 313 LEU E CD2 7569 N N . ALA C 319 ? 0.6554 0.8178 0.8390 -0.0697 0.0058 -0.1296 314 ALA E N 7570 C CA . ALA C 319 ? 0.6854 0.8588 0.8727 -0.0715 0.0051 -0.1351 314 ALA E CA 7571 C C . ALA C 319 ? 0.6627 0.8447 0.8462 -0.0691 0.0042 -0.1329 314 ALA E C 7572 O O . ALA C 319 ? 0.6119 0.7942 0.7888 -0.0651 0.0031 -0.1294 314 ALA E O 7573 C CB . ALA C 319 ? 0.6554 0.8337 0.8434 -0.0708 0.0037 -0.1407 314 ALA E CB 7574 N N . THR C 320 ? 0.6613 0.8502 0.8489 -0.0716 0.0048 -0.1350 315 THR E N 7575 C CA . THR C 320 ? 0.7058 0.9049 0.8908 -0.0695 0.0038 -0.1343 315 THR E CA 7576 C C . THR C 320 ? 0.7329 0.9441 0.9214 -0.0708 0.0027 -0.1407 315 THR E C 7577 O O . THR C 320 ? 0.7334 0.9534 0.9183 -0.0677 0.0012 -0.1412 315 THR E O 7578 C CB . THR C 320 ? 0.6734 0.8721 0.8594 -0.0707 0.0052 -0.1306 315 THR E CB 7579 O OG1 . THR C 320 ? 0.5635 0.7582 0.7564 -0.0759 0.0070 -0.1323 315 THR E OG1 7580 C CG2 . THR C 320 ? 0.6988 0.8889 0.8788 -0.0675 0.0055 -0.1239 315 THR E CG2 7581 N N . GLY C 321 ? 0.7035 0.9148 0.8988 -0.0753 0.0035 -0.1457 316 GLY E N 7582 C CA . GLY C 321 ? 0.7018 0.9244 0.9011 -0.0771 0.0025 -0.1523 316 GLY E CA 7583 C C . GLY C 321 ? 0.7410 0.9645 0.9402 -0.0764 0.0013 -0.1569 316 GLY E C 7584 O O . GLY C 321 ? 0.8097 1.0279 1.0041 -0.0731 0.0006 -0.1546 316 GLY E O 7585 N N . LEU C 322 ? 0.7046 0.9348 0.9094 -0.0797 0.0010 -0.1636 317 LEU E N 7586 C CA . LEU C 322 ? 0.6477 0.8814 0.8530 -0.0791 -0.0003 -0.1692 317 LEU E CA 7587 C C . LEU C 322 ? 0.5911 0.8156 0.8015 -0.0827 0.0006 -0.1727 317 LEU E C 7588 O O . LEU C 322 ? 0.5135 0.7311 0.7280 -0.0864 0.0022 -0.1718 317 LEU E O 7589 C CB . LEU C 322 ? 0.7685 1.0169 0.9766 -0.0803 -0.0014 -0.1748 317 LEU E CB 7590 C CG . LEU C 322 ? 0.8048 1.0628 1.0086 -0.0769 -0.0022 -0.1715 317 LEU E CG 7591 C CD1 . LEU C 322 ? 0.7250 0.9870 0.9322 -0.0797 -0.0011 -0.1704 317 LEU E CD1 7592 C CD2 . LEU C 322 ? 0.8364 1.1076 1.0390 -0.0749 -0.0042 -0.1760 317 LEU E CD2 7593 N N . ARG C 323 ? 0.5543 0.7794 0.7646 -0.0816 -0.0004 -0.1771 318 ARG E N 7594 C CA . ARG C 323 ? 0.6666 0.8853 0.8826 -0.0852 0.0001 -0.1823 318 ARG E CA 7595 C C . ARG C 323 ? 0.6495 0.8735 0.8723 -0.0905 0.0005 -0.1875 318 ARG E C 7596 O O . ARG C 323 ? 0.6318 0.8684 0.8552 -0.0906 -0.0004 -0.1904 318 ARG E O 7597 C CB . ARG C 323 ? 0.6924 0.9138 0.9079 -0.0834 -0.0012 -0.1877 318 ARG E CB 7598 C CG . ARG C 323 ? 0.7147 0.9368 0.9232 -0.0781 -0.0022 -0.1841 318 ARG E CG 7599 C CD . ARG C 323 ? 0.7544 0.9784 0.9633 -0.0769 -0.0033 -0.1897 318 ARG E CD 7600 N NE . ARG C 323 ? 0.7732 0.9949 0.9756 -0.0723 -0.0039 -0.1853 318 ARG E NE 7601 C CZ . ARG C 323 ? 0.8112 1.0229 1.0127 -0.0712 -0.0034 -0.1839 318 ARG E CZ 7602 N NH1 . ARG C 323 ? 0.7441 0.9466 0.9506 -0.0739 -0.0023 -0.1865 318 ARG E NH1 7603 N NH2 . ARG C 323 ? 0.8673 1.0785 1.0626 -0.0672 -0.0040 -0.1797 318 ARG E NH2 7604 N N . ASN C 324 ? 0.7444 0.9588 0.9723 -0.0947 0.0018 -0.1892 319 ASN E N 7605 C CA . ASN C 324 ? 0.7614 0.9787 0.9960 -0.1006 0.0024 -0.1933 319 ASN E CA 7606 C C . ASN C 324 ? 0.7704 0.9837 1.0101 -0.1037 0.0020 -0.2006 319 ASN E C 7607 O O . ASN C 324 ? 0.9345 1.1575 1.1761 -0.1045 0.0008 -0.2072 319 ASN E O 7608 C CB . ASN C 324 ? 0.7184 0.9268 0.9546 -0.1035 0.0043 -0.1876 319 ASN E CB 7609 C CG . ASN C 324 ? 0.6878 0.9035 0.9291 -0.1086 0.0050 -0.1893 319 ASN E CG 7610 O OD1 . ASN C 324 ? 0.7173 0.9465 0.9596 -0.1091 0.0039 -0.1933 319 ASN E OD1 7611 N ND2 . ASN C 324 ? 0.6179 0.8249 0.8623 -0.1126 0.0067 -0.1861 319 ASN E ND2 7612 N N . GLY D 12 ? 0.7017 0.9791 0.6814 0.1123 -0.0375 -0.1116 12 GLY B N 7613 C CA . GLY D 12 ? 0.7131 0.9784 0.6854 0.1186 -0.0392 -0.1133 12 GLY B CA 7614 C C . GLY D 12 ? 0.7781 1.0231 0.7472 0.1173 -0.0404 -0.1135 12 GLY B C 7615 O O . GLY D 12 ? 0.8146 1.0557 0.7868 0.1133 -0.0396 -0.1131 12 GLY B O 7616 N N . GLY D 13 ? 0.7172 0.9501 0.6797 0.1206 -0.0427 -0.1139 13 GLY B N 7617 C CA . GLY D 13 ? 0.6929 0.9078 0.6514 0.1185 -0.0447 -0.1130 13 GLY B CA 7618 C C . GLY D 13 ? 0.7599 0.9650 0.7070 0.1253 -0.0490 -0.1150 13 GLY B C 7619 O O . GLY D 13 ? 0.7026 0.9147 0.6448 0.1331 -0.0503 -0.1177 13 GLY B O 7620 N N . TRP D 14 ? 0.8867 1.0765 0.8290 0.1225 -0.0518 -0.1134 14 TRP B N 7621 C CA . TRP D 14 ? 0.9294 1.1080 0.8606 0.1269 -0.0568 -0.1144 14 TRP B CA 7622 C C . TRP D 14 ? 0.9674 1.1265 0.8857 0.1290 -0.0637 -0.1135 14 TRP B C 7623 O O . TRP D 14 ? 0.9786 1.1272 0.8959 0.1219 -0.0654 -0.1098 14 TRP B O 7624 C CB . TRP D 14 ? 0.9373 1.1139 0.8715 0.1210 -0.0559 -0.1124 14 TRP B CB 7625 C CG . TRP D 14 ? 1.0274 1.2190 0.9712 0.1194 -0.0510 -0.1134 14 TRP B CG 7626 C CD1 . TRP D 14 ? 1.0053 1.2106 0.9522 0.1237 -0.0489 -0.1160 14 TRP B CD1 7627 C CD2 . TRP D 14 ? 1.0334 1.2275 0.9835 0.1132 -0.0485 -0.1118 14 TRP B CD2 7628 N NE1 . TRP D 14 ? 0.9859 1.2001 0.9406 0.1196 -0.0455 -0.1158 14 TRP B NE1 7629 C CE2 . TRP D 14 ? 1.0386 1.2456 0.9951 0.1138 -0.0452 -0.1137 14 TRP B CE2 7630 C CE3 . TRP D 14 ? 1.0015 1.1894 0.9521 0.1072 -0.0489 -0.1088 14 TRP B CE3 7631 C CZ2 . TRP D 14 ? 1.0824 1.2939 1.0451 0.1094 -0.0427 -0.1132 14 TRP B CZ2 7632 C CZ3 . TRP D 14 ? 0.9790 1.1740 0.9363 0.1034 -0.0459 -0.1085 14 TRP B CZ3 7633 C CH2 . TRP D 14 ? 1.0751 1.2806 1.0380 0.1049 -0.0430 -0.1110 14 TRP B CH2 7634 N N . GLN D 15 ? 0.9691 1.1235 0.8763 0.1389 -0.0683 -0.1169 15 GLN B N 7635 C CA . GLN D 15 ? 1.0291 1.1615 0.9207 0.1423 -0.0768 -0.1167 15 GLN B CA 7636 C C . GLN D 15 ? 1.0135 1.1295 0.8982 0.1361 -0.0819 -0.1132 15 GLN B C 7637 O O . GLN D 15 ? 1.0507 1.1497 0.9274 0.1315 -0.0877 -0.1098 15 GLN B O 7638 C CB . GLN D 15 ? 1.0508 1.1807 0.9296 0.1563 -0.0820 -0.1221 15 GLN B CB 7639 C CG . GLN D 15 ? 1.1281 1.2762 1.0116 0.1633 -0.0779 -0.1253 15 GLN B CG 7640 C CD . GLN D 15 ? 1.1816 1.3239 1.0635 0.1626 -0.0791 -0.1244 15 GLN B CD 7641 O OE1 . GLN D 15 ? 1.1153 1.2368 0.9889 0.1591 -0.0846 -0.1222 15 GLN B OE1 7642 N NE2 . GLN D 15 ? 1.1672 1.3285 1.0567 0.1654 -0.0741 -0.1258 15 GLN B NE2 7643 N N . GLY D 16 ? 1.1023 1.2248 0.9904 0.1351 -0.0799 -0.1134 16 GLY B N 7644 C CA . GLY D 16 ? 1.0800 1.1901 0.9616 0.1296 -0.0847 -0.1100 16 GLY B CA 7645 C C . GLY D 16 ? 1.0396 1.1489 0.9275 0.1170 -0.0831 -0.1039 16 GLY B C 7646 O O . GLY D 16 ? 1.0145 1.1098 0.8934 0.1115 -0.0894 -0.0997 16 GLY B O 7647 N N . MET D 17 ? 1.0283 1.1533 0.9311 0.1123 -0.0750 -0.1032 17 MET B N 7648 C CA . MET D 17 ? 1.0298 1.1569 0.9390 0.1019 -0.0732 -0.0979 17 MET B CA 7649 C C . MET D 17 ? 1.0968 1.2117 0.9999 0.0985 -0.0777 -0.0947 17 MET B C 7650 O O . MET D 17 ? 1.1127 1.2305 1.0198 0.1006 -0.0752 -0.0962 17 MET B O 7651 C CB . MET D 17 ? 0.9920 1.1377 0.9173 0.0992 -0.0643 -0.0987 17 MET B CB 7652 C CG . MET D 17 ? 1.0047 1.1554 0.9355 0.0903 -0.0626 -0.0941 17 MET B CG 7653 S SD . MET D 17 ? 1.0258 1.1944 0.9727 0.0883 -0.0542 -0.0954 17 MET B SD 7654 C CE . MET D 17 ? 1.0209 1.1982 0.9728 0.0948 -0.0503 -0.1010 17 MET B CE 7655 N N . VAL D 18 ? 1.1747 1.2765 1.0680 0.0923 -0.0847 -0.0896 18 VAL B N 7656 C CA . VAL D 18 ? 1.1830 1.2702 1.0677 0.0881 -0.0910 -0.0856 18 VAL B CA 7657 C C . VAL D 18 ? 1.0718 1.1660 0.9632 0.0765 -0.0892 -0.0789 18 VAL B C 7658 O O . VAL D 18 ? 1.1091 1.1970 0.9981 0.0729 -0.0918 -0.0761 18 VAL B O 7659 C CB . VAL D 18 ? 1.2297 1.2922 1.0941 0.0893 -0.1033 -0.0841 18 VAL B CB 7660 C CG1 . VAL D 18 ? 1.1962 1.2505 1.0518 0.1029 -0.1061 -0.0913 18 VAL B CG1 7661 C CG2 . VAL D 18 ? 1.2478 1.3078 1.1077 0.0830 -0.1071 -0.0798 18 VAL B CG2 7662 N N . ASP D 19 ? 1.0665 1.1749 0.9662 0.0711 -0.0850 -0.0764 19 ASP B N 7663 C CA . ASP D 19 ? 1.1475 1.2644 1.0517 0.0604 -0.0845 -0.0694 19 ASP B CA 7664 C C . ASP D 19 ? 1.0419 1.1787 0.9622 0.0601 -0.0751 -0.0708 19 ASP B C 7665 O O . ASP D 19 ? 0.9519 1.1008 0.8775 0.0530 -0.0734 -0.0660 19 ASP B O 7666 C CB . ASP D 19 ? 1.3188 1.4393 1.2196 0.0536 -0.0874 -0.0643 19 ASP B CB 7667 C CG . ASP D 19 ? 1.4260 1.5575 1.3331 0.0590 -0.0820 -0.0690 19 ASP B CG 7668 O OD1 . ASP D 19 ? 1.5574 1.6870 1.4662 0.0683 -0.0792 -0.0759 19 ASP B OD1 7669 O OD2 . ASP D 19 ? 1.3784 1.5213 1.2884 0.0536 -0.0809 -0.0654 19 ASP B OD2 7670 N N . GLY D 20 ? 0.8701 1.0108 0.7975 0.0676 -0.0697 -0.0770 20 GLY B N 7671 C CA . GLY D 20 ? 0.8818 1.0384 0.8229 0.0675 -0.0621 -0.0786 20 GLY B CA 7672 C C . GLY D 20 ? 0.8779 1.0369 0.8250 0.0746 -0.0577 -0.0847 20 GLY B C 7673 O O . GLY D 20 ? 0.9640 1.1141 0.9051 0.0800 -0.0600 -0.0876 20 GLY B O 7674 N N . TRP D 21 ? 0.8015 0.9728 0.7596 0.0746 -0.0520 -0.0863 21 TRP B N 7675 C CA . TRP D 21 ? 0.7736 0.9475 0.7375 0.0793 -0.0485 -0.0907 21 TRP B CA 7676 C C . TRP D 21 ? 0.7726 0.9548 0.7416 0.0829 -0.0450 -0.0948 21 TRP B C 7677 O O . TRP D 21 ? 0.7906 0.9731 0.7599 0.0870 -0.0443 -0.0980 21 TRP B O 7678 C CB . TRP D 21 ? 0.7934 0.9723 0.7644 0.0769 -0.0459 -0.0899 21 TRP B CB 7679 C CG . TRP D 21 ? 0.8630 1.0329 0.8298 0.0753 -0.0487 -0.0876 21 TRP B CG 7680 C CD1 . TRP D 21 ? 0.9399 1.0969 0.8965 0.0765 -0.0536 -0.0867 21 TRP B CD1 7681 C CD2 . TRP D 21 ? 0.8413 1.0136 0.8131 0.0728 -0.0472 -0.0862 21 TRP B CD2 7682 N NE1 . TRP D 21 ? 0.9414 1.0926 0.8964 0.0745 -0.0553 -0.0848 21 TRP B NE1 7683 C CE2 . TRP D 21 ? 0.8774 1.0384 0.8421 0.0720 -0.0511 -0.0843 21 TRP B CE2 7684 C CE3 . TRP D 21 ? 0.9002 1.0821 0.8807 0.0718 -0.0436 -0.0867 21 TRP B CE3 7685 C CZ2 . TRP D 21 ? 0.8854 1.0455 0.8524 0.0695 -0.0509 -0.0824 21 TRP B CZ2 7686 C CZ3 . TRP D 21 ? 0.9821 1.1631 0.9647 0.0697 -0.0436 -0.0850 21 TRP B CZ3 7687 C CH2 . TRP D 21 ? 0.9231 1.0937 0.8996 0.0683 -0.0469 -0.0827 21 TRP B CH2 7688 N N . TYR D 22 ? 0.7661 0.9564 0.7391 0.0812 -0.0432 -0.0945 22 TYR B N 7689 C CA . TYR D 22 ? 0.7693 0.9663 0.7462 0.0840 -0.0407 -0.0979 22 TYR B CA 7690 C C . TYR D 22 ? 0.7839 0.9826 0.7572 0.0832 -0.0419 -0.0967 22 TYR B C 7691 O O . TYR D 22 ? 0.7760 0.9767 0.7476 0.0793 -0.0431 -0.0930 22 TYR B O 7692 C CB . TYR D 22 ? 0.7884 0.9936 0.7732 0.0837 -0.0376 -0.0995 22 TYR B CB 7693 C CG . TYR D 22 ? 0.7441 0.9481 0.7324 0.0827 -0.0370 -0.0992 22 TYR B CG 7694 C CD1 . TYR D 22 ? 0.7380 0.9381 0.7267 0.0838 -0.0371 -0.1005 22 TYR B CD1 7695 C CD2 . TYR D 22 ? 0.7170 0.9256 0.7085 0.0809 -0.0363 -0.0977 22 TYR B CD2 7696 C CE1 . TYR D 22 ? 0.7176 0.9168 0.7096 0.0825 -0.0367 -0.1000 22 TYR B CE1 7697 C CE2 . TYR D 22 ? 0.7034 0.9107 0.6980 0.0803 -0.0359 -0.0976 22 TYR B CE2 7698 C CZ . TYR D 22 ? 0.6757 0.8775 0.6704 0.0808 -0.0362 -0.0987 22 TYR B CZ 7699 O OH . TYR D 22 ? 0.6381 0.8387 0.6358 0.0797 -0.0360 -0.0982 22 TYR B OH 7700 N N . GLY D 23 ? 0.8474 1.0470 0.8197 0.0865 -0.0416 -0.0995 23 GLY B N 7701 C CA . GLY D 23 ? 0.8758 1.0772 0.8448 0.0858 -0.0426 -0.0986 23 GLY B CA 7702 C C . GLY D 23 ? 0.8323 1.0361 0.8013 0.0896 -0.0418 -0.1021 23 GLY B C 7703 O O . GLY D 23 ? 0.7250 0.9331 0.6989 0.0921 -0.0394 -0.1053 23 GLY B O 7704 N N . TYR D 24 ? 0.8033 1.0039 0.7661 0.0895 -0.0444 -0.1008 24 TYR B N 7705 C CA . TYR D 24 ? 0.7805 0.9843 0.7429 0.0926 -0.0437 -0.1035 24 TYR B CA 7706 C C . TYR D 24 ? 0.7605 0.9551 0.7138 0.0959 -0.0478 -0.1038 24 TYR B C 7707 O O . TYR D 24 ? 0.7999 0.9845 0.7449 0.0941 -0.0525 -0.1007 24 TYR B O 7708 C CB . TYR D 24 ? 0.8197 1.0303 0.7833 0.0898 -0.0430 -0.1019 24 TYR B CB 7709 C CG . TYR D 24 ? 0.7582 0.9779 0.7286 0.0875 -0.0401 -0.1013 24 TYR B CG 7710 C CD1 . TYR D 24 ? 0.7577 0.9839 0.7348 0.0901 -0.0369 -0.1052 24 TYR B CD1 7711 C CD2 . TYR D 24 ? 0.7709 0.9929 0.7402 0.0830 -0.0412 -0.0968 24 TYR B CD2 7712 C CE1 . TYR D 24 ? 0.7263 0.9599 0.7082 0.0896 -0.0351 -0.1055 24 TYR B CE1 7713 C CE2 . TYR D 24 ? 0.6825 0.9152 0.6577 0.0823 -0.0385 -0.0967 24 TYR B CE2 7714 C CZ . TYR D 24 ? 0.6284 0.8661 0.6096 0.0864 -0.0356 -0.1015 24 TYR B CZ 7715 O OH . TYR D 24 ? 0.6616 0.9085 0.6471 0.0875 -0.0338 -0.1024 24 TYR B OH 7716 N N . HIS D 25 ? 0.8110 1.0092 0.7650 0.1007 -0.0468 -0.1074 25 HIS B N 7717 C CA . HIS D 25 ? 0.9358 1.1280 0.8811 0.1052 -0.0505 -0.1085 25 HIS B CA 7718 C C . HIS D 25 ? 0.8563 1.0557 0.8042 0.1051 -0.0488 -0.1097 25 HIS B C 7719 O O . HIS D 25 ? 0.8052 1.0147 0.7607 0.1057 -0.0449 -0.1120 25 HIS B O 7720 C CB . HIS D 25 ? 1.0216 1.2148 0.9650 0.1119 -0.0509 -0.1118 25 HIS B CB 7721 C CG . HIS D 25 ? 1.0882 1.2746 1.0211 0.1184 -0.0556 -0.1135 25 HIS B CG 7722 N ND1 . HIS D 25 ? 1.1261 1.3210 1.0593 0.1249 -0.0547 -0.1171 25 HIS B ND1 7723 C CD2 . HIS D 25 ? 1.1488 1.3205 1.0698 0.1194 -0.0620 -0.1121 25 HIS B CD2 7724 C CE1 . HIS D 25 ? 1.1209 1.3068 1.0427 0.1309 -0.0600 -0.1184 25 HIS B CE1 7725 N NE2 . HIS D 25 ? 1.1692 1.3395 1.0830 0.1276 -0.0649 -0.1155 25 HIS B NE2 7726 N N . HIS D 26 ? 0.8480 1.0414 0.7889 0.1040 -0.0523 -0.1077 26 HIS B N 7727 C CA . HIS D 26 ? 0.8783 1.0781 0.8209 0.1038 -0.0510 -0.1085 26 HIS B CA 7728 C C . HIS D 26 ? 0.9515 1.1457 0.8859 0.1093 -0.0546 -0.1104 26 HIS B C 7729 O O . HIS D 26 ? 0.8818 1.0630 0.8055 0.1109 -0.0605 -0.1091 26 HIS B O 7730 C CB . HIS D 26 ? 0.7955 0.9963 0.7373 0.0975 -0.0518 -0.1044 26 HIS B CB 7731 C CG . HIS D 26 ? 0.8861 1.0742 0.8163 0.0950 -0.0584 -0.1003 26 HIS B CG 7732 N ND1 . HIS D 26 ? 1.0697 1.2498 0.9952 0.0903 -0.0621 -0.0959 26 HIS B ND1 7733 C CD2 . HIS D 26 ? 0.9832 1.1642 0.9047 0.0960 -0.0630 -0.0997 26 HIS B CD2 7734 C CE1 . HIS D 26 ? 1.1089 1.2767 1.0228 0.0879 -0.0692 -0.0924 26 HIS B CE1 7735 N NE2 . HIS D 26 ? 1.0607 1.2283 0.9717 0.0916 -0.0700 -0.0948 26 HIS B NE2 7736 N N . SER D 27 ? 1.0231 1.2265 0.9618 0.1123 -0.0518 -0.1135 27 SER B N 7737 C CA . SER D 27 ? 1.0628 1.2643 0.9950 0.1186 -0.0546 -0.1160 27 SER B CA 7738 C C . SER D 27 ? 1.0341 1.2404 0.9675 0.1172 -0.0537 -0.1160 27 SER B C 7739 O O . SER D 27 ? 0.9976 1.2155 0.9389 0.1171 -0.0495 -0.1180 27 SER B O 7740 C CB . SER D 27 ? 1.0687 1.2799 1.0052 0.1240 -0.0520 -0.1194 27 SER B CB 7741 O OG . SER D 27 ? 1.0888 1.2956 1.0161 0.1321 -0.0562 -0.1216 27 SER B OG 7742 N N . ASN D 28 ? 1.0491 1.2460 0.9741 0.1154 -0.0582 -0.1135 28 ASN B N 7743 C CA . ASN D 28 ? 1.0038 1.2044 0.9285 0.1140 -0.0581 -0.1132 28 ASN B CA 7744 C C . ASN D 28 ? 1.1455 1.3340 1.0574 0.1174 -0.0649 -0.1128 28 ASN B C 7745 O O . ASN D 28 ? 1.1231 1.3014 1.0265 0.1232 -0.0695 -0.1143 28 ASN B O 7746 C CB . ASN D 28 ? 0.9003 1.1060 0.8294 0.1062 -0.0561 -0.1095 28 ASN B CB 7747 C CG . ASN D 28 ? 0.9115 1.1066 0.8320 0.1007 -0.0616 -0.1040 28 ASN B CG 7748 O OD1 . ASN D 28 ? 0.8570 1.0377 0.7673 0.1024 -0.0677 -0.1030 28 ASN B OD1 7749 N ND2 . ASN D 28 ? 0.9992 1.2021 0.9231 0.0941 -0.0600 -0.1003 28 ASN B ND2 7750 N N . GLU D 29 ? 1.2549 1.4444 1.1649 0.1146 -0.0659 -0.1112 29 GLU B N 7751 C CA . GLU D 29 ? 1.3583 1.5364 1.2563 0.1180 -0.0726 -0.1112 29 GLU B CA 7752 C C . GLU D 29 ? 1.3031 1.4615 1.1872 0.1159 -0.0814 -0.1074 29 GLU B C 7753 O O . GLU D 29 ? 1.3052 1.4501 1.1774 0.1227 -0.0881 -0.1093 29 GLU B O 7754 C CB . GLU D 29 ? 1.5818 1.7656 1.4809 0.1140 -0.0718 -0.1095 29 GLU B CB 7755 C CG . GLU D 29 ? 1.6689 1.8524 1.5638 0.1211 -0.0735 -0.1132 29 GLU B CG 7756 C CD . GLU D 29 ? 1.7046 1.9045 1.6108 0.1253 -0.0665 -0.1178 29 GLU B CD 7757 O OE1 . GLU D 29 ? 1.7417 1.9535 1.6581 0.1207 -0.0608 -0.1175 29 GLU B OE1 7758 O OE2 . GLU D 29 ? 1.4799 1.6810 1.3839 0.1333 -0.0673 -0.1216 29 GLU B OE2 7759 N N . GLN D 30 ? 1.2405 1.3975 1.1256 0.1070 -0.0819 -0.1020 30 GLN B N 7760 C CA . GLN D 30 ? 1.2197 1.3580 1.0912 0.1021 -0.0913 -0.0967 30 GLN B CA 7761 C C . GLN D 30 ? 1.2458 1.3705 1.1103 0.1072 -0.0955 -0.0985 30 GLN B C 7762 O O . GLN D 30 ? 1.2797 1.3865 1.1317 0.1036 -0.1041 -0.0944 30 GLN B O 7763 C CB . GLN D 30 ? 1.2034 1.3481 1.0787 0.0901 -0.0904 -0.0896 30 GLN B CB 7764 C CG . GLN D 30 ? 1.1796 1.3365 1.0586 0.0842 -0.0883 -0.0866 30 GLN B CG 7765 C CD . GLN D 30 ? 1.1549 1.3341 1.0500 0.0852 -0.0777 -0.0898 30 GLN B CD 7766 O OE1 . GLN D 30 ? 1.1469 1.3382 1.0489 0.0792 -0.0742 -0.0865 30 GLN B OE1 7767 N NE2 . GLN D 30 ? 1.1642 1.3491 1.0647 0.0931 -0.0733 -0.0961 30 GLN B NE2 7768 N N . GLY D 31 ? 1.3172 1.4504 1.1890 0.1153 -0.0899 -0.1043 31 GLY B N 7769 C CA . GLY D 31 ? 1.3317 1.4561 1.1989 0.1208 -0.0924 -0.1065 31 GLY B CA 7770 C C . GLY D 31 ? 1.2397 1.3771 1.1204 0.1166 -0.0847 -0.1059 31 GLY B C 7771 O O . GLY D 31 ? 1.1009 1.2504 0.9918 0.1091 -0.0793 -0.1031 31 GLY B O 7772 N N . SER D 32 ? 1.1318 1.2670 1.0120 0.1223 -0.0846 -0.1088 32 SER B N 7773 C CA . SER D 32 ? 1.1016 1.2478 0.9936 0.1194 -0.0779 -0.1087 32 SER B CA 7774 C C . SER D 32 ? 1.1282 1.2617 1.0146 0.1146 -0.0823 -0.1047 32 SER B C 7775 O O . SER D 32 ? 1.1495 1.2649 1.0220 0.1132 -0.0911 -0.1019 32 SER B O 7776 C CB . SER D 32 ? 1.0738 1.2301 0.9709 0.1282 -0.0739 -0.1142 32 SER B CB 7777 O OG . SER D 32 ? 1.0548 1.1987 0.9390 0.1371 -0.0805 -0.1169 32 SER B OG 7778 N N . GLY D 33 ? 1.1332 1.2756 1.0298 0.1116 -0.0768 -0.1043 33 GLY B N 7779 C CA . GLY D 33 ? 1.1073 1.2404 1.0004 0.1063 -0.0799 -0.1003 33 GLY B CA 7780 C C . GLY D 33 ? 0.9880 1.1342 0.8946 0.1019 -0.0727 -0.0995 33 GLY B C 7781 O O . GLY D 33 ? 0.8956 1.0574 0.8139 0.1010 -0.0657 -0.1011 33 GLY B O 7782 N N . TYR D 34 ? 0.8764 1.0148 0.7801 0.0994 -0.0752 -0.0972 34 TYR B N 7783 C CA . TYR D 34 ? 0.7699 0.9185 0.6848 0.0962 -0.0693 -0.0967 34 TYR B CA 7784 C C . TYR D 34 ? 0.7514 0.9018 0.6679 0.0866 -0.0699 -0.0906 34 TYR B C 7785 O O . TYR D 34 ? 0.7446 0.8829 0.6506 0.0817 -0.0769 -0.0857 34 TYR B O 7786 C CB . TYR D 34 ? 0.7807 0.9215 0.6920 0.1005 -0.0711 -0.0985 34 TYR B CB 7787 C CG . TYR D 34 ? 0.7123 0.8552 0.6222 0.1106 -0.0703 -0.1043 34 TYR B CG 7788 C CD1 . TYR D 34 ? 0.7650 0.8944 0.6609 0.1180 -0.0774 -0.1065 34 TYR B CD1 7789 C CD2 . TYR D 34 ? 0.7211 0.8797 0.6427 0.1129 -0.0633 -0.1074 34 TYR B CD2 7790 C CE1 . TYR D 34 ? 0.7779 0.9129 0.6725 0.1283 -0.0765 -0.1119 34 TYR B CE1 7791 C CE2 . TYR D 34 ? 0.7971 0.9613 0.7178 0.1214 -0.0626 -0.1119 34 TYR B CE2 7792 C CZ . TYR D 34 ? 0.7909 0.9449 0.6986 0.1294 -0.0688 -0.1142 34 TYR B CZ 7793 O OH . TYR D 34 ? 0.8248 0.9881 0.7318 0.1386 -0.0679 -0.1186 34 TYR B OH 7794 N N . ALA D 35 ? 0.7638 0.9293 0.6925 0.0838 -0.0632 -0.0905 35 ALA B N 7795 C CA . ALA D 35 ? 0.7850 0.9559 0.7164 0.0757 -0.0631 -0.0849 35 ALA B CA 7796 C C . ALA D 35 ? 0.8094 0.9901 0.7513 0.0758 -0.0574 -0.0864 35 ALA B C 7797 O O . ALA D 35 ? 0.8439 1.0337 0.7944 0.0799 -0.0521 -0.0909 35 ALA B O 7798 C CB . ALA D 35 ? 0.6883 0.8705 0.6219 0.0714 -0.0619 -0.0822 35 ALA B CB 7799 N N . ALA D 36 ? 0.8364 1.0150 0.7772 0.0708 -0.0593 -0.0821 36 ALA B N 7800 C CA . ALA D 36 ? 0.9023 1.0886 0.8520 0.0710 -0.0548 -0.0832 36 ALA B CA 7801 C C . ALA D 36 ? 0.8782 1.0822 0.8365 0.0688 -0.0503 -0.0823 36 ALA B C 7802 O O . ALA D 36 ? 0.8403 1.0510 0.7965 0.0639 -0.0519 -0.0778 36 ALA B O 7803 C CB . ALA D 36 ? 0.9371 1.1137 0.8816 0.0671 -0.0588 -0.0792 36 ALA B CB 7804 N N . ASP D 37 ? 0.9076 1.1193 0.8747 0.0726 -0.0454 -0.0865 37 ASP B N 7805 C CA . ASP D 37 ? 0.9136 1.1407 0.8877 0.0720 -0.0420 -0.0863 37 ASP B CA 7806 C C . ASP D 37 ? 0.9877 1.2171 0.9622 0.0675 -0.0430 -0.0817 37 ASP B C 7807 O O . ASP D 37 ? 0.9046 1.1286 0.8813 0.0687 -0.0424 -0.0831 37 ASP B O 7808 C CB . ASP D 37 ? 0.8914 1.1225 0.8726 0.0779 -0.0380 -0.0924 37 ASP B CB 7809 C CG . ASP D 37 ? 0.8850 1.1310 0.8713 0.0796 -0.0355 -0.0934 37 ASP B CG 7810 O OD1 . ASP D 37 ? 0.9427 1.1973 0.9281 0.0797 -0.0352 -0.0930 37 ASP B OD1 7811 O OD2 . ASP D 37 ? 0.9275 1.1768 0.9178 0.0812 -0.0342 -0.0947 37 ASP B OD2 7812 N N . LYS D 38 ? 1.0334 1.2718 1.0057 0.0618 -0.0448 -0.0759 38 LYS B N 7813 C CA . LYS D 38 ? 1.0252 1.2689 0.9975 0.0563 -0.0462 -0.0703 38 LYS B CA 7814 C C . LYS D 38 ? 1.0344 1.2884 1.0149 0.0603 -0.0420 -0.0733 38 LYS B C 7815 O O . LYS D 38 ? 0.9825 1.2304 0.9637 0.0593 -0.0425 -0.0727 38 LYS B O 7816 C CB . LYS D 38 ? 1.0876 1.3461 1.0577 0.0497 -0.0481 -0.0635 38 LYS B CB 7817 C CG . LYS D 38 ? 1.2242 1.4767 1.1865 0.0398 -0.0542 -0.0548 38 LYS B CG 7818 C CD . LYS D 38 ? 1.2986 1.5290 1.2504 0.0380 -0.0601 -0.0541 38 LYS B CD 7819 C CE . LYS D 38 ? 1.4166 1.6463 1.3591 0.0274 -0.0671 -0.0449 38 LYS B CE 7820 N NZ . LYS D 38 ? 1.4476 1.6522 1.3779 0.0268 -0.0742 -0.0448 38 LYS B NZ 7821 N N . GLU D 39 ? 1.0177 1.2866 1.0036 0.0651 -0.0385 -0.0767 39 GLU B N 7822 C CA . GLU D 39 ? 1.0201 1.3002 1.0120 0.0693 -0.0357 -0.0792 39 GLU B CA 7823 C C . GLU D 39 ? 0.9155 1.1820 0.9099 0.0729 -0.0350 -0.0837 39 GLU B C 7824 O O . GLU D 39 ? 1.0319 1.2988 1.0280 0.0717 -0.0351 -0.0822 39 GLU B O 7825 C CB . GLU D 39 ? 1.1696 1.4649 1.1650 0.0761 -0.0330 -0.0837 39 GLU B CB 7826 C CG . GLU D 39 ? 1.3170 1.6227 1.3169 0.0822 -0.0312 -0.0871 39 GLU B CG 7827 C CD . GLU D 39 ? 1.4492 1.7679 1.4507 0.0907 -0.0297 -0.0925 39 GLU B CD 7828 O OE1 . GLU D 39 ? 1.5044 1.8368 1.5046 0.0899 -0.0293 -0.0905 39 GLU B OE1 7829 O OE2 . GLU D 39 ? 1.3630 1.6776 1.3661 0.0981 -0.0294 -0.0988 39 GLU B OE2 7830 N N . SER D 40 ? 0.8353 1.0911 0.8298 0.0768 -0.0344 -0.0889 40 SER B N 7831 C CA . SER D 40 ? 0.7564 1.0020 0.7534 0.0798 -0.0339 -0.0929 40 SER B CA 7832 C C . SER D 40 ? 0.7589 0.9921 0.7533 0.0759 -0.0356 -0.0902 40 SER B C 7833 O O . SER D 40 ? 0.7771 1.0059 0.7739 0.0767 -0.0353 -0.0914 40 SER B O 7834 C CB . SER D 40 ? 0.6785 0.9187 0.6762 0.0840 -0.0332 -0.0983 40 SER B CB 7835 O OG . SER D 40 ? 0.6533 0.8851 0.6473 0.0823 -0.0343 -0.0976 40 SER B OG 7836 N N . THR D 41 ? 0.6862 0.9132 0.6747 0.0720 -0.0381 -0.0865 41 THR B N 7837 C CA . THR D 41 ? 0.7477 0.9629 0.7315 0.0685 -0.0410 -0.0834 41 THR B CA 7838 C C . THR D 41 ? 0.7385 0.9583 0.7235 0.0644 -0.0417 -0.0790 41 THR B C 7839 O O . THR D 41 ? 0.7742 0.9869 0.7595 0.0641 -0.0421 -0.0790 41 THR B O 7840 C CB . THR D 41 ? 0.8174 1.0240 0.7923 0.0654 -0.0452 -0.0800 41 THR B CB 7841 O OG1 . THR D 41 ? 0.8025 1.0020 0.7754 0.0700 -0.0451 -0.0844 41 THR B OG1 7842 C CG2 . THR D 41 ? 0.8199 1.0144 0.7879 0.0611 -0.0498 -0.0757 41 THR B CG2 7843 N N . GLN D 42 ? 0.7904 1.0237 0.7762 0.0612 -0.0417 -0.0751 42 GLN B N 7844 C CA . GLN D 42 ? 0.7502 0.9923 0.7377 0.0573 -0.0421 -0.0705 42 GLN B CA 7845 C C . GLN D 42 ? 0.7757 1.0228 0.7703 0.0625 -0.0388 -0.0748 42 GLN B C 7846 O O . GLN D 42 ? 0.7833 1.0290 0.7789 0.0604 -0.0394 -0.0727 42 GLN B O 7847 C CB . GLN D 42 ? 0.8113 1.0721 0.7989 0.0534 -0.0424 -0.0656 42 GLN B CB 7848 C CG . GLN D 42 ? 0.8635 1.1325 0.8500 0.0461 -0.0447 -0.0580 42 GLN B CG 7849 C CD . GLN D 42 ? 0.9072 1.1575 0.8853 0.0387 -0.0504 -0.0529 42 GLN B CD 7850 O OE1 . GLN D 42 ? 0.9104 1.1520 0.8808 0.0343 -0.0546 -0.0497 42 GLN B OE1 7851 N NE2 . GLN D 42 ? 0.8928 1.1357 0.8713 0.0378 -0.0511 -0.0524 42 GLN B NE2 7852 N N . LYS D 43 ? 0.7544 1.0057 0.7530 0.0692 -0.0361 -0.0808 43 LYS B N 7853 C CA . LYS D 43 ? 0.8354 1.0886 0.8389 0.0746 -0.0344 -0.0853 43 LYS B CA 7854 C C . LYS D 43 ? 0.7901 1.0280 0.7938 0.0741 -0.0351 -0.0867 43 LYS B C 7855 O O . LYS D 43 ? 0.7718 1.0099 0.7781 0.0747 -0.0349 -0.0869 43 LYS B O 7856 C CB . LYS D 43 ? 0.9660 1.2223 0.9714 0.0814 -0.0331 -0.0914 43 LYS B CB 7857 C CG . LYS D 43 ? 1.1352 1.3969 1.1438 0.0876 -0.0327 -0.0955 43 LYS B CG 7858 C CD . LYS D 43 ? 1.2676 1.5494 1.2774 0.0893 -0.0320 -0.0933 43 LYS B CD 7859 C CE . LYS D 43 ? 1.3628 1.6513 1.3739 0.0985 -0.0322 -0.0991 43 LYS B CE 7860 N NZ . LYS D 43 ? 1.3741 1.6862 1.3856 0.1023 -0.0313 -0.0980 43 LYS B NZ 7861 N N . ALA D 44 ? 0.7135 0.9397 0.7142 0.0733 -0.0359 -0.0876 44 ALA B N 7862 C CA . ALA D 44 ? 0.7119 0.9259 0.7119 0.0728 -0.0366 -0.0884 44 ALA B CA 7863 C C . ALA D 44 ? 0.6551 0.8636 0.6519 0.0682 -0.0386 -0.0837 44 ALA B C 7864 O O . ALA D 44 ? 0.6405 0.8444 0.6387 0.0681 -0.0386 -0.0840 44 ALA B O 7865 C CB . ALA D 44 ? 0.6650 0.8714 0.6621 0.0742 -0.0370 -0.0907 44 ALA B CB 7866 N N . ILE D 45 ? 0.6506 0.8589 0.6422 0.0639 -0.0410 -0.0791 45 ILE B N 7867 C CA . ILE D 45 ? 0.6619 0.8644 0.6491 0.0587 -0.0441 -0.0740 45 ILE B CA 7868 C C . ILE D 45 ? 0.6903 0.9029 0.6827 0.0571 -0.0428 -0.0719 45 ILE B C 7869 O O . ILE D 45 ? 0.8138 1.0204 0.8058 0.0554 -0.0438 -0.0705 45 ILE B O 7870 C CB . ILE D 45 ? 0.6924 0.8923 0.6718 0.0532 -0.0483 -0.0686 45 ILE B CB 7871 C CG1 . ILE D 45 ? 0.7843 0.9687 0.7560 0.0551 -0.0513 -0.0705 45 ILE B CG1 7872 C CG2 . ILE D 45 ? 0.6481 0.8465 0.6236 0.0460 -0.0520 -0.0619 45 ILE B CG2 7873 C CD1 . ILE D 45 ? 0.7979 0.9773 0.7606 0.0506 -0.0563 -0.0661 45 ILE B CD1 7874 N N . ASP D 46 ? 0.6910 0.9197 0.6877 0.0584 -0.0407 -0.0718 46 ASP B N 7875 C CA . ASP D 46 ? 0.6867 0.9272 0.6881 0.0585 -0.0395 -0.0704 46 ASP B CA 7876 C C . ASP D 46 ? 0.6486 0.8827 0.6541 0.0632 -0.0380 -0.0753 46 ASP B C 7877 O O . ASP D 46 ? 0.5968 0.8303 0.6035 0.0615 -0.0385 -0.0734 46 ASP B O 7878 C CB . ASP D 46 ? 0.6644 0.9251 0.6693 0.0615 -0.0376 -0.0709 46 ASP B CB 7879 C CG . ASP D 46 ? 0.7731 1.0444 0.7743 0.0552 -0.0394 -0.0644 46 ASP B CG 7880 O OD1 . ASP D 46 ? 0.7469 1.0075 0.7421 0.0480 -0.0430 -0.0593 46 ASP B OD1 7881 O OD2 . ASP D 46 ? 0.7771 1.0676 0.7809 0.0576 -0.0377 -0.0643 46 ASP B OD2 7882 N N . GLY D 47 ? 0.5743 0.8029 0.5812 0.0682 -0.0368 -0.0810 47 GLY B N 7883 C CA . GLY D 47 ? 0.5932 0.8165 0.6034 0.0720 -0.0362 -0.0852 47 GLY B CA 7884 C C . GLY D 47 ? 0.5902 0.8007 0.5989 0.0691 -0.0372 -0.0842 47 GLY B C 7885 O O . GLY D 47 ? 0.5853 0.7937 0.5963 0.0692 -0.0374 -0.0843 47 GLY B O 7886 N N . VAL D 48 ? 0.5478 0.7504 0.5523 0.0672 -0.0382 -0.0832 48 VAL B N 7887 C CA . VAL D 48 ? 0.5818 0.7733 0.5836 0.0657 -0.0394 -0.0826 48 VAL B CA 7888 C C . VAL D 48 ? 0.5855 0.7751 0.5851 0.0614 -0.0412 -0.0779 48 VAL B C 7889 O O . VAL D 48 ? 0.5522 0.7360 0.5520 0.0607 -0.0417 -0.0776 48 VAL B O 7890 C CB . VAL D 48 ? 0.5949 0.7795 0.5915 0.0666 -0.0404 -0.0837 48 VAL B CB 7891 C CG1 . VAL D 48 ? 0.6449 0.8193 0.6361 0.0656 -0.0428 -0.0822 48 VAL B CG1 7892 C CG2 . VAL D 48 ? 0.6103 0.7964 0.6101 0.0703 -0.0387 -0.0882 48 VAL B CG2 7893 N N . THR D 49 ? 0.6308 0.8260 0.6281 0.0578 -0.0426 -0.0737 49 THR B N 7894 C CA . THR D 49 ? 0.6444 0.8394 0.6392 0.0524 -0.0450 -0.0681 49 THR B CA 7895 C C . THR D 49 ? 0.6433 0.8468 0.6446 0.0534 -0.0430 -0.0683 49 THR B C 7896 O O . THR D 49 ? 0.7449 0.9438 0.7456 0.0508 -0.0443 -0.0661 49 THR B O 7897 C CB . THR D 49 ? 0.6594 0.8607 0.6500 0.0471 -0.0474 -0.0626 49 THR B CB 7898 O OG1 . THR D 49 ? 0.6760 0.8644 0.6583 0.0459 -0.0509 -0.0620 49 THR B OG1 7899 C CG2 . THR D 49 ? 0.6399 0.8448 0.6289 0.0403 -0.0501 -0.0559 49 THR B CG2 7900 N N . ASN D 50 ? 0.5806 0.7959 0.5872 0.0577 -0.0404 -0.0714 50 ASN B N 7901 C CA . ASN D 50 ? 0.5593 0.7816 0.5710 0.0604 -0.0393 -0.0726 50 ASN B CA 7902 C C . ASN D 50 ? 0.5308 0.7416 0.5440 0.0621 -0.0393 -0.0757 50 ASN B C 7903 O O . ASN D 50 ? 0.5336 0.7455 0.5490 0.0619 -0.0395 -0.0749 50 ASN B O 7904 C CB . ASN D 50 ? 0.5801 0.8142 0.5954 0.0667 -0.0375 -0.0768 50 ASN B CB 7905 C CG . ASN D 50 ? 0.6920 0.9445 0.7094 0.0670 -0.0372 -0.0738 50 ASN B CG 7906 O OD1 . ASN D 50 ? 0.7602 1.0182 0.7805 0.0707 -0.0370 -0.0754 50 ASN B OD1 7907 N ND2 . ASN D 50 ? 0.7073 0.9703 0.7226 0.0626 -0.0375 -0.0690 50 ASN B ND2 7908 N N . LYS D 51 ? 0.5160 0.7174 0.5279 0.0637 -0.0391 -0.0790 51 LYS B N 7909 C CA . LYS D 51 ? 0.5153 0.7080 0.5286 0.0648 -0.0392 -0.0816 51 LYS B CA 7910 C C . LYS D 51 ? 0.4934 0.6789 0.5044 0.0610 -0.0404 -0.0783 51 LYS B C 7911 O O . LYS D 51 ? 0.4438 0.6274 0.4570 0.0607 -0.0406 -0.0782 51 LYS B O 7912 C CB . LYS D 51 ? 0.4979 0.6853 0.5101 0.0665 -0.0390 -0.0847 51 LYS B CB 7913 C CG . LYS D 51 ? 0.4968 0.6768 0.5095 0.0659 -0.0395 -0.0859 51 LYS B CG 7914 C CD . LYS D 51 ? 0.4964 0.6747 0.5082 0.0670 -0.0394 -0.0883 51 LYS B CD 7915 C CE . LYS D 51 ? 0.5046 0.6859 0.5184 0.0694 -0.0396 -0.0914 51 LYS B CE 7916 N NZ . LYS D 51 ? 0.4829 0.6621 0.4966 0.0687 -0.0403 -0.0929 51 LYS B NZ 7917 N N . VAL D 52 ? 0.4748 0.6555 0.4804 0.0585 -0.0418 -0.0758 52 VAL B N 7918 C CA . VAL D 52 ? 0.5177 0.6899 0.5190 0.0556 -0.0439 -0.0731 52 VAL B CA 7919 C C . VAL D 52 ? 0.4983 0.6748 0.5013 0.0521 -0.0446 -0.0691 52 VAL B C 7920 O O . VAL D 52 ? 0.4656 0.6374 0.4691 0.0510 -0.0452 -0.0684 52 VAL B O 7921 C CB . VAL D 52 ? 0.5190 0.6836 0.5120 0.0541 -0.0467 -0.0712 52 VAL B CB 7922 C CG1 . VAL D 52 ? 0.5422 0.6964 0.5287 0.0511 -0.0504 -0.0680 52 VAL B CG1 7923 C CG2 . VAL D 52 ? 0.5354 0.6963 0.5266 0.0584 -0.0461 -0.0753 52 VAL B CG2 7924 N N . ASN D 53 ? 0.4629 0.6495 0.4666 0.0500 -0.0447 -0.0662 53 ASN B N 7925 C CA . ASN D 53 ? 0.4567 0.6509 0.4619 0.0463 -0.0455 -0.0616 53 ASN B CA 7926 C C . ASN D 53 ? 0.4351 0.6351 0.4469 0.0500 -0.0435 -0.0643 53 ASN B C 7927 O O . ASN D 53 ? 0.4984 0.6989 0.5111 0.0477 -0.0442 -0.0618 53 ASN B O 7928 C CB . ASN D 53 ? 0.4843 0.6925 0.4893 0.0434 -0.0460 -0.0576 53 ASN B CB 7929 C CG . ASN D 53 ? 0.4755 0.6765 0.4723 0.0374 -0.0499 -0.0528 53 ASN B CG 7930 O OD1 . ASN D 53 ? 0.4609 0.6461 0.4510 0.0350 -0.0532 -0.0517 53 ASN B OD1 7931 N ND2 . ASN D 53 ? 0.5525 0.7650 0.5487 0.0352 -0.0502 -0.0500 53 ASN B ND2 7932 N N . SER D 54 ? 0.4699 0.6720 0.4853 0.0557 -0.0416 -0.0696 54 SER B N 7933 C CA . SER D 54 ? 0.4849 0.6887 0.5047 0.0598 -0.0410 -0.0728 54 SER B CA 7934 C C . SER D 54 ? 0.4847 0.6759 0.5040 0.0582 -0.0418 -0.0732 54 SER B C 7935 O O . SER D 54 ? 0.5275 0.7191 0.5490 0.0581 -0.0423 -0.0726 54 SER B O 7936 C CB . SER D 54 ? 0.4918 0.6969 0.5132 0.0658 -0.0403 -0.0783 54 SER B CB 7937 O OG . SER D 54 ? 0.5702 0.7890 0.5923 0.0685 -0.0396 -0.0784 54 SER B OG 7938 N N . ILE D 55 ? 0.4567 0.6385 0.4734 0.0573 -0.0420 -0.0743 55 ILE B N 7939 C CA . ILE D 55 ? 0.4826 0.6550 0.4985 0.0560 -0.0427 -0.0745 55 ILE B CA 7940 C C . ILE D 55 ? 0.5142 0.6831 0.5275 0.0520 -0.0440 -0.0703 55 ILE B C 7941 O O . ILE D 55 ? 0.5178 0.6826 0.5321 0.0511 -0.0445 -0.0700 55 ILE B O 7942 C CB . ILE D 55 ? 0.4981 0.6650 0.5111 0.0566 -0.0425 -0.0764 55 ILE B CB 7943 C CG1 . ILE D 55 ? 0.4941 0.6630 0.5100 0.0595 -0.0419 -0.0802 55 ILE B CG1 7944 C CG2 . ILE D 55 ? 0.5213 0.6813 0.5322 0.0553 -0.0433 -0.0757 55 ILE B CG2 7945 C CD1 . ILE D 55 ? 0.4958 0.6633 0.5094 0.0603 -0.0415 -0.0819 55 ILE B CD1 7946 N N . ILE D 56 ? 0.5042 0.6749 0.5138 0.0491 -0.0451 -0.0667 56 ILE B N 7947 C CA . ILE D 56 ? 0.5125 0.6797 0.5185 0.0444 -0.0475 -0.0619 56 ILE B CA 7948 C C . ILE D 56 ? 0.5238 0.7015 0.5343 0.0427 -0.0472 -0.0591 56 ILE B C 7949 O O . ILE D 56 ? 0.5603 0.7351 0.5711 0.0406 -0.0482 -0.0572 56 ILE B O 7950 C CB . ILE D 56 ? 0.4755 0.6390 0.4741 0.0407 -0.0505 -0.0583 56 ILE B CB 7951 C CG1 . ILE D 56 ? 0.4647 0.6164 0.4571 0.0433 -0.0517 -0.0611 56 ILE B CG1 7952 C CG2 . ILE D 56 ? 0.4844 0.6447 0.4781 0.0343 -0.0543 -0.0521 56 ILE B CG2 7953 C CD1 . ILE D 56 ? 0.4331 0.5787 0.4169 0.0409 -0.0555 -0.0586 56 ILE B CD1 7954 N N . ASP D 57 ? 0.5059 0.6972 0.5195 0.0439 -0.0460 -0.0587 57 ASP B N 7955 C CA . ASP D 57 ? 0.5019 0.7076 0.5187 0.0424 -0.0460 -0.0551 57 ASP B CA 7956 C C . ASP D 57 ? 0.4975 0.7064 0.5197 0.0474 -0.0448 -0.0586 57 ASP B C 7957 O O . ASP D 57 ? 0.5012 0.7193 0.5256 0.0464 -0.0451 -0.0558 57 ASP B O 7958 C CB . ASP D 57 ? 0.5272 0.7497 0.5453 0.0433 -0.0451 -0.0540 57 ASP B CB 7959 C CG . ASP D 57 ? 0.6069 0.8280 0.6191 0.0368 -0.0474 -0.0489 57 ASP B CG 7960 O OD1 . ASP D 57 ? 0.6580 0.8654 0.6641 0.0315 -0.0506 -0.0457 57 ASP B OD1 7961 O OD2 . ASP D 57 ? 0.5824 0.8153 0.5950 0.0375 -0.0467 -0.0484 57 ASP B OD2 7962 N N . LYS D 58 ? 0.4869 0.6885 0.5107 0.0525 -0.0439 -0.0643 58 LYS B N 7963 C CA . LYS D 58 ? 0.4723 0.6736 0.4996 0.0571 -0.0441 -0.0678 58 LYS B CA 7964 C C . LYS D 58 ? 0.4718 0.6633 0.4989 0.0540 -0.0452 -0.0663 58 LYS B C 7965 O O . LYS D 58 ? 0.4863 0.6774 0.5157 0.0568 -0.0460 -0.0681 58 LYS B O 7966 C CB . LYS D 58 ? 0.5421 0.7372 0.5696 0.0621 -0.0442 -0.0736 58 LYS B CB 7967 C CG . LYS D 58 ? 0.6072 0.8116 0.6361 0.0694 -0.0446 -0.0775 58 LYS B CG 7968 C CD . LYS D 58 ? 0.6129 0.8338 0.6422 0.0704 -0.0431 -0.0756 58 LYS B CD 7969 C CE . LYS D 58 ? 0.6827 0.9185 0.7138 0.0770 -0.0436 -0.0770 58 LYS B CE 7970 N NZ . LYS D 58 ? 0.6740 0.9118 0.7041 0.0860 -0.0447 -0.0834 58 LYS B NZ 7971 N N . MET D 59 ? 0.4870 0.6696 0.5106 0.0489 -0.0457 -0.0635 59 MET B N 7972 C CA . MET D 59 ? 0.5025 0.6768 0.5252 0.0459 -0.0468 -0.0617 59 MET B CA 7973 C C . MET D 59 ? 0.4879 0.6699 0.5120 0.0433 -0.0476 -0.0575 59 MET B C 7974 O O . MET D 59 ? 0.5210 0.7093 0.5431 0.0394 -0.0483 -0.0530 59 MET B O 7975 C CB . MET D 59 ? 0.5374 0.7013 0.5544 0.0423 -0.0478 -0.0600 59 MET B CB 7976 C CG . MET D 59 ? 0.5066 0.6616 0.5220 0.0402 -0.0490 -0.0590 59 MET B CG 7977 S SD . MET D 59 ? 0.5052 0.6572 0.5250 0.0429 -0.0482 -0.0628 59 MET B SD 7978 C CE . MET D 59 ? 0.5250 0.6728 0.5424 0.0447 -0.0475 -0.0659 59 MET B CE 7979 N N . ASN D 60 ? 0.4630 0.6450 0.4902 0.0452 -0.0478 -0.0587 60 ASN B N 7980 C CA . ASN D 60 ? 0.5099 0.6984 0.5385 0.0428 -0.0487 -0.0548 60 ASN B CA 7981 C C . ASN D 60 ? 0.5669 0.7437 0.5919 0.0371 -0.0502 -0.0515 60 ASN B C 7982 O O . ASN D 60 ? 0.5459 0.7117 0.5702 0.0376 -0.0503 -0.0537 60 ASN B O 7983 C CB . ASN D 60 ? 0.5294 0.7216 0.5619 0.0482 -0.0489 -0.0579 60 ASN B CB 7984 C CG . ASN D 60 ? 0.5716 0.7737 0.6060 0.0469 -0.0495 -0.0542 60 ASN B CG 7985 O OD1 . ASN D 60 ? 0.5897 0.8067 0.6247 0.0454 -0.0492 -0.0505 60 ASN B OD1 7986 N ND2 . ASN D 60 ? 0.6026 0.7980 0.6380 0.0470 -0.0507 -0.0547 60 ASN B ND2 7987 N N . THR D 61 ? 0.5884 0.7684 0.6106 0.0315 -0.0517 -0.0459 61 THR B N 7988 C CA . THR D 61 ? 0.6467 0.8149 0.6636 0.0262 -0.0542 -0.0425 61 THR B CA 7989 C C . THR D 61 ? 0.6353 0.8098 0.6546 0.0233 -0.0552 -0.0386 61 THR B C 7990 O O . THR D 61 ? 0.7308 0.9206 0.7529 0.0223 -0.0551 -0.0356 61 THR B O 7991 C CB . THR D 61 ? 0.6866 0.8507 0.6963 0.0214 -0.0569 -0.0388 61 THR B CB 7992 O OG1 . THR D 61 ? 0.7488 0.8969 0.7523 0.0223 -0.0582 -0.0412 61 THR B OG1 7993 C CG2 . THR D 61 ? 0.7723 0.9397 0.7783 0.0135 -0.0606 -0.0312 61 THR B CG2 7994 N N . GLN D 62 ? 0.5640 0.7288 0.5825 0.0223 -0.0561 -0.0387 62 GLN B N 7995 C CA . GLN D 62 ? 0.5095 0.6797 0.5293 0.0186 -0.0576 -0.0342 62 GLN B CA 7996 C C . GLN D 62 ? 0.4741 0.6307 0.4881 0.0135 -0.0606 -0.0312 62 GLN B C 7997 O O . GLN D 62 ? 0.4597 0.6026 0.4695 0.0147 -0.0611 -0.0339 62 GLN B O 7998 C CB . GLN D 62 ? 0.5190 0.6979 0.5459 0.0236 -0.0558 -0.0369 62 GLN B CB 7999 C CG . GLN D 62 ? 0.5445 0.7167 0.5740 0.0298 -0.0542 -0.0433 62 GLN B CG 8000 C CD . GLN D 62 ? 0.5056 0.6858 0.5401 0.0349 -0.0541 -0.0456 62 GLN B CD 8001 O OE1 . GLN D 62 ? 0.4818 0.6707 0.5181 0.0338 -0.0548 -0.0425 62 GLN B OE1 8002 N NE2 . GLN D 62 ? 0.5320 0.7082 0.5679 0.0406 -0.0539 -0.0510 62 GLN B NE2 8003 N N . PHE D 63 ? 0.3990 0.5611 0.4125 0.0080 -0.0628 -0.0255 63 PHE B N 8004 C CA . PHE D 63 ? 0.3956 0.5448 0.4028 0.0030 -0.0665 -0.0223 63 PHE B CA 8005 C C . PHE D 63 ? 0.3650 0.5058 0.3745 0.0069 -0.0649 -0.0265 63 PHE B C 8006 O O . PHE D 63 ? 0.3538 0.5028 0.3703 0.0097 -0.0627 -0.0279 63 PHE B O 8007 C CB . PHE D 63 ? 0.3833 0.5419 0.3904 -0.0041 -0.0693 -0.0148 63 PHE B CB 8008 C CG . PHE D 63 ? 0.4021 0.5456 0.4018 -0.0094 -0.0738 -0.0115 63 PHE B CG 8009 C CD1 . PHE D 63 ? 0.4387 0.5684 0.4272 -0.0151 -0.0795 -0.0079 63 PHE B CD1 8010 C CD2 . PHE D 63 ? 0.4001 0.5402 0.4026 -0.0079 -0.0729 -0.0128 63 PHE B CD2 8011 C CE1 . PHE D 63 ? 0.4519 0.5651 0.4317 -0.0190 -0.0846 -0.0055 63 PHE B CE1 8012 C CE2 . PHE D 63 ? 0.4629 0.5882 0.4579 -0.0122 -0.0772 -0.0103 63 PHE B CE2 8013 C CZ . PHE D 63 ? 0.4807 0.5921 0.4640 -0.0173 -0.0832 -0.0069 63 PHE B CZ 8014 N N . GLU D 64 ? 0.3603 0.4853 0.3631 0.0071 -0.0667 -0.0281 64 GLU B N 8015 C CA . GLU D 64 ? 0.3516 0.4697 0.3553 0.0088 -0.0662 -0.0302 64 GLU B CA 8016 C C . GLU D 64 ? 0.3760 0.4790 0.3697 0.0062 -0.0704 -0.0286 64 GLU B C 8017 O O . GLU D 64 ? 0.4060 0.5003 0.3910 0.0057 -0.0736 -0.0282 64 GLU B O 8018 C CB . GLU D 64 ? 0.3592 0.4764 0.3665 0.0147 -0.0629 -0.0362 64 GLU B CB 8019 C CG . GLU D 64 ? 0.3701 0.4983 0.3851 0.0184 -0.0598 -0.0389 64 GLU B CG 8020 C CD . GLU D 64 ? 0.3768 0.5133 0.3984 0.0190 -0.0591 -0.0383 64 GLU B CD 8021 O OE1 . GLU D 64 ? 0.3366 0.4701 0.3583 0.0167 -0.0604 -0.0362 64 GLU B OE1 8022 O OE2 . GLU D 64 ? 0.3823 0.5283 0.4085 0.0227 -0.0577 -0.0403 64 GLU B OE2 8023 N N . ALA D 65 ? 0.3348 0.4340 0.3289 0.0054 -0.0710 -0.0280 65 ALA B N 8024 C CA . ALA D 65 ? 0.3475 0.4326 0.3320 0.0042 -0.0751 -0.0273 65 ALA B CA 8025 C C . ALA D 65 ? 0.3585 0.4406 0.3441 0.0092 -0.0727 -0.0319 65 ALA B C 8026 O O . ALA D 65 ? 0.3995 0.4868 0.3920 0.0092 -0.0705 -0.0322 65 ALA B O 8027 C CB . ALA D 65 ? 0.3426 0.4262 0.3255 -0.0019 -0.0784 -0.0217 65 ALA B CB 8028 N N . VAL D 66 ? 0.3514 0.4268 0.3301 0.0137 -0.0736 -0.0354 66 VAL B N 8029 C CA . VAL D 66 ? 0.3470 0.4235 0.3266 0.0185 -0.0712 -0.0395 66 VAL B CA 8030 C C . VAL D 66 ? 0.3714 0.4367 0.3403 0.0202 -0.0753 -0.0399 66 VAL B C 8031 O O . VAL D 66 ? 0.3976 0.4528 0.3556 0.0225 -0.0794 -0.0407 66 VAL B O 8032 C CB . VAL D 66 ? 0.3381 0.4185 0.3177 0.0234 -0.0690 -0.0436 66 VAL B CB 8033 C CG1 . VAL D 66 ? 0.3258 0.4110 0.3069 0.0270 -0.0668 -0.0466 66 VAL B CG1 8034 C CG2 . VAL D 66 ? 0.3352 0.4248 0.3232 0.0225 -0.0659 -0.0437 66 VAL B CG2 8035 N N . GLY D 67 ? 0.3894 0.4558 0.3608 0.0193 -0.0747 -0.0393 67 GLY B N 8036 C CA . GLY D 67 ? 0.4116 0.4690 0.3733 0.0218 -0.0781 -0.0402 67 GLY B CA 8037 C C . GLY D 67 ? 0.3910 0.4566 0.3575 0.0239 -0.0750 -0.0420 67 GLY B C 8038 O O . GLY D 67 ? 0.4022 0.4789 0.3766 0.0247 -0.0708 -0.0435 67 GLY B O 8039 N N . ARG D 68 ? 0.3957 0.4554 0.3563 0.0244 -0.0776 -0.0415 68 ARG B N 8040 C CA . ARG D 68 ? 0.3831 0.4507 0.3464 0.0261 -0.0754 -0.0427 68 ARG B CA 8041 C C . ARG D 68 ? 0.4020 0.4638 0.3649 0.0219 -0.0775 -0.0396 68 ARG B C 8042 O O . ARG D 68 ? 0.4758 0.5290 0.4288 0.0245 -0.0812 -0.0402 68 ARG B O 8043 C CB . ARG D 68 ? 0.4123 0.4802 0.3653 0.0344 -0.0769 -0.0469 68 ARG B CB 8044 C CG . ARG D 68 ? 0.4240 0.5007 0.3783 0.0389 -0.0744 -0.0501 68 ARG B CG 8045 C CD . ARG D 68 ? 0.4231 0.5159 0.3900 0.0355 -0.0692 -0.0493 68 ARG B CD 8046 N NE . ARG D 68 ? 0.4241 0.5272 0.3927 0.0390 -0.0668 -0.0518 68 ARG B NE 8047 C CZ . ARG D 68 ? 0.4115 0.5166 0.3863 0.0367 -0.0648 -0.0516 68 ARG B CZ 8048 N NH1 . ARG D 68 ? 0.4101 0.5087 0.3899 0.0317 -0.0649 -0.0493 68 ARG B NH1 8049 N NH2 . ARG D 68 ? 0.4158 0.5306 0.3916 0.0398 -0.0628 -0.0538 68 ARG B NH2 8050 N N . GLU D 69 ? 0.4467 0.5126 0.4198 0.0160 -0.0755 -0.0364 69 GLU B N 8051 C CA . GLU D 69 ? 0.4204 0.4807 0.3937 0.0111 -0.0777 -0.0327 69 GLU B CA 8052 C C . GLU D 69 ? 0.4106 0.4762 0.3886 0.0099 -0.0761 -0.0322 69 GLU B C 8053 O O . GLU D 69 ? 0.3839 0.4455 0.3624 0.0061 -0.0778 -0.0292 69 GLU B O 8054 C CB . GLU D 69 ? 0.4601 0.5235 0.4414 0.0061 -0.0768 -0.0295 69 GLU B CB 8055 C CG . GLU D 69 ? 0.5423 0.6002 0.5186 0.0043 -0.0796 -0.0276 69 GLU B CG 8056 C CD . GLU D 69 ? 0.7242 0.7751 0.6964 -0.0015 -0.0841 -0.0224 69 GLU B CD 8057 O OE1 . GLU D 69 ? 0.6590 0.7037 0.6274 -0.0032 -0.0866 -0.0209 69 GLU B OE1 8058 O OE2 . GLU D 69 ? 0.6095 0.6619 0.5819 -0.0050 -0.0854 -0.0195 69 GLU B OE2 8059 N N . PHE D 70 ? 0.3704 0.4455 0.3517 0.0123 -0.0733 -0.0344 70 PHE B N 8060 C CA . PHE D 70 ? 0.3822 0.4633 0.3678 0.0100 -0.0723 -0.0331 70 PHE B CA 8061 C C . PHE D 70 ? 0.3855 0.4668 0.3628 0.0136 -0.0737 -0.0344 70 PHE B C 8062 O O . PHE D 70 ? 0.3949 0.4769 0.3643 0.0197 -0.0744 -0.0375 70 PHE B O 8063 C CB . PHE D 70 ? 0.3679 0.4597 0.3619 0.0084 -0.0694 -0.0334 70 PHE B CB 8064 C CG . PHE D 70 ? 0.3568 0.4478 0.3581 0.0058 -0.0687 -0.0326 70 PHE B CG 8065 C CD1 . PHE D 70 ? 0.3710 0.4639 0.3735 0.0079 -0.0674 -0.0344 70 PHE B CD1 8066 C CD2 . PHE D 70 ? 0.3523 0.4405 0.3586 0.0021 -0.0696 -0.0301 70 PHE B CD2 8067 C CE1 . PHE D 70 ? 0.3584 0.4512 0.3668 0.0065 -0.0670 -0.0340 70 PHE B CE1 8068 C CE2 . PHE D 70 ? 0.3332 0.4220 0.3453 0.0013 -0.0692 -0.0298 70 PHE B CE2 8069 C CZ . PHE D 70 ? 0.3198 0.4110 0.3328 0.0037 -0.0679 -0.0318 70 PHE B CZ 8070 N N . ASN D 71 ? 0.3890 0.4695 0.3673 0.0105 -0.0746 -0.0321 71 ASN B N 8071 C CA . ASN D 71 ? 0.3822 0.4630 0.3521 0.0144 -0.0763 -0.0334 71 ASN B CA 8072 C C . ASN D 71 ? 0.3726 0.4696 0.3451 0.0153 -0.0739 -0.0338 71 ASN B C 8073 O O . ASN D 71 ? 0.3137 0.4204 0.2939 0.0125 -0.0714 -0.0330 71 ASN B O 8074 C CB . ASN D 71 ? 0.3993 0.4708 0.3672 0.0110 -0.0789 -0.0307 71 ASN B CB 8075 C CG . ASN D 71 ? 0.4018 0.4794 0.3797 0.0046 -0.0772 -0.0273 71 ASN B CG 8076 O OD1 . ASN D 71 ? 0.3836 0.4727 0.3670 0.0030 -0.0750 -0.0269 71 ASN B OD1 8077 N ND2 . ASN D 71 ? 0.3854 0.4551 0.3650 0.0005 -0.0789 -0.0246 71 ASN B ND2 8078 N N . ASN D 72 ? 0.4041 0.5045 0.3696 0.0190 -0.0751 -0.0347 72 ASN B N 8079 C CA . ASN D 72 ? 0.4555 0.5746 0.4219 0.0206 -0.0731 -0.0349 72 ASN B CA 8080 C C . ASN D 72 ? 0.4099 0.5383 0.3866 0.0115 -0.0716 -0.0302 72 ASN B C 8081 O O . ASN D 72 ? 0.3977 0.5432 0.3766 0.0102 -0.0703 -0.0289 72 ASN B O 8082 C CB . ASN D 72 ? 0.5348 0.6564 0.4897 0.0285 -0.0752 -0.0376 72 ASN B CB 8083 C CG . ASN D 72 ? 0.6182 0.7634 0.5723 0.0325 -0.0730 -0.0386 72 ASN B CG 8084 O OD1 . ASN D 72 ? 0.6999 0.8555 0.6559 0.0344 -0.0710 -0.0398 72 ASN B OD1 8085 N ND2 . ASN D 72 ? 0.6355 0.7909 0.5870 0.0332 -0.0734 -0.0375 72 ASN B ND2 8086 N N . LEU D 73 ? 0.3688 0.4866 0.3509 0.0053 -0.0726 -0.0274 73 LEU B N 8087 C CA . LEU D 73 ? 0.3649 0.4874 0.3559 -0.0029 -0.0724 -0.0232 73 LEU B CA 8088 C C . LEU D 73 ? 0.3599 0.4766 0.3582 -0.0067 -0.0722 -0.0225 73 LEU B C 8089 O O . LEU D 73 ? 0.3749 0.4869 0.3787 -0.0122 -0.0736 -0.0198 73 LEU B O 8090 C CB . LEU D 73 ? 0.3677 0.4839 0.3586 -0.0064 -0.0742 -0.0206 73 LEU B CB 8091 C CG . LEU D 73 ? 0.3972 0.5237 0.3821 -0.0041 -0.0745 -0.0204 73 LEU B CG 8092 C CD1 . LEU D 73 ? 0.4016 0.5209 0.3855 -0.0069 -0.0764 -0.0182 73 LEU B CD1 8093 C CD2 . LEU D 73 ? 0.4235 0.5692 0.4118 -0.0079 -0.0735 -0.0179 73 LEU B CD2 8094 N N . GLU D 74 ? 0.3500 0.4657 0.3473 -0.0027 -0.0710 -0.0254 74 GLU B N 8095 C CA . GLU D 74 ? 0.3359 0.4476 0.3391 -0.0046 -0.0706 -0.0256 74 GLU B CA 8096 C C . GLU D 74 ? 0.3304 0.4512 0.3331 -0.0020 -0.0689 -0.0276 74 GLU B C 8097 O O . GLU D 74 ? 0.3339 0.4510 0.3380 0.0000 -0.0681 -0.0295 74 GLU B O 8098 C CB . GLU D 74 ? 0.3525 0.4523 0.3552 -0.0026 -0.0709 -0.0267 74 GLU B CB 8099 C CG . GLU D 74 ? 0.3929 0.4849 0.3969 -0.0056 -0.0727 -0.0243 74 GLU B CG 8100 C CD . GLU D 74 ? 0.4253 0.5082 0.4273 -0.0042 -0.0735 -0.0244 74 GLU B CD 8101 O OE1 . GLU D 74 ? 0.4758 0.5556 0.4717 -0.0006 -0.0737 -0.0262 74 GLU B OE1 8102 O OE2 . GLU D 74 ? 0.3470 0.4265 0.3532 -0.0070 -0.0744 -0.0223 74 GLU B OE2 8103 N N . ARG D 75 ? 0.3454 0.4799 0.3462 -0.0022 -0.0684 -0.0268 75 ARG B N 8104 C CA . ARG D 75 ? 0.3620 0.5085 0.3622 0.0000 -0.0669 -0.0282 75 ARG B CA 8105 C C . ARG D 75 ? 0.3400 0.4873 0.3469 -0.0058 -0.0676 -0.0263 75 ARG B C 8106 O O . ARG D 75 ? 0.3568 0.5082 0.3641 -0.0038 -0.0665 -0.0280 75 ARG B O 8107 C CB . ARG D 75 ? 0.4095 0.5739 0.4063 0.0010 -0.0664 -0.0272 75 ARG B CB 8108 C CG . ARG D 75 ? 0.5110 0.6760 0.4990 0.0094 -0.0662 -0.0303 75 ARG B CG 8109 C CD . ARG D 75 ? 0.6833 0.8415 0.6657 0.0177 -0.0657 -0.0352 75 ARG B CD 8110 N NE . ARG D 75 ? 0.8945 1.0529 0.8660 0.0273 -0.0667 -0.0390 75 ARG B NE 8111 C CZ . ARG D 75 ? 1.0531 1.1955 1.0168 0.0336 -0.0687 -0.0426 75 ARG B CZ 8112 N NH1 . ARG D 75 ? 1.1534 1.2810 1.1200 0.0307 -0.0692 -0.0424 75 ARG B NH1 8113 N NH2 . ARG D 75 ? 1.0879 1.2289 1.0399 0.0427 -0.0710 -0.0462 75 ARG B NH2 8114 N N . ARG D 76 ? 0.3139 0.4556 0.3251 -0.0127 -0.0702 -0.0230 76 ARG B N 8115 C CA . ARG D 76 ? 0.3371 0.4765 0.3524 -0.0175 -0.0723 -0.0218 76 ARG B CA 8116 C C . ARG D 76 ? 0.3284 0.4577 0.3453 -0.0130 -0.0713 -0.0254 76 ARG B C 8117 O O . ARG D 76 ? 0.2996 0.4309 0.3177 -0.0129 -0.0712 -0.0264 76 ARG B O 8118 C CB . ARG D 76 ? 0.3691 0.5023 0.3869 -0.0250 -0.0766 -0.0178 76 ARG B CB 8119 C CG . ARG D 76 ? 0.3903 0.5363 0.4068 -0.0312 -0.0782 -0.0132 76 ARG B CG 8120 C CD . ARG D 76 ? 0.3687 0.5067 0.3862 -0.0381 -0.0827 -0.0094 76 ARG B CD 8121 N NE . ARG D 76 ? 0.3721 0.4993 0.3899 -0.0343 -0.0818 -0.0112 76 ARG B NE 8122 C CZ . ARG D 76 ? 0.3625 0.4763 0.3819 -0.0366 -0.0853 -0.0103 76 ARG B CZ 8123 N NH1 . ARG D 76 ? 0.3710 0.4782 0.3910 -0.0420 -0.0906 -0.0082 76 ARG B NH1 8124 N NH2 . ARG D 76 ? 0.3447 0.4514 0.3645 -0.0331 -0.0841 -0.0117 76 ARG B NH2 8125 N N . ILE D 77 ? 0.3708 0.4901 0.3877 -0.0099 -0.0707 -0.0268 77 ILE B N 8126 C CA . ILE D 77 ? 0.3919 0.5038 0.4103 -0.0060 -0.0698 -0.0296 77 ILE B CA 8127 C C . ILE D 77 ? 0.3618 0.4781 0.3769 -0.0010 -0.0671 -0.0324 77 ILE B C 8128 O O . ILE D 77 ? 0.3352 0.4511 0.3519 0.0006 -0.0664 -0.0342 77 ILE B O 8129 C CB . ILE D 77 ? 0.4481 0.5514 0.4667 -0.0048 -0.0701 -0.0294 77 ILE B CB 8130 C CG1 . ILE D 77 ? 0.5179 0.6164 0.5398 -0.0088 -0.0732 -0.0271 77 ILE B CG1 8131 C CG2 . ILE D 77 ? 0.4517 0.5512 0.4718 -0.0013 -0.0692 -0.0315 77 ILE B CG2 8132 C CD1 . ILE D 77 ? 0.5643 0.6575 0.5859 -0.0085 -0.0735 -0.0260 77 ILE B CD1 8133 N N . GLU D 78 ? 0.3645 0.4848 0.3743 0.0019 -0.0660 -0.0330 78 GLU B N 8134 C CA . GLU D 78 ? 0.4055 0.5293 0.4107 0.0076 -0.0643 -0.0360 78 GLU B CA 8135 C C . GLU D 78 ? 0.3906 0.5247 0.3983 0.0066 -0.0635 -0.0362 78 GLU B C 8136 O O . GLU D 78 ? 0.3778 0.5117 0.3851 0.0098 -0.0623 -0.0386 78 GLU B O 8137 C CB . GLU D 78 ? 0.4928 0.6196 0.4903 0.0120 -0.0644 -0.0370 78 GLU B CB 8138 C CG . GLU D 78 ? 0.5831 0.7125 0.5735 0.0196 -0.0637 -0.0408 78 GLU B CG 8139 C CD . GLU D 78 ? 0.8045 0.9359 0.7855 0.0256 -0.0649 -0.0425 78 GLU B CD 8140 O OE1 . GLU D 78 ? 0.7987 0.9436 0.7794 0.0253 -0.0644 -0.0414 78 GLU B OE1 8141 O OE2 . GLU D 78 ? 0.8641 0.9831 0.8368 0.0305 -0.0672 -0.0447 78 GLU B OE2 8142 N N . ASN D 79 ? 0.3893 0.5327 0.3992 0.0015 -0.0644 -0.0333 79 ASN B N 8143 C CA . ASN D 79 ? 0.3790 0.5330 0.3909 -0.0009 -0.0644 -0.0326 79 ASN B CA 8144 C C . ASN D 79 ? 0.3428 0.4878 0.3587 -0.0026 -0.0655 -0.0334 79 ASN B C 8145 O O . ASN D 79 ? 0.2893 0.4385 0.3056 -0.0015 -0.0648 -0.0347 79 ASN B O 8146 C CB . ASN D 79 ? 0.4156 0.5813 0.4286 -0.0081 -0.0664 -0.0280 79 ASN B CB 8147 C CG . ASN D 79 ? 0.4419 0.6199 0.4562 -0.0119 -0.0671 -0.0261 79 ASN B CG 8148 O OD1 . ASN D 79 ? 0.5921 0.7679 0.6089 -0.0198 -0.0708 -0.0226 79 ASN B OD1 8149 N ND2 . ASN D 79 ? 0.3913 0.5808 0.4031 -0.0065 -0.0644 -0.0285 79 ASN B ND2 8150 N N . LEU D 80 ? 0.3575 0.4905 0.3759 -0.0045 -0.0675 -0.0328 80 LEU B N 8151 C CA . LEU D 80 ? 0.3629 0.4875 0.3843 -0.0046 -0.0690 -0.0341 80 LEU B CA 8152 C C . LEU D 80 ? 0.3434 0.4665 0.3641 0.0015 -0.0661 -0.0378 80 LEU B C 8153 O O . LEU D 80 ? 0.3205 0.4446 0.3422 0.0026 -0.0659 -0.0394 80 LEU B O 8154 C CB . LEU D 80 ? 0.4201 0.5341 0.4434 -0.0062 -0.0718 -0.0332 80 LEU B CB 8155 C CG . LEU D 80 ? 0.4870 0.5920 0.5124 -0.0042 -0.0739 -0.0352 80 LEU B CG 8156 C CD1 . LEU D 80 ? 0.5793 0.6844 0.6045 -0.0062 -0.0765 -0.0356 80 LEU B CD1 8157 C CD2 . LEU D 80 ? 0.4715 0.5681 0.4978 -0.0061 -0.0777 -0.0338 80 LEU B CD2 8158 N N . ASN D 81 ? 0.3710 0.4921 0.3891 0.0053 -0.0641 -0.0388 81 ASN B N 8159 C CA . ASN D 81 ? 0.3502 0.4696 0.3663 0.0103 -0.0621 -0.0415 81 ASN B CA 8160 C C . ASN D 81 ? 0.3549 0.4823 0.3683 0.0129 -0.0606 -0.0432 81 ASN B C 8161 O O . ASN D 81 ? 0.3603 0.4875 0.3740 0.0155 -0.0595 -0.0453 81 ASN B O 8162 C CB . ASN D 81 ? 0.3906 0.5046 0.4023 0.0126 -0.0619 -0.0414 81 ASN B CB 8163 C CG . ASN D 81 ? 0.3885 0.4995 0.3966 0.0167 -0.0611 -0.0435 81 ASN B CG 8164 O OD1 . ASN D 81 ? 0.3772 0.4855 0.3880 0.0167 -0.0610 -0.0436 81 ASN B OD1 8165 N ND2 . ASN D 81 ? 0.4074 0.5195 0.4089 0.0205 -0.0610 -0.0450 81 ASN B ND2 8166 N N . LYS D 82 ? 0.3501 0.4862 0.3608 0.0128 -0.0603 -0.0424 82 LYS B N 8167 C CA . LYS D 82 ? 0.3755 0.5224 0.3839 0.0158 -0.0589 -0.0440 82 LYS B CA 8168 C C . LYS D 82 ? 0.3774 0.5282 0.3901 0.0125 -0.0593 -0.0435 82 LYS B C 8169 O O . LYS D 82 ? 0.3557 0.5099 0.3675 0.0157 -0.0579 -0.0457 82 LYS B O 8170 C CB . LYS D 82 ? 0.3821 0.5418 0.3875 0.0160 -0.0588 -0.0427 82 LYS B CB 8171 C CG . LYS D 82 ? 0.3916 0.5661 0.3944 0.0196 -0.0574 -0.0441 82 LYS B CG 8172 C CD . LYS D 82 ? 0.3835 0.5741 0.3838 0.0194 -0.0574 -0.0422 82 LYS B CD 8173 C CE . LYS D 82 ? 0.4155 0.6264 0.4142 0.0220 -0.0562 -0.0425 82 LYS B CE 8174 N NZ . LYS D 82 ? 0.4340 0.6455 0.4312 0.0274 -0.0548 -0.0460 82 LYS B NZ 8175 N N . LYS D 83 ? 0.3979 0.5475 0.4144 0.0059 -0.0618 -0.0406 83 LYS B N 8176 C CA . LYS D 83 ? 0.3899 0.5418 0.4090 0.0021 -0.0635 -0.0398 83 LYS B CA 8177 C C . LYS D 83 ? 0.3777 0.5197 0.3983 0.0056 -0.0631 -0.0430 83 LYS B C 8178 O O . LYS D 83 ? 0.3752 0.5200 0.3962 0.0063 -0.0629 -0.0443 83 LYS B O 8179 C CB . LYS D 83 ? 0.3882 0.5377 0.4091 -0.0059 -0.0680 -0.0358 83 LYS B CB 8180 C CG . LYS D 83 ? 0.4128 0.5752 0.4326 -0.0113 -0.0690 -0.0316 83 LYS B CG 8181 C CD . LYS D 83 ? 0.4449 0.6026 0.4655 -0.0205 -0.0748 -0.0271 83 LYS B CD 8182 C CE . LYS D 83 ? 0.4890 0.6345 0.5101 -0.0209 -0.0764 -0.0267 83 LYS B CE 8183 N NZ . LYS D 83 ? 0.5637 0.6999 0.5844 -0.0288 -0.0832 -0.0231 83 LYS B NZ 8184 N N . MET D 84 ? 0.3769 0.5092 0.3982 0.0080 -0.0629 -0.0441 84 MET B N 8185 C CA . MET D 84 ? 0.3747 0.5007 0.3974 0.0117 -0.0623 -0.0468 84 MET B CA 8186 C C . MET D 84 ? 0.3551 0.4846 0.3754 0.0165 -0.0593 -0.0492 84 MET B C 8187 O O . MET D 84 ? 0.3260 0.4566 0.3471 0.0180 -0.0588 -0.0510 84 MET B O 8188 C CB . MET D 84 ? 0.4389 0.5575 0.4628 0.0127 -0.0628 -0.0466 84 MET B CB 8189 C CG . MET D 84 ? 0.5033 0.6185 0.5291 0.0162 -0.0627 -0.0488 84 MET B CG 8190 S SD . MET D 84 ? 0.5922 0.7048 0.6183 0.0179 -0.0618 -0.0478 84 MET B SD 8191 C CE . MET D 84 ? 0.6001 0.7149 0.6215 0.0199 -0.0591 -0.0483 84 MET B CE 8192 N N . GLU D 85 ? 0.3531 0.4834 0.3695 0.0190 -0.0578 -0.0493 85 GLU B N 8193 C CA . GLU D 85 ? 0.3890 0.5206 0.4012 0.0239 -0.0561 -0.0516 85 GLU B CA 8194 C C . GLU D 85 ? 0.3754 0.5161 0.3871 0.0251 -0.0552 -0.0529 85 GLU B C 8195 O O . GLU D 85 ? 0.3899 0.5307 0.4014 0.0277 -0.0542 -0.0549 85 GLU B O 8196 C CB . GLU D 85 ? 0.4446 0.5747 0.4504 0.0268 -0.0563 -0.0517 85 GLU B CB 8197 C CG . GLU D 85 ? 0.4600 0.5798 0.4632 0.0271 -0.0575 -0.0510 85 GLU B CG 8198 C CD . GLU D 85 ? 0.4838 0.5993 0.4781 0.0308 -0.0590 -0.0517 85 GLU B CD 8199 O OE1 . GLU D 85 ? 0.6067 0.7271 0.5958 0.0354 -0.0589 -0.0539 85 GLU B OE1 8200 O OE2 . GLU D 85 ? 0.4879 0.5951 0.4799 0.0294 -0.0608 -0.0501 85 GLU B OE2 8201 N N . ASP D 86 ? 0.3569 0.5071 0.3684 0.0230 -0.0555 -0.0514 86 ASP B N 8202 C CA . ASP D 86 ? 0.3679 0.5304 0.3791 0.0233 -0.0547 -0.0517 86 ASP B CA 8203 C C . ASP D 86 ? 0.3190 0.4798 0.3346 0.0198 -0.0557 -0.0515 86 ASP B C 8204 O O . ASP D 86 ? 0.3108 0.4765 0.3261 0.0217 -0.0548 -0.0531 86 ASP B O 8205 C CB . ASP D 86 ? 0.3788 0.5547 0.3896 0.0200 -0.0553 -0.0488 86 ASP B CB 8206 C CG . ASP D 86 ? 0.4378 0.6170 0.4430 0.0253 -0.0545 -0.0498 86 ASP B CG 8207 O OD1 . ASP D 86 ? 0.4770 0.6472 0.4773 0.0315 -0.0541 -0.0528 86 ASP B OD1 8208 O OD2 . ASP D 86 ? 0.4809 0.6708 0.4856 0.0230 -0.0550 -0.0473 86 ASP B OD2 8209 N N . GLY D 87 ? 0.3304 0.4834 0.3493 0.0151 -0.0582 -0.0498 87 GLY B N 8210 C CA . GLY D 87 ? 0.3518 0.4998 0.3732 0.0126 -0.0605 -0.0501 87 GLY B CA 8211 C C . GLY D 87 ? 0.3524 0.4968 0.3739 0.0178 -0.0586 -0.0536 87 GLY B C 8212 O O . GLY D 87 ? 0.3610 0.5086 0.3828 0.0177 -0.0589 -0.0545 87 GLY B O 8213 N N . PHE D 88 ? 0.3266 0.4654 0.3475 0.0216 -0.0570 -0.0549 88 PHE B N 8214 C CA . PHE D 88 ? 0.3493 0.4856 0.3704 0.0257 -0.0555 -0.0575 88 PHE B CA 8215 C C . PHE D 88 ? 0.3342 0.4762 0.3521 0.0290 -0.0534 -0.0590 88 PHE B C 8216 O O . PHE D 88 ? 0.3812 0.5241 0.3994 0.0310 -0.0527 -0.0609 88 PHE B O 8217 C CB . PHE D 88 ? 0.3588 0.4892 0.3799 0.0276 -0.0550 -0.0574 88 PHE B CB 8218 C CG . PHE D 88 ? 0.3217 0.4476 0.3460 0.0265 -0.0571 -0.0570 88 PHE B CG 8219 C CD1 . PHE D 88 ? 0.3580 0.4827 0.3841 0.0279 -0.0585 -0.0589 88 PHE B CD1 8220 C CD2 . PHE D 88 ? 0.2990 0.4218 0.3238 0.0249 -0.0580 -0.0551 88 PHE B CD2 8221 C CE1 . PHE D 88 ? 0.3391 0.4594 0.3669 0.0286 -0.0611 -0.0593 88 PHE B CE1 8222 C CE2 . PHE D 88 ? 0.3078 0.4269 0.3351 0.0249 -0.0602 -0.0551 88 PHE B CE2 8223 C CZ . PHE D 88 ? 0.3304 0.4482 0.3588 0.0273 -0.0619 -0.0574 88 PHE B CZ 8224 N N . LEU D 89 ? 0.3564 0.5022 0.3706 0.0303 -0.0527 -0.0586 89 LEU B N 8225 C CA . LEU D 89 ? 0.3877 0.5398 0.3979 0.0346 -0.0513 -0.0605 89 LEU B CA 8226 C C . LEU D 89 ? 0.3732 0.5348 0.3859 0.0328 -0.0511 -0.0605 89 LEU B C 8227 O O . LEU D 89 ? 0.3281 0.4923 0.3395 0.0359 -0.0501 -0.0626 89 LEU B O 8228 C CB . LEU D 89 ? 0.4350 0.5908 0.4397 0.0376 -0.0513 -0.0605 89 LEU B CB 8229 C CG . LEU D 89 ? 0.4679 0.6304 0.4669 0.0439 -0.0505 -0.0632 89 LEU B CG 8230 C CD1 . LEU D 89 ? 0.4980 0.6525 0.4885 0.0498 -0.0519 -0.0649 89 LEU B CD1 8231 C CD2 . LEU D 89 ? 0.5112 0.6902 0.5106 0.0436 -0.0500 -0.0623 89 LEU B CD2 8232 N N . ASP D 90 ? 0.3928 0.5591 0.4083 0.0271 -0.0528 -0.0578 90 ASP B N 8233 C CA . ASP D 90 ? 0.4008 0.5761 0.4179 0.0237 -0.0538 -0.0567 90 ASP B CA 8234 C C . ASP D 90 ? 0.3971 0.5647 0.4164 0.0234 -0.0548 -0.0584 90 ASP B C 8235 O O . ASP D 90 ? 0.4093 0.5819 0.4283 0.0247 -0.0540 -0.0597 90 ASP B O 8236 C CB . ASP D 90 ? 0.4361 0.6170 0.4548 0.0160 -0.0567 -0.0524 90 ASP B CB 8237 C CG . ASP D 90 ? 0.4876 0.6818 0.5041 0.0165 -0.0554 -0.0505 90 ASP B CG 8238 O OD1 . ASP D 90 ? 0.5034 0.7035 0.5164 0.0234 -0.0528 -0.0531 90 ASP B OD1 8239 O OD2 . ASP D 90 ? 0.4671 0.6655 0.4846 0.0102 -0.0577 -0.0466 90 ASP B OD2 8240 N N . VAL D 91 ? 0.3947 0.5507 0.4157 0.0226 -0.0564 -0.0587 91 VAL B N 8241 C CA . VAL D 91 ? 0.3802 0.5291 0.4024 0.0242 -0.0574 -0.0610 91 VAL B CA 8242 C C . VAL D 91 ? 0.3937 0.5442 0.4149 0.0300 -0.0541 -0.0639 91 VAL B C 8243 O O . VAL D 91 ? 0.4185 0.5708 0.4398 0.0309 -0.0541 -0.0655 91 VAL B O 8244 C CB . VAL D 91 ? 0.3634 0.5020 0.3870 0.0245 -0.0595 -0.0614 91 VAL B CB 8245 C CG1 . VAL D 91 ? 0.3523 0.4861 0.3764 0.0284 -0.0600 -0.0644 91 VAL B CG1 8246 C CG2 . VAL D 91 ? 0.3487 0.4833 0.3722 0.0187 -0.0642 -0.0588 91 VAL B CG2 8247 N N . TRP D 92 ? 0.3756 0.5244 0.3950 0.0334 -0.0519 -0.0644 92 TRP B N 8248 C CA . TRP D 92 ? 0.3939 0.5422 0.4115 0.0378 -0.0499 -0.0666 92 TRP B CA 8249 C C . TRP D 92 ? 0.4042 0.5596 0.4188 0.0402 -0.0487 -0.0677 92 TRP B C 8250 O O . TRP D 92 ? 0.4468 0.6030 0.4610 0.0426 -0.0478 -0.0696 92 TRP B O 8251 C CB . TRP D 92 ? 0.3774 0.5206 0.3924 0.0395 -0.0494 -0.0660 92 TRP B CB 8252 C CG . TRP D 92 ? 0.3810 0.5197 0.3989 0.0383 -0.0502 -0.0651 92 TRP B CG 8253 C CD1 . TRP D 92 ? 0.3891 0.5245 0.4074 0.0365 -0.0510 -0.0631 92 TRP B CD1 8254 C CD2 . TRP D 92 ? 0.3754 0.5141 0.3959 0.0397 -0.0501 -0.0662 92 TRP B CD2 8255 N NE1 . TRP D 92 ? 0.3972 0.5313 0.4183 0.0366 -0.0515 -0.0628 92 TRP B NE1 8256 C CE2 . TRP D 92 ? 0.3974 0.5340 0.4198 0.0390 -0.0510 -0.0648 92 TRP B CE2 8257 C CE3 . TRP D 92 ? 0.4051 0.5465 0.4263 0.0419 -0.0495 -0.0683 92 TRP B CE3 8258 C CZ2 . TRP D 92 ? 0.4239 0.5629 0.4487 0.0411 -0.0512 -0.0656 92 TRP B CZ2 8259 C CZ3 . TRP D 92 ? 0.4380 0.5806 0.4615 0.0439 -0.0498 -0.0692 92 TRP B CZ3 8260 C CH2 . TRP D 92 ? 0.4339 0.5761 0.4591 0.0438 -0.0505 -0.0679 92 TRP B CH2 8261 N N . THR D 93 ? 0.4183 0.5804 0.4310 0.0398 -0.0486 -0.0667 93 THR B N 8262 C CA . THR D 93 ? 0.4323 0.6042 0.4421 0.0429 -0.0476 -0.0679 93 THR B CA 8263 C C . THR D 93 ? 0.4237 0.6015 0.4366 0.0404 -0.0478 -0.0679 93 THR B C 8264 O O . THR D 93 ? 0.3864 0.5661 0.3981 0.0437 -0.0468 -0.0700 93 THR B O 8265 C CB . THR D 93 ? 0.4499 0.6319 0.4572 0.0435 -0.0476 -0.0667 93 THR B CB 8266 O OG1 . THR D 93 ? 0.4000 0.5749 0.4029 0.0467 -0.0479 -0.0672 93 THR B OG1 8267 C CG2 . THR D 93 ? 0.4719 0.6661 0.4758 0.0483 -0.0465 -0.0684 93 THR B CG2 8268 N N . TYR D 94 ? 0.4147 0.5940 0.4311 0.0341 -0.0500 -0.0654 94 TYR B N 8269 C CA . TYR D 94 ? 0.4684 0.6511 0.4866 0.0304 -0.0518 -0.0648 94 TYR B CA 8270 C C . TYR D 94 ? 0.4754 0.6493 0.4945 0.0330 -0.0517 -0.0677 94 TYR B C 8271 O O . TYR D 94 ? 0.3920 0.5699 0.4108 0.0341 -0.0513 -0.0690 94 TYR B O 8272 C CB . TYR D 94 ? 0.5098 0.6912 0.5297 0.0224 -0.0559 -0.0612 94 TYR B CB 8273 C CG . TYR D 94 ? 0.5048 0.6916 0.5249 0.0167 -0.0591 -0.0591 94 TYR B CG 8274 C CD1 . TYR D 94 ? 0.4818 0.6854 0.5015 0.0149 -0.0583 -0.0570 94 TYR B CD1 8275 C CD2 . TYR D 94 ? 0.5495 0.7244 0.5696 0.0134 -0.0637 -0.0593 94 TYR B CD2 8276 C CE1 . TYR D 94 ? 0.5283 0.7373 0.5479 0.0085 -0.0618 -0.0543 94 TYR B CE1 8277 C CE2 . TYR D 94 ? 0.5063 0.6837 0.5252 0.0074 -0.0679 -0.0570 94 TYR B CE2 8278 C CZ . TYR D 94 ? 0.5157 0.7105 0.5347 0.0042 -0.0669 -0.0541 94 TYR B CZ 8279 O OH . TYR D 94 ? 0.5010 0.6996 0.5187 -0.0029 -0.0715 -0.0510 94 TYR B OH 8280 N N . ASN D 95 ? 0.5108 0.6741 0.5307 0.0341 -0.0522 -0.0687 95 ASN B N 8281 C CA . ASN D 95 ? 0.5928 0.7502 0.6135 0.0371 -0.0522 -0.0713 95 ASN B CA 8282 C C . ASN D 95 ? 0.5571 0.7174 0.5761 0.0420 -0.0490 -0.0733 95 ASN B C 8283 O O . ASN D 95 ? 0.5203 0.6814 0.5394 0.0436 -0.0489 -0.0752 95 ASN B O 8284 C CB . ASN D 95 ? 0.5980 0.7470 0.6199 0.0380 -0.0533 -0.0717 95 ASN B CB 8285 C CG . ASN D 95 ? 0.7115 0.8547 0.7340 0.0340 -0.0579 -0.0705 95 ASN B CG 8286 O OD1 . ASN D 95 ? 0.7162 0.8604 0.7378 0.0294 -0.0609 -0.0690 95 ASN B OD1 8287 N ND2 . ASN D 95 ? 0.8643 1.0013 0.8875 0.0353 -0.0591 -0.0709 95 ASN B ND2 8288 N N . ALA D 96 ? 0.4329 0.5939 0.4494 0.0442 -0.0473 -0.0730 96 ALA B N 8289 C CA . ALA D 96 ? 0.4519 0.6132 0.4651 0.0486 -0.0456 -0.0746 96 ALA B CA 8290 C C . ALA D 96 ? 0.4469 0.6163 0.4586 0.0501 -0.0450 -0.0757 96 ALA B C 8291 O O . ALA D 96 ? 0.4677 0.6373 0.4787 0.0524 -0.0443 -0.0775 96 ALA B O 8292 C CB . ALA D 96 ? 0.4625 0.6201 0.4710 0.0506 -0.0455 -0.0739 96 ALA B CB 8293 N N . GLU D 97 ? 0.4251 0.6028 0.4365 0.0487 -0.0452 -0.0745 97 GLU B N 8294 C CA . GLU D 97 ? 0.4684 0.6573 0.4783 0.0505 -0.0446 -0.0752 97 GLU B CA 8295 C C . GLU D 97 ? 0.4811 0.6720 0.4942 0.0474 -0.0453 -0.0753 97 GLU B C 8296 O O . GLU D 97 ? 0.5099 0.7044 0.5218 0.0504 -0.0444 -0.0771 97 GLU B O 8297 C CB . GLU D 97 ? 0.5018 0.7026 0.5112 0.0489 -0.0449 -0.0730 97 GLU B CB 8298 C CG . GLU D 97 ? 0.5570 0.7574 0.5615 0.0536 -0.0445 -0.0736 97 GLU B CG 8299 C CD . GLU D 97 ? 0.5885 0.7944 0.5865 0.0619 -0.0438 -0.0765 97 GLU B CD 8300 O OE1 . GLU D 97 ? 0.6179 0.8310 0.6156 0.0639 -0.0432 -0.0778 97 GLU B OE1 8301 O OE2 . GLU D 97 ? 0.6352 0.8369 0.6271 0.0670 -0.0446 -0.0778 97 GLU B OE2 8302 N N . LEU D 98 ? 0.4815 0.6683 0.4978 0.0419 -0.0477 -0.0736 98 LEU B N 8303 C CA . LEU D 98 ? 0.5094 0.6953 0.5272 0.0389 -0.0498 -0.0738 98 LEU B CA 8304 C C . LEU D 98 ? 0.5372 0.7152 0.5551 0.0429 -0.0490 -0.0770 98 LEU B C 8305 O O . LEU D 98 ? 0.5538 0.7337 0.5716 0.0432 -0.0494 -0.0782 98 LEU B O 8306 C CB . LEU D 98 ? 0.5166 0.6974 0.5357 0.0323 -0.0541 -0.0713 98 LEU B CB 8307 C CG . LEU D 98 ? 0.5938 0.7850 0.6128 0.0257 -0.0562 -0.0670 98 LEU B CG 8308 C CD1 . LEU D 98 ? 0.6528 0.8359 0.6715 0.0186 -0.0623 -0.0648 98 LEU B CD1 8309 C CD2 . LEU D 98 ? 0.6730 0.8798 0.6915 0.0261 -0.0546 -0.0664 98 LEU B CD2 8310 N N . LEU D 99 ? 0.4975 0.6680 0.5156 0.0454 -0.0482 -0.0779 99 LEU B N 8311 C CA . LEU D 99 ? 0.4863 0.6527 0.5043 0.0492 -0.0471 -0.0803 99 LEU B CA 8312 C C . LEU D 99 ? 0.4922 0.6633 0.5079 0.0528 -0.0447 -0.0817 99 LEU B C 8313 O O . LEU D 99 ? 0.4781 0.6494 0.4939 0.0545 -0.0445 -0.0835 99 LEU B O 8314 C CB . LEU D 99 ? 0.4876 0.6490 0.5060 0.0505 -0.0465 -0.0799 99 LEU B CB 8315 C CG . LEU D 99 ? 0.5580 0.7187 0.5759 0.0539 -0.0450 -0.0812 99 LEU B CG 8316 C CD1 . LEU D 99 ? 0.5760 0.7356 0.5957 0.0552 -0.0465 -0.0833 99 LEU B CD1 8317 C CD2 . LEU D 99 ? 0.5924 0.7506 0.6098 0.0540 -0.0445 -0.0794 99 LEU B CD2 8318 N N . VAL D 100 ? 0.5126 0.6866 0.5255 0.0545 -0.0435 -0.0811 100 VAL B N 8319 C CA . VAL D 100 ? 0.5146 0.6912 0.5237 0.0587 -0.0423 -0.0826 100 VAL B CA 8320 C C . VAL D 100 ? 0.5196 0.7047 0.5296 0.0584 -0.0422 -0.0834 100 VAL B C 8321 O O . VAL D 100 ? 0.4907 0.6766 0.4997 0.0607 -0.0415 -0.0851 100 VAL B O 8322 C CB . VAL D 100 ? 0.5217 0.6981 0.5257 0.0617 -0.0423 -0.0823 100 VAL B CB 8323 C CG1 . VAL D 100 ? 0.5549 0.7354 0.5537 0.0669 -0.0421 -0.0843 100 VAL B CG1 8324 C CG2 . VAL D 100 ? 0.5281 0.6947 0.5298 0.0619 -0.0430 -0.0814 100 VAL B CG2 8325 N N . LEU D 101 ? 0.4824 0.6749 0.4940 0.0550 -0.0431 -0.0816 101 LEU B N 8326 C CA . LEU D 101 ? 0.5039 0.7061 0.5165 0.0529 -0.0437 -0.0812 101 LEU B CA 8327 C C . LEU D 101 ? 0.5143 0.7110 0.5288 0.0510 -0.0451 -0.0823 101 LEU B C 8328 O O . LEU D 101 ? 0.5802 0.7814 0.5942 0.0522 -0.0447 -0.0835 101 LEU B O 8329 C CB . LEU D 101 ? 0.4769 0.6876 0.4911 0.0471 -0.0455 -0.0777 101 LEU B CB 8330 C CG . LEU D 101 ? 0.4518 0.6788 0.4643 0.0482 -0.0446 -0.0763 101 LEU B CG 8331 C CD1 . LEU D 101 ? 0.4918 0.7199 0.4997 0.0568 -0.0423 -0.0790 101 LEU B CD1 8332 C CD2 . LEU D 101 ? 0.4174 0.6500 0.4317 0.0418 -0.0465 -0.0722 101 LEU B CD2 8333 N N . MET D 102 ? 0.5093 0.6964 0.5254 0.0487 -0.0470 -0.0823 102 MET B N 8334 C CA . MET D 102 ? 0.5303 0.7116 0.5470 0.0478 -0.0495 -0.0837 102 MET B CA 8335 C C . MET D 102 ? 0.5475 0.7263 0.5636 0.0531 -0.0473 -0.0868 102 MET B C 8336 O O . MET D 102 ? 0.5885 0.7676 0.6042 0.0540 -0.0480 -0.0884 102 MET B O 8337 C CB . MET D 102 ? 0.5943 0.7656 0.6114 0.0455 -0.0529 -0.0834 102 MET B CB 8338 C CG . MET D 102 ? 0.6729 0.8440 0.6898 0.0386 -0.0570 -0.0801 102 MET B CG 8339 S SD . MET D 102 ? 0.8367 0.9941 0.8531 0.0379 -0.0611 -0.0803 102 MET B SD 8340 C CE . MET D 102 ? 0.8985 1.0552 0.9133 0.0283 -0.0671 -0.0756 102 MET B CE 8341 N N . GLU D 103 ? 0.5366 0.7129 0.5524 0.0562 -0.0450 -0.0871 103 GLU B N 8342 C CA . GLU D 103 ? 0.5678 0.7432 0.5828 0.0601 -0.0433 -0.0889 103 GLU B CA 8343 C C . GLU D 103 ? 0.5841 0.7644 0.5967 0.0624 -0.0416 -0.0896 103 GLU B C 8344 O O . GLU D 103 ? 0.6255 0.8064 0.6376 0.0646 -0.0410 -0.0912 103 GLU B O 8345 C CB . GLU D 103 ? 0.5868 0.7588 0.6019 0.0612 -0.0425 -0.0881 103 GLU B CB 8346 C CG . GLU D 103 ? 0.6705 0.8388 0.6878 0.0609 -0.0443 -0.0886 103 GLU B CG 8347 C CD . GLU D 103 ? 0.7362 0.9045 0.7537 0.0637 -0.0454 -0.0914 103 GLU B CD 8348 O OE1 . GLU D 103 ? 0.6926 0.8648 0.7094 0.0661 -0.0437 -0.0923 103 GLU B OE1 8349 O OE2 . GLU D 103 ? 0.7721 0.9359 0.7896 0.0640 -0.0487 -0.0928 103 GLU B OE2 8350 N N . ASN D 104 ? 0.5198 0.7044 0.5306 0.0626 -0.0411 -0.0886 104 ASN B N 8351 C CA . ASN D 104 ? 0.5024 0.6924 0.5103 0.0656 -0.0402 -0.0898 104 ASN B CA 8352 C C . ASN D 104 ? 0.5258 0.7209 0.5356 0.0642 -0.0407 -0.0906 104 ASN B C 8353 O O . ASN D 104 ? 0.4499 0.6464 0.4583 0.0669 -0.0399 -0.0922 104 ASN B O 8354 C CB . ASN D 104 ? 0.4728 0.6683 0.4776 0.0676 -0.0400 -0.0891 104 ASN B CB 8355 C CG . ASN D 104 ? 0.4913 0.6796 0.4915 0.0706 -0.0402 -0.0890 104 ASN B CG 8356 O OD1 . ASN D 104 ? 0.5155 0.6959 0.5150 0.0704 -0.0404 -0.0889 104 ASN B OD1 8357 N ND2 . ASN D 104 ? 0.4757 0.6669 0.4721 0.0732 -0.0407 -0.0889 104 ASN B ND2 8358 N N . GLU D 105 ? 0.5426 0.7402 0.5549 0.0594 -0.0427 -0.0891 105 GLU B N 8359 C CA . GLU D 105 ? 0.5535 0.7543 0.5666 0.0569 -0.0445 -0.0893 105 GLU B CA 8360 C C . GLU D 105 ? 0.5848 0.7786 0.5979 0.0594 -0.0446 -0.0921 105 GLU B C 8361 O O . GLU D 105 ? 0.5934 0.7901 0.6057 0.0608 -0.0442 -0.0934 105 GLU B O 8362 C CB . GLU D 105 ? 0.6357 0.8355 0.6501 0.0502 -0.0483 -0.0868 105 GLU B CB 8363 C CG . GLU D 105 ? 0.7092 0.9129 0.7232 0.0459 -0.0514 -0.0858 105 GLU B CG 8364 C CD . GLU D 105 ? 0.8711 1.0672 0.8844 0.0391 -0.0573 -0.0837 105 GLU B CD 8365 O OE1 . GLU D 105 ? 0.9601 1.1622 0.9736 0.0328 -0.0595 -0.0795 105 GLU B OE1 8366 O OE2 . GLU D 105 ? 0.9011 1.0853 0.9128 0.0400 -0.0604 -0.0860 105 GLU B OE2 8367 N N . ARG D 106 ? 0.5209 0.7068 0.5346 0.0604 -0.0450 -0.0928 106 ARG B N 8368 C CA . ARG D 106 ? 0.5736 0.7552 0.5872 0.0632 -0.0455 -0.0954 106 ARG B CA 8369 C C . ARG D 106 ? 0.6040 0.7884 0.6165 0.0673 -0.0424 -0.0966 106 ARG B C 8370 O O . ARG D 106 ? 0.5632 0.7482 0.5752 0.0695 -0.0425 -0.0986 106 ARG B O 8371 C CB . ARG D 106 ? 0.6007 0.7760 0.6150 0.0640 -0.0469 -0.0959 106 ARG B CB 8372 C CG . ARG D 106 ? 0.7252 0.8948 0.7392 0.0600 -0.0512 -0.0949 106 ARG B CG 8373 C CD . ARG D 106 ? 0.9125 1.0743 0.9253 0.0628 -0.0545 -0.0973 106 ARG B CD 8374 N NE . ARG D 106 ? 1.1218 1.2802 1.1319 0.0653 -0.0574 -0.1004 106 ARG B NE 8375 C CZ . ARG D 106 ? 1.2444 1.3976 1.2524 0.0705 -0.0602 -0.1038 106 ARG B CZ 8376 N NH1 . ARG D 106 ? 1.4615 1.6138 1.4703 0.0734 -0.0599 -0.1041 106 ARG B NH1 8377 N NH2 . ARG D 106 ? 1.1649 1.3145 1.1693 0.0736 -0.0634 -0.1070 106 ARG B NH2 8378 N N . THR D 107 ? 0.6032 0.7885 0.6145 0.0681 -0.0405 -0.0951 107 THR B N 8379 C CA . THR D 107 ? 0.5592 0.7455 0.5681 0.0709 -0.0388 -0.0954 107 THR B CA 8380 C C . THR D 107 ? 0.5636 0.7542 0.5710 0.0723 -0.0385 -0.0967 107 THR B C 8381 O O . THR D 107 ? 0.6607 0.8522 0.6673 0.0741 -0.0379 -0.0979 107 THR B O 8382 C CB . THR D 107 ? 0.5518 0.7354 0.5578 0.0711 -0.0385 -0.0934 107 THR B CB 8383 O OG1 . THR D 107 ? 0.5457 0.7263 0.5534 0.0696 -0.0388 -0.0920 107 THR B OG1 8384 C CG2 . THR D 107 ? 0.5210 0.7034 0.5223 0.0733 -0.0384 -0.0932 107 THR B CG2 8385 N N . LEU D 108 ? 0.5976 0.7923 0.6047 0.0714 -0.0388 -0.0963 108 LEU B N 8386 C CA . LEU D 108 ? 0.6516 0.8528 0.6575 0.0728 -0.0385 -0.0973 108 LEU B CA 8387 C C . LEU D 108 ? 0.6649 0.8668 0.6729 0.0711 -0.0396 -0.0986 108 LEU B C 8388 O O . LEU D 108 ? 0.6198 0.8240 0.6266 0.0732 -0.0390 -0.1000 108 LEU B O 8389 C CB . LEU D 108 ? 0.6355 0.8448 0.6409 0.0722 -0.0387 -0.0961 108 LEU B CB 8390 C CG . LEU D 108 ? 0.7442 0.9532 0.7457 0.0757 -0.0382 -0.0957 108 LEU B CG 8391 C CD1 . LEU D 108 ? 0.7513 0.9728 0.7516 0.0771 -0.0382 -0.0952 108 LEU B CD1 8392 C CD2 . LEU D 108 ? 0.7313 0.9336 0.7276 0.0803 -0.0382 -0.0970 108 LEU B CD2 8393 N N . ASP D 109 ? 0.6318 0.8303 0.6419 0.0677 -0.0419 -0.0982 109 ASP B N 8394 C CA . ASP D 109 ? 0.6307 0.8265 0.6409 0.0668 -0.0443 -0.0998 109 ASP B CA 8395 C C . ASP D 109 ? 0.6493 0.8420 0.6589 0.0712 -0.0432 -0.1024 109 ASP B C 8396 O O . ASP D 109 ? 0.5837 0.7767 0.5924 0.0726 -0.0440 -0.1043 109 ASP B O 8397 C CB . ASP D 109 ? 0.6322 0.8218 0.6426 0.0626 -0.0485 -0.0989 109 ASP B CB 8398 C CG . ASP D 109 ? 0.7006 0.8958 0.7114 0.0566 -0.0506 -0.0956 109 ASP B CG 8399 O OD1 . ASP D 109 ? 0.6826 0.8874 0.6933 0.0558 -0.0495 -0.0946 109 ASP B OD1 8400 O OD2 . ASP D 109 ? 0.7667 0.9574 0.7775 0.0524 -0.0538 -0.0937 109 ASP B OD2 8401 N N . PHE D 110 ? 0.6197 0.8108 0.6297 0.0731 -0.0415 -0.1019 110 PHE B N 8402 C CA . PHE D 110 ? 0.5940 0.7858 0.6036 0.0765 -0.0403 -0.1033 110 PHE B CA 8403 C C . PHE D 110 ? 0.6532 0.8491 0.6610 0.0781 -0.0385 -0.1035 110 PHE B C 8404 O O . PHE D 110 ? 0.6567 0.8550 0.6640 0.0804 -0.0382 -0.1052 110 PHE B O 8405 C CB . PHE D 110 ? 0.5453 0.7363 0.5555 0.0765 -0.0393 -0.1015 110 PHE B CB 8406 C CG . PHE D 110 ? 0.4819 0.6773 0.4918 0.0789 -0.0381 -0.1015 110 PHE B CG 8407 C CD1 . PHE D 110 ? 0.5050 0.7033 0.5154 0.0824 -0.0389 -0.1041 110 PHE B CD1 8408 C CD2 . PHE D 110 ? 0.4961 0.6931 0.5044 0.0777 -0.0367 -0.0985 110 PHE B CD2 8409 C CE1 . PHE D 110 ? 0.4978 0.7042 0.5082 0.0846 -0.0375 -0.1035 110 PHE B CE1 8410 C CE2 . PHE D 110 ? 0.5276 0.7309 0.5355 0.0783 -0.0361 -0.0972 110 PHE B CE2 8411 C CZ . PHE D 110 ? 0.4958 0.7055 0.5053 0.0818 -0.0360 -0.0995 110 PHE B CZ 8412 N N . HIS D 111 ? 0.6624 0.8593 0.6685 0.0775 -0.0375 -0.1020 111 HIS B N 8413 C CA . HIS D 111 ? 0.6888 0.8880 0.6920 0.0795 -0.0366 -0.1023 111 HIS B CA 8414 C C . HIS D 111 ? 0.7016 0.9043 0.7054 0.0800 -0.0370 -0.1043 111 HIS B C 8415 O O . HIS D 111 ? 0.7127 0.9169 0.7157 0.0817 -0.0365 -0.1055 111 HIS B O 8416 C CB . HIS D 111 ? 0.5936 0.7916 0.5932 0.0802 -0.0366 -0.1009 111 HIS B CB 8417 C CG . HIS D 111 ? 0.6428 0.8357 0.6397 0.0798 -0.0371 -0.0988 111 HIS B CG 8418 N ND1 . HIS D 111 ? 0.7000 0.8893 0.6949 0.0796 -0.0378 -0.0975 111 HIS B ND1 8419 C CD2 . HIS D 111 ? 0.6407 0.8323 0.6366 0.0790 -0.0372 -0.0973 111 HIS B CD2 8420 C CE1 . HIS D 111 ? 0.6864 0.8706 0.6786 0.0784 -0.0388 -0.0952 111 HIS B CE1 8421 N NE2 . HIS D 111 ? 0.7029 0.8892 0.6957 0.0776 -0.0385 -0.0947 111 HIS B NE2 8422 N N . ASP D 112 ? 0.7182 0.9228 0.7232 0.0780 -0.0380 -0.1042 112 ASP B N 8423 C CA . ASP D 112 ? 0.8086 1.0161 0.8142 0.0768 -0.0394 -0.1054 112 ASP B CA 8424 C C . ASP D 112 ? 0.7820 0.9861 0.7875 0.0782 -0.0406 -0.1077 112 ASP B C 8425 O O . ASP D 112 ? 0.7573 0.9637 0.7617 0.0797 -0.0403 -0.1092 112 ASP B O 8426 C CB . ASP D 112 ? 0.8779 1.0857 0.8849 0.0723 -0.0419 -0.1038 112 ASP B CB 8427 C CG . ASP D 112 ? 0.8880 1.1042 0.8949 0.0701 -0.0427 -0.1027 112 ASP B CG 8428 O OD1 . ASP D 112 ? 1.0465 1.2693 1.0523 0.0726 -0.0405 -0.1022 112 ASP B OD1 8429 O OD2 . ASP D 112 ? 0.9349 1.1509 0.9419 0.0659 -0.0459 -0.1021 112 ASP B OD2 8430 N N . SER D 113 ? 0.7127 0.9117 0.7190 0.0782 -0.0420 -0.1083 113 SER B N 8431 C CA . SER D 113 ? 0.6798 0.8756 0.6850 0.0808 -0.0440 -0.1112 113 SER B CA 8432 C C . SER D 113 ? 0.6952 0.8961 0.7000 0.0848 -0.0413 -0.1123 113 SER B C 8433 O O . SER D 113 ? 0.6966 0.8985 0.6999 0.0875 -0.0422 -0.1148 113 SER B O 8434 C CB . SER D 113 ? 0.6866 0.8764 0.6918 0.0812 -0.0465 -0.1118 113 SER B CB 8435 O OG . SER D 113 ? 0.7487 0.9375 0.7523 0.0864 -0.0478 -0.1150 113 SER B OG 8436 N N . ASN D 114 ? 0.6256 0.8294 0.6309 0.0847 -0.0386 -0.1100 114 ASN B N 8437 C CA . ASN D 114 ? 0.6974 0.9065 0.7016 0.0868 -0.0367 -0.1096 114 ASN B CA 8438 C C . ASN D 114 ? 0.6892 0.9007 0.6916 0.0873 -0.0360 -0.1101 114 ASN B C 8439 O O . ASN D 114 ? 0.7580 0.9739 0.7595 0.0894 -0.0355 -0.1113 114 ASN B O 8440 C CB . ASN D 114 ? 0.6667 0.8764 0.6704 0.0850 -0.0354 -0.1060 114 ASN B CB 8441 C CG . ASN D 114 ? 0.7562 0.9664 0.7617 0.0850 -0.0356 -0.1052 114 ASN B CG 8442 O OD1 . ASN D 114 ? 0.5592 0.7706 0.5659 0.0878 -0.0366 -0.1077 114 ASN B OD1 8443 N ND2 . ASN D 114 ? 0.8069 1.0155 0.8119 0.0825 -0.0353 -0.1019 114 ASN B ND2 8444 N N . VAL D 115 ? 0.7622 0.9722 0.7639 0.0857 -0.0361 -0.1094 115 VAL B N 8445 C CA . VAL D 115 ? 0.8069 1.0194 0.8066 0.0866 -0.0357 -0.1099 115 VAL B CA 8446 C C . VAL D 115 ? 0.8037 1.0175 0.8042 0.0872 -0.0369 -0.1126 115 VAL B C 8447 O O . VAL D 115 ? 0.7017 0.9183 0.7009 0.0889 -0.0364 -0.1137 115 VAL B O 8448 C CB . VAL D 115 ? 0.8871 1.0998 0.8857 0.0860 -0.0357 -0.1088 115 VAL B CB 8449 C CG1 . VAL D 115 ? 0.8510 1.0680 0.8480 0.0874 -0.0357 -0.1099 115 VAL B CG1 8450 C CG2 . VAL D 115 ? 0.9553 1.1647 0.9506 0.0866 -0.0355 -0.1067 115 VAL B CG2 8451 N N . LYS D 116 ? 0.7321 0.9429 0.7339 0.0854 -0.0391 -0.1133 116 LYS B N 8452 C CA . LYS D 116 ? 0.7882 0.9974 0.7890 0.0854 -0.0419 -0.1156 116 LYS B CA 8453 C C . LYS D 116 ? 0.8620 1.0702 0.8615 0.0896 -0.0426 -0.1186 116 LYS B C 8454 O O . LYS D 116 ? 0.8760 1.0832 0.8735 0.0911 -0.0446 -0.1211 116 LYS B O 8455 C CB . LYS D 116 ? 0.7944 0.9987 0.7954 0.0814 -0.0455 -0.1148 116 LYS B CB 8456 C CG . LYS D 116 ? 0.9502 1.1502 0.9488 0.0800 -0.0501 -0.1165 116 LYS B CG 8457 C CD . LYS D 116 ? 1.0866 1.2837 1.0847 0.0734 -0.0543 -0.1139 116 LYS B CD 8458 C CE . LYS D 116 ? 1.1353 1.3347 1.1316 0.0696 -0.0573 -0.1131 116 LYS B CE 8459 N NZ . LYS D 116 ? 1.1009 1.2917 1.0929 0.0719 -0.0616 -0.1166 116 LYS B NZ 8460 N N . ASN D 117 ? 0.7917 1.0013 0.7920 0.0918 -0.0411 -0.1184 117 ASN B N 8461 C CA . ASN D 117 ? 0.7547 0.9678 0.7536 0.0967 -0.0412 -0.1210 117 ASN B CA 8462 C C . ASN D 117 ? 0.7296 0.9509 0.7282 0.0977 -0.0383 -0.1201 117 ASN B C 8463 O O . ASN D 117 ? 0.6967 0.9224 0.6938 0.1016 -0.0386 -0.1227 117 ASN B O 8464 C CB . ASN D 117 ? 0.8043 1.0191 0.8043 0.0987 -0.0409 -0.1206 117 ASN B CB 8465 C CG . ASN D 117 ? 0.7975 1.0033 0.7966 0.0990 -0.0448 -0.1224 117 ASN B CG 8466 O OD1 . ASN D 117 ? 0.8541 1.0519 0.8507 0.0982 -0.0488 -0.1243 117 ASN B OD1 8467 N ND2 . ASN D 117 ? 0.7096 0.9163 0.7101 0.0996 -0.0443 -0.1213 117 ASN B ND2 8468 N N . LEU D 118 ? 0.6699 0.8928 0.6690 0.0947 -0.0361 -0.1167 118 LEU B N 8469 C CA . LEU D 118 ? 0.7401 0.9682 0.7375 0.0949 -0.0345 -0.1155 118 LEU B CA 8470 C C . LEU D 118 ? 0.6807 0.9086 0.6770 0.0960 -0.0352 -0.1180 118 LEU B C 8471 O O . LEU D 118 ? 0.6507 0.8835 0.6459 0.0985 -0.0350 -0.1196 118 LEU B O 8472 C CB . LEU D 118 ? 0.7916 1.0175 0.7875 0.0919 -0.0338 -0.1119 118 LEU B CB 8473 C CG . LEU D 118 ? 0.8919 1.1206 0.8863 0.0901 -0.0334 -0.1081 118 LEU B CG 8474 C CD1 . LEU D 118 ? 0.8979 1.1218 0.8879 0.0883 -0.0343 -0.1056 118 LEU B CD1 8475 C CD2 . LEU D 118 ? 0.9436 1.1822 0.9380 0.0913 -0.0327 -0.1079 118 LEU B CD2 8476 N N . TYR D 119 ? 0.6674 0.8910 0.6640 0.0940 -0.0362 -0.1180 119 TYR B N 8477 C CA . TYR D 119 ? 0.7137 0.9374 0.7095 0.0939 -0.0373 -0.1196 119 TYR B CA 8478 C C . TYR D 119 ? 0.7276 0.9504 0.7222 0.0965 -0.0394 -0.1231 119 TYR B C 8479 O O . TYR D 119 ? 0.8314 1.0566 0.8246 0.0978 -0.0396 -0.1246 119 TYR B O 8480 C CB . TYR D 119 ? 0.6642 0.8856 0.6611 0.0906 -0.0388 -0.1186 119 TYR B CB 8481 C CG . TYR D 119 ? 0.6183 0.8420 0.6145 0.0895 -0.0401 -0.1193 119 TYR B CG 8482 C CD1 . TYR D 119 ? 0.6444 0.8733 0.6398 0.0901 -0.0384 -0.1184 119 TYR B CD1 8483 C CD2 . TYR D 119 ? 0.6562 0.8763 0.6514 0.0879 -0.0437 -0.1209 119 TYR B CD2 8484 C CE1 . TYR D 119 ? 0.6913 0.9243 0.6862 0.0890 -0.0396 -0.1187 119 TYR B CE1 8485 C CE2 . TYR D 119 ? 0.7085 0.9314 0.7029 0.0859 -0.0454 -0.1209 119 TYR B CE2 8486 C CZ . TYR D 119 ? 0.6860 0.9165 0.6807 0.0865 -0.0429 -0.1197 119 TYR B CZ 8487 O OH . TYR D 119 ? 0.8400 1.0752 0.8342 0.0846 -0.0443 -0.1195 119 TYR B OH 8488 N N . ASP D 120 ? 0.7177 0.9364 0.7122 0.0978 -0.0416 -0.1247 120 ASP B N 8489 C CA . ASP D 120 ? 0.7519 0.9674 0.7433 0.1017 -0.0450 -0.1289 120 ASP B CA 8490 C C . ASP D 120 ? 0.7716 0.9953 0.7619 0.1071 -0.0432 -0.1308 120 ASP B C 8491 O O . ASP D 120 ? 0.7715 0.9956 0.7589 0.1103 -0.0448 -0.1338 120 ASP B O 8492 C CB . ASP D 120 ? 0.7767 0.9836 0.7666 0.1022 -0.0491 -0.1303 120 ASP B CB 8493 C CG . ASP D 120 ? 0.9244 1.1230 0.9137 0.0960 -0.0529 -0.1287 120 ASP B CG 8494 O OD1 . ASP D 120 ? 0.9853 1.1861 0.9749 0.0926 -0.0527 -0.1273 120 ASP B OD1 8495 O OD2 . ASP D 120 ? 0.9891 1.1805 0.9777 0.0941 -0.0561 -0.1282 120 ASP B OD2 8496 N N . LYS D 121 ? 0.7229 0.9542 0.7151 0.1076 -0.0399 -0.1285 121 LYS B N 8497 C CA . LYS D 121 ? 0.8073 1.0501 0.7988 0.1117 -0.0381 -0.1291 121 LYS B CA 8498 C C . LYS D 121 ? 0.8886 1.1364 0.8794 0.1102 -0.0363 -0.1278 121 LYS B C 8499 O O . LYS D 121 ? 0.9045 1.1608 0.8937 0.1138 -0.0358 -0.1294 121 LYS B O 8500 C CB . LYS D 121 ? 0.8738 1.1244 0.8671 0.1116 -0.0361 -0.1262 121 LYS B CB 8501 C CG . LYS D 121 ? 0.9722 1.2335 0.9664 0.1084 -0.0332 -0.1213 121 LYS B CG 8502 C CD . LYS D 121 ? 1.0326 1.3040 1.0281 0.1087 -0.0321 -0.1188 121 LYS B CD 8503 C CE . LYS D 121 ? 1.1241 1.3880 1.1212 0.1087 -0.0332 -0.1192 121 LYS B CE 8504 N NZ . LYS D 121 ? 1.1925 1.4538 1.1911 0.1023 -0.0322 -0.1138 121 LYS B NZ 8505 N N . VAL D 122 ? 0.8907 1.1338 0.8822 0.1055 -0.0356 -0.1252 122 VAL B N 8506 C CA . VAL D 122 ? 0.8275 1.0727 0.8177 0.1047 -0.0348 -0.1249 122 VAL B CA 8507 C C . VAL D 122 ? 0.7962 1.0375 0.7849 0.1065 -0.0372 -0.1287 122 VAL B C 8508 O O . VAL D 122 ? 0.8128 1.0588 0.7997 0.1095 -0.0372 -0.1308 122 VAL B O 8509 C CB . VAL D 122 ? 0.7396 0.9813 0.7298 0.1007 -0.0340 -0.1215 122 VAL B CB 8510 C CG1 . VAL D 122 ? 0.7240 0.9661 0.7125 0.1007 -0.0341 -0.1221 122 VAL B CG1 8511 C CG2 . VAL D 122 ? 0.7348 0.9795 0.7241 0.0987 -0.0328 -0.1174 122 VAL B CG2 8512 N N . ARG D 123 ? 0.6800 0.9134 0.6691 0.1043 -0.0395 -0.1293 123 ARG B N 8513 C CA . ARG D 123 ? 0.7337 0.9616 0.7203 0.1048 -0.0433 -0.1324 123 ARG B CA 8514 C C . ARG D 123 ? 0.7833 1.0119 0.7664 0.1109 -0.0453 -0.1368 123 ARG B C 8515 O O . ARG D 123 ? 0.8342 1.0623 0.8147 0.1123 -0.0470 -0.1391 123 ARG B O 8516 C CB . ARG D 123 ? 0.6889 0.9082 0.6756 0.1012 -0.0468 -0.1319 123 ARG B CB 8517 C CG . ARG D 123 ? 0.7587 0.9698 0.7416 0.1000 -0.0525 -0.1340 123 ARG B CG 8518 C CD . ARG D 123 ? 0.8993 1.1012 0.8814 0.0962 -0.0569 -0.1330 123 ARG B CD 8519 N NE . ARG D 123 ? 1.1256 1.3157 1.1014 0.0989 -0.0637 -0.1368 123 ARG B NE 8520 C CZ . ARG D 123 ? 1.2992 1.4858 1.2724 0.1054 -0.0651 -0.1402 123 ARG B CZ 8521 N NH1 . ARG D 123 ? 1.4290 1.6246 1.4062 0.1088 -0.0596 -0.1397 123 ARG B NH1 8522 N NH2 . ARG D 123 ? 1.3545 1.5286 1.3202 0.1088 -0.0726 -0.1442 123 ARG B NH2 8523 N N . LEU D 124 ? 0.8629 1.0939 0.8456 0.1150 -0.0452 -0.1381 124 LEU B N 8524 C CA . LEU D 124 ? 0.8658 1.1000 0.8445 0.1227 -0.0471 -0.1428 124 LEU B CA 8525 C C . LEU D 124 ? 0.8204 1.0678 0.7989 0.1258 -0.0440 -0.1429 124 LEU B C 8526 O O . LEU D 124 ? 0.7734 1.0223 0.7478 0.1317 -0.0462 -0.1472 124 LEU B O 8527 C CB . LEU D 124 ? 0.9707 1.2068 0.9492 0.1272 -0.0477 -0.1440 124 LEU B CB 8528 C CG . LEU D 124 ? 1.1017 1.3233 1.0772 0.1276 -0.0532 -0.1462 124 LEU B CG 8529 C CD1 . LEU D 124 ? 1.0838 1.3098 1.0575 0.1352 -0.0541 -0.1490 124 LEU B CD1 8530 C CD2 . LEU D 124 ? 1.0743 1.2823 1.0436 0.1282 -0.0598 -0.1499 124 LEU B CD2 8531 N N . GLN D 125 ? 0.7421 0.9986 0.7241 0.1220 -0.0395 -0.1382 125 GLN B N 8532 C CA . GLN D 125 ? 0.7529 1.0217 0.7345 0.1229 -0.0369 -0.1371 125 GLN B CA 8533 C C . GLN D 125 ? 0.7393 1.0045 0.7195 0.1214 -0.0375 -0.1379 125 GLN B C 8534 O O . GLN D 125 ? 0.7944 1.0672 0.7725 0.1248 -0.0372 -0.1396 125 GLN B O 8535 C CB . GLN D 125 ? 0.7830 1.0590 0.7673 0.1176 -0.0336 -0.1309 125 GLN B CB 8536 C CG . GLN D 125 ? 0.7830 1.0680 0.7688 0.1183 -0.0325 -0.1288 125 GLN B CG 8537 C CD . GLN D 125 ? 0.8292 1.1218 0.8158 0.1122 -0.0305 -0.1221 125 GLN B CD 8538 O OE1 . GLN D 125 ? 0.7793 1.0636 0.7666 0.1069 -0.0305 -0.1186 125 GLN B OE1 8539 N NE2 . GLN D 125 ? 0.7215 1.0296 0.7070 0.1128 -0.0294 -0.1202 125 GLN B NE2 8540 N N . LEU D 126 ? 0.6511 0.9068 0.6326 0.1165 -0.0381 -0.1363 126 LEU B N 8541 C CA . LEU D 126 ? 0.6508 0.9039 0.6314 0.1144 -0.0386 -0.1365 126 LEU B CA 8542 C C . LEU D 126 ? 0.7020 0.9483 0.6796 0.1163 -0.0426 -0.1406 126 LEU B C 8543 O O . LEU D 126 ? 0.7333 0.9818 0.7093 0.1170 -0.0428 -0.1417 126 LEU B O 8544 C CB . LEU D 126 ? 0.6358 0.8845 0.6187 0.1091 -0.0378 -0.1330 126 LEU B CB 8545 C CG . LEU D 126 ? 0.6229 0.8749 0.6069 0.1069 -0.0351 -0.1287 126 LEU B CG 8546 C CD1 . LEU D 126 ? 0.6579 0.9065 0.6420 0.1039 -0.0349 -0.1265 126 LEU B CD1 8547 C CD2 . LEU D 126 ? 0.6323 0.8930 0.6148 0.1078 -0.0336 -0.1273 126 LEU B CD2 8548 N N . ARG D 127 ? 0.8279 1.0650 0.8041 0.1165 -0.0464 -0.1425 127 ARG B N 8549 C CA . ARG D 127 ? 0.8738 1.1007 0.8455 0.1166 -0.0522 -0.1456 127 ARG B CA 8550 C C . ARG D 127 ? 0.8195 1.0469 0.7919 0.1118 -0.0522 -0.1437 127 ARG B C 8551 O O . ARG D 127 ? 0.8052 1.0347 0.7814 0.1067 -0.0501 -0.1399 127 ARG B O 8552 C CB . ARG D 127 ? 1.0476 1.2730 1.0134 0.1244 -0.0555 -0.1512 127 ARG B CB 8553 C CG . ARG D 127 ? 1.1307 1.3506 1.0929 0.1299 -0.0590 -0.1545 127 ARG B CG 8554 C CD . ARG D 127 ? 1.2918 1.5132 1.2475 0.1393 -0.0620 -0.1604 127 ARG B CD 8555 N NE . ARG D 127 ? 1.4114 1.6511 1.3700 0.1439 -0.0561 -0.1600 127 ARG B NE 8556 C CZ . ARG D 127 ? 1.4473 1.6964 1.4027 0.1505 -0.0557 -0.1632 127 ARG B CZ 8557 N NH1 . ARG D 127 ? 1.4606 1.7007 1.4092 0.1542 -0.0610 -0.1679 127 ARG B NH1 8558 N NH2 . ARG D 127 ? 1.3492 1.6172 1.3077 0.1529 -0.0505 -0.1614 127 ARG B NH2 8559 N N . ASP D 128 ? 0.7810 1.0077 0.7496 0.1140 -0.0544 -0.1465 128 ASP B N 8560 C CA . ASP D 128 ? 0.7415 0.9688 0.7103 0.1095 -0.0551 -0.1449 128 ASP B CA 8561 C C . ASP D 128 ? 0.7282 0.9664 0.7000 0.1098 -0.0498 -0.1430 128 ASP B C 8562 O O . ASP D 128 ? 0.7048 0.9452 0.6772 0.1066 -0.0498 -0.1414 128 ASP B O 8563 C CB . ASP D 128 ? 0.7992 1.0183 0.7617 0.1106 -0.0614 -0.1484 128 ASP B CB 8564 C CG . ASP D 128 ? 0.8438 1.0647 0.8020 0.1190 -0.0616 -0.1533 128 ASP B CG 8565 O OD1 . ASP D 128 ? 0.8486 1.0801 0.8094 0.1230 -0.0564 -0.1532 128 ASP B OD1 8566 O OD2 . ASP D 128 ? 0.9382 1.1502 0.8896 0.1214 -0.0676 -0.1570 128 ASP B OD2 8567 N N . ASN D 129 ? 0.6786 0.9238 0.6517 0.1132 -0.0458 -0.1427 129 ASN B N 8568 C CA . ASN D 129 ? 0.6962 0.9495 0.6711 0.1124 -0.0417 -0.1399 129 ASN B CA 8569 C C . ASN D 129 ? 0.6898 0.9428 0.6675 0.1082 -0.0402 -0.1361 129 ASN B C 8570 O O . ASN D 129 ? 0.6346 0.8915 0.6123 0.1078 -0.0382 -0.1341 129 ASN B O 8571 C CB . ASN D 129 ? 0.6844 0.9455 0.6594 0.1151 -0.0388 -0.1391 129 ASN B CB 8572 C CG . ASN D 129 ? 0.6772 0.9440 0.6491 0.1203 -0.0394 -0.1425 129 ASN B CG 8573 O OD1 . ASN D 129 ? 0.6963 0.9586 0.6653 0.1225 -0.0425 -0.1463 129 ASN B OD1 8574 N ND2 . ASN D 129 ? 0.6267 0.9040 0.5987 0.1219 -0.0369 -0.1411 129 ASN B ND2 8575 N N . ALA D 130 ? 0.7127 0.9609 0.6920 0.1057 -0.0416 -0.1353 130 ALA B N 8576 C CA . ALA D 130 ? 0.7360 0.9855 0.7175 0.1026 -0.0406 -0.1323 130 ALA B CA 8577 C C . ALA D 130 ? 0.7052 0.9515 0.6877 0.0986 -0.0436 -0.1316 130 ALA B C 8578 O O . ALA D 130 ? 0.6963 0.9363 0.6773 0.0978 -0.0471 -0.1333 130 ALA B O 8579 C CB . ALA D 130 ? 0.7497 0.9993 0.7322 0.1031 -0.0381 -0.1300 130 ALA B CB 8580 N N . LYS D 131 ? 0.6674 0.9185 0.6515 0.0964 -0.0428 -0.1290 131 LYS B N 8581 C CA . LYS D 131 ? 0.7505 1.0033 0.7359 0.0916 -0.0454 -0.1270 131 LYS B CA 8582 C C . LYS D 131 ? 0.7429 0.9960 0.7305 0.0905 -0.0442 -0.1249 131 LYS B C 8583 O O . LYS D 131 ? 0.7304 0.9877 0.7185 0.0930 -0.0414 -0.1238 131 LYS B O 8584 C CB . LYS D 131 ? 0.7687 1.0312 0.7543 0.0910 -0.0450 -0.1256 131 LYS B CB 8585 C CG . LYS D 131 ? 0.8499 1.1200 0.8370 0.0855 -0.0474 -0.1226 131 LYS B CG 8586 C CD . LYS D 131 ? 0.9113 1.1943 0.8987 0.0876 -0.0456 -0.1215 131 LYS B CD 8587 C CE . LYS D 131 ? 1.0246 1.3182 1.0128 0.0818 -0.0487 -0.1187 131 LYS B CE 8588 N NZ . LYS D 131 ? 1.0072 1.3136 0.9977 0.0794 -0.0485 -0.1151 131 LYS B NZ 8589 N N . GLU D 132 ? 0.8096 1.0571 0.7976 0.0869 -0.0471 -0.1243 132 GLU B N 8590 C CA . GLU D 132 ? 0.8740 1.1223 0.8642 0.0850 -0.0465 -0.1219 132 GLU B CA 8591 C C . GLU D 132 ? 0.8530 1.1130 0.8448 0.0823 -0.0462 -0.1188 132 GLU B C 8592 O O . GLU D 132 ? 0.7873 1.0512 0.7792 0.0767 -0.0496 -0.1166 132 GLU B O 8593 C CB . GLU D 132 ? 0.8697 1.1090 0.8591 0.0812 -0.0506 -0.1218 132 GLU B CB 8594 C CG . GLU D 132 ? 0.8799 1.1098 0.8678 0.0853 -0.0506 -0.1249 132 GLU B CG 8595 C CD . GLU D 132 ? 0.9737 1.1948 0.9608 0.0827 -0.0545 -0.1246 132 GLU B CD 8596 O OE1 . GLU D 132 ? 0.9260 1.1482 0.9156 0.0816 -0.0527 -0.1226 132 GLU B OE1 8597 O OE2 . GLU D 132 ? 1.0060 1.2178 0.9889 0.0820 -0.0599 -0.1266 132 GLU B OE2 8598 N N . LEU D 133 ? 0.8319 1.0978 0.8240 0.0865 -0.0427 -0.1184 133 LEU B N 8599 C CA . LEU D 133 ? 0.8589 1.1383 0.8519 0.0863 -0.0423 -0.1161 133 LEU B CA 8600 C C . LEU D 133 ? 0.9340 1.2174 0.9292 0.0813 -0.0437 -0.1130 133 LEU B C 8601 O O . LEU D 133 ? 0.8369 1.1346 0.8332 0.0790 -0.0444 -0.1103 133 LEU B O 8602 C CB . LEU D 133 ? 0.8908 1.1729 0.8816 0.0936 -0.0394 -0.1173 133 LEU B CB 8603 C CG . LEU D 133 ? 0.9582 1.2421 0.9462 0.0980 -0.0387 -0.1192 133 LEU B CG 8604 C CD1 . LEU D 133 ? 0.9622 1.2425 0.9459 0.1048 -0.0375 -0.1204 133 LEU B CD1 8605 C CD2 . LEU D 133 ? 1.0616 1.3602 1.0503 0.0970 -0.0397 -0.1181 133 LEU B CD2 8606 N N . GLY D 134 ? 0.9989 1.2715 0.9946 0.0798 -0.0442 -0.1133 134 GLY B N 8607 C CA . GLY D 134 ? 0.9542 1.2288 0.9517 0.0746 -0.0460 -0.1102 134 GLY B CA 8608 C C . GLY D 134 ? 0.8840 1.1653 0.8823 0.0780 -0.0433 -0.1092 134 GLY B C 8609 O O . GLY D 134 ? 0.7225 1.0113 0.7224 0.0739 -0.0443 -0.1061 134 GLY B O 8610 N N . ASN D 135 ? 0.8374 1.1157 0.8337 0.0852 -0.0403 -0.1117 135 ASN B N 8611 C CA . ASN D 135 ? 0.7884 1.0693 0.7835 0.0896 -0.0386 -0.1115 135 ASN B CA 8612 C C . ASN D 135 ? 0.7805 1.0471 0.7736 0.0929 -0.0374 -0.1133 135 ASN B C 8613 O O . ASN D 135 ? 0.7273 0.9920 0.7171 0.0979 -0.0366 -0.1139 135 ASN B O 8614 C CB . ASN D 135 ? 0.7998 1.0924 0.7920 0.0959 -0.0377 -0.1123 135 ASN B CB 8615 C CG . ASN D 135 ? 0.8846 1.1707 0.8731 0.1008 -0.0372 -0.1151 135 ASN B CG 8616 O OD1 . ASN D 135 ? 0.8282 1.1043 0.8172 0.0988 -0.0373 -0.1160 135 ASN B OD1 8617 N ND2 . ASN D 135 ? 0.7964 1.0890 0.7807 0.1079 -0.0371 -0.1164 135 ASN B ND2 8618 N N . GLY D 136 ? 0.7499 1.0069 0.7442 0.0901 -0.0379 -0.1140 136 GLY B N 8619 C CA . GLY D 136 ? 0.6884 0.9352 0.6812 0.0925 -0.0368 -0.1151 136 GLY B CA 8620 C C . GLY D 136 ? 0.6897 0.9344 0.6797 0.0956 -0.0363 -0.1167 136 GLY B C 8621 O O . GLY D 136 ? 0.7147 0.9530 0.7035 0.0964 -0.0358 -0.1169 136 GLY B O 8622 N N . CYS D 137 ? 0.7627 1.0139 0.7516 0.0971 -0.0365 -0.1174 137 CYS B N 8623 C CA . CYS D 137 ? 0.7480 0.9975 0.7339 0.1000 -0.0362 -0.1187 137 CYS B CA 8624 C C . CYS D 137 ? 0.7211 0.9716 0.7086 0.0981 -0.0366 -0.1200 137 CYS B C 8625 O O . CYS D 137 ? 0.6785 0.9323 0.6684 0.0948 -0.0379 -0.1199 137 CYS B O 8626 C CB . CYS D 137 ? 0.7726 1.0271 0.7546 0.1046 -0.0366 -0.1190 137 CYS B CB 8627 S SG . CYS D 137 ? 0.7909 1.0411 0.7681 0.1088 -0.0373 -0.1184 137 CYS B SG 8628 N N . PHE D 138 ? 0.7285 0.9757 0.7139 0.0998 -0.0361 -0.1209 138 PHE B N 8629 C CA . PHE D 138 ? 0.7109 0.9591 0.6967 0.0994 -0.0364 -0.1226 138 PHE B CA 8630 C C . PHE D 138 ? 0.7216 0.9730 0.7044 0.1021 -0.0363 -0.1230 138 PHE B C 8631 O O . PHE D 138 ? 0.6759 0.9244 0.6550 0.1043 -0.0361 -0.1223 138 PHE B O 8632 C CB . PHE D 138 ? 0.7530 0.9972 0.7386 0.0998 -0.0359 -0.1232 138 PHE B CB 8633 C CG . PHE D 138 ? 0.6915 0.9324 0.6794 0.0983 -0.0366 -0.1236 138 PHE B CG 8634 C CD1 . PHE D 138 ? 0.6656 0.9048 0.6541 0.0974 -0.0388 -0.1257 138 PHE B CD1 8635 C CD2 . PHE D 138 ? 0.6895 0.9278 0.6782 0.0977 -0.0358 -0.1220 138 PHE B CD2 8636 C CE1 . PHE D 138 ? 0.7275 0.9618 0.7168 0.0964 -0.0404 -0.1263 138 PHE B CE1 8637 C CE2 . PHE D 138 ? 0.7170 0.9521 0.7077 0.0966 -0.0367 -0.1224 138 PHE B CE2 8638 C CZ . PHE D 138 ? 0.7062 0.9390 0.6970 0.0961 -0.0392 -0.1247 138 PHE B CZ 8639 N N . GLU D 139 ? 0.7671 1.0237 0.7506 0.1014 -0.0370 -0.1240 139 GLU B N 8640 C CA . GLU D 139 ? 0.7892 1.0494 0.7700 0.1041 -0.0370 -0.1247 139 GLU B CA 8641 C C . GLU D 139 ? 0.7586 1.0172 0.7389 0.1039 -0.0370 -0.1262 139 GLU B C 8642 O O . GLU D 139 ? 0.6680 0.9274 0.6499 0.1019 -0.0382 -0.1275 139 GLU B O 8643 C CB . GLU D 139 ? 0.9447 1.2140 0.9263 0.1039 -0.0378 -0.1244 139 GLU B CB 8644 C CG . GLU D 139 ? 1.0853 1.3587 1.0632 0.1083 -0.0378 -0.1250 139 GLU B CG 8645 C CD . GLU D 139 ? 1.0656 1.3514 1.0447 0.1084 -0.0385 -0.1247 139 GLU B CD 8646 O OE1 . GLU D 139 ? 0.9996 1.2899 0.9821 0.1033 -0.0394 -0.1238 139 GLU B OE1 8647 O OE2 . GLU D 139 ? 1.1386 1.4299 1.1145 0.1136 -0.0387 -0.1251 139 GLU B OE2 8648 N N . PHE D 140 ? 0.7308 0.9869 0.7081 0.1058 -0.0364 -0.1259 140 PHE B N 8649 C CA . PHE D 140 ? 0.7952 1.0519 0.7718 0.1060 -0.0362 -0.1271 140 PHE B CA 8650 C C . PHE D 140 ? 0.7959 1.0569 0.7719 0.1067 -0.0369 -0.1287 140 PHE B C 8651 O O . PHE D 140 ? 0.7680 1.0318 0.7426 0.1080 -0.0372 -0.1283 140 PHE B O 8652 C CB . PHE D 140 ? 0.7766 1.0316 0.7497 0.1066 -0.0359 -0.1253 140 PHE B CB 8653 C CG . PHE D 140 ? 0.7722 1.0250 0.7459 0.1052 -0.0353 -0.1235 140 PHE B CG 8654 C CD1 . PHE D 140 ? 0.8283 1.0762 0.8003 0.1045 -0.0360 -0.1212 140 PHE B CD1 8655 C CD2 . PHE D 140 ? 0.7095 0.9660 0.6848 0.1050 -0.0345 -0.1242 140 PHE B CD2 8656 C CE1 . PHE D 140 ? 0.7970 1.0433 0.7694 0.1026 -0.0357 -0.1191 140 PHE B CE1 8657 C CE2 . PHE D 140 ? 0.7855 1.0423 0.7613 0.1038 -0.0340 -0.1223 140 PHE B CE2 8658 C CZ . PHE D 140 ? 0.7830 1.0347 0.7577 0.1020 -0.0346 -0.1195 140 PHE B CZ 8659 N N . TYR D 141 ? 0.7825 1.0439 0.7590 0.1064 -0.0374 -0.1308 141 TYR B N 8660 C CA . TYR D 141 ? 0.7917 1.0563 0.7671 0.1069 -0.0382 -0.1323 141 TYR B CA 8661 C C . TYR D 141 ? 0.7829 1.0493 0.7555 0.1089 -0.0373 -0.1323 141 TYR B C 8662 O O . TYR D 141 ? 0.9154 1.1842 0.8868 0.1097 -0.0378 -0.1339 141 TYR B O 8663 C CB . TYR D 141 ? 0.7790 1.0413 0.7548 0.1059 -0.0404 -0.1347 141 TYR B CB 8664 C CG . TYR D 141 ? 0.7706 1.0311 0.7481 0.1023 -0.0429 -0.1341 141 TYR B CG 8665 C CD1 . TYR D 141 ? 0.7448 1.0109 0.7237 0.1001 -0.0430 -0.1319 141 TYR B CD1 8666 C CD2 . TYR D 141 ? 0.7817 1.0355 0.7586 0.1012 -0.0457 -0.1356 141 TYR B CD2 8667 C CE1 . TYR D 141 ? 0.7921 1.0589 0.7724 0.0956 -0.0456 -0.1303 141 TYR B CE1 8668 C CE2 . TYR D 141 ? 0.7174 0.9686 0.6949 0.0965 -0.0490 -0.1342 141 TYR B CE2 8669 C CZ . TYR D 141 ? 0.7466 1.0052 0.7262 0.0930 -0.0488 -0.1312 141 TYR B CZ 8670 O OH . TYR D 141 ? 0.6115 0.8702 0.5917 0.0873 -0.0523 -0.1287 141 TYR B OH 8671 N N . HIS D 142 ? 0.7296 0.9947 0.7007 0.1091 -0.0364 -0.1300 142 HIS B N 8672 C CA . HIS D 142 ? 0.7055 0.9724 0.6733 0.1095 -0.0362 -0.1287 142 HIS B CA 8673 C C . HIS D 142 ? 0.7980 1.0605 0.7624 0.1086 -0.0370 -0.1253 142 HIS B C 8674 O O . HIS D 142 ? 0.8144 1.0727 0.7791 0.1086 -0.0374 -0.1245 142 HIS B O 8675 C CB . HIS D 142 ? 0.6872 0.9587 0.6557 0.1099 -0.0353 -0.1296 142 HIS B CB 8676 C CG . HIS D 142 ? 0.6537 0.9254 0.6231 0.1088 -0.0346 -0.1277 142 HIS B CG 8677 N ND1 . HIS D 142 ? 0.6500 0.9209 0.6223 0.1097 -0.0343 -0.1297 142 HIS B ND1 8678 C CD2 . HIS D 142 ? 0.6044 0.8770 0.5718 0.1065 -0.0346 -0.1237 142 HIS B CD2 8679 C CE1 . HIS D 142 ? 0.6720 0.9446 0.6447 0.1085 -0.0336 -0.1273 142 HIS B CE1 8680 N NE2 . HIS D 142 ? 0.6557 0.9297 0.6256 0.1061 -0.0338 -0.1233 142 HIS B NE2 8681 N N . LYS D 143 ? 0.8536 1.1167 0.8139 0.1076 -0.0379 -0.1229 143 LYS B N 8682 C CA . LYS D 143 ? 0.9104 1.1665 0.8650 0.1062 -0.0405 -0.1193 143 LYS B CA 8683 C C . LYS D 143 ? 0.9217 1.1787 0.8762 0.1025 -0.0405 -0.1158 143 LYS B C 8684 O O . LYS D 143 ? 0.8880 1.1534 0.8435 0.1006 -0.0394 -0.1146 143 LYS B O 8685 C CB . LYS D 143 ? 1.0386 1.2934 0.9874 0.1064 -0.0429 -0.1181 143 LYS B CB 8686 C CG . LYS D 143 ? 1.1196 1.3643 1.0611 0.1087 -0.0468 -0.1174 143 LYS B CG 8687 C CD . LYS D 143 ? 1.2636 1.4993 1.1962 0.1054 -0.0517 -0.1126 143 LYS B CD 8688 C CE . LYS D 143 ? 1.2353 1.4774 1.1670 0.1003 -0.0518 -0.1092 143 LYS B CE 8689 N NZ . LYS D 143 ? 1.1023 1.3450 1.0325 0.0941 -0.0532 -0.1039 143 LYS B NZ 8690 N N . CYS D 144 ? 0.9572 1.2072 0.9105 0.1017 -0.0417 -0.1142 144 CYS B N 8691 C CA . CYS D 144 ? 0.9642 1.2152 0.9182 0.0981 -0.0416 -0.1110 144 CYS B CA 8692 C C . CYS D 144 ? 1.0162 1.2572 0.9623 0.0948 -0.0463 -0.1062 144 CYS B C 8693 O O . CYS D 144 ? 0.9910 1.2219 0.9340 0.0964 -0.0484 -0.1064 144 CYS B O 8694 C CB . CYS D 144 ? 0.9647 1.2157 0.9246 0.0997 -0.0392 -0.1135 144 CYS B CB 8695 S SG . CYS D 144 ? 0.9057 1.1614 0.8689 0.0968 -0.0379 -0.1111 144 CYS B SG 8696 N N . ASP D 145 ? 1.0306 1.2742 0.9724 0.0902 -0.0486 -0.1017 145 ASP B N 8697 C CA . ASP D 145 ? 1.1066 1.3387 1.0386 0.0857 -0.0547 -0.0963 145 ASP B CA 8698 C C . ASP D 145 ? 1.0882 1.3183 1.0205 0.0818 -0.0555 -0.0928 145 ASP B C 8699 O O . ASP D 145 ? 0.9361 1.1737 0.8765 0.0834 -0.0510 -0.0952 145 ASP B O 8700 C CB . ASP D 145 ? 1.1500 1.3860 1.0767 0.0805 -0.0578 -0.0916 145 ASP B CB 8701 C CG . ASP D 145 ? 1.2466 1.5004 1.1782 0.0754 -0.0550 -0.0879 145 ASP B CG 8702 O OD1 . ASP D 145 ? 1.2895 1.5469 1.2156 0.0686 -0.0586 -0.0816 145 ASP B OD1 8703 O OD2 . ASP D 145 ? 1.3850 1.6499 1.3253 0.0784 -0.0496 -0.0913 145 ASP B OD2 8704 N N . ASN D 146 ? 1.0835 1.3023 1.0065 0.0766 -0.0620 -0.0873 146 ASN B N 8705 C CA . ASN D 146 ? 0.9946 1.2095 0.9162 0.0722 -0.0639 -0.0833 146 ASN B CA 8706 C C . ASN D 146 ? 0.9329 1.1662 0.8617 0.0669 -0.0602 -0.0798 146 ASN B C 8707 O O . ASN D 146 ? 1.0455 1.2801 0.9771 0.0653 -0.0593 -0.0784 146 ASN B O 8708 C CB . ASN D 146 ? 0.9389 1.1355 0.8466 0.0669 -0.0734 -0.0775 146 ASN B CB 8709 C CG . ASN D 146 ? 0.9748 1.1513 0.8745 0.0739 -0.0778 -0.0816 146 ASN B CG 8710 O OD1 . ASN D 146 ? 1.0177 1.1764 0.9041 0.0716 -0.0866 -0.0782 146 ASN B OD1 8711 N ND2 . ASN D 146 ? 0.9325 1.1118 0.8390 0.0825 -0.0726 -0.0887 146 ASN B ND2 8712 N N . LYS D 147 ? 0.9601 1.2084 0.8913 0.0649 -0.0583 -0.0783 147 LYS B N 8713 C CA . LYS D 147 ? 1.0351 1.3047 0.9731 0.0620 -0.0544 -0.0759 147 LYS B CA 8714 C C . LYS D 147 ? 0.9186 1.1979 0.8667 0.0703 -0.0474 -0.0835 147 LYS B C 8715 O O . LYS D 147 ? 0.9110 1.2028 0.8646 0.0707 -0.0443 -0.0835 147 LYS B O 8716 C CB . LYS D 147 ? 1.1478 1.4320 1.0834 0.0567 -0.0556 -0.0708 147 LYS B CB 8717 C CG . LYS D 147 ? 1.2911 1.5626 1.2150 0.0487 -0.0638 -0.0638 147 LYS B CG 8718 C CD . LYS D 147 ? 1.3466 1.6330 1.2684 0.0437 -0.0648 -0.0591 147 LYS B CD 8719 C CE . LYS D 147 ? 1.3780 1.6467 1.2899 0.0425 -0.0709 -0.0583 147 LYS B CE 8720 N NZ . LYS D 147 ? 1.4250 1.7029 1.3307 0.0329 -0.0756 -0.0499 147 LYS B NZ 8721 N N . CYS D 148 ? 0.8572 1.1304 0.8068 0.0767 -0.0456 -0.0898 148 CYS B N 8722 C CA . CYS D 148 ? 0.8585 1.1366 0.8159 0.0836 -0.0407 -0.0967 148 CYS B CA 8723 C C . CYS D 148 ? 0.7875 1.0571 0.7473 0.0847 -0.0403 -0.0980 148 CYS B C 8724 O O . CYS D 148 ? 0.7563 1.0329 0.7215 0.0867 -0.0375 -0.0999 148 CYS B O 8725 C CB . CYS D 148 ? 0.8841 1.1572 0.8416 0.0886 -0.0399 -0.1020 148 CYS B CB 8726 S SG . CYS D 148 ? 0.9678 1.2410 0.9326 0.0955 -0.0362 -0.1098 148 CYS B SG 8727 N N . MET D 149 ? 0.7441 0.9984 0.6992 0.0842 -0.0433 -0.0974 149 MET B N 8728 C CA . MET D 149 ? 0.8055 1.0511 0.7613 0.0847 -0.0437 -0.0978 149 MET B CA 8729 C C . MET D 149 ? 0.8316 1.0830 0.7890 0.0802 -0.0436 -0.0935 149 MET B C 8730 O O . MET D 149 ? 0.7084 0.9635 0.6716 0.0823 -0.0408 -0.0958 149 MET B O 8731 C CB . MET D 149 ? 0.8181 1.0473 0.7657 0.0847 -0.0485 -0.0966 149 MET B CB 8732 C CG . MET D 149 ? 0.7632 0.9866 0.7109 0.0911 -0.0479 -0.1019 149 MET B CG 8733 S SD . MET D 149 ? 0.7856 1.0184 0.7436 0.0957 -0.0422 -0.1080 149 MET B SD 8734 C CE . MET D 149 ? 0.8992 1.1259 0.8543 0.1011 -0.0434 -0.1115 149 MET B CE 8735 N N . GLU D 150 ? 0.8744 1.1270 0.8261 0.0736 -0.0473 -0.0869 150 GLU B N 8736 C CA . GLU D 150 ? 0.9471 1.2091 0.9003 0.0683 -0.0474 -0.0818 150 GLU B CA 8737 C C . GLU D 150 ? 0.9053 1.1860 0.8671 0.0721 -0.0420 -0.0849 150 GLU B C 8738 O O . GLU D 150 ? 0.9294 1.2154 0.8949 0.0719 -0.0406 -0.0843 150 GLU B O 8739 C CB . GLU D 150 ? 1.0518 1.3168 0.9977 0.0594 -0.0525 -0.0734 150 GLU B CB 8740 C CG . GLU D 150 ? 1.0553 1.3351 1.0027 0.0527 -0.0528 -0.0668 150 GLU B CG 8741 C CD . GLU D 150 ? 1.0682 1.3358 1.0133 0.0495 -0.0556 -0.0642 150 GLU B CD 8742 O OE1 . GLU D 150 ? 1.0320 1.2967 0.9702 0.0404 -0.0613 -0.0561 150 GLU B OE1 8743 O OE2 . GLU D 150 ? 1.1120 1.3718 1.0612 0.0557 -0.0528 -0.0700 150 GLU B OE2 8744 N N . SER D 151 ? 0.8340 1.1239 0.7983 0.0763 -0.0395 -0.0886 151 SER B N 8745 C CA . SER D 151 ? 0.7520 1.0586 0.7224 0.0814 -0.0355 -0.0923 151 SER B CA 8746 C C . SER D 151 ? 0.7034 1.0035 0.6786 0.0875 -0.0333 -0.0986 151 SER B C 8747 O O . SER D 151 ? 0.6808 0.9902 0.6595 0.0900 -0.0316 -0.0996 151 SER B O 8748 C CB . SER D 151 ? 0.7161 1.0331 0.6865 0.0847 -0.0341 -0.0949 151 SER B CB 8749 O OG . SER D 151 ? 0.6903 0.9961 0.6612 0.0897 -0.0335 -0.1010 151 SER B OG 8750 N N . VAL D 152 ? 0.7349 1.0199 0.7099 0.0899 -0.0336 -0.1024 152 VAL B N 8751 C CA . VAL D 152 ? 0.8616 1.1404 0.8407 0.0940 -0.0323 -0.1072 152 VAL B CA 8752 C C . VAL D 152 ? 0.8202 1.0957 0.8002 0.0911 -0.0328 -0.1042 152 VAL B C 8753 O O . VAL D 152 ? 0.6793 0.9566 0.6629 0.0939 -0.0316 -0.1067 152 VAL B O 8754 C CB . VAL D 152 ? 0.8976 1.1637 0.8766 0.0960 -0.0327 -0.1108 152 VAL B CB 8755 C CG1 . VAL D 152 ? 0.9493 1.2182 0.9297 0.1004 -0.0320 -0.1158 152 VAL B CG1 8756 C CG2 . VAL D 152 ? 0.9857 1.2433 0.9599 0.0931 -0.0349 -0.1079 152 VAL B CG2 8757 N N . ARG D 153 ? 0.8933 1.1633 0.8690 0.0856 -0.0352 -0.0988 153 ARG B N 8758 C CA . ARG D 153 ? 0.9380 1.2038 0.9134 0.0820 -0.0364 -0.0952 153 ARG B CA 8759 C C . ARG D 153 ? 0.9358 1.2167 0.9142 0.0807 -0.0351 -0.0926 153 ARG B C 8760 O O . ARG D 153 ? 0.8324 1.1123 0.8139 0.0817 -0.0343 -0.0934 153 ARG B O 8761 C CB . ARG D 153 ? 0.8883 1.1434 0.8563 0.0764 -0.0407 -0.0899 153 ARG B CB 8762 C CG . ARG D 153 ? 0.8945 1.1338 0.8591 0.0792 -0.0423 -0.0928 153 ARG B CG 8763 C CD . ARG D 153 ? 0.8746 1.1005 0.8305 0.0750 -0.0477 -0.0882 153 ARG B CD 8764 N NE . ARG D 153 ? 0.9367 1.1537 0.8860 0.0768 -0.0507 -0.0892 153 ARG B NE 8765 C CZ . ARG D 153 ? 0.9415 1.1567 0.8837 0.0726 -0.0547 -0.0850 153 ARG B CZ 8766 N NH1 . ARG D 153 ? 0.9974 1.2204 0.9383 0.0654 -0.0564 -0.0787 153 ARG B NH1 8767 N NH2 . ARG D 153 ? 0.9274 1.1338 0.8637 0.0755 -0.0575 -0.0868 153 ARG B NH2 8768 N N . ASN D 154 ? 0.9434 1.2398 0.9210 0.0788 -0.0350 -0.0895 154 ASN B N 8769 C CA . ASN D 154 ? 1.0263 1.3414 1.0069 0.0784 -0.0337 -0.0870 154 ASN B CA 8770 C C . ASN D 154 ? 0.9584 1.2866 0.9432 0.0873 -0.0305 -0.0934 154 ASN B C 8771 O O . ASN D 154 ? 1.0431 1.3912 1.0295 0.0889 -0.0294 -0.0920 154 ASN B O 8772 C CB . ASN D 154 ? 1.0913 1.4192 1.0681 0.0699 -0.0360 -0.0782 154 ASN B CB 8773 C CG . ASN D 154 ? 1.1093 1.4433 1.0831 0.0689 -0.0367 -0.0772 154 ASN B CG 8774 O OD1 . ASN D 154 ? 1.2916 1.6251 1.2671 0.0757 -0.0345 -0.0835 154 ASN B OD1 8775 N ND2 . ASN D 154 ? 1.1112 1.4510 1.0800 0.0597 -0.0402 -0.0687 154 ASN B ND2 8776 N N . GLY D 155 ? 0.8869 1.2040 0.8727 0.0933 -0.0298 -0.1003 155 GLY B N 8777 C CA . GLY D 155 ? 0.9063 1.2298 0.8943 0.1022 -0.0285 -0.1072 155 GLY B CA 8778 C C . GLY D 155 ? 0.9034 1.2430 0.8902 0.1064 -0.0277 -0.1089 155 GLY B C 8779 O O . GLY D 155 ? 0.9225 1.2692 0.9097 0.1147 -0.0273 -0.1144 155 GLY B O 8780 N N . THR D 156 ? 0.9403 1.2846 0.9247 0.1013 -0.0280 -0.1045 156 THR B N 8781 C CA . THR D 156 ? 0.9472 1.3089 0.9304 0.1044 -0.0271 -0.1053 156 THR B CA 8782 C C . THR D 156 ? 0.8292 1.1818 0.8104 0.1065 -0.0275 -0.1091 156 THR B C 8783 O O . THR D 156 ? 0.8145 1.1802 0.7943 0.1091 -0.0269 -0.1099 156 THR B O 8784 C CB . THR D 156 ? 1.0176 1.3966 0.9990 0.0963 -0.0276 -0.0963 156 THR B CB 8785 O OG1 . THR D 156 ? 0.9101 1.2741 0.8883 0.0871 -0.0302 -0.0907 156 THR B OG1 8786 C CG2 . THR D 156 ? 1.0978 1.4936 1.0814 0.0949 -0.0271 -0.0922 156 THR B CG2 8787 N N . TYR D 157 ? 0.8625 1.1944 0.8433 0.1050 -0.0285 -0.1110 157 TYR B N 8788 C CA . TYR D 157 ? 0.7964 1.1193 0.7757 0.1068 -0.0289 -0.1146 157 TYR B CA 8789 C C . TYR D 157 ? 0.9175 1.2499 0.8964 0.1147 -0.0284 -0.1203 157 TYR B C 8790 O O . TYR D 157 ? 0.8729 1.2058 0.8525 0.1211 -0.0287 -0.1252 157 TYR B O 8791 C CB . TYR D 157 ? 0.7759 1.0797 0.7562 0.1070 -0.0298 -0.1176 157 TYR B CB 8792 C CG . TYR D 157 ? 0.7423 1.0383 0.7216 0.1096 -0.0304 -0.1220 157 TYR B CG 8793 C CD1 . TYR D 157 ? 0.8023 1.0923 0.7795 0.1061 -0.0310 -0.1199 157 TYR B CD1 8794 C CD2 . TYR D 157 ? 0.6935 0.9873 0.6729 0.1156 -0.0313 -0.1281 157 TYR B CD2 8795 C CE1 . TYR D 157 ? 0.7777 1.0624 0.7542 0.1082 -0.0316 -0.1235 157 TYR B CE1 8796 C CE2 . TYR D 157 ? 0.6740 0.9608 0.6521 0.1168 -0.0325 -0.1314 157 TYR B CE2 8797 C CZ . TYR D 157 ? 0.8112 1.0947 0.7884 0.1130 -0.0322 -0.1289 157 TYR B CZ 8798 O OH . TYR D 157 ? 0.7383 1.0169 0.7145 0.1140 -0.0333 -0.1318 157 TYR B OH 8799 N N . ASP D 158 ? 0.9853 1.3237 0.9620 0.1144 -0.0283 -0.1198 158 ASP B N 8800 C CA . ASP D 158 ? 0.9682 1.3176 0.9434 0.1218 -0.0280 -0.1248 158 ASP B CA 8801 C C . ASP D 158 ? 0.9002 1.2347 0.8739 0.1246 -0.0294 -0.1302 158 ASP B C 8802 O O . ASP D 158 ? 0.7970 1.1283 0.7695 0.1211 -0.0295 -0.1286 158 ASP B O 8803 C CB . ASP D 158 ? 0.9618 1.3328 0.9358 0.1190 -0.0269 -0.1195 158 ASP B CB 8804 C CG . ASP D 158 ? 0.8887 1.2646 0.8601 0.1212 -0.0269 -0.1215 158 ASP B CG 8805 O OD1 . ASP D 158 ? 0.8500 1.2280 0.8200 0.1143 -0.0272 -0.1160 158 ASP B OD1 8806 O OD2 . ASP D 158 ? 0.7871 1.1649 0.7570 0.1298 -0.0273 -0.1284 158 ASP B OD2 8807 N N . TYR D 159 ? 0.8229 1.1480 0.7963 0.1303 -0.0312 -0.1362 159 TYR B N 8808 C CA . TYR D 159 ? 0.7542 1.0645 0.7256 0.1324 -0.0337 -0.1411 159 TYR B CA 8809 C C . TYR D 159 ? 0.7802 1.0970 0.7486 0.1358 -0.0340 -0.1437 159 TYR B C 8810 O O . TYR D 159 ? 0.7283 1.0362 0.6959 0.1334 -0.0349 -0.1443 159 TYR B O 8811 C CB . TYR D 159 ? 0.6699 0.9700 0.6395 0.1380 -0.0370 -0.1467 159 TYR B CB 8812 C CG . TYR D 159 ? 0.6701 0.9550 0.6365 0.1391 -0.0410 -0.1511 159 TYR B CG 8813 C CD1 . TYR D 159 ? 0.6865 0.9570 0.6545 0.1332 -0.0425 -0.1497 159 TYR B CD1 8814 C CD2 . TYR D 159 ? 0.6813 0.9669 0.6425 0.1458 -0.0438 -0.1565 159 TYR B CD2 8815 C CE1 . TYR D 159 ? 0.6933 0.9515 0.6582 0.1327 -0.0468 -0.1526 159 TYR B CE1 8816 C CE2 . TYR D 159 ? 0.6980 0.9686 0.6553 0.1458 -0.0485 -0.1600 159 TYR B CE2 8817 C CZ . TYR D 159 ? 0.7339 0.9911 0.6932 0.1386 -0.0501 -0.1576 159 TYR B CZ 8818 O OH . TYR D 159 ? 0.7002 0.9439 0.6557 0.1367 -0.0552 -0.1597 159 TYR B OH 8819 N N . PRO D 160 ? 0.8165 1.1500 0.7829 0.1419 -0.0334 -0.1454 160 PRO B N 8820 C CA . PRO D 160 ? 0.8899 1.2305 0.8529 0.1458 -0.0337 -0.1480 160 PRO B CA 8821 C C . PRO D 160 ? 0.8181 1.1588 0.7822 0.1385 -0.0322 -0.1433 160 PRO B C 8822 O O . PRO D 160 ? 0.8468 1.1786 0.8092 0.1388 -0.0336 -0.1459 160 PRO B O 8823 C CB . PRO D 160 ? 0.9105 1.2746 0.8724 0.1519 -0.0323 -0.1483 160 PRO B CB 8824 C CG . PRO D 160 ? 0.8939 1.2604 0.8577 0.1533 -0.0321 -0.1476 160 PRO B CG 8825 C CD . PRO D 160 ? 0.8046 1.1488 0.7705 0.1483 -0.0334 -0.1472 160 PRO B CD 8826 N N . GLN D 161 ? 0.8317 1.1812 0.7979 0.1318 -0.0300 -0.1363 161 GLN B N 8827 C CA . GLN D 161 ? 0.8353 1.1829 0.8010 0.1249 -0.0295 -0.1315 161 GLN B CA 8828 C C . GLN D 161 ? 0.7863 1.1160 0.7517 0.1233 -0.0309 -0.1336 161 GLN B C 8829 O O . GLN D 161 ? 0.7572 1.0870 0.7209 0.1217 -0.0311 -0.1328 161 GLN B O 8830 C CB . GLN D 161 ? 0.8912 1.2402 0.8580 0.1167 -0.0291 -0.1238 161 GLN B CB 8831 C CG . GLN D 161 ? 0.9806 1.3452 0.9454 0.1118 -0.0288 -0.1175 161 GLN B CG 8832 C CD . GLN D 161 ? 1.0165 1.3702 0.9785 0.1050 -0.0306 -0.1132 161 GLN B CD 8833 O OE1 . GLN D 161 ? 1.1680 1.5093 1.1293 0.1000 -0.0321 -0.1097 161 GLN B OE1 8834 N NE2 . GLN D 161 ? 0.9077 1.2653 0.8674 0.1057 -0.0309 -0.1139 161 GLN B NE2 8835 N N . TYR D 162 ? 0.7467 1.0627 0.7138 0.1234 -0.0320 -0.1358 162 TYR B N 8836 C CA . TYR D 162 ? 0.6848 0.9871 0.6524 0.1204 -0.0330 -0.1359 162 TYR B CA 8837 C C . TYR D 162 ? 0.6449 0.9382 0.6116 0.1237 -0.0354 -0.1414 162 TYR B C 8838 O O . TYR D 162 ? 0.5455 0.8309 0.5126 0.1209 -0.0363 -0.1412 162 TYR B O 8839 C CB . TYR D 162 ? 0.6953 0.9896 0.6650 0.1159 -0.0328 -0.1324 162 TYR B CB 8840 C CG . TYR D 162 ? 0.7646 1.0640 0.7335 0.1114 -0.0320 -0.1264 162 TYR B CG 8841 C CD1 . TYR D 162 ? 0.6831 0.9897 0.6532 0.1108 -0.0312 -0.1240 162 TYR B CD1 8842 C CD2 . TYR D 162 ? 0.7839 1.0802 0.7500 0.1076 -0.0328 -0.1227 162 TYR B CD2 8843 C CE1 . TYR D 162 ? 0.6905 1.0011 0.6590 0.1053 -0.0314 -0.1177 162 TYR B CE1 8844 C CE2 . TYR D 162 ? 0.7880 1.0861 0.7516 0.1026 -0.0338 -0.1167 162 TYR B CE2 8845 C CZ . TYR D 162 ? 0.7648 1.0701 0.7296 0.1009 -0.0331 -0.1139 162 TYR B CZ 8846 O OH . TYR D 162 ? 0.7845 1.0914 0.7460 0.0946 -0.0350 -0.1071 162 TYR B OH 8847 N N . SER D 163 ? 0.6928 0.9876 0.6575 0.1295 -0.0371 -0.1461 163 SER B N 8848 C CA . SER D 163 ? 0.7973 1.0802 0.7596 0.1319 -0.0411 -0.1509 163 SER B CA 8849 C C . SER D 163 ? 0.8079 1.0861 0.7689 0.1296 -0.0425 -0.1514 163 SER B C 8850 O O . SER D 163 ? 0.8361 1.1045 0.7977 0.1258 -0.0447 -0.1511 163 SER B O 8851 C CB . SER D 163 ? 0.8452 1.1302 0.8025 0.1403 -0.0439 -0.1567 163 SER B CB 8852 O OG . SER D 163 ? 0.8568 1.1544 0.8148 0.1442 -0.0416 -0.1562 163 SER B OG 8853 N N . GLU D 164 ? 0.8019 1.0891 0.7614 0.1313 -0.0410 -0.1515 164 GLU B N 8854 C CA . GLU D 164 ? 0.8791 1.1644 0.8367 0.1305 -0.0423 -0.1526 164 GLU B CA 8855 C C . GLU D 164 ? 0.7471 1.0288 0.7075 0.1245 -0.0413 -0.1487 164 GLU B C 8856 O O . GLU D 164 ? 0.7043 0.9796 0.6643 0.1224 -0.0436 -0.1495 164 GLU B O 8857 C CB . GLU D 164 ? 0.9645 1.2623 0.9201 0.1334 -0.0404 -0.1527 164 GLU B CB 8858 C CG . GLU D 164 ? 1.0492 1.3498 0.9998 0.1410 -0.0428 -0.1584 164 GLU B CG 8859 C CD . GLU D 164 ? 1.2948 1.5901 1.2422 0.1413 -0.0455 -0.1610 164 GLU B CD 8860 O OE1 . GLU D 164 ? 1.4738 1.7746 1.4223 0.1384 -0.0434 -0.1584 164 GLU B OE1 8861 O OE2 . GLU D 164 ? 1.4376 1.7223 1.3805 0.1444 -0.0504 -0.1657 164 GLU B OE2 8862 N N . GLU D 165 ? 0.7458 1.0325 0.7083 0.1219 -0.0383 -0.1444 165 GLU B N 8863 C CA . GLU D 165 ? 0.8047 1.0881 0.7687 0.1178 -0.0377 -0.1411 165 GLU B CA 8864 C C . GLU D 165 ? 0.7586 1.0346 0.7249 0.1156 -0.0391 -0.1411 165 GLU B C 8865 O O . GLU D 165 ? 0.8235 1.0981 0.7904 0.1135 -0.0396 -0.1399 165 GLU B O 8866 C CB . GLU D 165 ? 0.9249 1.2116 0.8889 0.1157 -0.0358 -0.1365 165 GLU B CB 8867 C CG . GLU D 165 ? 0.9861 1.2680 0.9497 0.1132 -0.0361 -0.1336 165 GLU B CG 8868 C CD . GLU D 165 ? 1.0791 1.3608 1.0406 0.1110 -0.0359 -0.1292 165 GLU B CD 8869 O OE1 . GLU D 165 ? 0.9435 1.2310 0.9046 0.1102 -0.0352 -0.1275 165 GLU B OE1 8870 O OE2 . GLU D 165 ? 1.2036 1.4796 1.1631 0.1101 -0.0371 -0.1272 165 GLU B OE2 8871 N N . ALA D 166 ? 0.7899 1.0626 0.7571 0.1162 -0.0397 -0.1421 166 ALA B N 8872 C CA . ALA D 166 ? 0.8297 1.0958 0.7988 0.1135 -0.0414 -0.1417 166 ALA B CA 8873 C C . ALA D 166 ? 0.7300 0.9907 0.6971 0.1129 -0.0455 -0.1444 166 ALA B C 8874 O O . ALA D 166 ? 0.7249 0.9841 0.6931 0.1090 -0.0472 -0.1429 166 ALA B O 8875 C CB . ALA D 166 ? 0.9083 1.1722 0.8787 0.1142 -0.0410 -0.1415 166 ALA B CB 8876 N N . ARG D 167 ? 0.7401 0.9987 0.7035 0.1167 -0.0478 -0.1482 167 ARG B N 8877 C CA . ARG D 167 ? 0.8611 1.1125 0.8205 0.1162 -0.0530 -0.1509 167 ARG B CA 8878 C C . ARG D 167 ? 0.8682 1.1229 0.8286 0.1122 -0.0530 -0.1488 167 ARG B C 8879 O O . ARG D 167 ? 0.9224 1.1731 0.8824 0.1074 -0.0566 -0.1476 167 ARG B O 8880 C CB . ARG D 167 ? 0.9125 1.1628 0.8665 0.1227 -0.0553 -0.1559 167 ARG B CB 8881 C CG . ARG D 167 ? 1.0499 1.2867 0.9976 0.1238 -0.0626 -0.1596 167 ARG B CG 8882 C CD . ARG D 167 ? 1.1634 1.3973 1.1037 0.1303 -0.0664 -0.1650 167 ARG B CD 8883 N NE . ARG D 167 ? 1.2415 1.4823 1.1825 0.1291 -0.0645 -0.1641 167 ARG B NE 8884 C CZ . ARG D 167 ? 1.2930 1.5438 1.2333 0.1343 -0.0613 -0.1659 167 ARG B CZ 8885 N NH1 . ARG D 167 ? 1.2845 1.5420 1.2233 0.1415 -0.0596 -0.1686 167 ARG B NH1 8886 N NH2 . ARG D 167 ? 1.2219 1.4775 1.1629 0.1322 -0.0599 -0.1647 167 ARG B NH2 8887 N N . LEU D 168 ? 0.8776 1.1405 0.8392 0.1137 -0.0492 -0.1478 168 LEU B N 8888 C CA . LEU D 168 ? 0.8863 1.1531 0.8479 0.1115 -0.0494 -0.1467 168 LEU B CA 8889 C C . LEU D 168 ? 0.8995 1.1693 0.8647 0.1073 -0.0486 -0.1430 168 LEU B C 8890 O O . LEU D 168 ? 0.8858 1.1578 0.8511 0.1040 -0.0508 -0.1418 168 LEU B O 8891 C CB . LEU D 168 ? 0.9381 1.2121 0.8993 0.1143 -0.0460 -0.1463 168 LEU B CB 8892 C CG . LEU D 168 ? 0.9868 1.2631 0.9443 0.1177 -0.0466 -0.1493 168 LEU B CG 8893 C CD1 . LEU D 168 ? 0.9475 1.2172 0.9013 0.1177 -0.0516 -0.1526 168 LEU B CD1 8894 C CD2 . LEU D 168 ? 1.0349 1.3157 0.9913 0.1220 -0.0445 -0.1505 168 LEU B CD2 8895 N N . LYS D 169 ? 0.9079 1.1792 0.8756 0.1079 -0.0456 -0.1410 169 LYS B N 8896 C CA . LYS D 169 ? 0.9215 1.1966 0.8919 0.1056 -0.0447 -0.1379 169 LYS B CA 8897 C C . LYS D 169 ? 0.9336 1.2065 0.9056 0.1011 -0.0476 -0.1367 169 LYS B C 8898 O O . LYS D 169 ? 0.9944 1.2735 0.9685 0.0986 -0.0476 -0.1341 169 LYS B O 8899 C CB . LYS D 169 ? 0.9351 1.2106 0.9061 0.1079 -0.0416 -0.1364 169 LYS B CB 8900 C CG . LYS D 169 ? 1.0006 1.2788 0.9733 0.1072 -0.0409 -0.1339 169 LYS B CG 8901 C CD . LYS D 169 ? 1.1475 1.4335 1.1198 0.1080 -0.0413 -0.1331 169 LYS B CD 8902 C CE . LYS D 169 ? 1.2248 1.5130 1.1958 0.1113 -0.0403 -0.1317 169 LYS B CE 8903 N NZ . LYS D 169 ? 1.3099 1.5930 1.2767 0.1148 -0.0398 -0.1319 169 LYS B NZ 8904 N N . ARG D 170 ? 0.9216 1.1862 0.8919 0.1003 -0.0504 -0.1385 170 ARG B N 8905 C CA . ARG D 170 ? 0.8885 1.1485 0.8589 0.0953 -0.0544 -0.1372 170 ARG B CA 8906 C C . ARG D 170 ? 0.9451 1.2047 0.9129 0.0906 -0.0594 -0.1366 170 ARG B C 8907 O O . ARG D 170 ? 1.0032 1.2679 0.9726 0.0847 -0.0616 -0.1330 170 ARG B O 8908 C CB . ARG D 170 ? 0.9095 1.1590 0.8776 0.0972 -0.0565 -0.1398 170 ARG B CB 8909 C CG . ARG D 170 ? 0.8846 1.1284 0.8529 0.0923 -0.0601 -0.1378 170 ARG B CG 8910 C CD . ARG D 170 ? 0.8966 1.1274 0.8602 0.0947 -0.0645 -0.1413 170 ARG B CD 8911 N NE . ARG D 170 ? 0.8373 1.0695 0.8012 0.1020 -0.0603 -0.1443 170 ARG B NE 8912 C CZ . ARG D 170 ? 0.8572 1.0862 0.8167 0.1080 -0.0617 -0.1487 170 ARG B CZ 8913 N NH1 . ARG D 170 ? 0.8509 1.0720 0.8042 0.1084 -0.0677 -0.1515 170 ARG B NH1 8914 N NH2 . ARG D 170 ? 0.8701 1.1045 0.8307 0.1138 -0.0576 -0.1503 170 ARG B NH2 8915 N N . GLU D 171 ? 1.0163 1.2706 0.9798 0.0931 -0.0617 -0.1399 171 GLU B N 8916 C CA . GLU D 171 ? 1.1695 1.4219 1.1295 0.0886 -0.0672 -0.1394 171 GLU B CA 8917 C C . GLU D 171 ? 1.1671 1.4333 1.1304 0.0858 -0.0651 -0.1361 171 GLU B C 8918 O O . GLU D 171 ? 1.0892 1.3580 1.0510 0.0800 -0.0694 -0.1338 171 GLU B O 8919 C CB . GLU D 171 ? 1.2749 1.5199 1.2292 0.0934 -0.0695 -0.1442 171 GLU B CB 8920 C CG . GLU D 171 ? 1.3610 1.5931 1.3101 0.0979 -0.0729 -0.1485 171 GLU B CG 8921 C CD . GLU D 171 ? 1.4095 1.6384 1.3532 0.1049 -0.0739 -0.1537 171 GLU B CD 8922 O OE1 . GLU D 171 ? 1.3922 1.6082 1.3282 0.1069 -0.0807 -0.1574 171 GLU B OE1 8923 O OE2 . GLU D 171 ? 1.3033 1.5423 1.2497 0.1085 -0.0684 -0.1542 171 GLU B OE2 8924 N N . GLU D 172 ? 1.1957 1.4708 1.1627 0.0903 -0.0589 -0.1359 172 GLU B N 8925 C CA . GLU D 172 ? 1.2369 1.5253 1.2064 0.0899 -0.0567 -0.1334 172 GLU B CA 8926 C C . GLU D 172 ? 1.3082 1.6062 1.2809 0.0847 -0.0577 -0.1290 172 GLU B C 8927 O O . GLU D 172 ? 1.2329 1.5445 1.2074 0.0847 -0.0563 -0.1269 172 GLU B O 8928 C CB . GLU D 172 ? 1.2069 1.4984 1.1775 0.0966 -0.0512 -0.1346 172 GLU B CB 8929 C CG . GLU D 172 ? 1.1467 1.4494 1.1180 0.0990 -0.0492 -0.1335 172 GLU B CG 8930 C CD . GLU D 172 ? 1.1770 1.4799 1.1483 0.1045 -0.0456 -0.1336 172 GLU B CD 8931 O OE1 . GLU D 172 ? 1.0676 1.3654 1.0365 0.1080 -0.0441 -0.1352 172 GLU B OE1 8932 O OE2 . GLU D 172 ? 1.1119 1.4199 1.0848 0.1049 -0.0448 -0.1318 172 GLU B OE2 8933 N N . ILE D 173 ? 1.4143 1.7061 1.3871 0.0807 -0.0601 -0.1277 173 ILE B N 8934 C CA . ILE D 173 ? 1.3495 1.6511 1.3250 0.0746 -0.0617 -0.1230 173 ILE B CA 8935 C C . ILE D 173 ? 1.2735 1.5639 1.2464 0.0670 -0.0681 -0.1214 173 ILE B C 8936 O O . ILE D 173 ? 0.9816 1.2652 0.9501 0.0615 -0.0745 -0.1207 173 ILE B O 8937 C CB . ILE D 173 ? 1.2683 1.5760 1.2474 0.0792 -0.0565 -0.1226 173 ILE B CB 8938 C CG1 . ILE D 173 ? 1.2367 1.5392 1.2151 0.0878 -0.0518 -0.1264 173 ILE B CG1 8939 C CG2 . ILE D 173 ? 1.2687 1.5962 1.2506 0.0781 -0.0554 -0.1188 173 ILE B CG2 8940 C CD1 . ILE D 173 ? 1.2225 1.5232 1.2024 0.0917 -0.0485 -0.1266 173 ILE B CD1 8941 N N . GLY E 12 ? 0.8041 1.0871 0.8284 0.0418 -0.0675 -0.1474 12 GLY D N 8942 C CA . GLY E 12 ? 0.8121 1.1113 0.8487 0.0368 -0.0600 -0.1469 12 GLY D CA 8943 C C . GLY E 12 ? 0.8685 1.1816 0.9286 0.0432 -0.0535 -0.1559 12 GLY D C 8944 O O . GLY E 12 ? 0.8742 1.1879 0.9425 0.0506 -0.0539 -0.1633 12 GLY D O 8945 N N . GLY E 13 ? 0.8822 1.2062 0.9522 0.0402 -0.0482 -0.1556 13 GLY D N 8946 C CA . GLY E 13 ? 0.8375 1.1735 0.9278 0.0455 -0.0428 -0.1638 13 GLY D CA 8947 C C . GLY E 13 ? 0.7888 1.1463 0.8847 0.0449 -0.0396 -0.1685 13 GLY D C 8948 O O . GLY E 13 ? 0.7275 1.0927 0.8120 0.0393 -0.0407 -0.1650 13 GLY D O 8949 N N . TRP E 14 ? 0.7602 1.1271 0.8725 0.0502 -0.0361 -0.1765 14 TRP D N 8950 C CA . TRP E 14 ? 0.7602 1.1482 0.8792 0.0520 -0.0337 -0.1833 14 TRP D CA 8951 C C . TRP E 14 ? 0.7524 1.1526 0.8822 0.0529 -0.0304 -0.1864 14 TRP D C 8952 O O . TRP E 14 ? 0.6701 1.0664 0.8120 0.0585 -0.0293 -0.1918 14 TRP D O 8953 C CB . TRP E 14 ? 0.7250 1.1155 0.8535 0.0594 -0.0338 -0.1927 14 TRP D CB 8954 C CG . TRP E 14 ? 0.6578 1.0417 0.7783 0.0607 -0.0371 -0.1929 14 TRP D CG 8955 C CD1 . TRP E 14 ? 0.6582 1.0389 0.7625 0.0565 -0.0405 -0.1871 14 TRP D CD1 8956 C CD2 . TRP E 14 ? 0.6142 0.9940 0.7421 0.0669 -0.0379 -0.1999 14 TRP D CD2 8957 N NE1 . TRP E 14 ? 0.7191 1.0935 0.8205 0.0608 -0.0438 -0.1903 14 TRP D NE1 8958 C CE2 . TRP E 14 ? 0.6491 1.0240 0.7654 0.0671 -0.0419 -0.1984 14 TRP D CE2 8959 C CE3 . TRP E 14 ? 0.5913 0.9703 0.7333 0.0716 -0.0361 -0.2072 14 TRP D CE3 8960 C CZ2 . TRP E 14 ? 0.6404 1.0124 0.7606 0.0727 -0.0437 -0.2047 14 TRP D CZ2 8961 C CZ3 . TRP E 14 ? 0.5926 0.9687 0.7380 0.0757 -0.0374 -0.2131 14 TRP D CZ3 8962 C CH2 . TRP E 14 ? 0.5880 0.9618 0.7233 0.0766 -0.0411 -0.2121 14 TRP D CH2 8963 N N . GLN E 15 ? 0.8172 1.2331 0.9421 0.0479 -0.0292 -0.1840 15 GLN D N 8964 C CA . GLN E 15 ? 0.8484 1.2808 0.9837 0.0504 -0.0267 -0.1893 15 GLN D CA 8965 C C . GLN E 15 ? 0.7941 1.2345 0.9429 0.0597 -0.0263 -0.2008 15 GLN D C 8966 O O . GLN E 15 ? 0.6969 1.1382 0.8559 0.0648 -0.0259 -0.2058 15 GLN D O 8967 C CB . GLN E 15 ? 0.8779 1.3324 1.0059 0.0436 -0.0255 -0.1874 15 GLN D CB 8968 C CG . GLN E 15 ? 0.9265 1.3746 1.0410 0.0333 -0.0260 -0.1762 15 GLN D CG 8969 C CD . GLN E 15 ? 0.9878 1.4313 1.1080 0.0331 -0.0248 -0.1738 15 GLN D CD 8970 O OE1 . GLN E 15 ? 1.0120 1.4642 1.1450 0.0397 -0.0234 -0.1807 15 GLN D OE1 8971 N NE2 . GLN E 15 ? 1.0621 1.4910 1.1716 0.0258 -0.0260 -0.1639 15 GLN D NE2 8972 N N . GLY E 16 ? 0.8251 1.2698 0.9726 0.0618 -0.0272 -0.2050 16 GLY D N 8973 C CA . GLY E 16 ? 0.8457 1.2992 1.0041 0.0700 -0.0273 -0.2160 16 GLY D CA 8974 C C . GLY E 16 ? 0.7770 1.2139 0.9453 0.0760 -0.0281 -0.2206 16 GLY D C 8975 O O . GLY E 16 ? 0.8155 1.2573 0.9931 0.0825 -0.0287 -0.2292 16 GLY D O 8976 N N . MET E 17 ? 0.7336 1.1509 0.8992 0.0737 -0.0286 -0.2151 17 MET D N 8977 C CA . MET E 17 ? 0.7576 1.1597 0.9313 0.0773 -0.0291 -0.2185 17 MET D CA 8978 C C . MET E 17 ? 0.8183 1.2144 0.9963 0.0776 -0.0287 -0.2171 17 MET D C 8979 O O . MET E 17 ? 0.8712 1.2591 1.0446 0.0731 -0.0281 -0.2092 17 MET D O 8980 C CB . MET E 17 ? 0.8007 1.1867 0.9706 0.0748 -0.0297 -0.2143 17 MET D CB 8981 C CG . MET E 17 ? 0.8523 1.2273 1.0307 0.0778 -0.0300 -0.2199 17 MET D CG 8982 S SD . MET E 17 ? 1.1084 1.4676 1.2840 0.0750 -0.0304 -0.2162 17 MET D SD 8983 C CE . MET E 17 ? 1.0536 1.4201 1.2193 0.0747 -0.0321 -0.2142 17 MET D CE 8984 N N . VAL E 18 ? 0.7967 1.1955 0.9828 0.0834 -0.0297 -0.2250 18 VAL D N 8985 C CA . VAL E 18 ? 0.7875 1.1817 0.9773 0.0854 -0.0305 -0.2252 18 VAL D CA 8986 C C . VAL E 18 ? 0.7958 1.1703 0.9903 0.0876 -0.0322 -0.2280 18 VAL D C 8987 O O . VAL E 18 ? 0.7717 1.1364 0.9670 0.0877 -0.0330 -0.2259 18 VAL D O 8988 C CB . VAL E 18 ? 0.8163 1.2300 1.0102 0.0912 -0.0316 -0.2325 18 VAL D CB 8989 C CG1 . VAL E 18 ? 0.8217 1.2559 1.0099 0.0867 -0.0294 -0.2284 18 VAL D CG1 8990 C CG2 . VAL E 18 ? 0.7656 1.1857 0.9646 0.0980 -0.0337 -0.2433 18 VAL D CG2 8991 N N . ASP E 19 ? 0.8474 1.2159 1.0443 0.0887 -0.0331 -0.2328 19 ASP D N 8992 C CA . ASP E 19 ? 0.9576 1.3079 1.1578 0.0898 -0.0352 -0.2363 19 ASP D CA 8993 C C . ASP E 19 ? 0.9020 1.2359 1.1000 0.0833 -0.0337 -0.2302 19 ASP D C 8994 O O . ASP E 19 ? 0.8910 1.2108 1.0907 0.0820 -0.0350 -0.2328 19 ASP D O 8995 C CB . ASP E 19 ? 1.0579 1.4101 1.2621 0.0945 -0.0377 -0.2463 19 ASP D CB 8996 C CG . ASP E 19 ? 1.2092 1.5722 1.4129 0.0936 -0.0360 -0.2480 19 ASP D CG 8997 O OD1 . ASP E 19 ? 1.2365 1.6105 1.4362 0.0913 -0.0338 -0.2429 19 ASP D OD1 8998 O OD2 . ASP E 19 ? 1.3585 1.7185 1.5650 0.0950 -0.0375 -0.2545 19 ASP D OD2 8999 N N . GLY E 20 ? 0.8085 1.1444 1.0020 0.0790 -0.0314 -0.2223 20 GLY D N 9000 C CA . GLY E 20 ? 0.7489 1.0718 0.9404 0.0738 -0.0302 -0.2174 20 GLY D CA 9001 C C . GLY E 20 ? 0.6797 1.0040 0.8648 0.0703 -0.0288 -0.2092 20 GLY D C 9002 O O . GLY E 20 ? 0.7574 1.0914 0.9385 0.0703 -0.0285 -0.2058 20 GLY D O 9003 N N . TRP E 21 ? 0.7199 1.0346 0.9034 0.0669 -0.0283 -0.2063 21 TRP D N 9004 C CA . TRP E 21 ? 0.7074 1.0197 0.8839 0.0641 -0.0280 -0.1987 21 TRP D CA 9005 C C . TRP E 21 ? 0.6363 0.9540 0.8085 0.0651 -0.0291 -0.1998 21 TRP D C 9006 O O . TRP E 21 ? 0.5255 0.8453 0.6894 0.0643 -0.0303 -0.1945 21 TRP D O 9007 C CB . TRP E 21 ? 0.7664 1.0654 0.9429 0.0606 -0.0274 -0.1948 21 TRP D CB 9008 C CG . TRP E 21 ? 0.8597 1.1525 1.0355 0.0589 -0.0269 -0.1894 21 TRP D CG 9009 C CD1 . TRP E 21 ? 0.9461 1.2452 1.1213 0.0603 -0.0270 -0.1879 21 TRP D CD1 9010 C CD2 . TRP E 21 ? 0.9435 1.2241 1.1191 0.0555 -0.0263 -0.1853 21 TRP D CD2 9011 N NE1 . TRP E 21 ? 0.9915 1.2826 1.1664 0.0585 -0.0267 -0.1834 21 TRP D NE1 9012 C CE2 . TRP E 21 ? 1.0091 1.2879 1.1839 0.0554 -0.0263 -0.1813 21 TRP D CE2 9013 C CE3 . TRP E 21 ? 1.0657 1.3381 1.2416 0.0525 -0.0258 -0.1851 21 TRP D CE3 9014 C CZ2 . TRP E 21 ? 1.0077 1.2752 1.1818 0.0526 -0.0259 -0.1767 21 TRP D CZ2 9015 C CZ3 . TRP E 21 ? 1.1024 1.3642 1.2774 0.0492 -0.0251 -0.1804 21 TRP D CZ3 9016 C CH2 . TRP E 21 ? 1.0685 1.3271 1.2425 0.0494 -0.0253 -0.1760 21 TRP D CH2 9017 N N . TYR E 22 ? 0.6144 0.9334 0.7912 0.0665 -0.0293 -0.2065 22 TYR D N 9018 C CA . TYR E 22 ? 0.6237 0.9484 0.7973 0.0686 -0.0308 -0.2092 22 TYR D CA 9019 C C . TYR E 22 ? 0.6620 0.9962 0.8409 0.0716 -0.0309 -0.2175 22 TYR D C 9020 O O . TYR E 22 ? 0.7044 1.0368 0.8905 0.0714 -0.0301 -0.2227 22 TYR D O 9021 C CB . TYR E 22 ? 0.6553 0.9745 0.8297 0.0676 -0.0312 -0.2106 22 TYR D CB 9022 C CG . TYR E 22 ? 0.6602 0.9691 0.8329 0.0643 -0.0306 -0.2048 22 TYR D CG 9023 C CD1 . TYR E 22 ? 0.7127 1.0167 0.8770 0.0636 -0.0318 -0.1969 22 TYR D CD1 9024 C CD2 . TYR E 22 ? 0.6864 0.9901 0.8649 0.0611 -0.0289 -0.2072 22 TYR D CD2 9025 C CE1 . TYR E 22 ? 0.7520 1.0466 0.9147 0.0609 -0.0314 -0.1919 22 TYR D CE1 9026 C CE2 . TYR E 22 ? 0.6985 0.9935 0.8753 0.0580 -0.0283 -0.2022 22 TYR D CE2 9027 C CZ . TYR E 22 ? 0.7310 1.0218 0.9004 0.0584 -0.0295 -0.1947 22 TYR D CZ 9028 O OH . TYR E 22 ? 0.7056 0.9881 0.8737 0.0555 -0.0290 -0.1903 22 TYR D OH 9029 N N . GLY E 23 ? 0.6003 0.9433 0.7747 0.0742 -0.0324 -0.2188 23 GLY D N 9030 C CA . GLY E 23 ? 0.6652 1.0177 0.8443 0.0774 -0.0327 -0.2269 23 GLY D CA 9031 C C . GLY E 23 ? 0.6455 1.0070 0.8184 0.0801 -0.0347 -0.2282 23 GLY D C 9032 O O . GLY E 23 ? 0.6304 0.9886 0.7951 0.0802 -0.0369 -0.2244 23 GLY D O 9033 N N . TYR E 24 ? 0.6532 1.0253 0.8296 0.0828 -0.0345 -0.2340 24 TYR D N 9034 C CA . TYR E 24 ? 0.6356 1.0169 0.8078 0.0857 -0.0364 -0.2373 24 TYR D CA 9035 C C . TYR E 24 ? 0.6720 1.0653 0.8413 0.0864 -0.0361 -0.2373 24 TYR D C 9036 O O . TYR E 24 ? 0.6745 1.0725 0.8500 0.0870 -0.0345 -0.2398 24 TYR D O 9037 C CB . TYR E 24 ? 0.6807 1.0658 0.8613 0.0883 -0.0364 -0.2468 24 TYR D CB 9038 C CG . TYR E 24 ? 0.6704 1.0473 0.8560 0.0866 -0.0360 -0.2490 24 TYR D CG 9039 C CD1 . TYR E 24 ? 0.6183 0.9938 0.8000 0.0874 -0.0378 -0.2490 24 TYR D CD1 9040 C CD2 . TYR E 24 ? 0.6387 1.0099 0.8321 0.0840 -0.0342 -0.2516 24 TYR D CD2 9041 C CE1 . TYR E 24 ? 0.6372 1.0088 0.8239 0.0854 -0.0371 -0.2518 24 TYR D CE1 9042 C CE2 . TYR E 24 ? 0.6372 1.0025 0.8344 0.0808 -0.0335 -0.2536 24 TYR D CE2 9043 C CZ . TYR E 24 ? 0.6376 1.0047 0.8320 0.0814 -0.0346 -0.2539 24 TYR D CZ 9044 O OH . TYR E 24 ? 0.6639 1.0283 0.8622 0.0779 -0.0338 -0.2565 24 TYR D OH 9045 N N . HIS E 25 ? 0.7124 1.1106 0.8715 0.0863 -0.0382 -0.2346 25 HIS D N 9046 C CA . HIS E 25 ? 0.7973 1.2104 0.9534 0.0868 -0.0381 -0.2363 25 HIS D CA 9047 C C . HIS E 25 ? 0.8481 1.2674 1.0034 0.0907 -0.0401 -0.2427 25 HIS D C 9048 O O . HIS E 25 ? 0.7899 1.2034 0.9369 0.0911 -0.0431 -0.2406 25 HIS D O 9049 C CB . HIS E 25 ? 0.8887 1.3031 1.0310 0.0817 -0.0390 -0.2273 25 HIS D CB 9050 C CG . HIS E 25 ? 0.9404 1.3727 1.0795 0.0809 -0.0383 -0.2291 25 HIS D CG 9051 N ND1 . HIS E 25 ? 0.9365 1.3727 1.0612 0.0773 -0.0406 -0.2246 25 HIS D ND1 9052 C CD2 . HIS E 25 ? 0.8637 1.3114 1.0117 0.0832 -0.0360 -0.2355 25 HIS D CD2 9053 C CE1 . HIS E 25 ? 0.8595 1.3145 0.9848 0.0766 -0.0390 -0.2279 25 HIS D CE1 9054 N NE2 . HIS E 25 ? 0.8897 1.3526 1.0296 0.0808 -0.0363 -0.2349 25 HIS D NE2 9055 N N . HIS E 26 ? 0.8978 1.3286 1.0615 0.0941 -0.0390 -0.2510 26 HIS D N 9056 C CA . HIS E 26 ? 0.9362 1.3733 1.1009 0.0980 -0.0407 -0.2580 26 HIS D CA 9057 C C . HIS E 26 ? 0.9453 1.3981 1.1051 0.0985 -0.0409 -0.2595 26 HIS D C 9058 O O . HIS E 26 ? 0.8944 1.3575 1.0580 0.0984 -0.0389 -0.2611 26 HIS D O 9059 C CB . HIS E 26 ? 0.9803 1.4168 1.1582 0.1012 -0.0398 -0.2672 26 HIS D CB 9060 C CG . HIS E 26 ? 1.1249 1.5695 1.3106 0.1032 -0.0384 -0.2728 26 HIS D CG 9061 N ND1 . HIS E 26 ? 1.2269 1.6648 1.4188 0.1024 -0.0371 -0.2725 26 HIS D ND1 9062 C CD2 . HIS E 26 ? 1.1835 1.6424 1.3715 0.1068 -0.0387 -0.2794 26 HIS D CD2 9063 C CE1 . HIS E 26 ? 1.2648 1.7117 1.4620 0.1060 -0.0373 -0.2790 26 HIS D CE1 9064 N NE2 . HIS E 26 ? 1.2813 1.7417 1.4767 0.1088 -0.0380 -0.2835 26 HIS D NE2 9065 N N . SER E 27 ? 0.9970 1.4520 1.1476 0.0993 -0.0436 -0.2592 27 SER D N 9066 C CA . SER E 27 ? 0.9840 1.4532 1.1266 0.0984 -0.0443 -0.2593 27 SER D CA 9067 C C . SER E 27 ? 0.9585 1.4350 1.1036 0.1035 -0.0460 -0.2677 27 SER D C 9068 O O . SER E 27 ? 0.8980 1.3679 1.0350 0.1048 -0.0495 -0.2667 27 SER D O 9069 C CB . SER E 27 ? 1.0151 1.4780 1.1395 0.0927 -0.0469 -0.2489 27 SER D CB 9070 O OG . SER E 27 ? 1.0952 1.5726 1.2126 0.0881 -0.0456 -0.2462 27 SER D OG 9071 N N . ASN E 28 ? 0.9180 1.4070 1.0742 0.1072 -0.0441 -0.2765 28 ASN D N 9072 C CA . ASN E 28 ? 0.8497 1.3472 1.0094 0.1122 -0.0456 -0.2854 28 ASN D CA 9073 C C . ASN E 28 ? 0.9454 1.4624 1.1070 0.1139 -0.0444 -0.2909 28 ASN D C 9074 O O . ASN E 28 ? 0.9465 1.4725 1.1041 0.1105 -0.0428 -0.2870 28 ASN D O 9075 C CB . ASN E 28 ? 0.7529 1.2433 0.9253 0.1158 -0.0454 -0.2929 28 ASN D CB 9076 C CG . ASN E 28 ? 0.7773 1.2698 0.9621 0.1173 -0.0433 -0.2987 28 ASN D CG 9077 O OD1 . ASN E 28 ? 0.7809 1.2811 0.9662 0.1170 -0.0419 -0.2979 28 ASN D OD1 9078 N ND2 . ASN E 28 ? 0.7629 1.2490 0.9571 0.1191 -0.0435 -0.3053 28 ASN D ND2 9079 N N . GLU E 29 ? 1.0221 1.5471 1.1900 0.1190 -0.0453 -0.3004 29 GLU D N 9080 C CA . GLU E 29 ? 1.1494 1.6943 1.3184 0.1215 -0.0447 -0.3066 29 GLU D CA 9081 C C . GLU E 29 ? 1.0653 1.6187 1.2436 0.1233 -0.0427 -0.3109 29 GLU D C 9082 O O . GLU E 29 ? 1.0204 1.5909 1.1955 0.1225 -0.0416 -0.3114 29 GLU D O 9083 C CB . GLU E 29 ? 1.2743 1.8247 1.4489 0.1271 -0.0464 -0.3166 29 GLU D CB 9084 C CG . GLU E 29 ? 1.3930 1.9596 1.5590 0.1276 -0.0476 -0.3183 29 GLU D CG 9085 C CD . GLU E 29 ? 1.4720 2.0307 1.6255 0.1260 -0.0506 -0.3131 29 GLU D CD 9086 O OE1 . GLU E 29 ? 1.4913 2.0407 1.6488 0.1293 -0.0525 -0.3168 29 GLU D OE1 9087 O OE2 . GLU E 29 ? 1.5624 2.1241 1.7010 0.1213 -0.0517 -0.3057 29 GLU D OE2 9088 N N . GLN E 30 ? 1.1360 1.6772 1.3247 0.1254 -0.0425 -0.3141 30 GLN D N 9089 C CA . GLN E 30 ? 1.1091 1.6548 1.3070 0.1291 -0.0420 -0.3200 30 GLN D CA 9090 C C . GLN E 30 ? 1.0888 1.6368 1.2836 0.1256 -0.0402 -0.3131 30 GLN D C 9091 O O . GLN E 30 ? 1.0442 1.5959 1.2456 0.1291 -0.0404 -0.3177 30 GLN D O 9092 C CB . GLN E 30 ? 1.1179 1.6468 1.3255 0.1315 -0.0433 -0.3250 30 GLN D CB 9093 C CG . GLN E 30 ? 1.1413 1.6694 1.3538 0.1350 -0.0452 -0.3339 30 GLN D CG 9094 C CD . GLN E 30 ? 1.2549 1.7723 1.4649 0.1316 -0.0453 -0.3304 30 GLN D CD 9095 O OE1 . GLN E 30 ? 1.3699 1.8729 1.5846 0.1299 -0.0455 -0.3312 30 GLN D OE1 9096 N NE2 . GLN E 30 ? 1.3138 1.8382 1.5154 0.1305 -0.0454 -0.3265 30 GLN D NE2 9097 N N . GLY E 31 ? 1.1454 1.6910 1.3296 0.1190 -0.0392 -0.3026 31 GLY D N 9098 C CA . GLY E 31 ? 1.1189 1.6657 1.2989 0.1142 -0.0374 -0.2950 31 GLY D CA 9099 C C . GLY E 31 ? 1.0717 1.5960 1.2498 0.1104 -0.0374 -0.2868 31 GLY D C 9100 O O . GLY E 31 ? 0.9504 1.4602 1.1332 0.1123 -0.0384 -0.2890 31 GLY D O 9101 N N . SER E 32 ? 1.0873 1.6100 1.2584 0.1046 -0.0361 -0.2778 32 SER D N 9102 C CA . SER E 32 ? 1.0998 1.6024 1.2684 0.1008 -0.0361 -0.2696 32 SER D CA 9103 C C . SER E 32 ? 1.1219 1.6193 1.2984 0.1016 -0.0348 -0.2696 32 SER D C 9104 O O . SER E 32 ? 1.0652 1.5743 1.2487 0.1057 -0.0345 -0.2762 32 SER D O 9105 C CB . SER E 32 ? 1.0581 1.5589 1.2114 0.0934 -0.0364 -0.2588 32 SER D CB 9106 O OG . SER E 32 ? 1.0012 1.5188 1.1504 0.0895 -0.0348 -0.2567 32 SER D OG 9107 N N . GLY E 33 ? 1.1441 1.6238 1.3191 0.0983 -0.0346 -0.2626 33 GLY D N 9108 C CA . GLY E 33 ? 1.0642 1.5359 1.2458 0.0987 -0.0338 -0.2619 33 GLY D CA 9109 C C . GLY E 33 ? 0.9967 1.4473 1.1775 0.0957 -0.0338 -0.2557 33 GLY D C 9110 O O . GLY E 33 ? 1.0600 1.5018 1.2380 0.0949 -0.0347 -0.2545 33 GLY D O 9111 N N . TYR E 34 ? 0.8703 1.3139 1.0537 0.0944 -0.0329 -0.2524 34 TYR D N 9112 C CA . TYR E 34 ? 0.8071 1.2322 0.9896 0.0911 -0.0327 -0.2463 34 TYR D CA 9113 C C . TYR E 34 ? 0.7893 1.2028 0.9810 0.0937 -0.0332 -0.2519 34 TYR D C 9114 O O . TYR E 34 ? 0.7745 1.1916 0.9721 0.0977 -0.0341 -0.2583 34 TYR D O 9115 C CB . TYR E 34 ? 0.7362 1.1599 0.9146 0.0871 -0.0316 -0.2384 34 TYR D CB 9116 C CG . TYR E 34 ? 0.7591 1.1921 0.9261 0.0822 -0.0313 -0.2315 34 TYR D CG 9117 C CD1 . TYR E 34 ? 0.7789 1.2315 0.9443 0.0818 -0.0304 -0.2331 34 TYR D CD1 9118 C CD2 . TYR E 34 ? 0.7276 1.1496 0.8844 0.0777 -0.0324 -0.2235 34 TYR D CD2 9119 C CE1 . TYR E 34 ? 0.8218 1.2825 0.9751 0.0753 -0.0302 -0.2262 34 TYR D CE1 9120 C CE2 . TYR E 34 ? 0.7891 1.2163 0.9329 0.0721 -0.0331 -0.2165 34 TYR D CE2 9121 C CZ . TYR E 34 ? 0.7825 1.2289 0.9244 0.0701 -0.0318 -0.2175 34 TYR D CZ 9122 O OH . TYR E 34 ? 0.8473 1.2982 0.9748 0.0628 -0.0326 -0.2101 34 TYR D OH 9123 N N . ALA E 35 ? 0.8377 1.2370 1.0296 0.0912 -0.0333 -0.2497 35 ALA D N 9124 C CA . ALA E 35 ? 0.8360 1.2224 1.0346 0.0911 -0.0336 -0.2533 35 ALA D CA 9125 C C . ALA E 35 ? 0.8589 1.2313 1.0552 0.0862 -0.0327 -0.2464 35 ALA D C 9126 O O . ALA E 35 ? 0.8573 1.2283 1.0494 0.0842 -0.0325 -0.2430 35 ALA D O 9127 C CB . ALA E 35 ? 0.8263 1.2131 1.0296 0.0929 -0.0347 -0.2617 35 ALA D CB 9128 N N . ALA E 36 ? 0.8941 1.2558 1.0930 0.0848 -0.0326 -0.2449 36 ALA D N 9129 C CA . ALA E 36 ? 0.9112 1.2601 1.1082 0.0801 -0.0316 -0.2385 36 ALA D CA 9130 C C . ALA E 36 ? 0.8860 1.2266 1.0863 0.0772 -0.0317 -0.2424 36 ALA D C 9131 O O . ALA E 36 ? 0.9053 1.2437 1.1098 0.0778 -0.0328 -0.2492 36 ALA D O 9132 C CB . ALA E 36 ? 0.9251 1.2660 1.1225 0.0794 -0.0317 -0.2351 36 ALA D CB 9133 N N . ASP E 37 ? 0.8308 1.1678 1.0286 0.0739 -0.0307 -0.2386 37 ASP D N 9134 C CA . ASP E 37 ? 0.8631 1.1943 1.0641 0.0698 -0.0303 -0.2419 37 ASP D CA 9135 C C . ASP E 37 ? 0.8670 1.1842 1.0686 0.0655 -0.0299 -0.2390 37 ASP D C 9136 O O . ASP E 37 ? 0.9851 1.2966 1.1838 0.0636 -0.0290 -0.2322 37 ASP D O 9137 C CB . ASP E 37 ? 0.9061 1.2399 1.1042 0.0687 -0.0299 -0.2397 37 ASP D CB 9138 C CG . ASP E 37 ? 0.8951 1.2289 1.0972 0.0648 -0.0293 -0.2453 37 ASP D CG 9139 O OD1 . ASP E 37 ? 1.0582 1.3989 1.2638 0.0658 -0.0299 -0.2527 37 ASP D OD1 9140 O OD2 . ASP E 37 ? 0.8603 1.1882 1.0620 0.0603 -0.0282 -0.2426 37 ASP D OD2 9141 N N . LYS E 38 ? 0.9396 1.2505 1.1441 0.0639 -0.0311 -0.2443 38 LYS D N 9142 C CA . LYS E 38 ? 0.9698 1.2651 1.1732 0.0600 -0.0319 -0.2421 38 LYS D CA 9143 C C . LYS E 38 ? 0.8709 1.1591 1.0729 0.0527 -0.0300 -0.2383 38 LYS D C 9144 O O . LYS E 38 ? 0.7917 1.0715 0.9912 0.0507 -0.0295 -0.2321 38 LYS D O 9145 C CB . LYS E 38 ? 1.1518 1.4398 1.3566 0.0593 -0.0347 -0.2494 38 LYS D CB 9146 C CG . LYS E 38 ? 1.3070 1.5755 1.5085 0.0547 -0.0369 -0.2479 38 LYS D CG 9147 C CD . LYS E 38 ? 1.4311 1.6938 1.6310 0.0608 -0.0396 -0.2461 38 LYS D CD 9148 C CE . LYS E 38 ? 1.4843 1.7253 1.6797 0.0575 -0.0438 -0.2473 38 LYS D CE 9149 N NZ . LYS E 38 ? 1.5003 1.7371 1.6950 0.0658 -0.0490 -0.2524 38 LYS D NZ 9150 N N . GLU E 39 ? 0.9471 1.2402 1.1509 0.0486 -0.0291 -0.2427 39 GLU D N 9151 C CA . GLU E 39 ? 0.9592 1.2475 1.1621 0.0406 -0.0274 -0.2409 39 GLU D CA 9152 C C . GLU E 39 ? 0.9082 1.1978 1.1089 0.0415 -0.0258 -0.2337 39 GLU D C 9153 O O . GLU E 39 ? 1.0341 1.3137 1.2325 0.0370 -0.0251 -0.2288 39 GLU D O 9154 C CB . GLU E 39 ? 1.0190 1.3178 1.2249 0.0367 -0.0264 -0.2479 39 GLU D CB 9155 C CG . GLU E 39 ? 1.1186 1.4162 1.3239 0.0277 -0.0244 -0.2471 39 GLU D CG 9156 C CD . GLU E 39 ? 1.1537 1.4649 1.3624 0.0234 -0.0233 -0.2549 39 GLU D CD 9157 O OE1 . GLU E 39 ? 1.1394 1.4529 1.3500 0.0225 -0.0245 -0.2612 39 GLU D OE1 9158 O OE2 . GLU E 39 ? 1.1717 1.4924 1.3813 0.0211 -0.0216 -0.2554 39 GLU D OE2 9159 N N . SER E 40 ? 0.7404 1.0412 0.9407 0.0472 -0.0257 -0.2330 40 SER D N 9160 C CA . SER E 40 ? 0.7369 1.0380 0.9339 0.0481 -0.0251 -0.2269 40 SER D CA 9161 C C . SER E 40 ? 0.7695 1.0622 0.9628 0.0497 -0.0254 -0.2190 40 SER D C 9162 O O . SER E 40 ? 0.7713 1.0590 0.9617 0.0480 -0.0248 -0.2133 40 SER D O 9163 C CB . SER E 40 ? 0.7371 1.0499 0.9324 0.0537 -0.0263 -0.2288 40 SER D CB 9164 O OG . SER E 40 ? 0.6081 0.9236 0.8007 0.0592 -0.0277 -0.2268 40 SER D OG 9165 N N . THR E 41 ? 0.7012 0.9939 0.8949 0.0533 -0.0263 -0.2193 41 THR D N 9166 C CA . THR E 41 ? 0.7054 0.9915 0.8968 0.0543 -0.0266 -0.2134 41 THR D CA 9167 C C . THR E 41 ? 0.7400 1.0118 0.9313 0.0492 -0.0264 -0.2110 41 THR D C 9168 O O . THR E 41 ? 0.6107 0.8764 0.7992 0.0480 -0.0259 -0.2045 41 THR D O 9169 C CB . THR E 41 ? 0.6638 0.9551 0.8567 0.0594 -0.0280 -0.2165 41 THR D CB 9170 O OG1 . THR E 41 ? 0.5775 0.8810 0.7681 0.0632 -0.0281 -0.2158 41 THR D OG1 9171 C CG2 . THR E 41 ? 0.6683 0.9528 0.8601 0.0603 -0.0287 -0.2127 41 THR D CG2 9172 N N . GLN E 42 ? 0.7408 1.0067 0.9341 0.0457 -0.0271 -0.2162 42 GLN D N 9173 C CA . GLN E 42 ? 0.7372 0.9878 0.9284 0.0397 -0.0275 -0.2141 42 GLN D CA 9174 C C . GLN E 42 ? 0.7123 0.9614 0.9020 0.0338 -0.0252 -0.2101 42 GLN D C 9175 O O . GLN E 42 ? 0.7131 0.9511 0.8998 0.0303 -0.0251 -0.2050 42 GLN D O 9176 C CB . GLN E 42 ? 0.7412 0.9849 0.9328 0.0357 -0.0293 -0.2207 42 GLN D CB 9177 C CG . GLN E 42 ? 0.7442 0.9683 0.9313 0.0309 -0.0317 -0.2187 42 GLN D CG 9178 C CD . GLN E 42 ? 0.7905 1.0078 0.9760 0.0380 -0.0347 -0.2166 42 GLN D CD 9179 O OE1 . GLN E 42 ? 0.8212 1.0410 1.0081 0.0445 -0.0374 -0.2214 42 GLN D OE1 9180 N NE2 . GLN E 42 ? 0.8497 1.0599 1.0325 0.0370 -0.0342 -0.2098 42 GLN D NE2 9181 N N . LYS E 43 ? 0.7641 1.0247 0.9556 0.0331 -0.0237 -0.2129 43 LYS D N 9182 C CA . LYS E 43 ? 0.8132 1.0756 1.0037 0.0286 -0.0218 -0.2107 43 LYS D CA 9183 C C . LYS E 43 ? 0.7263 0.9847 0.9135 0.0315 -0.0218 -0.2027 43 LYS D C 9184 O O . LYS E 43 ? 0.7555 1.0054 0.9404 0.0273 -0.0210 -0.1980 43 LYS D O 9185 C CB . LYS E 43 ? 0.9254 1.2034 1.1185 0.0302 -0.0213 -0.2165 43 LYS D CB 9186 C CG . LYS E 43 ? 1.1258 1.4101 1.3191 0.0259 -0.0197 -0.2176 43 LYS D CG 9187 C CD . LYS E 43 ? 1.3032 1.5987 1.5004 0.0212 -0.0188 -0.2264 43 LYS D CD 9188 C CE . LYS E 43 ? 1.2651 1.5737 1.4635 0.0198 -0.0178 -0.2299 43 LYS D CE 9189 N NZ . LYS E 43 ? 1.2442 1.5686 1.4470 0.0180 -0.0174 -0.2396 43 LYS D NZ 9190 N N . ALA E 44 ? 0.6297 0.8937 0.8159 0.0383 -0.0228 -0.2009 44 ALA D N 9191 C CA . ALA E 44 ? 0.6475 0.9086 0.8295 0.0405 -0.0231 -0.1935 44 ALA D CA 9192 C C . ALA E 44 ? 0.6250 0.8750 0.8058 0.0390 -0.0231 -0.1884 44 ALA D C 9193 O O . ALA E 44 ? 0.6306 0.8749 0.8086 0.0374 -0.0227 -0.1826 44 ALA D O 9194 C CB . ALA E 44 ? 0.6460 0.9152 0.8257 0.0465 -0.0245 -0.1928 44 ALA D CB 9195 N N . ILE E 45 ? 0.6900 0.9371 0.8727 0.0403 -0.0241 -0.1912 45 ILE D N 9196 C CA . ILE E 45 ? 0.6616 0.8978 0.8430 0.0400 -0.0251 -0.1878 45 ILE D CA 9197 C C . ILE E 45 ? 0.6581 0.8814 0.8376 0.0330 -0.0247 -0.1857 45 ILE D C 9198 O O . ILE E 45 ? 0.6423 0.8579 0.8191 0.0319 -0.0247 -0.1800 45 ILE D O 9199 C CB . ILE E 45 ? 0.6973 0.9327 0.8806 0.0440 -0.0275 -0.1928 45 ILE D CB 9200 C CG1 . ILE E 45 ? 0.7411 0.9889 0.9251 0.0504 -0.0279 -0.1926 45 ILE D CG1 9201 C CG2 . ILE E 45 ? 0.7534 0.9737 0.9346 0.0430 -0.0298 -0.1915 45 ILE D CG2 9202 C CD1 . ILE E 45 ? 0.8273 1.0792 1.0140 0.0556 -0.0302 -0.1992 45 ILE D CD1 9203 N N . ASP E 46 ? 0.6386 0.8601 0.8189 0.0278 -0.0243 -0.1903 46 ASP D N 9204 C CA . ASP E 46 ? 0.6713 0.8820 0.8487 0.0196 -0.0236 -0.1884 46 ASP D CA 9205 C C . ASP E 46 ? 0.7001 0.9142 0.8764 0.0179 -0.0214 -0.1833 46 ASP D C 9206 O O . ASP E 46 ? 0.6700 0.8740 0.8430 0.0139 -0.0212 -0.1784 46 ASP D O 9207 C CB . ASP E 46 ? 0.7107 0.9226 0.8888 0.0127 -0.0231 -0.1945 46 ASP D CB 9208 C CG . ASP E 46 ? 0.7753 0.9790 0.9526 0.0129 -0.0262 -0.1994 46 ASP D CG 9209 O OD1 . ASP E 46 ? 0.7650 0.9631 0.9418 0.0194 -0.0289 -0.1986 46 ASP D OD1 9210 O OD2 . ASP E 46 ? 0.7872 0.9910 0.9644 0.0066 -0.0263 -0.2045 46 ASP D OD2 9211 N N . GLY E 47 ? 0.6050 0.8326 0.7833 0.0213 -0.0203 -0.1847 47 GLY D N 9212 C CA . GLY E 47 ? 0.6195 0.8507 0.7962 0.0203 -0.0191 -0.1816 47 GLY D CA 9213 C C . GLY E 47 ? 0.5798 0.8047 0.7532 0.0232 -0.0197 -0.1738 47 GLY D C 9214 O O . GLY E 47 ? 0.5392 0.7585 0.7101 0.0200 -0.0190 -0.1696 47 GLY D O 9215 N N . VAL E 48 ? 0.5502 0.7773 0.7232 0.0290 -0.0210 -0.1724 48 VAL D N 9216 C CA . VAL E 48 ? 0.5595 0.7833 0.7292 0.0315 -0.0217 -0.1655 48 VAL D CA 9217 C C . VAL E 48 ? 0.6333 0.8453 0.8023 0.0289 -0.0218 -0.1622 48 VAL D C 9218 O O . VAL E 48 ? 0.6800 0.8864 0.8461 0.0279 -0.0217 -0.1562 48 VAL D O 9219 C CB . VAL E 48 ? 0.5382 0.7698 0.7073 0.0369 -0.0229 -0.1655 48 VAL D CB 9220 C CG1 . VAL E 48 ? 0.6091 0.8379 0.7755 0.0382 -0.0235 -0.1596 48 VAL D CG1 9221 C CG2 . VAL E 48 ? 0.5107 0.7497 0.6768 0.0393 -0.0238 -0.1659 48 VAL D CG2 9222 N N . THR E 49 ? 0.6174 0.8243 0.7883 0.0277 -0.0226 -0.1662 49 THR D N 9223 C CA . THR E 49 ? 0.6236 0.8168 0.7923 0.0256 -0.0239 -0.1638 49 THR D CA 9224 C C . THR E 49 ? 0.6146 0.7991 0.7803 0.0182 -0.0226 -0.1607 49 THR D C 9225 O O . THR E 49 ? 0.5319 0.7069 0.6946 0.0169 -0.0232 -0.1556 49 THR D O 9226 C CB . THR E 49 ? 0.5876 0.7750 0.7571 0.0265 -0.0264 -0.1694 49 THR D CB 9227 O OG1 . THR E 49 ? 0.6495 0.8456 0.8216 0.0340 -0.0278 -0.1717 49 THR D OG1 9228 C CG2 . THR E 49 ? 0.5807 0.7501 0.7458 0.0237 -0.0291 -0.1676 49 THR D CG2 9229 N N . ASN E 50 ? 0.6178 0.8069 0.7845 0.0134 -0.0210 -0.1643 50 ASN D N 9230 C CA . ASN E 50 ? 0.6358 0.8206 0.7999 0.0059 -0.0194 -0.1623 50 ASN D CA 9231 C C . ASN E 50 ? 0.6237 0.8115 0.7867 0.0076 -0.0183 -0.1570 50 ASN D C 9232 O O . ASN E 50 ? 0.6521 0.8327 0.8120 0.0029 -0.0177 -0.1532 50 ASN D O 9233 C CB . ASN E 50 ? 0.7133 0.9076 0.8795 0.0007 -0.0176 -0.1683 50 ASN D CB 9234 C CG . ASN E 50 ? 0.8325 1.0169 0.9952 -0.0089 -0.0177 -0.1698 50 ASN D CG 9235 O OD1 . ASN E 50 ? 0.7578 0.9405 0.9177 -0.0164 -0.0160 -0.1679 50 ASN D OD1 9236 N ND2 . ASN E 50 ? 0.8652 1.0420 1.0271 -0.0093 -0.0200 -0.1729 50 ASN D ND2 9237 N N . LYS E 51 ? 0.5055 0.7030 0.6699 0.0139 -0.0186 -0.1568 51 LYS D N 9238 C CA . LYS E 51 ? 0.5138 0.7130 0.6757 0.0159 -0.0186 -0.1522 51 LYS D CA 9239 C C . LYS E 51 ? 0.4872 0.6759 0.6462 0.0161 -0.0193 -0.1453 51 LYS D C 9240 O O . LYS E 51 ? 0.4317 0.6157 0.5880 0.0136 -0.0188 -0.1412 51 LYS D O 9241 C CB . LYS E 51 ? 0.5402 0.7488 0.7018 0.0223 -0.0199 -0.1530 51 LYS D CB 9242 C CG . LYS E 51 ? 0.5104 0.7170 0.6670 0.0247 -0.0212 -0.1471 51 LYS D CG 9243 C CD . LYS E 51 ? 0.5226 0.7356 0.6762 0.0302 -0.0235 -0.1475 51 LYS D CD 9244 C CE . LYS E 51 ? 0.5717 0.7937 0.7264 0.0323 -0.0243 -0.1543 51 LYS D CE 9245 N NZ . LYS E 51 ? 0.5957 0.8189 0.7437 0.0376 -0.0281 -0.1530 51 LYS D NZ 9246 N N . VAL E 52 ? 0.5089 0.6959 0.6685 0.0197 -0.0205 -0.1446 52 VAL D N 9247 C CA . VAL E 52 ? 0.4918 0.6720 0.6494 0.0210 -0.0215 -0.1392 52 VAL D CA 9248 C C . VAL E 52 ? 0.5477 0.7149 0.7033 0.0162 -0.0217 -0.1374 52 VAL D C 9249 O O . VAL E 52 ? 0.6180 0.7792 0.7708 0.0146 -0.0216 -0.1321 52 VAL D O 9250 C CB . VAL E 52 ? 0.5396 0.7235 0.6991 0.0261 -0.0230 -0.1411 52 VAL D CB 9251 C CG1 . VAL E 52 ? 0.5997 0.7774 0.7577 0.0275 -0.0244 -0.1371 52 VAL D CG1 9252 C CG2 . VAL E 52 ? 0.5384 0.7347 0.6978 0.0297 -0.0230 -0.1411 52 VAL D CG2 9253 N N . ASN E 53 ? 0.5397 0.7016 0.6957 0.0132 -0.0222 -0.1418 53 ASN D N 9254 C CA . ASN E 53 ? 0.5711 0.7185 0.7231 0.0074 -0.0231 -0.1401 53 ASN D CA 9255 C C . ASN E 53 ? 0.5499 0.6967 0.6996 0.0008 -0.0207 -0.1374 53 ASN D C 9256 O O . ASN E 53 ? 0.6193 0.7551 0.7647 -0.0030 -0.0212 -0.1333 53 ASN D O 9257 C CB . ASN E 53 ? 0.5666 0.7071 0.7176 0.0043 -0.0248 -0.1455 53 ASN D CB 9258 C CG . ASN E 53 ? 0.6062 0.7431 0.7580 0.0113 -0.0284 -0.1482 53 ASN D CG 9259 O OD1 . ASN E 53 ? 0.4874 0.6247 0.6397 0.0172 -0.0298 -0.1457 53 ASN D OD1 9260 N ND2 . ASN E 53 ? 0.6972 0.8317 0.8491 0.0105 -0.0300 -0.1540 53 ASN D ND2 9261 N N . SER E 54 ? 0.4794 0.6386 0.6316 -0.0001 -0.0185 -0.1402 54 SER D N 9262 C CA . SER E 54 ? 0.4849 0.6471 0.6356 -0.0054 -0.0164 -0.1391 54 SER D CA 9263 C C . SER E 54 ? 0.4929 0.6530 0.6416 -0.0022 -0.0167 -0.1328 54 SER D C 9264 O O . SER E 54 ? 0.4208 0.5752 0.5663 -0.0067 -0.0160 -0.1295 54 SER D O 9265 C CB . SER E 54 ? 0.4808 0.6587 0.6350 -0.0047 -0.0150 -0.1449 54 SER D CB 9266 O OG . SER E 54 ? 0.4993 0.6801 0.6548 -0.0101 -0.0142 -0.1507 54 SER D OG 9267 N N . ILE E 55 ? 0.5088 0.6733 0.6586 0.0048 -0.0178 -0.1312 55 ILE D N 9268 C CA . ILE E 55 ? 0.5092 0.6713 0.6563 0.0074 -0.0186 -0.1252 55 ILE D CA 9269 C C . ILE E 55 ? 0.5242 0.6740 0.6689 0.0057 -0.0193 -0.1203 55 ILE D C 9270 O O . ILE E 55 ? 0.6233 0.7689 0.7652 0.0048 -0.0194 -0.1153 55 ILE D O 9271 C CB . ILE E 55 ? 0.4781 0.6471 0.6254 0.0137 -0.0200 -0.1246 55 ILE D CB 9272 C CG1 . ILE E 55 ? 0.4830 0.6614 0.6303 0.0156 -0.0202 -0.1284 55 ILE D CG1 9273 C CG2 . ILE E 55 ? 0.5289 0.6936 0.6725 0.0153 -0.0211 -0.1178 55 ILE D CG2 9274 C CD1 . ILE E 55 ? 0.4823 0.6668 0.6285 0.0209 -0.0220 -0.1287 55 ILE D CD1 9275 N N . ILE E 56 ? 0.5579 0.7018 0.7033 0.0059 -0.0205 -0.1221 56 ILE D N 9276 C CA . ILE E 56 ? 0.4986 0.6300 0.6411 0.0057 -0.0224 -0.1186 56 ILE D CA 9277 C C . ILE E 56 ? 0.5419 0.6611 0.6799 -0.0018 -0.0224 -0.1177 56 ILE D C 9278 O O . ILE E 56 ? 0.5354 0.6460 0.6696 -0.0037 -0.0229 -0.1130 56 ILE D O 9279 C CB . ILE E 56 ? 0.4738 0.6037 0.6180 0.0107 -0.0250 -0.1220 56 ILE D CB 9280 C CG1 . ILE E 56 ? 0.4771 0.6196 0.6246 0.0172 -0.0251 -0.1219 56 ILE D CG1 9281 C CG2 . ILE E 56 ? 0.4475 0.5627 0.5879 0.0112 -0.0283 -0.1203 56 ILE D CG2 9282 C CD1 . ILE E 56 ? 0.4534 0.5993 0.6036 0.0227 -0.0273 -0.1267 56 ILE D CD1 9283 N N . ASP E 57 ? 0.5855 0.7045 0.7233 -0.0067 -0.0218 -0.1223 57 ASP D N 9284 C CA . ASP E 57 ? 0.6464 0.7524 0.7782 -0.0154 -0.0224 -0.1219 57 ASP D CA 9285 C C . ASP E 57 ? 0.5886 0.6977 0.7182 -0.0225 -0.0195 -0.1196 57 ASP D C 9286 O O . ASP E 57 ? 0.6028 0.7004 0.7260 -0.0300 -0.0200 -0.1173 57 ASP D O 9287 C CB . ASP E 57 ? 0.7698 0.8750 0.9013 -0.0198 -0.0229 -0.1279 57 ASP D CB 9288 C CG . ASP E 57 ? 0.8761 0.9753 1.0083 -0.0132 -0.0267 -0.1310 57 ASP D CG 9289 O OD1 . ASP E 57 ? 0.8766 0.9704 1.0086 -0.0062 -0.0294 -0.1287 57 ASP D OD1 9290 O OD2 . ASP E 57 ? 0.9959 1.0968 1.1290 -0.0151 -0.0271 -0.1363 57 ASP D OD2 9291 N N . LYS E 58 ? 0.5536 0.6781 0.6876 -0.0202 -0.0169 -0.1207 58 LYS D N 9292 C CA . LYS E 58 ? 0.5354 0.6659 0.6680 -0.0255 -0.0144 -0.1200 58 LYS D CA 9293 C C . LYS E 58 ? 0.5762 0.6996 0.7056 -0.0244 -0.0150 -0.1134 58 LYS D C 9294 O O . LYS E 58 ? 0.5100 0.6350 0.6368 -0.0299 -0.0134 -0.1123 58 LYS D O 9295 C CB . LYS E 58 ? 0.5355 0.6842 0.6733 -0.0215 -0.0129 -0.1246 58 LYS D CB 9296 C CG . LYS E 58 ? 0.5917 0.7523 0.7309 -0.0282 -0.0106 -0.1311 58 LYS D CG 9297 C CD . LYS E 58 ? 0.5883 0.7441 0.7267 -0.0339 -0.0107 -0.1345 58 LYS D CD 9298 C CE . LYS E 58 ? 0.5929 0.7507 0.7275 -0.0466 -0.0086 -0.1368 58 LYS D CE 9299 N NZ . LYS E 58 ? 0.5585 0.7370 0.6978 -0.0488 -0.0062 -0.1447 58 LYS D NZ 9300 N N . MET E 59 ? 0.6210 0.7379 0.7506 -0.0177 -0.0172 -0.1095 59 MET D N 9301 C CA . MET E 59 ? 0.6216 0.7306 0.7479 -0.0167 -0.0181 -0.1033 59 MET D CA 9302 C C . MET E 59 ? 0.6622 0.7560 0.7820 -0.0238 -0.0191 -0.1005 59 MET D C 9303 O O . MET E 59 ? 0.7713 0.8533 0.8881 -0.0245 -0.0216 -0.1009 59 MET D O 9304 C CB . MET E 59 ? 0.6287 0.7357 0.7567 -0.0088 -0.0204 -0.1007 59 MET D CB 9305 C CG . MET E 59 ? 0.6065 0.7083 0.7319 -0.0073 -0.0212 -0.0945 59 MET D CG 9306 S SD . MET E 59 ? 0.5324 0.6423 0.6572 -0.0082 -0.0193 -0.0925 59 MET D SD 9307 C CE . MET E 59 ? 0.5119 0.6329 0.6398 -0.0010 -0.0202 -0.0936 59 MET D CE 9308 N N . ASN E 60 ? 0.6929 0.7864 0.8095 -0.0287 -0.0175 -0.0977 60 ASN D N 9309 C CA . ASN E 60 ? 0.6683 0.7470 0.7773 -0.0354 -0.0186 -0.0938 60 ASN D CA 9310 C C . ASN E 60 ? 0.6940 0.7638 0.8016 -0.0296 -0.0211 -0.0882 60 ASN D C 9311 O O . ASN E 60 ? 0.7288 0.8056 0.8391 -0.0252 -0.0202 -0.0859 60 ASN D O 9312 C CB . ASN E 60 ? 0.6748 0.7598 0.7812 -0.0437 -0.0156 -0.0939 60 ASN D CB 9313 C CG . ASN E 60 ? 0.7088 0.7782 0.8058 -0.0528 -0.0167 -0.0899 60 ASN D CG 9314 O OD1 . ASN E 60 ? 0.8130 0.8702 0.9041 -0.0586 -0.0186 -0.0906 60 ASN D OD1 9315 N ND2 . ASN E 60 ? 0.6685 0.7372 0.7628 -0.0543 -0.0159 -0.0858 60 ASN D ND2 9316 N N . THR E 61 ? 0.7297 0.7834 0.8321 -0.0297 -0.0246 -0.0865 61 THR D N 9317 C CA . THR E 61 ? 0.6890 0.7341 0.7898 -0.0239 -0.0277 -0.0824 61 THR D CA 9318 C C . THR E 61 ? 0.6586 0.6877 0.7500 -0.0308 -0.0293 -0.0782 61 THR D C 9319 O O . THR E 61 ? 0.6841 0.7017 0.7683 -0.0382 -0.0307 -0.0790 61 THR D O 9320 C CB . THR E 61 ? 0.7596 0.7998 0.8619 -0.0168 -0.0316 -0.0854 61 THR D CB 9321 O OG1 . THR E 61 ? 0.8506 0.9020 0.9593 -0.0082 -0.0315 -0.0850 61 THR D OG1 9322 C CG2 . THR E 61 ? 0.7821 0.8007 0.8754 -0.0173 -0.0372 -0.0841 61 THR D CG2 9323 N N . GLN E 62 ? 0.6898 0.7172 0.7800 -0.0290 -0.0295 -0.0735 62 GLN D N 9324 C CA . GLN E 62 ? 0.6795 0.6897 0.7600 -0.0343 -0.0319 -0.0692 62 GLN D CA 9325 C C . GLN E 62 ? 0.6443 0.6473 0.7235 -0.0276 -0.0352 -0.0654 62 GLN D C 9326 O O . GLN E 62 ? 0.5966 0.6109 0.6828 -0.0205 -0.0344 -0.0648 62 GLN D O 9327 C CB . GLN E 62 ? 0.6539 0.6669 0.7303 -0.0445 -0.0283 -0.0673 62 GLN D CB 9328 C CG . GLN E 62 ? 0.6250 0.6581 0.7088 -0.0439 -0.0236 -0.0688 62 GLN D CG 9329 C CD . GLN E 62 ? 0.6351 0.6725 0.7145 -0.0543 -0.0204 -0.0687 62 GLN D CD 9330 O OE1 . GLN E 62 ? 0.6564 0.6808 0.7264 -0.0625 -0.0216 -0.0657 62 GLN D OE1 9331 N NE2 . GLN E 62 ? 0.5592 0.6151 0.6446 -0.0540 -0.0168 -0.0722 62 GLN D NE2 9332 N N . PHE E 63 ? 0.6433 0.6270 0.7125 -0.0307 -0.0394 -0.0627 63 PHE D N 9333 C CA . PHE E 63 ? 0.5949 0.5708 0.6619 -0.0246 -0.0431 -0.0593 63 PHE D CA 9334 C C . PHE E 63 ? 0.5761 0.5626 0.6465 -0.0250 -0.0394 -0.0553 63 PHE D C 9335 O O . PHE E 63 ? 0.5057 0.4926 0.5726 -0.0331 -0.0364 -0.0531 63 PHE D O 9336 C CB . PHE E 63 ? 0.5914 0.5429 0.6449 -0.0288 -0.0486 -0.0568 63 PHE D CB 9337 C CG . PHE E 63 ? 0.6076 0.5513 0.6586 -0.0218 -0.0529 -0.0541 63 PHE D CG 9338 C CD1 . PHE E 63 ? 0.6681 0.6073 0.7202 -0.0113 -0.0587 -0.0574 63 PHE D CD1 9339 C CD2 . PHE E 63 ? 0.6249 0.5686 0.6737 -0.0248 -0.0512 -0.0490 63 PHE D CD2 9340 C CE1 . PHE E 63 ? 0.6586 0.5932 0.7091 -0.0041 -0.0629 -0.0558 63 PHE D CE1 9341 C CE2 . PHE E 63 ? 0.6871 0.6250 0.7342 -0.0180 -0.0553 -0.0468 63 PHE D CE2 9342 C CZ . PHE E 63 ? 0.6736 0.6074 0.7217 -0.0075 -0.0611 -0.0504 63 PHE D CZ 9343 N N . GLU E 64 ? 0.5470 0.5423 0.6237 -0.0168 -0.0398 -0.0547 64 GLU D N 9344 C CA . GLU E 64 ? 0.5572 0.5573 0.6347 -0.0167 -0.0381 -0.0503 64 GLU D CA 9345 C C . GLU E 64 ? 0.5640 0.5627 0.6427 -0.0087 -0.0419 -0.0491 64 GLU D C 9346 O O . GLU E 64 ? 0.5424 0.5455 0.6253 -0.0019 -0.0441 -0.0526 64 GLU D O 9347 C CB . GLU E 64 ? 0.5259 0.5440 0.6108 -0.0166 -0.0335 -0.0508 64 GLU D CB 9348 C CG . GLU E 64 ? 0.5051 0.5296 0.5909 -0.0226 -0.0298 -0.0537 64 GLU D CG 9349 C CD . GLU E 64 ? 0.4889 0.5080 0.5681 -0.0315 -0.0282 -0.0518 64 GLU D CD 9350 O OE1 . GLU E 64 ? 0.4808 0.4922 0.5550 -0.0331 -0.0293 -0.0474 64 GLU D OE1 9351 O OE2 . GLU E 64 ? 0.4392 0.4630 0.5181 -0.0372 -0.0257 -0.0549 64 GLU D OE2 9352 N N . ALA E 65 ? 0.5522 0.5470 0.6277 -0.0097 -0.0423 -0.0447 65 ALA D N 9353 C CA . ALA E 65 ? 0.5137 0.5097 0.5906 -0.0028 -0.0454 -0.0435 65 ALA D CA 9354 C C . ALA E 65 ? 0.4633 0.4729 0.5451 -0.0028 -0.0421 -0.0406 65 ALA D C 9355 O O . ALA E 65 ? 0.4877 0.4944 0.5661 -0.0074 -0.0404 -0.0368 65 ALA D O 9356 C CB . ALA E 65 ? 0.5343 0.5120 0.6019 -0.0035 -0.0499 -0.0409 65 ALA D CB 9357 N N . VAL E 66 ? 0.4084 0.4321 0.4970 0.0019 -0.0416 -0.0424 66 VAL D N 9358 C CA . VAL E 66 ? 0.3827 0.4180 0.4743 0.0012 -0.0393 -0.0396 66 VAL D CA 9359 C C . VAL E 66 ? 0.3871 0.4265 0.4796 0.0055 -0.0419 -0.0382 66 VAL D C 9360 O O . VAL E 66 ? 0.4265 0.4738 0.5228 0.0105 -0.0437 -0.0415 66 VAL D O 9361 C CB . VAL E 66 ? 0.3719 0.4208 0.4688 0.0019 -0.0370 -0.0421 66 VAL D CB 9362 C CG1 . VAL E 66 ? 0.3809 0.4373 0.4779 0.0002 -0.0357 -0.0387 66 VAL D CG1 9363 C CG2 . VAL E 66 ? 0.3515 0.3989 0.4486 -0.0010 -0.0347 -0.0449 66 VAL D CG2 9364 N N . GLY E 67 ? 0.3865 0.4223 0.4759 0.0034 -0.0420 -0.0338 67 GLY D N 9365 C CA . GLY E 67 ? 0.4313 0.4726 0.5216 0.0063 -0.0440 -0.0321 67 GLY D CA 9366 C C . GLY E 67 ? 0.4232 0.4676 0.5120 0.0024 -0.0424 -0.0274 67 GLY D C 9367 O O . GLY E 67 ? 0.4475 0.4944 0.5360 -0.0009 -0.0400 -0.0263 67 GLY D O 9368 N N . ARG E 68 ? 0.4385 0.4819 0.5256 0.0034 -0.0443 -0.0249 68 ARG D N 9369 C CA . ARG E 68 ? 0.4377 0.4831 0.5227 0.0001 -0.0437 -0.0205 68 ARG D CA 9370 C C . ARG E 68 ? 0.4202 0.4557 0.5011 0.0003 -0.0456 -0.0178 68 ARG D C 9371 O O . ARG E 68 ? 0.3833 0.4229 0.4648 0.0028 -0.0478 -0.0173 68 ARG D O 9372 C CB . ARG E 68 ? 0.4269 0.4873 0.5149 0.0004 -0.0441 -0.0205 68 ARG D CB 9373 C CG . ARG E 68 ? 0.4776 0.5472 0.5679 -0.0010 -0.0423 -0.0223 68 ARG D CG 9374 C CD . ARG E 68 ? 0.4607 0.5247 0.5471 -0.0051 -0.0408 -0.0198 68 ARG D CD 9375 N NE . ARG E 68 ? 0.4478 0.5191 0.5349 -0.0064 -0.0399 -0.0212 68 ARG D NE 9376 C CZ . ARG E 68 ? 0.4539 0.5238 0.5423 -0.0058 -0.0384 -0.0240 68 ARG D CZ 9377 N NH1 . ARG E 68 ? 0.4460 0.5085 0.5354 -0.0046 -0.0374 -0.0261 68 ARG D NH1 9378 N NH2 . ARG E 68 ? 0.4516 0.5276 0.5395 -0.0069 -0.0382 -0.0249 68 ARG D NH2 9379 N N . GLU E 69 ? 0.4698 0.4934 0.5462 -0.0025 -0.0447 -0.0161 69 GLU D N 9380 C CA . GLU E 69 ? 0.4931 0.5049 0.5643 -0.0026 -0.0468 -0.0138 69 GLU D CA 9381 C C . GLU E 69 ? 0.4706 0.4812 0.5387 -0.0057 -0.0462 -0.0095 69 GLU D C 9382 O O . GLU E 69 ? 0.4724 0.4736 0.5357 -0.0062 -0.0478 -0.0071 69 GLU D O 9383 C CB . GLU E 69 ? 0.6218 0.6211 0.6883 -0.0055 -0.0463 -0.0146 69 GLU D CB 9384 C CG . GLU E 69 ? 0.7630 0.7572 0.8295 -0.0023 -0.0486 -0.0185 69 GLU D CG 9385 C CD . GLU E 69 ? 0.9791 0.9572 1.0383 -0.0002 -0.0535 -0.0179 69 GLU D CD 9386 O OE1 . GLU E 69 ? 0.9823 0.9554 1.0379 0.0012 -0.0561 -0.0151 69 GLU D OE1 9387 O OE2 . GLU E 69 ? 0.9237 0.8925 0.9797 0.0001 -0.0555 -0.0205 69 GLU D OE2 9388 N N . PHE E 70 ? 0.4063 0.4248 0.4760 -0.0077 -0.0445 -0.0085 70 PHE D N 9389 C CA . PHE E 70 ? 0.4319 0.4479 0.4978 -0.0103 -0.0446 -0.0048 70 PHE D CA 9390 C C . PHE E 70 ? 0.4225 0.4438 0.4887 -0.0095 -0.0467 -0.0024 70 PHE D C 9391 O O . PHE E 70 ? 0.4051 0.4362 0.4745 -0.0087 -0.0471 -0.0034 70 PHE D O 9392 C CB . PHE E 70 ? 0.4084 0.4265 0.4734 -0.0128 -0.0427 -0.0053 70 PHE D CB 9393 C CG . PHE E 70 ? 0.3955 0.4103 0.4601 -0.0145 -0.0405 -0.0080 70 PHE D CG 9394 C CD1 . PHE E 70 ? 0.3948 0.4142 0.4628 -0.0140 -0.0390 -0.0115 70 PHE D CD1 9395 C CD2 . PHE E 70 ? 0.3950 0.4024 0.4552 -0.0173 -0.0399 -0.0069 70 PHE D CD2 9396 C CE1 . PHE E 70 ? 0.3864 0.4037 0.4539 -0.0163 -0.0369 -0.0142 70 PHE D CE1 9397 C CE2 . PHE E 70 ? 0.3831 0.3886 0.4420 -0.0205 -0.0376 -0.0094 70 PHE D CE2 9398 C CZ . PHE E 70 ? 0.3734 0.3840 0.4361 -0.0200 -0.0362 -0.0131 70 PHE D CZ 9399 N N . ASN E 71 ? 0.3923 0.4078 0.4547 -0.0103 -0.0479 0.0006 71 ASN D N 9400 C CA . ASN E 71 ? 0.3856 0.4061 0.4479 -0.0100 -0.0501 0.0027 71 ASN D CA 9401 C C . ASN E 71 ? 0.3879 0.4116 0.4477 -0.0135 -0.0504 0.0052 71 ASN D C 9402 O O . ASN E 71 ? 0.4164 0.4385 0.4746 -0.0151 -0.0494 0.0048 71 ASN D O 9403 C CB . ASN E 71 ? 0.3945 0.4073 0.4537 -0.0086 -0.0520 0.0046 71 ASN D CB 9404 C CG . ASN E 71 ? 0.4519 0.4560 0.5057 -0.0117 -0.0513 0.0074 71 ASN D CG 9405 O OD1 . ASN E 71 ? 0.5153 0.5208 0.5676 -0.0141 -0.0506 0.0085 71 ASN D OD1 9406 N ND2 . ASN E 71 ? 0.4748 0.4694 0.5249 -0.0114 -0.0520 0.0083 71 ASN D ND2 9407 N N . ASN E 72 ? 0.4054 0.4327 0.4641 -0.0145 -0.0524 0.0076 72 ASN D N 9408 C CA . ASN E 72 ? 0.4668 0.4961 0.5217 -0.0185 -0.0538 0.0101 72 ASN D CA 9409 C C . ASN E 72 ? 0.4368 0.4559 0.4858 -0.0199 -0.0546 0.0121 72 ASN D C 9410 O O . ASN E 72 ? 0.3956 0.4129 0.4398 -0.0225 -0.0565 0.0136 72 ASN D O 9411 C CB . ASN E 72 ? 0.5387 0.5761 0.5939 -0.0202 -0.0557 0.0117 72 ASN D CB 9412 C CG . ASN E 72 ? 0.6520 0.6917 0.7018 -0.0261 -0.0576 0.0145 72 ASN D CG 9413 O OD1 . ASN E 72 ? 0.6635 0.7065 0.7120 -0.0287 -0.0575 0.0141 72 ASN D OD1 9414 N ND2 . ASN E 72 ? 0.7522 0.7889 0.7976 -0.0286 -0.0599 0.0176 72 ASN D ND2 9415 N N . LEU E 73 ? 0.4091 0.4211 0.4575 -0.0181 -0.0536 0.0119 73 LEU D N 9416 C CA . LEU E 73 ? 0.4146 0.4196 0.4583 -0.0187 -0.0538 0.0122 73 LEU D CA 9417 C C . LEU E 73 ? 0.4229 0.4266 0.4677 -0.0178 -0.0513 0.0089 73 LEU D C 9418 O O . LEU E 73 ? 0.3946 0.3945 0.4366 -0.0180 -0.0507 0.0082 73 LEU D O 9419 C CB . LEU E 73 ? 0.4429 0.4427 0.4839 -0.0187 -0.0548 0.0146 73 LEU D CB 9420 C CG . LEU E 73 ? 0.4952 0.4960 0.5335 -0.0203 -0.0578 0.0177 73 LEU D CG 9421 C CD1 . LEU E 73 ? 0.4985 0.4950 0.5347 -0.0199 -0.0588 0.0199 73 LEU D CD1 9422 C CD2 . LEU E 73 ? 0.5338 0.5318 0.5666 -0.0222 -0.0603 0.0184 73 LEU D CD2 9423 N N . GLU E 74 ? 0.3805 0.3888 0.4293 -0.0171 -0.0498 0.0065 74 GLU D N 9424 C CA . GLU E 74 ? 0.3860 0.3950 0.4362 -0.0168 -0.0474 0.0029 74 GLU D CA 9425 C C . GLU E 74 ? 0.3821 0.3960 0.4337 -0.0162 -0.0478 0.0009 74 GLU D C 9426 O O . GLU E 74 ? 0.3592 0.3764 0.4144 -0.0155 -0.0457 -0.0021 74 GLU D O 9427 C CB . GLU E 74 ? 0.3926 0.4001 0.4456 -0.0167 -0.0452 0.0016 74 GLU D CB 9428 C CG . GLU E 74 ? 0.3705 0.3710 0.4201 -0.0179 -0.0452 0.0037 74 GLU D CG 9429 C CD . GLU E 74 ? 0.3977 0.3933 0.4477 -0.0179 -0.0447 0.0030 74 GLU D CD 9430 O OE1 . GLU E 74 ? 0.4487 0.4466 0.5023 -0.0153 -0.0455 0.0018 74 GLU D OE1 9431 O OE2 . GLU E 74 ? 0.4048 0.3937 0.4505 -0.0206 -0.0440 0.0036 74 GLU D OE2 9432 N N . ARG E 75 ? 0.3953 0.4087 0.4431 -0.0169 -0.0508 0.0028 75 ARG D N 9433 C CA . ARG E 75 ? 0.4155 0.4320 0.4625 -0.0172 -0.0520 0.0017 75 ARG D CA 9434 C C . ARG E 75 ? 0.4104 0.4254 0.4557 -0.0150 -0.0522 -0.0021 75 ARG D C 9435 O O . ARG E 75 ? 0.4184 0.4365 0.4647 -0.0143 -0.0521 -0.0044 75 ARG D O 9436 C CB . ARG E 75 ? 0.4840 0.4981 0.5247 -0.0199 -0.0559 0.0053 75 ARG D CB 9437 C CG . ARG E 75 ? 0.5664 0.5861 0.6092 -0.0226 -0.0559 0.0083 75 ARG D CG 9438 C CD . ARG E 75 ? 0.7205 0.7500 0.7696 -0.0223 -0.0534 0.0063 75 ARG D CD 9439 N NE . ARG E 75 ? 1.0572 1.0955 1.1079 -0.0249 -0.0539 0.0080 75 ARG D NE 9440 C CZ . ARG E 75 ? 1.1470 1.1949 1.2047 -0.0228 -0.0521 0.0058 75 ARG D CZ 9441 N NH1 . ARG E 75 ? 1.2051 1.2521 1.2679 -0.0185 -0.0499 0.0024 75 ARG D NH1 9442 N NH2 . ARG E 75 ? 1.0485 1.1070 1.1075 -0.0249 -0.0529 0.0065 75 ARG D NH2 9443 N N . ARG E 76 ? 0.3804 0.3918 0.4228 -0.0136 -0.0529 -0.0035 76 ARG D N 9444 C CA . ARG E 76 ? 0.3632 0.3764 0.4048 -0.0107 -0.0532 -0.0087 76 ARG D CA 9445 C C . ARG E 76 ? 0.3478 0.3678 0.3960 -0.0108 -0.0488 -0.0122 76 ARG D C 9446 O O . ARG E 76 ? 0.3557 0.3793 0.4050 -0.0091 -0.0489 -0.0158 76 ARG D O 9447 C CB . ARG E 76 ? 0.3554 0.3668 0.3935 -0.0090 -0.0546 -0.0106 76 ARG D CB 9448 C CG . ARG E 76 ? 0.3426 0.3458 0.3728 -0.0082 -0.0602 -0.0080 76 ARG D CG 9449 C CD . ARG E 76 ? 0.3510 0.3529 0.3784 -0.0066 -0.0612 -0.0093 76 ARG D CD 9450 N NE . ARG E 76 ? 0.3334 0.3380 0.3650 -0.0096 -0.0567 -0.0073 76 ARG D NE 9451 C CZ . ARG E 76 ? 0.3164 0.3250 0.3485 -0.0096 -0.0546 -0.0100 76 ARG D CZ 9452 N NH1 . ARG E 76 ? 0.3352 0.3477 0.3649 -0.0060 -0.0565 -0.0155 76 ARG D NH1 9453 N NH2 . ARG E 76 ? 0.3090 0.3176 0.3431 -0.0131 -0.0512 -0.0073 76 ARG D NH2 9454 N N . ILE E 77 ? 0.3766 0.3973 0.4284 -0.0131 -0.0453 -0.0112 77 ILE D N 9455 C CA . ILE E 77 ? 0.3865 0.4114 0.4433 -0.0142 -0.0415 -0.0141 77 ILE D CA 9456 C C . ILE E 77 ? 0.3687 0.3961 0.4291 -0.0135 -0.0413 -0.0141 77 ILE D C 9457 O O . ILE E 77 ? 0.3634 0.3953 0.4267 -0.0128 -0.0398 -0.0178 77 ILE D O 9458 C CB . ILE E 77 ? 0.4165 0.4378 0.4737 -0.0172 -0.0392 -0.0122 77 ILE D CB 9459 C CG1 . ILE E 77 ? 0.4656 0.4864 0.5192 -0.0189 -0.0388 -0.0128 77 ILE D CG1 9460 C CG2 . ILE E 77 ? 0.4743 0.4975 0.5347 -0.0189 -0.0364 -0.0150 77 ILE D CG2 9461 C CD1 . ILE E 77 ? 0.5061 0.5205 0.5573 -0.0220 -0.0380 -0.0093 77 ILE D CD1 9462 N N . GLU E 78 ? 0.3821 0.4082 0.4425 -0.0136 -0.0428 -0.0104 78 GLU D N 9463 C CA . GLU E 78 ? 0.4102 0.4412 0.4736 -0.0131 -0.0429 -0.0106 78 GLU D CA 9464 C C . GLU E 78 ? 0.4037 0.4368 0.4649 -0.0122 -0.0444 -0.0127 78 GLU D C 9465 O O . GLU E 78 ? 0.3624 0.4003 0.4269 -0.0114 -0.0431 -0.0155 78 GLU D O 9466 C CB . GLU E 78 ? 0.4662 0.4983 0.5290 -0.0141 -0.0446 -0.0069 78 GLU D CB 9467 C CG . GLU E 78 ? 0.6059 0.6461 0.6718 -0.0142 -0.0446 -0.0075 78 GLU D CG 9468 C CD . GLU E 78 ? 0.8832 0.9278 0.9486 -0.0158 -0.0462 -0.0043 78 GLU D CD 9469 O OE1 . GLU E 78 ? 0.6962 0.7386 0.7559 -0.0188 -0.0487 -0.0010 78 GLU D OE1 9470 O OE2 . GLU E 78 ? 0.8988 0.9495 0.9692 -0.0141 -0.0454 -0.0057 78 GLU D OE2 9471 N N . ASN E 79 ? 0.3769 0.4055 0.4318 -0.0118 -0.0477 -0.0118 79 ASN D N 9472 C CA . ASN E 79 ? 0.3874 0.4155 0.4383 -0.0102 -0.0505 -0.0141 79 ASN D CA 9473 C C . ASN E 79 ? 0.4134 0.4463 0.4681 -0.0075 -0.0483 -0.0200 79 ASN D C 9474 O O . ASN E 79 ? 0.3705 0.4063 0.4255 -0.0061 -0.0488 -0.0227 79 ASN D O 9475 C CB . ASN E 79 ? 0.3746 0.3947 0.4165 -0.0094 -0.0557 -0.0126 79 ASN D CB 9476 C CG . ASN E 79 ? 0.3803 0.3973 0.4162 -0.0071 -0.0599 -0.0150 79 ASN D CG 9477 O OD1 . ASN E 79 ? 0.4469 0.4606 0.4787 -0.0031 -0.0630 -0.0185 79 ASN D OD1 9478 N ND2 . ASN E 79 ? 0.4017 0.4197 0.4361 -0.0093 -0.0607 -0.0133 79 ASN D ND2 9479 N N . LEU E 80 ? 0.4048 0.4391 0.4620 -0.0076 -0.0458 -0.0220 80 LEU D N 9480 C CA . LEU E 80 ? 0.3935 0.4344 0.4543 -0.0065 -0.0433 -0.0279 80 LEU D CA 9481 C C . LEU E 80 ? 0.3858 0.4308 0.4524 -0.0077 -0.0402 -0.0288 80 LEU D C 9482 O O . LEU E 80 ? 0.3574 0.4075 0.4259 -0.0061 -0.0397 -0.0331 80 LEU D O 9483 C CB . LEU E 80 ? 0.4483 0.4907 0.5096 -0.0084 -0.0408 -0.0292 80 LEU D CB 9484 C CG . LEU E 80 ? 0.5174 0.5681 0.5821 -0.0099 -0.0373 -0.0348 80 LEU D CG 9485 C CD1 . LEU E 80 ? 0.6072 0.6647 0.6719 -0.0056 -0.0392 -0.0408 80 LEU D CD1 9486 C CD2 . LEU E 80 ? 0.5381 0.5906 0.6007 -0.0123 -0.0361 -0.0354 80 LEU D CD2 9487 N N . ASN E 81 ? 0.3448 0.3876 0.4138 -0.0099 -0.0386 -0.0254 81 ASN D N 9488 C CA . ASN E 81 ? 0.3554 0.4016 0.4294 -0.0102 -0.0365 -0.0269 81 ASN D CA 9489 C C . ASN E 81 ? 0.3425 0.3924 0.4166 -0.0084 -0.0381 -0.0274 81 ASN D C 9490 O O . ASN E 81 ? 0.4121 0.4668 0.4897 -0.0076 -0.0368 -0.0306 81 ASN D O 9491 C CB . ASN E 81 ? 0.3823 0.4250 0.4579 -0.0113 -0.0358 -0.0238 81 ASN D CB 9492 C CG . ASN E 81 ? 0.3964 0.4422 0.4766 -0.0104 -0.0347 -0.0259 81 ASN D CG 9493 O OD1 . ASN E 81 ? 0.4835 0.5290 0.5656 -0.0113 -0.0328 -0.0290 81 ASN D OD1 9494 N ND2 . ASN E 81 ? 0.4260 0.4755 0.5077 -0.0090 -0.0359 -0.0245 81 ASN D ND2 9495 N N . LYS E 82 ? 0.3662 0.4138 0.4358 -0.0085 -0.0411 -0.0238 82 LYS D N 9496 C CA . LYS E 82 ? 0.3720 0.4223 0.4397 -0.0084 -0.0430 -0.0235 82 LYS D CA 9497 C C . LYS E 82 ? 0.3670 0.4180 0.4327 -0.0059 -0.0443 -0.0276 82 LYS D C 9498 O O . LYS E 82 ? 0.4242 0.4797 0.4913 -0.0053 -0.0441 -0.0297 82 LYS D O 9499 C CB . LYS E 82 ? 0.3851 0.4311 0.4457 -0.0106 -0.0467 -0.0186 82 LYS D CB 9500 C CG . LYS E 82 ? 0.4096 0.4572 0.4654 -0.0122 -0.0493 -0.0175 82 LYS D CG 9501 C CD . LYS E 82 ? 0.4146 0.4558 0.4613 -0.0159 -0.0535 -0.0123 82 LYS D CD 9502 C CE . LYS E 82 ? 0.4243 0.4632 0.4620 -0.0191 -0.0575 -0.0103 82 LYS D CE 9503 N NZ . LYS E 82 ? 0.4374 0.4837 0.4774 -0.0190 -0.0561 -0.0128 82 LYS D NZ 9504 N N . LYS E 83 ? 0.3475 0.3949 0.4096 -0.0041 -0.0461 -0.0293 83 LYS D N 9505 C CA . LYS E 83 ? 0.3424 0.3910 0.4019 -0.0004 -0.0485 -0.0342 83 LYS D CA 9506 C C . LYS E 83 ? 0.3493 0.4067 0.4165 0.0001 -0.0443 -0.0395 83 LYS D C 9507 O O . LYS E 83 ? 0.3119 0.3728 0.3792 0.0025 -0.0452 -0.0432 83 LYS D O 9508 C CB . LYS E 83 ? 0.3304 0.3753 0.3849 0.0025 -0.0517 -0.0364 83 LYS D CB 9509 C CG . LYS E 83 ? 0.3391 0.3732 0.3837 0.0027 -0.0575 -0.0321 83 LYS D CG 9510 C CD . LYS E 83 ? 0.3799 0.4111 0.4196 0.0073 -0.0614 -0.0361 83 LYS D CD 9511 C CE . LYS E 83 ? 0.3926 0.4267 0.4363 0.0057 -0.0580 -0.0357 83 LYS D CE 9512 N NZ . LYS E 83 ? 0.3844 0.4203 0.4254 0.0103 -0.0607 -0.0410 83 LYS D NZ 9513 N N . MET E 84 ? 0.3488 0.4087 0.4216 -0.0023 -0.0400 -0.0398 84 MET D N 9514 C CA . MET E 84 ? 0.3603 0.4268 0.4391 -0.0032 -0.0362 -0.0442 84 MET D CA 9515 C C . MET E 84 ? 0.3725 0.4414 0.4548 -0.0032 -0.0353 -0.0441 84 MET D C 9516 O O . MET E 84 ? 0.3246 0.3989 0.4091 -0.0016 -0.0348 -0.0484 84 MET D O 9517 C CB . MET E 84 ? 0.3920 0.4575 0.4731 -0.0070 -0.0329 -0.0436 84 MET D CB 9518 C CG . MET E 84 ? 0.4548 0.5260 0.5402 -0.0094 -0.0295 -0.0484 84 MET D CG 9519 S SD . MET E 84 ? 0.5597 0.6244 0.6457 -0.0149 -0.0268 -0.0457 84 MET D SD 9520 C CE . MET E 84 ? 0.5094 0.5706 0.5980 -0.0124 -0.0279 -0.0431 84 MET D CE 9521 N N . GLU E 85 ? 0.4272 0.4931 0.5099 -0.0046 -0.0352 -0.0396 85 GLU D N 9522 C CA . GLU E 85 ? 0.4495 0.5196 0.5356 -0.0042 -0.0346 -0.0399 85 GLU D CA 9523 C C . GLU E 85 ? 0.4085 0.4820 0.4920 -0.0025 -0.0367 -0.0410 85 GLU D C 9524 O O . GLU E 85 ? 0.3686 0.4474 0.4555 -0.0014 -0.0356 -0.0446 85 GLU D O 9525 C CB . GLU E 85 ? 0.5179 0.5870 0.6041 -0.0052 -0.0351 -0.0355 85 GLU D CB 9526 C CG . GLU E 85 ? 0.5684 0.6351 0.6582 -0.0056 -0.0334 -0.0355 85 GLU D CG 9527 C CD . GLU E 85 ? 0.5300 0.5988 0.6209 -0.0051 -0.0345 -0.0328 85 GLU D CD 9528 O OE1 . GLU E 85 ? 0.5476 0.6230 0.6378 -0.0053 -0.0356 -0.0318 85 GLU D OE1 9529 O OE2 . GLU E 85 ? 0.5097 0.5740 0.6014 -0.0048 -0.0345 -0.0322 85 GLU D OE2 9530 N N . ASP E 86 ? 0.3792 0.4482 0.4556 -0.0028 -0.0404 -0.0377 86 ASP D N 9531 C CA . ASP E 86 ? 0.3765 0.4453 0.4471 -0.0020 -0.0437 -0.0378 86 ASP D CA 9532 C C . ASP E 86 ? 0.3904 0.4611 0.4613 0.0017 -0.0444 -0.0438 86 ASP D C 9533 O O . ASP E 86 ? 0.3779 0.4518 0.4480 0.0030 -0.0454 -0.0459 86 ASP D O 9534 C CB . ASP E 86 ? 0.4080 0.4682 0.4686 -0.0035 -0.0485 -0.0330 86 ASP D CB 9535 C CG . ASP E 86 ? 0.4421 0.5024 0.5020 -0.0078 -0.0481 -0.0275 86 ASP D CG 9536 O OD1 . ASP E 86 ? 0.5130 0.5813 0.5801 -0.0089 -0.0446 -0.0277 86 ASP D OD1 9537 O OD2 . ASP E 86 ? 0.4149 0.4678 0.4668 -0.0099 -0.0517 -0.0234 86 ASP D OD2 9538 N N . GLY E 87 ? 0.3254 0.3956 0.3975 0.0034 -0.0439 -0.0468 87 GLY D N 9539 C CA . GLY E 87 ? 0.3401 0.4151 0.4134 0.0070 -0.0442 -0.0534 87 GLY D CA 9540 C C . GLY E 87 ? 0.3416 0.4250 0.4223 0.0067 -0.0405 -0.0574 87 GLY D C 9541 O O . GLY E 87 ? 0.3676 0.4545 0.4476 0.0095 -0.0420 -0.0613 87 GLY D O 9542 N N . PHE E 88 ? 0.3559 0.4413 0.4428 0.0033 -0.0361 -0.0565 88 PHE D N 9543 C CA . PHE E 88 ? 0.3670 0.4589 0.4604 0.0027 -0.0329 -0.0605 88 PHE D CA 9544 C C . PHE E 88 ? 0.4069 0.5006 0.5005 0.0037 -0.0338 -0.0594 88 PHE D C 9545 O O . PHE E 88 ? 0.3917 0.4912 0.4881 0.0051 -0.0330 -0.0637 88 PHE D O 9546 C CB . PHE E 88 ? 0.3659 0.4563 0.4636 -0.0009 -0.0294 -0.0598 88 PHE D CB 9547 C CG . PHE E 88 ? 0.3837 0.4752 0.4817 -0.0035 -0.0276 -0.0623 88 PHE D CG 9548 C CD1 . PHE E 88 ? 0.4040 0.5038 0.5042 -0.0034 -0.0264 -0.0686 88 PHE D CD1 9549 C CD2 . PHE E 88 ? 0.4371 0.5228 0.5331 -0.0064 -0.0270 -0.0587 88 PHE D CD2 9550 C CE1 . PHE E 88 ? 0.4344 0.5382 0.5346 -0.0067 -0.0245 -0.0715 88 PHE D CE1 9551 C CE2 . PHE E 88 ? 0.4272 0.5154 0.5228 -0.0097 -0.0252 -0.0611 88 PHE D CE2 9552 C CZ . PHE E 88 ? 0.4302 0.5281 0.5278 -0.0103 -0.0237 -0.0676 88 PHE D CZ 9553 N N . LEU E 89 ? 0.3982 0.4883 0.4884 0.0026 -0.0354 -0.0540 89 LEU D N 9554 C CA . LEU E 89 ? 0.3957 0.4897 0.4851 0.0026 -0.0363 -0.0531 89 LEU D CA 9555 C C . LEU E 89 ? 0.3829 0.4769 0.4667 0.0049 -0.0396 -0.0551 89 LEU D C 9556 O O . LEU E 89 ? 0.3932 0.4928 0.4786 0.0058 -0.0393 -0.0576 89 LEU D O 9557 C CB . LEU E 89 ? 0.4125 0.5050 0.4988 0.0000 -0.0373 -0.0473 89 LEU D CB 9558 C CG . LEU E 89 ? 0.4819 0.5813 0.5671 -0.0012 -0.0379 -0.0466 89 LEU D CG 9559 C CD1 . LEU E 89 ? 0.5035 0.6096 0.5939 -0.0023 -0.0359 -0.0456 89 LEU D CD1 9560 C CD2 . LEU E 89 ? 0.5498 0.6444 0.6243 -0.0037 -0.0422 -0.0423 89 LEU D CD2 9561 N N . ASP E 90 ? 0.3950 0.4823 0.4719 0.0064 -0.0432 -0.0546 90 ASP D N 9562 C CA . ASP E 90 ? 0.4215 0.5063 0.4912 0.0096 -0.0479 -0.0568 90 ASP D CA 9563 C C . ASP E 90 ? 0.4029 0.4956 0.4786 0.0132 -0.0461 -0.0643 90 ASP D C 9564 O O . ASP E 90 ? 0.4314 0.5268 0.5054 0.0151 -0.0477 -0.0667 90 ASP D O 9565 C CB . ASP E 90 ? 0.4473 0.5218 0.5072 0.0116 -0.0534 -0.0553 90 ASP D CB 9566 C CG . ASP E 90 ? 0.5018 0.5675 0.5534 0.0073 -0.0563 -0.0477 90 ASP D CG 9567 O OD1 . ASP E 90 ? 0.5575 0.6267 0.6099 0.0028 -0.0545 -0.0440 90 ASP D OD1 9568 O OD2 . ASP E 90 ? 0.6084 0.6645 0.6524 0.0082 -0.0606 -0.0458 90 ASP D OD2 9569 N N . VAL E 91 ? 0.3964 0.4934 0.4786 0.0134 -0.0429 -0.0679 91 VAL D N 9570 C CA . VAL E 91 ? 0.4347 0.5411 0.5230 0.0155 -0.0407 -0.0754 91 VAL D CA 9571 C C . VAL E 91 ? 0.4314 0.5436 0.5257 0.0140 -0.0375 -0.0767 91 VAL D C 9572 O O . VAL E 91 ? 0.4737 0.5908 0.5684 0.0167 -0.0385 -0.0810 91 VAL D O 9573 C CB . VAL E 91 ? 0.4019 0.5125 0.4954 0.0134 -0.0372 -0.0783 91 VAL D CB 9574 C CG1 . VAL E 91 ? 0.4117 0.5330 0.5118 0.0131 -0.0340 -0.0853 91 VAL D CG1 9575 C CG2 . VAL E 91 ? 0.4335 0.5420 0.5218 0.0164 -0.0406 -0.0796 91 VAL D CG2 9576 N N . TRP E 92 ? 0.4047 0.5160 0.5030 0.0104 -0.0343 -0.0732 92 TRP D N 9577 C CA . TRP E 92 ? 0.3918 0.5087 0.4958 0.0098 -0.0318 -0.0754 92 TRP D CA 9578 C C . TRP E 92 ? 0.4196 0.5383 0.5199 0.0114 -0.0343 -0.0741 92 TRP D C 9579 O O . TRP E 92 ? 0.4102 0.5351 0.5137 0.0127 -0.0334 -0.0780 92 TRP D O 9580 C CB . TRP E 92 ? 0.3623 0.4771 0.4707 0.0068 -0.0290 -0.0729 92 TRP D CB 9581 C CG . TRP E 92 ? 0.3476 0.4604 0.4589 0.0042 -0.0266 -0.0747 92 TRP D CG 9582 C CD1 . TRP E 92 ? 0.3578 0.4641 0.4677 0.0016 -0.0261 -0.0711 92 TRP D CD1 9583 C CD2 . TRP E 92 ? 0.3611 0.4783 0.4763 0.0028 -0.0244 -0.0804 92 TRP D CD2 9584 N NE1 . TRP E 92 ? 0.3820 0.4878 0.4938 -0.0017 -0.0238 -0.0738 92 TRP D NE1 9585 C CE2 . TRP E 92 ? 0.3726 0.4854 0.4876 -0.0015 -0.0227 -0.0796 92 TRP D CE2 9586 C CE3 . TRP E 92 ? 0.3888 0.5133 0.5071 0.0041 -0.0238 -0.0859 92 TRP D CE3 9587 C CZ2 . TRP E 92 ? 0.3613 0.4769 0.4784 -0.0055 -0.0204 -0.0839 92 TRP D CZ2 9588 C CZ3 . TRP E 92 ? 0.3839 0.5118 0.5053 0.0007 -0.0214 -0.0907 92 TRP D CZ3 9589 C CH2 . TRP E 92 ? 0.3907 0.5141 0.5111 -0.0045 -0.0197 -0.0895 92 TRP D CH2 9590 N N . THR E 93 ? 0.4189 0.5323 0.5121 0.0103 -0.0372 -0.0686 93 THR D N 9591 C CA . THR E 93 ? 0.4142 0.5293 0.5022 0.0100 -0.0395 -0.0668 93 THR D CA 9592 C C . THR E 93 ? 0.4421 0.5573 0.5258 0.0136 -0.0427 -0.0710 93 THR D C 9593 O O . THR E 93 ? 0.5109 0.6322 0.5960 0.0144 -0.0422 -0.0734 93 THR D O 9594 C CB . THR E 93 ? 0.3949 0.5036 0.4739 0.0066 -0.0426 -0.0599 93 THR D CB 9595 O OG1 . THR E 93 ? 0.3552 0.4660 0.4390 0.0038 -0.0397 -0.0569 93 THR D OG1 9596 C CG2 . THR E 93 ? 0.4111 0.5222 0.4833 0.0045 -0.0449 -0.0579 93 THR D CG2 9597 N N . TYR E 94 ? 0.4022 0.5111 0.4804 0.0164 -0.0462 -0.0721 94 TYR D N 9598 C CA . TYR E 94 ? 0.4088 0.5168 0.4816 0.0212 -0.0506 -0.0765 94 TYR D CA 9599 C C . TYR E 94 ? 0.4431 0.5623 0.5255 0.0237 -0.0472 -0.0841 94 TYR D C 9600 O O . TYR E 94 ? 0.4037 0.5261 0.4843 0.0261 -0.0490 -0.0871 94 TYR D O 9601 C CB . TYR E 94 ? 0.4143 0.5149 0.4808 0.0250 -0.0552 -0.0778 94 TYR D CB 9602 C CG . TYR E 94 ? 0.4277 0.5242 0.4852 0.0310 -0.0621 -0.0819 94 TYR D CG 9603 C CD1 . TYR E 94 ? 0.4347 0.5202 0.4789 0.0304 -0.0682 -0.0775 94 TYR D CD1 9604 C CD2 . TYR E 94 ? 0.4332 0.5365 0.4943 0.0373 -0.0631 -0.0905 94 TYR D CD2 9605 C CE1 . TYR E 94 ? 0.4338 0.5127 0.4677 0.0366 -0.0758 -0.0812 94 TYR D CE1 9606 C CE2 . TYR E 94 ? 0.4303 0.5292 0.4823 0.0443 -0.0706 -0.0951 94 TYR D CE2 9607 C CZ . TYR E 94 ? 0.4218 0.5072 0.4599 0.0442 -0.0772 -0.0902 94 TYR D CZ 9608 O OH . TYR E 94 ? 0.4281 0.5064 0.4553 0.0513 -0.0856 -0.0943 94 TYR D OH 9609 N N . ASN E 95 ? 0.4124 0.5371 0.5039 0.0225 -0.0425 -0.0869 95 ASN D N 9610 C CA . ASN E 95 ? 0.4472 0.5822 0.5471 0.0233 -0.0392 -0.0939 95 ASN D CA 9611 C C . ASN E 95 ? 0.4558 0.5953 0.5598 0.0219 -0.0368 -0.0939 95 ASN D C 9612 O O . ASN E 95 ? 0.4464 0.5925 0.5527 0.0243 -0.0369 -0.0991 95 ASN D O 9613 C CB . ASN E 95 ? 0.4688 0.6074 0.5756 0.0204 -0.0350 -0.0963 95 ASN D CB 9614 C CG . ASN E 95 ? 0.5770 0.7162 0.6809 0.0228 -0.0372 -0.0991 95 ASN D CG 9615 O OD1 . ASN E 95 ? 0.5548 0.6916 0.6518 0.0280 -0.0425 -0.1007 95 ASN D OD1 9616 N ND2 . ASN E 95 ? 0.6713 0.8129 0.7793 0.0189 -0.0337 -0.0998 95 ASN D ND2 9617 N N . ALA E 96 ? 0.4389 0.5759 0.5441 0.0185 -0.0349 -0.0887 96 ALA D N 9618 C CA . ALA E 96 ? 0.4388 0.5816 0.5486 0.0177 -0.0327 -0.0896 96 ALA D CA 9619 C C . ALA E 96 ? 0.4417 0.5865 0.5456 0.0195 -0.0358 -0.0893 96 ALA D C 9620 O O . ALA E 96 ? 0.3919 0.5437 0.4992 0.0211 -0.0350 -0.0937 96 ALA D O 9621 C CB . ALA E 96 ? 0.4443 0.5854 0.5562 0.0149 -0.0309 -0.0852 96 ALA D CB 9622 N N . GLU E 97 ? 0.4679 0.6058 0.5619 0.0188 -0.0398 -0.0843 97 GLU D N 9623 C CA . GLU E 97 ? 0.4773 0.6150 0.5629 0.0188 -0.0434 -0.0827 97 GLU D CA 9624 C C . GLU E 97 ? 0.4984 0.6370 0.5819 0.0237 -0.0462 -0.0885 97 GLU D C 9625 O O . GLU E 97 ? 0.4793 0.6231 0.5620 0.0246 -0.0467 -0.0907 97 GLU D O 9626 C CB . GLU E 97 ? 0.5083 0.6358 0.5815 0.0158 -0.0478 -0.0756 97 GLU D CB 9627 C CG . GLU E 97 ? 0.5667 0.6952 0.6413 0.0105 -0.0454 -0.0699 97 GLU D CG 9628 C CD . GLU E 97 ? 0.5928 0.7303 0.6667 0.0064 -0.0441 -0.0677 97 GLU D CD 9629 O OE1 . GLU E 97 ? 0.7032 0.8433 0.7719 0.0063 -0.0460 -0.0688 97 GLU D OE1 9630 O OE2 . GLU E 97 ? 0.5907 0.7337 0.6688 0.0034 -0.0413 -0.0654 97 GLU D OE2 9631 N N . LEU E 98 ? 0.5094 0.6443 0.5921 0.0273 -0.0482 -0.0916 98 LEU D N 9632 C CA . LEU E 98 ? 0.5294 0.6667 0.6102 0.0330 -0.0515 -0.0982 98 LEU D CA 9633 C C . LEU E 98 ? 0.4796 0.6296 0.5719 0.0342 -0.0470 -0.1055 98 LEU D C 9634 O O . LEU E 98 ? 0.4568 0.6111 0.5480 0.0378 -0.0490 -0.1102 98 LEU D O 9635 C CB . LEU E 98 ? 0.5582 0.6905 0.6351 0.0372 -0.0553 -0.1008 98 LEU D CB 9636 C CG . LEU E 98 ? 0.6231 0.7405 0.6847 0.0388 -0.0630 -0.0961 98 LEU D CG 9637 C CD1 . LEU E 98 ? 0.6834 0.7995 0.7418 0.0463 -0.0681 -0.1027 98 LEU D CD1 9638 C CD2 . LEU E 98 ? 0.6416 0.7527 0.6920 0.0382 -0.0677 -0.0930 98 LEU D CD2 9639 N N . LEU E 99 ? 0.4558 0.6105 0.5579 0.0311 -0.0415 -0.1064 99 LEU D N 9640 C CA . LEU E 99 ? 0.4822 0.6467 0.5942 0.0305 -0.0373 -0.1121 99 LEU D CA 9641 C C . LEU E 99 ? 0.5315 0.7001 0.6444 0.0304 -0.0367 -0.1121 99 LEU D C 9642 O O . LEU E 99 ? 0.5561 0.7320 0.6723 0.0327 -0.0364 -0.1178 99 LEU D O 9643 C CB . LEU E 99 ? 0.4822 0.6462 0.6011 0.0258 -0.0326 -0.1107 99 LEU D CB 9644 C CG . LEU E 99 ? 0.5666 0.7370 0.6939 0.0238 -0.0287 -0.1151 99 LEU D CG 9645 C CD1 . LEU E 99 ? 0.5659 0.7445 0.6967 0.0248 -0.0282 -0.1228 99 LEU D CD1 9646 C CD2 . LEU E 99 ? 0.5995 0.7652 0.7307 0.0191 -0.0255 -0.1123 99 LEU D CD2 9647 N N . VAL E 100 ? 0.5046 0.6700 0.6148 0.0277 -0.0364 -0.1061 100 VAL D N 9648 C CA . VAL E 100 ? 0.5120 0.6833 0.6226 0.0273 -0.0359 -0.1061 100 VAL D CA 9649 C C . VAL E 100 ? 0.4842 0.6556 0.5865 0.0302 -0.0403 -0.1073 100 VAL D C 9650 O O . VAL E 100 ? 0.5081 0.6868 0.6131 0.0318 -0.0398 -0.1114 100 VAL D O 9651 C CB . VAL E 100 ? 0.5039 0.6740 0.6125 0.0235 -0.0351 -0.0996 100 VAL D CB 9652 C CG1 . VAL E 100 ? 0.5428 0.7201 0.6486 0.0227 -0.0357 -0.0990 100 VAL D CG1 9653 C CG2 . VAL E 100 ? 0.5269 0.6986 0.6447 0.0222 -0.0311 -0.1004 100 VAL D CG2 9654 N N . LEU E 101 ? 0.4981 0.6601 0.5894 0.0308 -0.0452 -0.1035 101 LEU D N 9655 C CA . LEU E 101 ? 0.4720 0.6302 0.5526 0.0338 -0.0510 -0.1043 101 LEU D CA 9656 C C . LEU E 101 ? 0.5172 0.6815 0.6023 0.0397 -0.0518 -0.1130 101 LEU D C 9657 O O . LEU E 101 ? 0.6024 0.7699 0.6844 0.0419 -0.0539 -0.1156 101 LEU D O 9658 C CB . LEU E 101 ? 0.4441 0.5881 0.5115 0.0340 -0.0571 -0.0994 101 LEU D CB 9659 C CG . LEU E 101 ? 0.4985 0.6330 0.5514 0.0291 -0.0613 -0.0913 101 LEU D CG 9660 C CD1 . LEU E 101 ? 0.5118 0.6543 0.5686 0.0223 -0.0565 -0.0870 101 LEU D CD1 9661 C CD2 . LEU E 101 ? 0.5220 0.6419 0.5650 0.0287 -0.0660 -0.0867 101 LEU D CD2 9662 N N . MET E 102 ? 0.5313 0.6983 0.6233 0.0418 -0.0501 -0.1176 102 MET D N 9663 C CA . MET E 102 ? 0.5151 0.6897 0.6110 0.0472 -0.0512 -0.1264 102 MET D CA 9664 C C . MET E 102 ? 0.4875 0.6742 0.5943 0.0460 -0.0461 -0.1315 102 MET D C 9665 O O . MET E 102 ? 0.4293 0.6224 0.5366 0.0499 -0.0478 -0.1374 102 MET D O 9666 C CB . MET E 102 ? 0.5517 0.7286 0.6522 0.0484 -0.0503 -0.1302 102 MET D CB 9667 C CG . MET E 102 ? 0.6825 0.8490 0.7725 0.0521 -0.0565 -0.1283 102 MET D CG 9668 S SD . MET E 102 ? 0.7592 0.9320 0.8567 0.0520 -0.0537 -0.1326 102 MET D SD 9669 C CE . MET E 102 ? 0.7585 0.9180 0.8417 0.0585 -0.0629 -0.1312 102 MET D CE 9670 N N . GLU E 103 ? 0.4756 0.6646 0.5906 0.0409 -0.0406 -0.1296 103 GLU D N 9671 C CA . GLU E 103 ? 0.5132 0.7113 0.6375 0.0397 -0.0365 -0.1343 103 GLU D CA 9672 C C . GLU E 103 ? 0.5172 0.7181 0.6393 0.0403 -0.0372 -0.1333 103 GLU D C 9673 O O . GLU E 103 ? 0.5656 0.7744 0.6924 0.0419 -0.0362 -0.1389 103 GLU D O 9674 C CB . GLU E 103 ? 0.5148 0.7123 0.6468 0.0347 -0.0316 -0.1332 103 GLU D CB 9675 C CG . GLU E 103 ? 0.6157 0.8151 0.7512 0.0334 -0.0303 -0.1370 103 GLU D CG 9676 C CD . GLU E 103 ? 0.6663 0.8770 0.8065 0.0351 -0.0299 -0.1460 103 GLU D CD 9677 O OE1 . GLU E 103 ? 0.7237 0.9396 0.8680 0.0350 -0.0286 -0.1494 103 GLU D OE1 9678 O OE2 . GLU E 103 ? 0.7431 0.9587 0.8829 0.0369 -0.0312 -0.1504 103 GLU D OE2 9679 N N . ASN E 104 ? 0.5101 0.7052 0.6242 0.0388 -0.0392 -0.1264 104 ASN D N 9680 C CA . ASN E 104 ? 0.5387 0.7377 0.6487 0.0390 -0.0405 -0.1256 104 ASN D CA 9681 C C . ASN E 104 ? 0.5924 0.7922 0.6962 0.0437 -0.0450 -0.1298 104 ASN D C 9682 O O . ASN E 104 ? 0.5323 0.7399 0.6386 0.0450 -0.0444 -0.1336 104 ASN D O 9683 C CB . ASN E 104 ? 0.4880 0.6818 0.5892 0.0349 -0.0419 -0.1173 104 ASN D CB 9684 C CG . ASN E 104 ? 0.4864 0.6843 0.5951 0.0313 -0.0374 -0.1151 104 ASN D CG 9685 O OD1 . ASN E 104 ? 0.4800 0.6826 0.5993 0.0322 -0.0338 -0.1196 104 ASN D OD1 9686 N ND2 . ASN E 104 ? 0.4536 0.6489 0.5562 0.0273 -0.0380 -0.1083 104 ASN D ND2 9687 N N . GLU E 105 ? 0.6719 0.8633 0.7672 0.0468 -0.0500 -0.1293 105 GLU D N 9688 C CA . GLU E 105 ? 0.6542 0.8452 0.7429 0.0526 -0.0555 -0.1340 105 GLU D CA 9689 C C . GLU E 105 ? 0.6268 0.8309 0.7271 0.0556 -0.0523 -0.1433 105 GLU D C 9690 O O . GLU E 105 ? 0.5990 0.8083 0.6982 0.0583 -0.0539 -0.1470 105 GLU D O 9691 C CB . GLU E 105 ? 0.7684 0.9497 0.8485 0.0571 -0.0615 -0.1345 105 GLU D CB 9692 C CG . GLU E 105 ? 0.9474 1.1245 1.0163 0.0636 -0.0693 -0.1380 105 GLU D CG 9693 C CD . GLU E 105 ? 1.1732 1.3467 1.2381 0.0713 -0.0751 -0.1437 105 GLU D CD 9694 O OE1 . GLU E 105 ? 1.3626 1.5210 1.4142 0.0730 -0.0819 -0.1394 105 GLU D OE1 9695 O OE2 . GLU E 105 ? 1.2910 1.4774 1.3660 0.0757 -0.0734 -0.1530 105 GLU D OE2 9696 N N . ARG E 106 ? 0.5918 0.8013 0.7030 0.0541 -0.0478 -0.1467 106 ARG D N 9697 C CA . ARG E 106 ? 0.6679 0.8898 0.7895 0.0555 -0.0449 -0.1556 106 ARG D CA 9698 C C . ARG E 106 ? 0.6643 0.8934 0.7932 0.0530 -0.0409 -0.1574 106 ARG D C 9699 O O . ARG E 106 ? 0.7289 0.9672 0.8622 0.0554 -0.0406 -0.1645 106 ARG D O 9700 C CB . ARG E 106 ? 0.7039 0.9290 0.8334 0.0527 -0.0413 -0.1582 106 ARG D CB 9701 C CG . ARG E 106 ? 0.8934 1.1144 1.0169 0.0563 -0.0454 -0.1586 106 ARG D CG 9702 C CD . ARG E 106 ? 1.0701 1.3019 1.2015 0.0557 -0.0429 -0.1660 106 ARG D CD 9703 N NE . ARG E 106 ? 1.2900 1.5347 1.4243 0.0606 -0.0447 -0.1758 106 ARG D NE 9704 C CZ . ARG E 106 ? 1.4157 1.6746 1.5580 0.0593 -0.0421 -0.1840 106 ARG D CZ 9705 N NH1 . ARG E 106 ? 1.5603 1.8207 1.7073 0.0527 -0.0377 -0.1829 106 ARG D NH1 9706 N NH2 . ARG E 106 ? 1.2298 1.5020 1.3749 0.0639 -0.0438 -0.1934 106 ARG D NH2 9707 N N . THR E 107 ? 0.5522 0.7778 0.6824 0.0487 -0.0380 -0.1517 107 THR D N 9708 C CA . THR E 107 ? 0.5124 0.7443 0.6490 0.0471 -0.0348 -0.1535 107 THR D CA 9709 C C . THR E 107 ? 0.5098 0.7462 0.6411 0.0503 -0.0377 -0.1549 107 THR D C 9710 O O . THR E 107 ? 0.4374 0.6823 0.5742 0.0519 -0.0365 -0.1610 107 THR D O 9711 C CB . THR E 107 ? 0.5023 0.7300 0.6403 0.0431 -0.0322 -0.1475 107 THR D CB 9712 O OG1 . THR E 107 ? 0.5103 0.7343 0.6540 0.0401 -0.0295 -0.1477 107 THR D OG1 9713 C CG2 . THR E 107 ? 0.5410 0.7759 0.6838 0.0430 -0.0303 -0.1498 107 THR D CG2 9714 N N . LEU E 108 ? 0.5029 0.7327 0.6225 0.0509 -0.0418 -0.1493 108 LEU D N 9715 C CA . LEU E 108 ? 0.5547 0.7868 0.6667 0.0530 -0.0452 -0.1496 108 LEU D CA 9716 C C . LEU E 108 ? 0.5905 0.8259 0.7018 0.0588 -0.0484 -0.1570 108 LEU D C 9717 O O . LEU E 108 ? 0.6159 0.8587 0.7281 0.0608 -0.0488 -0.1610 108 LEU D O 9718 C CB . LEU E 108 ? 0.5744 0.7964 0.6716 0.0506 -0.0495 -0.1412 108 LEU D CB 9719 C CG . LEU E 108 ? 0.6026 0.8244 0.6999 0.0444 -0.0464 -0.1343 108 LEU D CG 9720 C CD1 . LEU E 108 ? 0.6394 0.8537 0.7205 0.0408 -0.0510 -0.1267 108 LEU D CD1 9721 C CD2 . LEU E 108 ? 0.5962 0.8309 0.7040 0.0432 -0.0414 -0.1374 108 LEU D CD2 9722 N N . ASP E 109 ? 0.5750 0.8067 0.6853 0.0619 -0.0509 -0.1594 109 ASP D N 9723 C CA . ASP E 109 ? 0.5480 0.7856 0.6589 0.0682 -0.0541 -0.1679 109 ASP D CA 9724 C C . ASP E 109 ? 0.5255 0.7772 0.6507 0.0674 -0.0487 -0.1759 109 ASP D C 9725 O O . ASP E 109 ? 0.4767 0.7366 0.6036 0.0715 -0.0503 -0.1829 109 ASP D O 9726 C CB . ASP E 109 ? 0.5330 0.7660 0.6403 0.0722 -0.0580 -0.1699 109 ASP D CB 9727 C CG . ASP E 109 ? 0.5905 0.8076 0.6805 0.0750 -0.0659 -0.1638 109 ASP D CG 9728 O OD1 . ASP E 109 ? 0.5321 0.7430 0.6113 0.0750 -0.0697 -0.1600 109 ASP D OD1 9729 O OD2 . ASP E 109 ? 0.6074 0.8175 0.6938 0.0767 -0.0686 -0.1627 109 ASP D OD2 9730 N N . PHE E 110 ? 0.4860 0.7394 0.6205 0.0620 -0.0430 -0.1748 110 PHE D N 9731 C CA . PHE E 110 ? 0.5162 0.7798 0.6624 0.0598 -0.0385 -0.1816 110 PHE D CA 9732 C C . PHE E 110 ? 0.5870 0.8560 0.7347 0.0606 -0.0379 -0.1833 110 PHE D C 9733 O O . PHE E 110 ? 0.5655 0.8437 0.7191 0.0618 -0.0370 -0.1907 110 PHE D O 9734 C CB . PHE E 110 ? 0.4990 0.7587 0.6513 0.0535 -0.0339 -0.1784 110 PHE D CB 9735 C CG . PHE E 110 ? 0.4760 0.7418 0.6381 0.0496 -0.0298 -0.1838 110 PHE D CG 9736 C CD1 . PHE E 110 ? 0.4938 0.7690 0.6611 0.0491 -0.0290 -0.1920 110 PHE D CD1 9737 C CD2 . PHE E 110 ? 0.4789 0.7401 0.6440 0.0462 -0.0273 -0.1808 110 PHE D CD2 9738 C CE1 . PHE E 110 ? 0.5074 0.7860 0.6819 0.0440 -0.0257 -0.1964 110 PHE D CE1 9739 C CE2 . PHE E 110 ? 0.4962 0.7593 0.6682 0.0425 -0.0247 -0.1855 110 PHE D CE2 9740 C CZ . PHE E 110 ? 0.5196 0.7905 0.6958 0.0407 -0.0239 -0.1929 110 PHE D CZ 9741 N N . HIS E 111 ? 0.5647 0.8290 0.7069 0.0595 -0.0384 -0.1768 111 HIS D N 9742 C CA . HIS E 111 ? 0.5683 0.8392 0.7117 0.0602 -0.0378 -0.1785 111 HIS D CA 9743 C C . HIS E 111 ? 0.5843 0.8595 0.7220 0.0653 -0.0419 -0.1826 111 HIS D C 9744 O O . HIS E 111 ? 0.5377 0.8219 0.6811 0.0671 -0.0410 -0.1894 111 HIS D O 9745 C CB . HIS E 111 ? 0.5304 0.7981 0.6690 0.0574 -0.0372 -0.1711 111 HIS D CB 9746 C CG . HIS E 111 ? 0.5522 0.8191 0.6986 0.0539 -0.0332 -0.1698 111 HIS D CG 9747 N ND1 . HIS E 111 ? 0.5958 0.8568 0.7391 0.0508 -0.0325 -0.1627 111 HIS D ND1 9748 C CD2 . HIS E 111 ? 0.5920 0.8621 0.7482 0.0531 -0.0302 -0.1749 111 HIS D CD2 9749 C CE1 . HIS E 111 ? 0.5776 0.8385 0.7288 0.0491 -0.0295 -0.1638 111 HIS D CE1 9750 N NE2 . HIS E 111 ? 0.5571 0.8222 0.7154 0.0504 -0.0284 -0.1710 111 HIS D NE2 9751 N N . ASP E 112 ? 0.6159 0.8832 0.7416 0.0674 -0.0470 -0.1784 112 ASP D N 9752 C CA . ASP E 112 ? 0.6680 0.9353 0.7855 0.0732 -0.0528 -0.1820 112 ASP D CA 9753 C C . ASP E 112 ? 0.6868 0.9648 0.8132 0.0774 -0.0523 -0.1924 112 ASP D C 9754 O O . ASP E 112 ? 0.7264 1.0118 0.8534 0.0805 -0.0535 -0.1976 112 ASP D O 9755 C CB . ASP E 112 ? 0.7669 1.0216 0.8724 0.0755 -0.0585 -0.1778 112 ASP D CB 9756 C CG . ASP E 112 ? 0.9128 1.1588 1.0019 0.0775 -0.0653 -0.1738 112 ASP D CG 9757 O OD1 . ASP E 112 ? 1.1688 1.4102 1.2512 0.0720 -0.0647 -0.1660 112 ASP D OD1 9758 O OD2 . ASP E 112 ? 0.9182 1.1617 1.0001 0.0842 -0.0716 -0.1783 112 ASP D OD2 9759 N N . SER E 113 ? 0.6778 0.9577 0.8112 0.0767 -0.0503 -0.1955 113 SER D N 9760 C CA . SER E 113 ? 0.6615 0.9534 0.8031 0.0794 -0.0498 -0.2058 113 SER D CA 9761 C C . SER E 113 ? 0.6310 0.9334 0.7833 0.0763 -0.0450 -0.2109 113 SER D C 9762 O O . SER E 113 ? 0.6841 0.9973 0.8403 0.0795 -0.0458 -0.2193 113 SER D O 9763 C CB . SER E 113 ? 0.6441 0.9368 0.7902 0.0775 -0.0482 -0.2072 113 SER D CB 9764 O OG . SER E 113 ? 0.6618 0.9686 0.8184 0.0761 -0.0452 -0.2164 113 SER D OG 9765 N N . ASN E 114 ? 0.5584 0.8574 0.7152 0.0705 -0.0405 -0.2064 114 ASN D N 9766 C CA . ASN E 114 ? 0.5323 0.8384 0.6980 0.0678 -0.0368 -0.2111 114 ASN D CA 9767 C C . ASN E 114 ? 0.5338 0.8456 0.6969 0.0720 -0.0388 -0.2137 114 ASN D C 9768 O O . ASN E 114 ? 0.5603 0.8814 0.7297 0.0727 -0.0379 -0.2210 114 ASN D O 9769 C CB . ASN E 114 ? 0.5500 0.8493 0.7191 0.0622 -0.0330 -0.2058 114 ASN D CB 9770 C CG . ASN E 114 ? 0.5458 0.8406 0.7191 0.0570 -0.0304 -0.2049 114 ASN D CG 9771 O OD1 . ASN E 114 ? 0.5919 0.8920 0.7678 0.0561 -0.0302 -0.2098 114 ASN D OD1 9772 N ND2 . ASN E 114 ? 0.5557 0.8417 0.7291 0.0533 -0.0284 -0.1989 114 ASN D ND2 9773 N N . VAL E 115 ? 0.5892 0.8953 0.7425 0.0739 -0.0417 -0.2073 115 VAL D N 9774 C CA . VAL E 115 ? 0.6465 0.9571 0.7950 0.0768 -0.0439 -0.2082 115 VAL D CA 9775 C C . VAL E 115 ? 0.6934 1.0089 0.8384 0.0829 -0.0483 -0.2147 115 VAL D C 9776 O O . VAL E 115 ? 0.5904 0.9148 0.7384 0.0853 -0.0485 -0.2206 115 VAL D O 9777 C CB . VAL E 115 ? 0.6997 1.0025 0.8364 0.0755 -0.0460 -0.1990 115 VAL D CB 9778 C CG1 . VAL E 115 ? 0.7699 1.0762 0.8979 0.0783 -0.0497 -0.1995 115 VAL D CG1 9779 C CG2 . VAL E 115 ? 0.7297 1.0325 0.8711 0.0705 -0.0416 -0.1946 115 VAL D CG2 9780 N N . LYS E 116 ? 0.7388 1.0486 0.8774 0.0860 -0.0524 -0.2141 116 LYS D N 9781 C CA . LYS E 116 ? 0.7402 1.0545 0.8752 0.0932 -0.0577 -0.2212 116 LYS D CA 9782 C C . LYS E 116 ? 0.7017 1.0309 0.8499 0.0937 -0.0547 -0.2319 116 LYS D C 9783 O O . LYS E 116 ? 0.7222 1.0596 0.8700 0.0995 -0.0581 -0.2395 116 LYS D O 9784 C CB . LYS E 116 ? 0.7801 1.0841 0.9046 0.0972 -0.0635 -0.2184 116 LYS D CB 9785 C CG . LYS E 116 ? 0.8590 1.1662 0.9776 0.1066 -0.0709 -0.2263 116 LYS D CG 9786 C CD . LYS E 116 ? 0.9250 1.2426 1.0533 0.1085 -0.0697 -0.2345 116 LYS D CD 9787 C CE . LYS E 116 ? 0.9527 1.2649 1.0706 0.1175 -0.0783 -0.2375 116 LYS D CE 9788 N NZ . LYS E 116 ? 0.9439 1.2583 1.0540 0.1266 -0.0857 -0.2438 116 LYS D NZ 9789 N N . ASN E 117 ? 0.6253 0.9578 0.7843 0.0873 -0.0488 -0.2327 117 ASN D N 9790 C CA . ASN E 117 ? 0.6334 0.9797 0.8037 0.0856 -0.0457 -0.2424 117 ASN D CA 9791 C C . ASN E 117 ? 0.6707 1.0230 0.8458 0.0846 -0.0437 -0.2457 117 ASN D C 9792 O O . ASN E 117 ? 0.5903 0.9545 0.7710 0.0859 -0.0436 -0.2545 117 ASN D O 9793 C CB . ASN E 117 ? 0.6399 0.9860 0.8181 0.0778 -0.0407 -0.2420 117 ASN D CB 9794 C CG . ASN E 117 ? 0.7910 1.1366 0.9669 0.0788 -0.0422 -0.2419 117 ASN D CG 9795 O OD1 . ASN E 117 ? 0.7127 1.0614 0.8831 0.0863 -0.0475 -0.2454 117 ASN D OD1 9796 N ND2 . ASN E 117 ? 0.8379 1.1789 1.0173 0.0717 -0.0383 -0.2382 117 ASN D ND2 9797 N N . LEU E 118 ? 0.6989 1.0440 0.8721 0.0822 -0.0421 -0.2392 118 LEU D N 9798 C CA . LEU E 118 ? 0.7523 1.1032 0.9289 0.0825 -0.0409 -0.2424 118 LEU D CA 9799 C C . LEU E 118 ? 0.7378 1.0948 0.9083 0.0895 -0.0455 -0.2463 118 LEU D C 9800 O O . LEU E 118 ? 0.8958 1.2636 1.0719 0.0913 -0.0455 -0.2547 118 LEU D O 9801 C CB . LEU E 118 ? 0.8078 1.1518 0.9823 0.0799 -0.0391 -0.2352 118 LEU D CB 9802 C CG . LEU E 118 ? 0.8147 1.1558 0.9971 0.0745 -0.0349 -0.2349 118 LEU D CG 9803 C CD1 . LEU E 118 ? 0.8692 1.2105 1.0498 0.0753 -0.0345 -0.2317 118 LEU D CD1 9804 C CD2 . LEU E 118 ? 0.8214 1.1688 1.0130 0.0720 -0.0330 -0.2436 118 LEU D CD2 9805 N N . TYR E 119 ? 0.6430 0.9921 0.8013 0.0929 -0.0499 -0.2401 119 TYR D N 9806 C CA . TYR E 119 ? 0.6550 1.0058 0.8039 0.0995 -0.0557 -0.2423 119 TYR D CA 9807 C C . TYR E 119 ? 0.6666 1.0273 0.8194 0.1049 -0.0583 -0.2525 119 TYR D C 9808 O O . TYR E 119 ? 0.7935 1.1619 0.9457 0.1091 -0.0605 -0.2583 119 TYR D O 9809 C CB . TYR E 119 ? 0.6841 1.0212 0.8174 0.1015 -0.0611 -0.2340 119 TYR D CB 9810 C CG . TYR E 119 ? 0.7808 1.1157 0.9009 0.1076 -0.0682 -0.2349 119 TYR D CG 9811 C CD1 . TYR E 119 ? 0.8225 1.1562 0.9349 0.1055 -0.0687 -0.2303 119 TYR D CD1 9812 C CD2 . TYR E 119 ? 0.7596 1.0942 0.8743 0.1154 -0.0748 -0.2408 119 TYR D CD2 9813 C CE1 . TYR E 119 ? 0.8398 1.1701 0.9384 0.1101 -0.0754 -0.2304 119 TYR D CE1 9814 C CE2 . TYR E 119 ? 0.7664 1.0969 0.8674 0.1214 -0.0822 -0.2416 119 TYR D CE2 9815 C CZ . TYR E 119 ? 0.8292 1.1566 0.9216 0.1183 -0.0826 -0.2359 119 TYR D CZ 9816 O OH . TYR E 119 ? 0.7668 1.0887 0.8439 0.1232 -0.0902 -0.2360 119 TYR D OH 9817 N N . ASP E 120 ? 0.6876 1.0497 0.8446 0.1046 -0.0579 -0.2552 120 ASP D N 9818 C CA . ASP E 120 ? 0.7203 1.0949 0.8817 0.1096 -0.0603 -0.2659 120 ASP D CA 9819 C C . ASP E 120 ? 0.6854 1.0754 0.8595 0.1064 -0.0559 -0.2748 120 ASP D C 9820 O O . ASP E 120 ? 0.6497 1.0513 0.8253 0.1118 -0.0587 -0.2835 120 ASP D O 9821 C CB . ASP E 120 ? 0.7833 1.1584 0.9468 0.1090 -0.0602 -0.2671 120 ASP D CB 9822 C CG . ASP E 120 ? 0.8960 1.2587 1.0457 0.1157 -0.0675 -0.2625 120 ASP D CG 9823 O OD1 . ASP E 120 ? 1.0568 1.4126 1.1948 0.1218 -0.0737 -0.2609 120 ASP D OD1 9824 O OD2 . ASP E 120 ? 0.9692 1.3275 1.1183 0.1147 -0.0675 -0.2602 120 ASP D OD2 9825 N N . LYS E 121 ? 0.7016 1.0911 0.8843 0.0979 -0.0496 -0.2728 121 LYS D N 9826 C CA . LYS E 121 ? 0.8484 1.2502 1.0420 0.0936 -0.0459 -0.2810 121 LYS D CA 9827 C C . LYS E 121 ? 0.8303 1.2359 1.0234 0.0969 -0.0470 -0.2837 121 LYS D C 9828 O O . LYS E 121 ? 0.8504 1.2686 1.0500 0.0971 -0.0465 -0.2927 121 LYS D O 9829 C CB . LYS E 121 ? 0.9040 1.3011 1.1045 0.0835 -0.0402 -0.2783 121 LYS D CB 9830 C CG . LYS E 121 ? 1.0281 1.4233 1.2337 0.0786 -0.0370 -0.2787 121 LYS D CG 9831 C CD . LYS E 121 ? 1.1307 1.5212 1.3419 0.0686 -0.0328 -0.2780 121 LYS D CD 9832 C CE . LYS E 121 ? 1.2493 1.6295 1.4574 0.0655 -0.0317 -0.2703 121 LYS D CE 9833 N NZ . LYS E 121 ? 1.3716 1.7368 1.5774 0.0629 -0.0302 -0.2618 121 LYS D NZ 9834 N N . VAL E 122 ? 0.8163 1.2123 1.0011 0.0994 -0.0487 -0.2763 122 VAL D N 9835 C CA . VAL E 122 ? 0.8092 1.2094 0.9912 0.1034 -0.0506 -0.2784 122 VAL D CA 9836 C C . VAL E 122 ? 0.8871 1.2928 1.0623 0.1120 -0.0568 -0.2835 122 VAL D C 9837 O O . VAL E 122 ? 1.0091 1.4269 1.1890 0.1148 -0.0575 -0.2923 122 VAL D O 9838 C CB . VAL E 122 ? 0.6627 1.0533 0.8373 0.1025 -0.0505 -0.2690 122 VAL D CB 9839 C CG1 . VAL E 122 ? 0.6680 1.0627 0.8357 0.1074 -0.0538 -0.2703 122 VAL D CG1 9840 C CG2 . VAL E 122 ? 0.6345 1.0235 0.8173 0.0961 -0.0451 -0.2674 122 VAL D CG2 9841 N N . ARG E 123 ? 0.8274 1.2236 0.9910 0.1163 -0.0619 -0.2783 123 ARG D N 9842 C CA . ARG E 123 ? 0.8648 1.2637 1.0204 0.1255 -0.0692 -0.2837 123 ARG D CA 9843 C C . ARG E 123 ? 0.8627 1.2801 1.0294 0.1282 -0.0688 -0.2969 123 ARG D C 9844 O O . ARG E 123 ? 0.7589 1.1845 0.9235 0.1349 -0.0731 -0.3041 123 ARG D O 9845 C CB . ARG E 123 ? 0.9297 1.3152 1.0733 0.1291 -0.0746 -0.2779 123 ARG D CB 9846 C CG . ARG E 123 ? 1.0310 1.4151 1.1632 0.1398 -0.0840 -0.2828 123 ARG D CG 9847 C CD . ARG E 123 ? 1.2241 1.5987 1.3490 0.1435 -0.0889 -0.2807 123 ARG D CD 9848 N NE . ARG E 123 ? 1.4032 1.7938 1.5360 0.1498 -0.0909 -0.2934 123 ARG D NE 9849 C CZ . ARG E 123 ? 1.4643 1.8691 1.6119 0.1452 -0.0848 -0.2990 123 ARG D CZ 9850 N NH1 . ARG E 123 ? 1.3400 1.7423 1.4956 0.1346 -0.0768 -0.2928 123 ARG D NH1 9851 N NH2 . ARG E 123 ? 1.4492 1.8713 1.6028 0.1511 -0.0873 -0.3114 123 ARG D NH2 9852 N N . LEU E 124 ? 0.8370 1.2613 1.0149 0.1222 -0.0638 -0.3001 124 LEU D N 9853 C CA . LEU E 124 ? 0.9065 1.3503 1.0952 0.1223 -0.0626 -0.3125 124 LEU D CA 9854 C C . LEU E 124 ? 0.9066 1.3618 1.1026 0.1208 -0.0604 -0.3194 124 LEU D C 9855 O O . LEU E 124 ? 1.0528 1.5239 1.2529 0.1251 -0.0626 -0.3300 124 LEU D O 9856 C CB . LEU E 124 ? 0.9255 1.3737 1.1241 0.1129 -0.0566 -0.3133 124 LEU D CB 9857 C CG . LEU E 124 ? 1.0511 1.4999 1.2482 0.1142 -0.0581 -0.3135 124 LEU D CG 9858 C CD1 . LEU E 124 ? 1.0513 1.5122 1.2600 0.1040 -0.0519 -0.3184 124 LEU D CD1 9859 C CD2 . LEU E 124 ? 1.0976 1.5547 1.2890 0.1263 -0.0659 -0.3212 124 LEU D CD2 9860 N N . GLN E 125 ? 0.8717 1.3201 1.0703 0.1144 -0.0560 -0.3141 125 GLN D N 9861 C CA . GLN E 125 ? 0.8159 1.2735 1.0219 0.1119 -0.0535 -0.3202 125 GLN D CA 9862 C C . GLN E 125 ? 0.8047 1.2652 1.0040 0.1206 -0.0585 -0.3226 125 GLN D C 9863 O O . GLN E 125 ? 0.7870 1.2615 0.9906 0.1238 -0.0599 -0.3324 125 GLN D O 9864 C CB . GLN E 125 ? 0.7550 1.2025 0.9638 0.1044 -0.0487 -0.3137 125 GLN D CB 9865 C CG . GLN E 125 ? 0.7555 1.1995 0.9708 0.0948 -0.0441 -0.3122 125 GLN D CG 9866 C CD . GLN E 125 ? 0.7636 1.1982 0.9818 0.0886 -0.0405 -0.3082 125 GLN D CD 9867 O OE1 . GLN E 125 ? 0.7327 1.1549 0.9462 0.0885 -0.0400 -0.2994 125 GLN D OE1 9868 N NE2 . GLN E 125 ? 0.7708 1.2114 0.9961 0.0835 -0.0386 -0.3152 125 GLN D NE2 9869 N N . LEU E 126 ? 0.8152 1.2625 1.0027 0.1243 -0.0616 -0.3137 126 LEU D N 9870 C CA . LEU E 126 ? 0.8826 1.3294 1.0609 0.1310 -0.0663 -0.3136 126 LEU D CA 9871 C C . LEU E 126 ? 0.9303 1.3821 1.1016 0.1408 -0.0737 -0.3200 126 LEU D C 9872 O O . LEU E 126 ? 1.0611 1.5206 1.2311 0.1456 -0.0765 -0.3257 126 LEU D O 9873 C CB . LEU E 126 ? 0.9054 1.3365 1.0715 0.1301 -0.0675 -0.3016 126 LEU D CB 9874 C CG . LEU E 126 ? 0.8925 1.3192 1.0640 0.1221 -0.0612 -0.2954 126 LEU D CG 9875 C CD1 . LEU E 126 ? 0.8700 1.2879 1.0298 0.1218 -0.0626 -0.2861 126 LEU D CD1 9876 C CD2 . LEU E 126 ? 0.9047 1.3426 1.0888 0.1191 -0.0569 -0.3030 126 LEU D CD2 9877 N N . ARG E 127 ? 0.9278 1.3753 1.0943 0.1444 -0.0774 -0.3195 127 ARG D N 9878 C CA . ARG E 127 ? 0.9580 1.4090 1.1165 0.1553 -0.0859 -0.3262 127 ARG D CA 9879 C C . ARG E 127 ? 1.0373 1.4788 1.1804 0.1615 -0.0926 -0.3226 127 ARG D C 9880 O O . ARG E 127 ? 1.0600 1.4854 1.1919 0.1586 -0.0932 -0.3115 127 ARG D O 9881 C CB . ARG E 127 ? 0.9450 1.4188 1.1168 0.1573 -0.0848 -0.3405 127 ARG D CB 9882 C CG . ARG E 127 ? 0.9689 1.4512 1.1533 0.1498 -0.0787 -0.3433 127 ARG D CG 9883 C CD . ARG E 127 ? 1.0271 1.5327 1.2266 0.1460 -0.0747 -0.3558 127 ARG D CD 9884 N NE . ARG E 127 ? 1.0591 1.5661 1.2691 0.1333 -0.0665 -0.3535 127 ARG D NE 9885 C CZ . ARG E 127 ? 1.0821 1.6047 1.3044 0.1254 -0.0614 -0.3614 127 ARG D CZ 9886 N NH1 . ARG E 127 ? 1.2382 1.7783 1.4652 0.1289 -0.0631 -0.3725 127 ARG D NH1 9887 N NH2 . ARG E 127 ? 0.9068 1.4267 1.1355 0.1135 -0.0551 -0.3581 127 ARG D NH2 9888 N N . ASP E 128 ? 1.1946 1.6466 1.3368 0.1692 -0.0973 -0.3320 128 ASP D N 9889 C CA . ASP E 128 ? 1.2864 1.7293 1.4125 0.1751 -0.1044 -0.3291 128 ASP D CA 9890 C C . ASP E 128 ? 1.2560 1.7027 1.3850 0.1697 -0.0995 -0.3267 128 ASP D C 9891 O O . ASP E 128 ? 1.2646 1.7041 1.3799 0.1728 -0.1044 -0.3232 128 ASP D O 9892 C CB . ASP E 128 ? 1.4209 1.8714 1.5420 0.1875 -0.1134 -0.3402 128 ASP D CB 9893 C CG . ASP E 128 ? 1.4646 1.9406 1.6038 0.1884 -0.1094 -0.3542 128 ASP D CG 9894 O OD1 . ASP E 128 ? 1.5279 2.0141 1.6823 0.1791 -0.1002 -0.3551 128 ASP D OD1 9895 O OD2 . ASP E 128 ? 1.3913 1.8769 1.5288 0.1986 -0.1163 -0.3646 128 ASP D OD2 9896 N N . ASN E 129 ? 1.1548 1.6122 1.3005 0.1617 -0.0904 -0.3287 129 ASN D N 9897 C CA . ASN E 129 ? 1.0021 1.4621 1.1508 0.1565 -0.0856 -0.3260 129 ASN D CA 9898 C C . ASN E 129 ? 1.0168 1.4617 1.1541 0.1518 -0.0850 -0.3131 129 ASN D C 9899 O O . ASN E 129 ? 0.9929 1.4401 1.1301 0.1484 -0.0821 -0.3105 129 ASN D O 9900 C CB . ASN E 129 ? 0.9251 1.3960 1.0923 0.1490 -0.0772 -0.3305 129 ASN D CB 9901 C CG . ASN E 129 ? 0.9660 1.4548 1.1448 0.1514 -0.0769 -0.3438 129 ASN D CG 9902 O OD1 . ASN E 129 ? 1.0110 1.5060 1.1855 0.1596 -0.0828 -0.3506 129 ASN D OD1 9903 N ND2 . ASN E 129 ? 0.9119 1.4086 1.1045 0.1443 -0.0705 -0.3480 129 ASN D ND2 9904 N N . ALA E 130 ? 1.0862 1.5168 1.2142 0.1512 -0.0876 -0.3053 130 ALA D N 9905 C CA . ALA E 130 ? 1.0469 1.4630 1.1616 0.1465 -0.0880 -0.2929 130 ALA D CA 9906 C C . ALA E 130 ? 0.9979 1.3967 1.0952 0.1501 -0.0959 -0.2867 130 ALA D C 9907 O O . ALA E 130 ? 0.9281 1.3259 1.0252 0.1565 -0.1004 -0.2920 130 ALA D O 9908 C CB . ALA E 130 ? 1.0376 1.4536 1.1627 0.1377 -0.0798 -0.2876 130 ALA D CB 9909 N N . LYS E 131 ? 1.1138 1.4995 1.1957 0.1457 -0.0978 -0.2758 131 LYS D N 9910 C CA . LYS E 131 ? 1.2273 1.5929 1.2878 0.1477 -0.1064 -0.2682 131 LYS D CA 9911 C C . LYS E 131 ? 1.1672 1.5220 1.2264 0.1402 -0.1030 -0.2583 131 LYS D C 9912 O O . LYS E 131 ? 1.1081 1.4646 1.1686 0.1317 -0.0972 -0.2515 131 LYS D O 9913 C CB . LYS E 131 ? 1.2905 1.6498 1.3326 0.1463 -0.1112 -0.2629 131 LYS D CB 9914 C CG . LYS E 131 ? 1.3297 1.6655 1.3449 0.1470 -0.1216 -0.2542 131 LYS D CG 9915 C CD . LYS E 131 ? 1.3976 1.7307 1.3969 0.1410 -0.1232 -0.2476 131 LYS D CD 9916 C CE . LYS E 131 ? 1.4311 1.7429 1.4017 0.1446 -0.1361 -0.2432 131 LYS D CE 9917 N NZ . LYS E 131 ? 1.4272 1.7177 1.3771 0.1360 -0.1398 -0.2298 131 LYS D NZ 9918 N N . GLU E 132 ? 1.1525 1.4978 1.2096 0.1437 -0.1065 -0.2582 132 GLU D N 9919 C CA . GLU E 132 ? 1.2567 1.5896 1.3101 0.1375 -0.1048 -0.2486 132 GLU D CA 9920 C C . GLU E 132 ? 1.2862 1.6013 1.3162 0.1328 -0.1103 -0.2371 132 GLU D C 9921 O O . GLU E 132 ? 1.4121 1.7105 1.4226 0.1377 -0.1206 -0.2350 132 GLU D O 9922 C CB . GLU E 132 ? 1.4051 1.7312 1.4589 0.1435 -0.1090 -0.2518 132 GLU D CB 9923 C CG . GLU E 132 ? 1.4797 1.8231 1.5562 0.1449 -0.1024 -0.2614 132 GLU D CG 9924 C CD . GLU E 132 ? 1.6273 1.9660 1.7038 0.1501 -0.1063 -0.2644 132 GLU D CD 9925 O OE1 . GLU E 132 ? 1.6623 1.9856 1.7300 0.1473 -0.1080 -0.2559 132 GLU D OE1 9926 O OE2 . GLU E 132 ? 1.6753 2.0268 1.7606 0.1572 -0.1078 -0.2758 132 GLU D OE2 9927 N N . LEU E 133 ? 1.2640 1.5825 1.2948 0.1231 -0.1041 -0.2299 133 LEU D N 9928 C CA . LEU E 133 ? 1.3241 1.6286 1.3329 0.1160 -0.1083 -0.2185 133 LEU D CA 9929 C C . LEU E 133 ? 1.3496 1.6333 1.3452 0.1136 -0.1129 -0.2100 133 LEU D C 9930 O O . LEU E 133 ? 1.4151 1.6816 1.3875 0.1093 -0.1198 -0.2012 133 LEU D O 9931 C CB . LEU E 133 ? 1.3632 1.6807 1.3779 0.1062 -0.0998 -0.2142 133 LEU D CB 9932 C CG . LEU E 133 ? 1.4126 1.7455 1.4293 0.1064 -0.0981 -0.2189 133 LEU D CG 9933 C CD1 . LEU E 133 ? 1.4032 1.7524 1.4312 0.0985 -0.0888 -0.2170 133 LEU D CD1 9934 C CD2 . LEU E 133 ? 1.3974 1.7183 1.3884 0.1055 -0.1071 -0.2140 133 LEU D CD2 9935 N N . GLY E 134 ? 1.2451 1.5300 1.2545 0.1156 -0.1094 -0.2124 134 GLY D N 9936 C CA . GLY E 134 ? 1.1974 1.4637 1.1962 0.1145 -0.1138 -0.2056 134 GLY D CA 9937 C C . GLY E 134 ? 1.0921 1.3546 1.0885 0.1028 -0.1086 -0.1948 134 GLY D C 9938 O O . GLY E 134 ? 1.0438 1.2882 1.0256 0.0997 -0.1134 -0.1869 134 GLY D O 9939 N N . ASN E 135 ? 1.0350 1.3150 1.0457 0.0967 -0.0991 -0.1950 135 ASN D N 9940 C CA . ASN E 135 ? 0.9663 1.2477 0.9785 0.0865 -0.0931 -0.1866 135 ASN D CA 9941 C C . ASN E 135 ? 0.9184 1.2168 0.9560 0.0862 -0.0830 -0.1918 135 ASN D C 9942 O O . ASN E 135 ? 0.8117 1.1185 0.8552 0.0792 -0.0767 -0.1881 135 ASN D O 9943 C CB . ASN E 135 ? 1.0170 1.3024 1.0164 0.0781 -0.0929 -0.1806 135 ASN D CB 9944 C CG . ASN E 135 ? 0.9925 1.2987 1.0035 0.0800 -0.0883 -0.1881 135 ASN D CG 9945 O OD1 . ASN E 135 ? 0.8903 1.2061 0.9172 0.0878 -0.0861 -0.1979 135 ASN D OD1 9946 N ND2 . ASN E 135 ? 0.9269 1.2410 0.9295 0.0723 -0.0868 -0.1837 135 ASN D ND2 9947 N N . GLY E 136 ? 0.9075 1.2111 0.9591 0.0937 -0.0820 -0.2009 136 GLY D N 9948 C CA . GLY E 136 ? 0.9363 1.2539 1.0100 0.0934 -0.0736 -0.2067 136 GLY D CA 9949 C C . GLY E 136 ? 0.9468 1.2811 1.0312 0.0955 -0.0702 -0.2147 136 GLY D C 9950 O O . GLY E 136 ? 0.9406 1.2850 1.0422 0.0960 -0.0646 -0.2208 136 GLY D O 9951 N N . CYS E 137 ? 0.9784 1.3147 1.0518 0.0964 -0.0740 -0.2147 137 CYS D N 9952 C CA . CYS E 137 ? 1.0165 1.3689 1.0989 0.0984 -0.0711 -0.2222 137 CYS D CA 9953 C C . CYS E 137 ? 1.0040 1.3593 1.0869 0.1065 -0.0754 -0.2309 137 CYS D C 9954 O O . CYS E 137 ? 0.9766 1.3207 1.0466 0.1109 -0.0829 -0.2302 137 CYS D O 9955 C CB . CYS E 137 ? 1.0100 1.3674 1.0819 0.0932 -0.0710 -0.2172 137 CYS D CB 9956 S SG . CYS E 137 ? 0.9629 1.3241 1.0389 0.0844 -0.0646 -0.2100 137 CYS D SG 9957 N N . PHE E 138 ? 1.0287 1.3992 1.1264 0.1086 -0.0712 -0.2396 138 PHE D N 9958 C CA . PHE E 138 ? 1.1125 1.4899 1.2129 0.1157 -0.0744 -0.2490 138 PHE D CA 9959 C C . PHE E 138 ? 1.1140 1.5015 1.2114 0.1157 -0.0742 -0.2511 138 PHE D C 9960 O O . PHE E 138 ? 1.1049 1.5030 1.2118 0.1120 -0.0684 -0.2521 138 PHE D O 9961 C CB . PHE E 138 ? 1.1090 1.4964 1.2289 0.1175 -0.0697 -0.2582 138 PHE D CB 9962 C CG . PHE E 138 ? 1.2268 1.6071 1.3496 0.1182 -0.0702 -0.2581 138 PHE D CG 9963 C CD1 . PHE E 138 ? 1.3087 1.6878 1.4279 0.1251 -0.0759 -0.2635 138 PHE D CD1 9964 C CD2 . PHE E 138 ? 1.2703 1.6458 1.3988 0.1125 -0.0656 -0.2528 138 PHE D CD2 9965 C CE1 . PHE E 138 ? 1.3124 1.6870 1.4343 0.1261 -0.0766 -0.2641 138 PHE D CE1 9966 C CE2 . PHE E 138 ? 1.2671 1.6367 1.3979 0.1129 -0.0661 -0.2527 138 PHE D CE2 9967 C CZ . PHE E 138 ? 1.3113 1.6812 1.4391 0.1196 -0.0714 -0.2585 138 PHE D CZ 9968 N N . GLU E 139 ? 1.1550 1.5392 1.2389 0.1201 -0.0810 -0.2521 139 GLU D N 9969 C CA . GLU E 139 ? 1.1521 1.5469 1.2331 0.1207 -0.0813 -0.2551 139 GLU D CA 9970 C C . GLU E 139 ? 0.9791 1.3855 1.0713 0.1280 -0.0818 -0.2672 139 GLU D C 9971 O O . GLU E 139 ? 0.8952 1.2972 0.9816 0.1348 -0.0881 -0.2714 139 GLU D O 9972 C CB . GLU E 139 ? 1.3366 1.7203 1.3936 0.1196 -0.0887 -0.2479 139 GLU D CB 9973 C CG . GLU E 139 ? 1.4181 1.8138 1.4711 0.1167 -0.0872 -0.2483 139 GLU D CG 9974 C CD . GLU E 139 ? 1.5037 1.8879 1.5314 0.1151 -0.0952 -0.2417 139 GLU D CD 9975 O OE1 . GLU E 139 ? 1.5562 1.9410 1.5775 0.1212 -0.1007 -0.2469 139 GLU D OE1 9976 O OE2 . GLU E 139 ? 1.4650 1.8389 1.4785 0.1073 -0.0964 -0.2313 139 GLU D OE2 9977 N N . PHE E 140 ? 0.9291 1.3503 1.0368 0.1267 -0.0756 -0.2733 140 PHE D N 9978 C CA . PHE E 140 ? 1.0340 1.4672 1.1534 0.1322 -0.0753 -0.2850 140 PHE D CA 9979 C C . PHE E 140 ? 1.0540 1.4907 1.1625 0.1376 -0.0812 -0.2884 140 PHE D C 9980 O O . PHE E 140 ? 1.1147 1.5509 1.2112 0.1352 -0.0827 -0.2832 140 PHE D O 9981 C CB . PHE E 140 ? 1.0375 1.4834 1.1736 0.1293 -0.0683 -0.2901 140 PHE D CB 9982 C CG . PHE E 140 ? 0.9583 1.4018 1.1075 0.1255 -0.0633 -0.2904 140 PHE D CG 9983 C CD1 . PHE E 140 ? 0.9793 1.4177 1.1289 0.1199 -0.0596 -0.2828 140 PHE D CD1 9984 C CD2 . PHE E 140 ? 0.8359 1.2836 0.9972 0.1270 -0.0621 -0.2985 140 PHE D CD2 9985 C CE1 . PHE E 140 ? 0.9254 1.3605 1.0861 0.1165 -0.0555 -0.2830 140 PHE D CE1 9986 C CE2 . PHE E 140 ? 0.8489 1.2937 1.0208 0.1224 -0.0577 -0.2985 140 PHE D CE2 9987 C CZ . PHE E 140 ? 0.8754 1.3129 1.0468 0.1174 -0.0546 -0.2906 140 PHE D CZ 9988 N N . TYR E 141 ? 1.1280 1.5694 1.2408 0.1445 -0.0844 -0.2975 141 TYR D N 9989 C CA . TYR E 141 ? 1.1628 1.6095 1.2683 0.1507 -0.0899 -0.3031 141 TYR D CA 9990 C C . TYR E 141 ? 1.1113 1.5758 1.2315 0.1509 -0.0851 -0.3121 141 TYR D C 9991 O O . TYR E 141 ? 1.1206 1.5931 1.2403 0.1566 -0.0884 -0.3197 141 TYR D O 9992 C CB . TYR E 141 ? 1.1873 1.6314 1.2900 0.1592 -0.0966 -0.3096 141 TYR D CB 9993 C CG . TYR E 141 ? 1.1906 1.6156 1.2748 0.1616 -0.1043 -0.3021 141 TYR D CG 9994 C CD1 . TYR E 141 ? 1.1883 1.5990 1.2516 0.1585 -0.1087 -0.2915 141 TYR D CD1 9995 C CD2 . TYR E 141 ? 1.2305 1.6519 1.3171 0.1669 -0.1076 -0.3061 141 TYR D CD2 9996 C CE1 . TYR E 141 ? 1.2448 1.6354 1.2894 0.1604 -0.1167 -0.2847 141 TYR D CE1 9997 C CE2 . TYR E 141 ? 1.2942 1.6969 1.3632 0.1701 -0.1156 -0.3000 141 TYR D CE2 9998 C CZ . TYR E 141 ? 1.2569 1.6429 1.3044 0.1669 -0.1204 -0.2892 141 TYR D CZ 9999 O OH . TYR E 141 ? 1.2708 1.6359 1.2993 0.1697 -0.1292 -0.2831 141 TYR D OH 10000 N N . HIS E 142 ? 1.0697 1.5394 1.2023 0.1451 -0.0778 -0.3115 142 HIS D N 10001 C CA . HIS E 142 ? 1.0677 1.5519 1.2144 0.1449 -0.0735 -0.3200 142 HIS D CA 10002 C C . HIS E 142 ? 1.1336 1.6194 1.2864 0.1388 -0.0676 -0.3159 142 HIS D C 10003 O O . HIS E 142 ? 1.1089 1.5862 1.2552 0.1344 -0.0665 -0.3066 142 HIS D O 10004 C CB . HIS E 142 ? 1.0543 1.5451 1.2159 0.1467 -0.0721 -0.3301 142 HIS D CB 10005 C CG . HIS E 142 ? 1.0145 1.5010 1.1869 0.1411 -0.0672 -0.3286 142 HIS D CG 10006 N ND1 . HIS E 142 ? 1.0066 1.4861 1.1787 0.1409 -0.0682 -0.3268 142 HIS D ND1 10007 C CD2 . HIS E 142 ? 0.9980 1.4856 1.1809 0.1359 -0.0618 -0.3290 142 HIS D CD2 10008 C CE1 . HIS E 142 ? 0.9711 1.4478 1.1529 0.1348 -0.0632 -0.3255 142 HIS D CE1 10009 N NE2 . HIS E 142 ? 0.9551 1.4355 1.1431 0.1319 -0.0596 -0.3267 142 HIS D NE2 10010 N N . LYS E 143 ? 1.2060 1.7029 1.3707 0.1389 -0.0643 -0.3236 143 LYS D N 10011 C CA . LYS E 143 ? 1.2164 1.7174 1.3862 0.1354 -0.0600 -0.3222 143 LYS D CA 10012 C C . LYS E 143 ? 1.0800 1.5762 1.2630 0.1320 -0.0561 -0.3241 143 LYS D C 10013 O O . LYS E 143 ? 0.9191 1.4180 1.1125 0.1325 -0.0555 -0.3323 143 LYS D O 10014 C CB . LYS E 143 ? 1.3041 1.8193 1.4759 0.1388 -0.0604 -0.3297 143 LYS D CB 10015 C CG . LYS E 143 ? 1.4167 1.9343 1.5732 0.1415 -0.0650 -0.3270 143 LYS D CG 10016 C CD . LYS E 143 ? 1.4661 1.9922 1.6150 0.1395 -0.0641 -0.3235 143 LYS D CD 10017 C CE . LYS E 143 ? 1.4850 2.0270 1.6423 0.1427 -0.0628 -0.3333 143 LYS D CE 10018 N NZ . LYS E 143 ? 1.5053 2.0529 1.6731 0.1408 -0.0584 -0.3352 143 LYS D NZ 10019 N N . CYS E 144 ? 0.9103 1.3989 1.0917 0.1279 -0.0539 -0.3163 144 CYS D N 10020 C CA . CYS E 144 ? 0.9081 1.3885 1.0987 0.1242 -0.0509 -0.3158 144 CYS D CA 10021 C C . CYS E 144 ? 0.8624 1.3442 1.0577 0.1225 -0.0482 -0.3152 144 CYS D C 10022 O O . CYS E 144 ? 0.7273 1.2066 0.9172 0.1203 -0.0471 -0.3076 144 CYS D O 10023 C CB . CYS E 144 ? 0.9300 1.3984 1.1145 0.1216 -0.0515 -0.3074 144 CYS D CB 10024 S SG . CYS E 144 ? 0.8110 1.2689 1.0051 0.1168 -0.0485 -0.3069 144 CYS D SG 10025 N N . ASP E 145 ? 0.9480 1.4339 1.1529 0.1236 -0.0475 -0.3238 145 ASP D N 10026 C CA . ASP E 145 ? 1.0213 1.5091 1.2306 0.1240 -0.0463 -0.3256 145 ASP D CA 10027 C C . ASP E 145 ? 1.0424 1.5168 1.2548 0.1200 -0.0446 -0.3210 145 ASP D C 10028 O O . ASP E 145 ? 1.0542 1.5193 1.2649 0.1165 -0.0441 -0.3160 145 ASP D O 10029 C CB . ASP E 145 ? 1.0134 1.5080 1.2303 0.1273 -0.0473 -0.3367 145 ASP D CB 10030 C CG . ASP E 145 ? 1.1035 1.5893 1.3279 0.1245 -0.0476 -0.3423 145 ASP D CG 10031 O OD1 . ASP E 145 ? 1.1949 1.6805 1.4252 0.1255 -0.0487 -0.3501 145 ASP D OD1 10032 O OD2 . ASP E 145 ? 1.2621 1.7416 1.4860 0.1209 -0.0470 -0.3393 145 ASP D OD2 10033 N N . ASN E 146 ? 1.0710 1.5449 1.2872 0.1210 -0.0443 -0.3229 146 ASN D N 10034 C CA . ASN E 146 ? 1.1194 1.5803 1.3375 0.1178 -0.0434 -0.3186 146 ASN D CA 10035 C C . ASN E 146 ? 1.1615 1.6086 1.3845 0.1136 -0.0435 -0.3209 146 ASN D C 10036 O O . ASN E 146 ? 1.2166 1.6518 1.4393 0.1096 -0.0425 -0.3154 146 ASN D O 10037 C CB . ASN E 146 ? 1.0540 1.5178 1.2748 0.1214 -0.0442 -0.3219 146 ASN D CB 10038 C CG . ASN E 146 ? 1.0365 1.5126 1.2520 0.1229 -0.0430 -0.3168 146 ASN D CG 10039 O OD1 . ASN E 146 ? 1.0799 1.5632 1.2977 0.1267 -0.0438 -0.3207 146 ASN D OD1 10040 N ND2 . ASN E 146 ? 1.0072 1.4859 1.2151 0.1197 -0.0417 -0.3086 146 ASN D ND2 10041 N N . LYS E 147 ? 1.1079 1.5575 1.3349 0.1138 -0.0447 -0.3288 147 LYS D N 10042 C CA . LYS E 147 ? 1.1080 1.5470 1.3387 0.1080 -0.0447 -0.3313 147 LYS D CA 10043 C C . LYS E 147 ? 1.0120 1.4532 1.2410 0.1052 -0.0434 -0.3282 147 LYS D C 10044 O O . LYS E 147 ? 0.9025 1.3355 1.1330 0.0995 -0.0424 -0.3268 147 LYS D O 10045 C CB . LYS E 147 ? 1.1825 1.6232 1.4179 0.1084 -0.0467 -0.3417 147 LYS D CB 10046 C CG . LYS E 147 ? 1.3330 1.7743 1.5691 0.1138 -0.0490 -0.3456 147 LYS D CG 10047 C CD . LYS E 147 ? 1.3623 1.7973 1.6018 0.1133 -0.0521 -0.3550 147 LYS D CD 10048 C CE . LYS E 147 ? 1.3130 1.7535 1.5530 0.1213 -0.0550 -0.3607 147 LYS D CE 10049 N NZ . LYS E 147 ? 1.2606 1.6868 1.5015 0.1210 -0.0595 -0.3678 147 LYS D NZ 10050 N N . CYS E 148 ? 0.9609 1.4132 1.1859 0.1095 -0.0438 -0.3273 148 CYS D N 10051 C CA . CYS E 148 ? 0.9353 1.3893 1.1567 0.1090 -0.0439 -0.3242 148 CYS D CA 10052 C C . CYS E 148 ? 0.8706 1.3147 1.0873 0.1063 -0.0427 -0.3141 148 CYS D C 10053 O O . CYS E 148 ? 0.7639 1.2022 0.9817 0.1025 -0.0419 -0.3123 148 CYS D O 10054 C CB . CYS E 148 ? 0.8764 1.3419 1.0922 0.1148 -0.0460 -0.3254 148 CYS D CB 10055 S SG . CYS E 148 ? 0.8072 1.2721 1.0147 0.1165 -0.0481 -0.3206 148 CYS D SG 10056 N N . MET E 149 ? 0.8583 1.3020 1.0700 0.1081 -0.0425 -0.3081 149 MET D N 10057 C CA . MET E 149 ? 0.7307 1.1650 0.9381 0.1053 -0.0413 -0.2986 149 MET D CA 10058 C C . MET E 149 ? 0.7391 1.1616 0.9521 0.1003 -0.0397 -0.2980 149 MET D C 10059 O O . MET E 149 ? 0.7924 1.2078 1.0039 0.0970 -0.0389 -0.2933 149 MET D O 10060 C CB . MET E 149 ? 0.7741 1.2125 0.9778 0.1071 -0.0409 -0.2949 149 MET D CB 10061 C CG . MET E 149 ? 0.8004 1.2460 0.9939 0.1089 -0.0421 -0.2898 149 MET D CG 10062 S SD . MET E 149 ? 0.7879 1.2295 0.9722 0.1092 -0.0448 -0.2858 149 MET D SD 10063 C CE . MET E 149 ? 0.7612 1.2078 0.9308 0.1096 -0.0468 -0.2789 149 MET D CE 10064 N N . GLU E 150 ? 0.7883 1.2078 1.0066 0.0997 -0.0397 -0.3029 150 GLU D N 10065 C CA . GLU E 150 ? 0.8266 1.2327 1.0485 0.0942 -0.0390 -0.3026 150 GLU D CA 10066 C C . GLU E 150 ? 0.8243 1.2286 1.0481 0.0890 -0.0383 -0.3044 150 GLU D C 10067 O O . GLU E 150 ? 0.9168 1.3114 1.1404 0.0836 -0.0371 -0.3003 150 GLU D O 10068 C CB . GLU E 150 ? 0.9104 1.3123 1.1362 0.0948 -0.0408 -0.3095 150 GLU D CB 10069 C CG . GLU E 150 ? 1.0167 1.4025 1.2441 0.0883 -0.0413 -0.3101 150 GLU D CG 10070 C CD . GLU E 150 ? 1.1696 1.5435 1.3941 0.0869 -0.0409 -0.3024 150 GLU D CD 10071 O OE1 . GLU E 150 ? 1.3821 1.7446 1.6064 0.0870 -0.0432 -0.3039 150 GLU D OE1 10072 O OE2 . GLU E 150 ? 1.2564 1.6318 1.4783 0.0864 -0.0388 -0.2949 150 GLU D OE2 10073 N N . SER E 151 ? 0.8019 1.2169 1.0276 0.0906 -0.0390 -0.3108 151 SER D N 10074 C CA . SER E 151 ? 0.7576 1.1750 0.9859 0.0859 -0.0383 -0.3143 151 SER D CA 10075 C C . SER E 151 ? 0.6747 1.0919 0.8992 0.0859 -0.0377 -0.3081 151 SER D C 10076 O O . SER E 151 ? 0.6225 1.0369 0.8488 0.0802 -0.0364 -0.3081 151 SER D O 10077 C CB . SER E 151 ? 0.7375 1.1683 0.9691 0.0882 -0.0396 -0.3237 151 SER D CB 10078 O OG . SER E 151 ? 0.7566 1.1979 0.9844 0.0953 -0.0411 -0.3234 151 SER D OG 10079 N N . VAL E 152 ? 0.7172 1.1376 0.9356 0.0918 -0.0390 -0.3034 152 VAL D N 10080 C CA . VAL E 152 ? 0.8312 1.2487 1.0444 0.0922 -0.0394 -0.2975 152 VAL D CA 10081 C C . VAL E 152 ? 0.8686 1.2735 1.0814 0.0871 -0.0373 -0.2902 152 VAL D C 10082 O O . VAL E 152 ? 1.0123 1.4143 1.2245 0.0844 -0.0368 -0.2879 152 VAL D O 10083 C CB . VAL E 152 ? 0.8738 1.2929 1.0776 0.0984 -0.0422 -0.2925 152 VAL D CB 10084 C CG1 . VAL E 152 ? 0.9609 1.3901 1.1626 0.1037 -0.0454 -0.2986 152 VAL D CG1 10085 C CG2 . VAL E 152 ? 1.0109 1.4303 1.2116 0.1003 -0.0421 -0.2894 152 VAL D CG2 10086 N N . ARG E 153 ? 0.8883 1.2867 1.1014 0.0862 -0.0364 -0.2872 153 ARG D N 10087 C CA . ARG E 153 ? 0.9459 1.3319 1.1584 0.0821 -0.0349 -0.2804 153 ARG D CA 10088 C C . ARG E 153 ? 0.9997 1.3783 1.2165 0.0747 -0.0334 -0.2823 153 ARG D C 10089 O O . ARG E 153 ? 1.0812 1.4517 1.2962 0.0711 -0.0323 -0.2765 153 ARG D O 10090 C CB . ARG E 153 ? 0.8659 1.2488 1.0781 0.0841 -0.0350 -0.2787 153 ARG D CB 10091 C CG . ARG E 153 ? 0.8705 1.2589 1.0765 0.0886 -0.0357 -0.2734 153 ARG D CG 10092 C CD . ARG E 153 ? 0.8662 1.2530 1.0727 0.0898 -0.0354 -0.2716 153 ARG D CD 10093 N NE . ARG E 153 ? 0.9041 1.3034 1.1091 0.0946 -0.0363 -0.2746 153 ARG D NE 10094 C CZ . ARG E 153 ? 0.8670 1.2718 1.0766 0.0976 -0.0373 -0.2822 153 ARG D CZ 10095 N NH1 . ARG E 153 ? 0.8182 1.2149 1.0334 0.0963 -0.0379 -0.2875 153 ARG D NH1 10096 N NH2 . ARG E 153 ? 0.9417 1.3598 1.1493 0.1018 -0.0379 -0.2846 153 ARG D NH2 10097 N N . ASN E 154 ? 0.9396 1.3206 1.1611 0.0717 -0.0336 -0.2902 154 ASN D N 10098 C CA . ASN E 154 ? 0.9432 1.3176 1.1670 0.0628 -0.0324 -0.2921 154 ASN D CA 10099 C C . ASN E 154 ? 0.8616 1.2481 1.0882 0.0597 -0.0316 -0.2977 154 ASN D C 10100 O O . ASN E 154 ? 0.9148 1.3005 1.1439 0.0513 -0.0307 -0.3017 154 ASN D O 10101 C CB . ASN E 154 ? 1.0020 1.3668 1.2273 0.0590 -0.0337 -0.2961 154 ASN D CB 10102 C CG . ASN E 154 ? 1.2123 1.5863 1.4405 0.0625 -0.0353 -0.3046 154 ASN D CG 10103 O OD1 . ASN E 154 ? 1.2603 1.6488 1.4903 0.0662 -0.0352 -0.3085 154 ASN D OD1 10104 N ND2 . ASN E 154 ? 1.3644 1.7292 1.5926 0.0620 -0.0376 -0.3078 154 ASN D ND2 10105 N N . GLY E 155 ? 0.7221 1.1198 0.9476 0.0663 -0.0325 -0.2982 155 GLY D N 10106 C CA . GLY E 155 ? 0.6598 1.0702 0.8874 0.0652 -0.0324 -0.3036 155 GLY D CA 10107 C C . GLY E 155 ? 0.7501 1.1734 0.9830 0.0634 -0.0327 -0.3142 155 GLY D C 10108 O O . GLY E 155 ? 0.7983 1.2338 1.0341 0.0608 -0.0322 -0.3198 155 GLY D O 10109 N N . THR E 156 ? 0.7987 1.2213 1.0329 0.0652 -0.0336 -0.3175 156 THR D N 10110 C CA . THR E 156 ? 0.8182 1.2523 1.0572 0.0633 -0.0342 -0.3278 156 THR D CA 10111 C C . THR E 156 ? 0.8220 1.2689 1.0612 0.0730 -0.0365 -0.3327 156 THR D C 10112 O O . THR E 156 ? 0.8979 1.3559 1.1412 0.0722 -0.0371 -0.3415 156 THR D O 10113 C CB . THR E 156 ? 0.8304 1.2539 1.0706 0.0571 -0.0343 -0.3300 156 THR D CB 10114 O OG1 . THR E 156 ? 0.8391 1.2537 1.0767 0.0636 -0.0357 -0.3260 156 THR D OG1 10115 C CG2 . THR E 156 ? 0.8330 1.2439 1.0721 0.0455 -0.0327 -0.3270 156 THR D CG2 10116 N N . TYR E 157 ? 0.8142 1.2596 1.0481 0.0814 -0.0381 -0.3270 157 TYR D N 10117 C CA . TYR E 157 ? 0.8146 1.2707 1.0463 0.0903 -0.0410 -0.3307 157 TYR D CA 10118 C C . TYR E 157 ? 0.9259 1.3982 1.1616 0.0912 -0.0421 -0.3404 157 TYR D C 10119 O O . TYR E 157 ? 0.9347 1.4117 1.1712 0.0895 -0.0419 -0.3415 157 TYR D O 10120 C CB . TYR E 157 ? 0.8172 1.2689 1.0404 0.0970 -0.0430 -0.3227 157 TYR D CB 10121 C CG . TYR E 157 ? 0.7894 1.2499 1.0073 0.1059 -0.0470 -0.3255 157 TYR D CG 10122 C CD1 . TYR E 157 ? 0.8526 1.3129 1.0661 0.1102 -0.0483 -0.3237 157 TYR D CD1 10123 C CD2 . TYR E 157 ? 0.7680 1.2369 0.9843 0.1102 -0.0499 -0.3300 157 TYR D CD2 10124 C CE1 . TYR E 157 ? 0.8549 1.3215 1.0618 0.1176 -0.0523 -0.3256 157 TYR D CE1 10125 C CE2 . TYR E 157 ? 0.8277 1.3021 1.0374 0.1188 -0.0546 -0.3323 157 TYR D CE2 10126 C CZ . TYR E 157 ? 0.8475 1.3200 1.0521 0.1221 -0.0558 -0.3298 157 TYR D CZ 10127 O OH . TYR E 157 ? 0.8477 1.3243 1.0438 0.1300 -0.0609 -0.3316 157 TYR D OH 10128 N N . ASP E 158 ? 1.1706 1.6527 1.4088 0.0944 -0.0435 -0.3479 158 ASP D N 10129 C CA . ASP E 158 ? 1.1522 1.6519 1.3950 0.0953 -0.0447 -0.3586 158 ASP D CA 10130 C C . ASP E 158 ? 1.1732 1.6812 1.4107 0.1068 -0.0491 -0.3606 158 ASP D C 10131 O O . ASP E 158 ? 1.1108 1.6188 1.3453 0.1122 -0.0509 -0.3606 158 ASP D O 10132 C CB . ASP E 158 ? 1.1805 1.6852 1.4300 0.0894 -0.0435 -0.3666 158 ASP D CB 10133 C CG . ASP E 158 ? 1.2520 1.7769 1.5063 0.0914 -0.0450 -0.3784 158 ASP D CG 10134 O OD1 . ASP E 158 ? 1.1524 1.6827 1.4072 0.0964 -0.0469 -0.3831 158 ASP D OD1 10135 O OD2 . ASP E 158 ? 1.1640 1.7006 1.4220 0.0875 -0.0443 -0.3838 158 ASP D OD2 10136 N N . TYR E 159 ? 1.1815 1.6961 1.4170 0.1106 -0.0514 -0.3624 159 TYR D N 10137 C CA . TYR E 159 ? 1.1358 1.6548 1.3636 0.1221 -0.0571 -0.3637 159 TYR D CA 10138 C C . TYR E 159 ? 1.1175 1.6515 1.3477 0.1276 -0.0598 -0.3740 159 TYR D C 10139 O O . TYR E 159 ? 0.9188 1.4502 1.1412 0.1354 -0.0637 -0.3723 159 TYR D O 10140 C CB . TYR E 159 ? 1.1392 1.6618 1.3648 0.1252 -0.0595 -0.3648 159 TYR D CB 10141 C CG . TYR E 159 ? 1.1307 1.6569 1.3474 0.1378 -0.0669 -0.3677 159 TYR D CG 10142 C CD1 . TYR E 159 ? 1.0866 1.5968 1.2899 0.1439 -0.0711 -0.3583 159 TYR D CD1 10143 C CD2 . TYR E 159 ? 1.1016 1.6466 1.3221 0.1433 -0.0702 -0.3799 159 TYR D CD2 10144 C CE1 . TYR E 159 ? 1.1357 1.6453 1.3281 0.1550 -0.0790 -0.3604 159 TYR D CE1 10145 C CE2 . TYR E 159 ? 1.1267 1.6728 1.3376 0.1559 -0.0782 -0.3829 159 TYR D CE2 10146 C CZ . TYR E 159 ? 1.0765 1.6033 1.2726 0.1617 -0.0830 -0.3728 159 TYR D CZ 10147 O OH . TYR E 159 ? 0.9047 1.4287 1.0885 0.1739 -0.0921 -0.3750 159 TYR D OH 10148 N N . PRO E 160 ? 1.1916 1.7417 1.4319 0.1229 -0.0579 -0.3847 160 PRO D N 10149 C CA . PRO E 160 ? 1.2386 1.8039 1.4819 0.1278 -0.0604 -0.3949 160 PRO D CA 10150 C C . PRO E 160 ? 1.1162 1.6747 1.3566 0.1298 -0.0606 -0.3922 160 PRO D C 10151 O O . PRO E 160 ? 1.0540 1.6156 1.2884 0.1388 -0.0650 -0.3939 160 PRO D O 10152 C CB . PRO E 160 ? 1.2915 1.8715 1.5463 0.1178 -0.0566 -0.4045 160 PRO D CB 10153 C CG . PRO E 160 ? 1.2759 1.8508 1.5328 0.1091 -0.0530 -0.4001 160 PRO D CG 10154 C CD . PRO E 160 ? 1.2318 1.7893 1.4797 0.1138 -0.0544 -0.3884 160 PRO D CD 10155 N N . GLN E 161 ? 1.0642 1.6134 1.3082 0.1217 -0.0564 -0.3883 161 GLN D N 10156 C CA . GLN E 161 ? 0.9891 1.5329 1.2311 0.1235 -0.0564 -0.3863 161 GLN D CA 10157 C C . GLN E 161 ? 0.9908 1.5313 1.2222 0.1333 -0.0604 -0.3813 161 GLN D C 10158 O O . GLN E 161 ? 1.1399 1.6851 1.3701 0.1372 -0.0618 -0.3844 161 GLN D O 10159 C CB . GLN E 161 ? 1.0303 1.5591 1.2736 0.1161 -0.0526 -0.3792 161 GLN D CB 10160 C CG . GLN E 161 ? 1.0480 1.5772 1.2984 0.1096 -0.0507 -0.3850 161 GLN D CG 10161 C CD . GLN E 161 ? 1.0385 1.5592 1.2862 0.1123 -0.0508 -0.3812 161 GLN D CD 10162 O OE1 . GLN E 161 ? 0.9623 1.4705 1.2066 0.1111 -0.0496 -0.3727 161 GLN D OE1 10163 N NE2 . GLN E 161 ? 1.1474 1.6765 1.3967 0.1163 -0.0525 -0.3879 161 GLN D NE2 10164 N N . TYR E 162 ? 0.8447 1.3767 1.0672 0.1367 -0.0625 -0.3736 162 TYR D N 10165 C CA . TYR E 162 ? 0.8963 1.4213 1.1059 0.1436 -0.0664 -0.3667 162 TYR D CA 10166 C C . TYR E 162 ? 0.8558 1.3828 1.0558 0.1526 -0.0731 -0.3684 162 TYR D C 10167 O O . TYR E 162 ? 0.7754 1.2955 0.9626 0.1577 -0.0773 -0.3630 162 TYR D O 10168 C CB . TYR E 162 ? 0.9648 1.4739 1.1684 0.1398 -0.0643 -0.3542 162 TYR D CB 10169 C CG . TYR E 162 ? 1.0291 1.5343 1.2402 0.1327 -0.0590 -0.3522 162 TYR D CG 10170 C CD1 . TYR E 162 ? 1.0820 1.5832 1.3013 0.1253 -0.0552 -0.3523 162 TYR D CD1 10171 C CD2 . TYR E 162 ? 1.0054 1.5110 1.2146 0.1335 -0.0584 -0.3507 162 TYR D CD2 10172 C CE1 . TYR E 162 ? 1.0792 1.5745 1.3037 0.1197 -0.0517 -0.3508 162 TYR D CE1 10173 C CE2 . TYR E 162 ? 0.9787 1.4807 1.1944 0.1286 -0.0547 -0.3501 162 TYR D CE2 10174 C CZ . TYR E 162 ? 1.0415 1.5371 1.2644 0.1219 -0.0517 -0.3501 162 TYR D CZ 10175 O OH . TYR E 162 ? 1.0164 1.5058 1.2441 0.1177 -0.0493 -0.3498 162 TYR D OH 10176 N N . SER E 163 ? 1.0223 1.5590 1.2274 0.1545 -0.0746 -0.3763 163 SER D N 10177 C CA . SER E 163 ? 1.1016 1.6385 1.2971 0.1641 -0.0819 -0.3782 163 SER D CA 10178 C C . SER E 163 ? 1.1844 1.7210 1.3687 0.1727 -0.0882 -0.3793 163 SER D C 10179 O O . SER E 163 ? 1.1385 1.6625 1.3072 0.1786 -0.0943 -0.3729 163 SER D O 10180 C CB . SER E 163 ? 1.0504 1.6050 1.2553 0.1661 -0.0829 -0.3905 163 SER D CB 10181 O OG . SER E 163 ? 1.1047 1.6661 1.3231 0.1557 -0.0759 -0.3932 163 SER D OG 10182 N N . GLU E 164 ? 1.3077 1.8575 1.4994 0.1729 -0.0868 -0.3874 164 GLU D N 10183 C CA . GLU E 164 ? 1.2987 1.8530 1.4823 0.1815 -0.0928 -0.3918 164 GLU D CA 10184 C C . GLU E 164 ? 1.1516 1.6932 1.3221 0.1815 -0.0941 -0.3819 164 GLU D C 10185 O O . GLU E 164 ? 1.0690 1.6032 1.2239 0.1885 -0.1012 -0.3791 164 GLU D O 10186 C CB . GLU E 164 ? 1.3974 1.9721 1.5947 0.1812 -0.0908 -0.4050 164 GLU D CB 10187 C CG . GLU E 164 ? 1.4904 2.0794 1.6974 0.1818 -0.0911 -0.4151 164 GLU D CG 10188 C CD . GLU E 164 ? 1.3833 1.9941 1.6007 0.1834 -0.0912 -0.4292 164 GLU D CD 10189 O OE1 . GLU E 164 ? 1.3168 1.9308 1.5305 0.1884 -0.0940 -0.4320 164 GLU D OE1 10190 O OE2 . GLU E 164 ? 1.3314 1.9569 1.5603 0.1792 -0.0886 -0.4375 164 GLU D OE2 10191 N N . GLU E 165 ? 0.9830 1.5214 1.1585 0.1735 -0.0876 -0.3762 165 GLU D N 10192 C CA . GLU E 165 ? 0.9600 1.4881 1.1234 0.1720 -0.0879 -0.3661 165 GLU D CA 10193 C C . GLU E 165 ? 1.0987 1.6094 1.2455 0.1730 -0.0924 -0.3552 165 GLU D C 10194 O O . GLU E 165 ? 1.0967 1.5989 1.2275 0.1741 -0.0962 -0.3481 165 GLU D O 10195 C CB . GLU E 165 ? 0.8657 1.3941 1.0389 0.1636 -0.0803 -0.3629 165 GLU D CB 10196 C CG . GLU E 165 ? 0.8475 1.3690 1.0103 0.1610 -0.0795 -0.3532 165 GLU D CG 10197 C CD . GLU E 165 ? 0.8281 1.3509 1.0011 0.1543 -0.0727 -0.3514 165 GLU D CD 10198 O OE1 . GLU E 165 ? 0.8382 1.3648 1.0253 0.1514 -0.0691 -0.3573 165 GLU D OE1 10199 O OE2 . GLU E 165 ? 0.7801 1.3003 0.9465 0.1518 -0.0715 -0.3444 165 GLU D OE2 10200 N N . ALA E 166 ? 1.1876 1.6928 1.3377 0.1717 -0.0917 -0.3537 166 ALA D N 10201 C CA . ALA E 166 ? 1.2626 1.7507 1.3979 0.1728 -0.0962 -0.3442 166 ALA D CA 10202 C C . ALA E 166 ? 1.2356 1.7206 1.3586 0.1832 -0.1061 -0.3485 166 ALA D C 10203 O O . ALA E 166 ? 1.1507 1.6207 1.2545 0.1859 -0.1128 -0.3412 166 ALA D O 10204 C CB . ALA E 166 ? 1.3866 1.8707 1.5308 0.1676 -0.0917 -0.3415 166 ALA D CB 10205 N N . ARG E 167 ? 1.4298 1.9289 1.5631 0.1887 -0.1074 -0.3607 167 ARG D N 10206 C CA . ARG E 167 ? 1.6400 2.1407 1.7639 0.2005 -0.1173 -0.3681 167 ARG D CA 10207 C C . ARG E 167 ? 1.7157 2.2093 1.8220 0.2059 -0.1246 -0.3660 167 ARG D C 10208 O O . ARG E 167 ? 1.7323 2.2163 1.8226 0.2152 -0.1349 -0.3669 167 ARG D O 10209 C CB . ARG E 167 ? 1.6597 2.1838 1.8013 0.2037 -0.1155 -0.3835 167 ARG D CB 10210 C CG . ARG E 167 ? 1.7182 2.2478 1.8671 0.2055 -0.1159 -0.3886 167 ARG D CG 10211 C CD . ARG E 167 ? 1.6889 2.2438 1.8545 0.2073 -0.1140 -0.4040 167 ARG D CD 10212 N NE . ARG E 167 ? 1.7349 2.3010 1.8991 0.2146 -0.1185 -0.4129 167 ARG D NE 10213 C CZ . ARG E 167 ? 1.6022 2.1911 1.7815 0.2135 -0.1152 -0.4251 167 ARG D CZ 10214 N NH1 . ARG E 167 ? 1.5390 2.1415 1.7351 0.2046 -0.1076 -0.4298 167 ARG D NH1 10215 N NH2 . ARG E 167 ? 1.5040 2.1014 1.6805 0.2207 -0.1198 -0.4325 167 ARG D NH2 10216 N N . LEU E 168 ? 1.7732 2.2715 1.8819 0.2005 -0.1197 -0.3636 168 LEU D N 10217 C CA . LEU E 168 ? 1.8214 2.3161 1.9148 0.2042 -0.1255 -0.3621 168 LEU D CA 10218 C C . LEU E 168 ? 1.7776 2.2563 1.8542 0.1973 -0.1254 -0.3479 168 LEU D C 10219 O O . LEU E 168 ? 1.6213 2.0911 1.6787 0.2002 -0.1326 -0.3444 168 LEU D O 10220 C CB . LEU E 168 ? 1.8562 2.3714 1.9632 0.2049 -0.1216 -0.3724 168 LEU D CB 10221 C CG . LEU E 168 ? 1.8849 2.4156 1.9992 0.2146 -0.1260 -0.3871 168 LEU D CG 10222 C CD1 . LEU E 168 ? 1.8792 2.4002 1.9745 0.2263 -0.1386 -0.3891 168 LEU D CD1 10223 C CD2 . LEU E 168 ? 1.8944 2.4383 2.0283 0.2130 -0.1211 -0.3955 168 LEU D CD2 10224 N N . LYS E 169 ? 1.8061 2.2813 1.8888 0.1879 -0.1179 -0.3400 169 LYS D N 10225 C CA . LYS E 169 ? 1.8261 2.2860 1.8920 0.1807 -0.1183 -0.3262 169 LYS D CA 10226 C C . LYS E 169 ? 1.9583 2.3957 2.0040 0.1836 -0.1272 -0.3188 169 LYS D C 10227 O O . LYS E 169 ? 1.9338 2.3556 1.9598 0.1787 -0.1307 -0.3076 169 LYS D O 10228 C CB . LYS E 169 ? 1.6623 2.1266 1.7415 0.1707 -0.1080 -0.3210 169 LYS D CB 10229 C CG . LYS E 169 ? 1.5364 1.9860 1.6014 0.1627 -0.1076 -0.3071 169 LYS D CG 10230 C CD . LYS E 169 ? 1.4786 1.9235 1.5231 0.1599 -0.1118 -0.3005 169 LYS D CD 10231 C CE . LYS E 169 ? 1.3983 1.8417 1.4382 0.1490 -0.1065 -0.2899 169 LYS D CE 10232 N NZ . LYS E 169 ? 1.3533 1.8169 1.4113 0.1456 -0.0975 -0.2946 169 LYS D NZ 10233 N N . ARG E 170 ? 1.9851 2.4212 2.0349 0.1913 -0.1314 -0.3254 170 ARG D N 10234 C CA . ARG E 170 ? 1.9965 2.4116 2.0291 0.1949 -0.1399 -0.3196 170 ARG D CA 10235 C C . ARG E 170 ? 1.9672 2.3659 1.9728 0.2016 -0.1529 -0.3174 170 ARG D C 10236 O O . ARG E 170 ? 1.6706 2.0517 1.6555 0.1954 -0.1562 -0.3055 170 ARG D O 10237 C CB . ARG E 170 ? 1.9665 2.3884 2.0137 0.2007 -0.1396 -0.3283 170 ARG D CB 10238 C CG . ARG E 170 ? 1.8506 2.2565 1.8925 0.1980 -0.1404 -0.3204 170 ARG D CG 10239 C CD . ARG E 170 ? 1.6896 2.1038 1.7448 0.2041 -0.1406 -0.3295 170 ARG D CD 10240 N NE . ARG E 170 ? 1.5797 2.0148 1.6609 0.1981 -0.1291 -0.3355 170 ARG D NE 10241 C CZ . ARG E 170 ? 1.4915 1.9473 1.5891 0.2026 -0.1272 -0.3488 170 ARG D CZ 10242 N NH1 . ARG E 170 ? 1.4475 1.9088 1.5403 0.2143 -0.1359 -0.3589 170 ARG D NH1 10243 N NH2 . ARG E 170 ? 1.4448 1.9159 1.5633 0.1950 -0.1170 -0.3524 170 ARG D NH2 10244 N N . GLU E 171 ? 1.9665 2.3716 1.9717 0.2133 -0.1599 -0.3287 171 GLU D N 10245 C CA . GLU E 171 ? 1.9277 2.3140 1.9059 0.2222 -0.1745 -0.3279 171 GLU D CA 10246 C C . GLU E 171 ? 1.8743 2.2541 1.8345 0.2175 -0.1772 -0.3212 171 GLU D C 10247 O O . GLU E 171 ? 1.6517 2.0220 1.5936 0.2257 -0.1883 -0.3238 171 GLU D O 10248 C CB . GLU E 171 ? 1.9087 2.3060 1.8923 0.2373 -0.1818 -0.3434 171 GLU D CB 10249 C CG . GLU E 171 ? 1.8910 2.3107 1.9019 0.2407 -0.1751 -0.3551 171 GLU D CG 10250 C CD . GLU E 171 ? 1.8774 2.3244 1.9125 0.2359 -0.1639 -0.3627 171 GLU D CD 10251 O OE1 . GLU E 171 ? 1.8054 2.2727 1.8567 0.2424 -0.1630 -0.3764 171 GLU D OE1 10252 O OE2 . GLU E 171 ? 1.8156 2.2640 1.8526 0.2256 -0.1564 -0.3554 171 GLU D OE2 10253 N N . GLU E 172 ? 1.9042 2.2890 1.8684 0.2044 -0.1675 -0.3127 172 GLU D N 10254 C CA . GLU E 172 ? 1.9457 2.3297 1.8958 0.1978 -0.1677 -0.3066 172 GLU D CA 10255 C C . GLU E 172 ? 2.0002 2.3569 1.9178 0.1906 -0.1756 -0.2918 172 GLU D C 10256 O O . GLU E 172 ? 1.9135 2.2605 1.8087 0.1904 -0.1833 -0.2885 172 GLU D O 10257 C CB . GLU E 172 ? 1.8639 2.2699 1.8349 0.1878 -0.1535 -0.3061 172 GLU D CB 10258 C CG . GLU E 172 ? 1.7760 2.2075 1.7715 0.1934 -0.1477 -0.3201 172 GLU D CG 10259 C CD . GLU E 172 ? 1.6760 2.1274 1.6890 0.1850 -0.1358 -0.3206 172 GLU D CD 10260 O OE1 . GLU E 172 ? 1.5500 2.0201 1.5795 0.1893 -0.1324 -0.3316 172 GLU D OE1 10261 O OE2 . GLU E 172 ? 1.5387 1.9878 1.5494 0.1747 -0.1302 -0.3110 172 GLU D OE2 10262 N N . ILE E 173 ? 1.9778 2.3215 1.8923 0.1843 -0.1740 -0.2831 173 ILE D N 10263 C CA . ILE E 173 ? 1.8718 2.1923 1.7586 0.1737 -0.1788 -0.2680 173 ILE D CA 10264 C C . ILE E 173 ? 1.7480 2.0373 1.6068 0.1814 -0.1950 -0.2652 173 ILE D C 10265 O O . ILE E 173 ? 1.5546 1.8389 1.4043 0.1931 -0.2049 -0.2726 173 ILE D O 10266 C CB . ILE E 173 ? 1.7837 2.1040 1.6780 0.1615 -0.1696 -0.2586 173 ILE D CB 10267 C CG1 . ILE E 173 ? 1.7171 2.0651 1.6463 0.1599 -0.1550 -0.2654 173 ILE D CG1 10268 C CG2 . ILE E 173 ? 1.7205 2.0334 1.5938 0.1467 -0.1691 -0.2453 173 ILE D CG2 10269 C CD1 . ILE E 173 ? 1.6036 1.9484 1.5417 0.1528 -0.1484 -0.2589 173 ILE D CD1 10270 N N . GLY F 12 ? 0.7350 1.0713 0.9809 -0.0628 0.0073 -0.2987 12 GLY F N 10271 C CA . GLY F 12 ? 0.8273 1.1552 1.0732 -0.0687 0.0075 -0.2938 12 GLY F CA 10272 C C . GLY F 12 ? 0.8398 1.1767 1.0801 -0.0692 0.0089 -0.2890 12 GLY F C 10273 O O . GLY F 12 ? 0.8843 1.2342 1.1207 -0.0652 0.0097 -0.2899 12 GLY F O 10274 N N . GLY F 13 ? 0.8902 1.2203 1.1299 -0.0740 0.0091 -0.2839 13 GLY F N 10275 C CA . GLY F 13 ? 0.9168 1.2555 1.1516 -0.0747 0.0103 -0.2796 13 GLY F CA 10276 C C . GLY F 13 ? 0.9248 1.2717 1.1627 -0.0817 0.0109 -0.2830 13 GLY F C 10277 O O . GLY F 13 ? 0.9587 1.3019 1.2024 -0.0866 0.0101 -0.2880 13 GLY F O 10278 N N . TRP F 14 ? 0.9255 1.2833 1.1594 -0.0822 0.0120 -0.2805 14 TRP F N 10279 C CA . TRP F 14 ? 0.9122 1.2824 1.1485 -0.0884 0.0128 -0.2843 14 TRP F CA 10280 C C . TRP F 14 ? 0.8839 1.2535 1.1194 -0.0949 0.0132 -0.2792 14 TRP F C 10281 O O . TRP F 14 ? 0.8758 1.2538 1.1064 -0.0924 0.0140 -0.2755 14 TRP F O 10282 C CB . TRP F 14 ? 0.8613 1.2507 1.0942 -0.0839 0.0137 -0.2878 14 TRP F CB 10283 C CG . TRP F 14 ? 0.8378 1.2330 1.0715 -0.0790 0.0134 -0.2937 14 TRP F CG 10284 C CD1 . TRP F 14 ? 0.8038 1.1939 1.0428 -0.0802 0.0127 -0.2991 14 TRP F CD1 10285 C CD2 . TRP F 14 ? 0.7462 1.1544 0.9750 -0.0722 0.0134 -0.2951 14 TRP F CD2 10286 N NE1 . TRP F 14 ? 0.7757 1.1759 1.0134 -0.0746 0.0128 -0.3036 14 TRP F NE1 10287 C CE2 . TRP F 14 ? 0.7222 1.1334 0.9537 -0.0699 0.0131 -0.3010 14 TRP F CE2 10288 C CE3 . TRP F 14 ? 0.6525 1.0700 0.8748 -0.0675 0.0134 -0.2920 14 TRP F CE3 10289 C CZ2 . TRP F 14 ? 0.7022 1.1253 0.9298 -0.0638 0.0128 -0.3033 14 TRP F CZ2 10290 C CZ3 . TRP F 14 ? 0.6696 1.0977 0.8880 -0.0610 0.0127 -0.2943 14 TRP F CZ3 10291 C CH2 . TRP F 14 ? 0.6697 1.1005 0.8906 -0.0595 0.0125 -0.2997 14 TRP F CH2 10292 N N . GLN F 15 ? 0.9010 1.2619 1.1414 -0.1033 0.0125 -0.2794 15 GLN F N 10293 C CA . GLN F 15 ? 0.9188 1.2801 1.1589 -0.1110 0.0128 -0.2746 15 GLN F CA 10294 C C . GLN F 15 ? 0.9289 1.3110 1.1664 -0.1118 0.0144 -0.2758 15 GLN F C 10295 O O . GLN F 15 ? 0.8491 1.2354 1.0840 -0.1147 0.0150 -0.2709 15 GLN F O 10296 C CB . GLN F 15 ? 1.0080 1.3603 1.2539 -0.1210 0.0113 -0.2765 15 GLN F CB 10297 C CG . GLN F 15 ? 1.0936 1.4231 1.3418 -0.1230 0.0091 -0.2729 15 GLN F CG 10298 C CD . GLN F 15 ? 1.0968 1.4181 1.3423 -0.1267 0.0090 -0.2638 15 GLN F CD 10299 O OE1 . GLN F 15 ? 1.1584 1.4916 1.4004 -0.1284 0.0105 -0.2602 15 GLN F OE1 10300 N NE2 . GLN F 15 ? 0.9106 1.2121 1.1575 -0.1275 0.0069 -0.2602 15 GLN F NE2 10301 N N . GLY F 16 ? 1.0320 1.4281 1.2704 -0.1095 0.0149 -0.2828 16 GLY F N 10302 C CA . GLY F 16 ? 1.0728 1.4901 1.3091 -0.1097 0.0162 -0.2852 16 GLY F CA 10303 C C . GLY F 16 ? 1.0902 1.5145 1.3197 -0.1019 0.0167 -0.2810 16 GLY F C 10304 O O . GLY F 16 ? 1.2342 1.6677 1.4615 -0.1043 0.0174 -0.2781 16 GLY F O 10305 N N . MET F 17 ? 1.1286 1.5486 1.3545 -0.0926 0.0161 -0.2805 17 MET F N 10306 C CA . MET F 17 ? 1.1564 1.5830 1.3754 -0.0843 0.0158 -0.2775 17 MET F CA 10307 C C . MET F 17 ? 1.1847 1.6043 1.4009 -0.0857 0.0158 -0.2700 17 MET F C 10308 O O . MET F 17 ? 1.3060 1.7087 1.5222 -0.0856 0.0153 -0.2653 17 MET F O 10309 C CB . MET F 17 ? 1.0872 1.5068 1.3027 -0.0754 0.0146 -0.2771 17 MET F CB 10310 C CG . MET F 17 ? 1.0937 1.5219 1.3019 -0.0669 0.0137 -0.2753 17 MET F CG 10311 S SD . MET F 17 ? 1.1510 1.5694 1.3538 -0.0574 0.0117 -0.2729 17 MET F SD 10312 C CE . MET F 17 ? 1.2359 1.6656 1.4415 -0.0562 0.0118 -0.2810 17 MET F CE 10313 N N . VAL F 18 ? 1.1409 1.5745 1.3547 -0.0868 0.0164 -0.2693 18 VAL F N 10314 C CA . VAL F 18 ? 1.1415 1.5716 1.3528 -0.0886 0.0165 -0.2627 18 VAL F CA 10315 C C . VAL F 18 ? 1.0946 1.5324 1.2987 -0.0795 0.0156 -0.2607 18 VAL F C 10316 O O . VAL F 18 ? 1.2482 1.6810 1.4494 -0.0789 0.0154 -0.2552 18 VAL F O 10317 C CB . VAL F 18 ? 1.2016 1.6405 1.4163 -0.0994 0.0177 -0.2623 18 VAL F CB 10318 C CG1 . VAL F 18 ? 1.2535 1.6761 1.4735 -0.1088 0.0176 -0.2596 18 VAL F CG1 10319 C CG2 . VAL F 18 ? 1.2412 1.7009 1.4580 -0.1019 0.0185 -0.2692 18 VAL F CG2 10320 N N . ASP F 19 ? 1.0348 1.4843 1.2358 -0.0721 0.0148 -0.2652 19 ASP F N 10321 C CA . ASP F 19 ? 1.0397 1.4970 1.2337 -0.0633 0.0132 -0.2639 19 ASP F CA 10322 C C . ASP F 19 ? 0.9003 1.3437 1.0888 -0.0543 0.0110 -0.2606 19 ASP F C 10323 O O . ASP F 19 ? 0.7768 1.2249 0.9589 -0.0461 0.0089 -0.2602 19 ASP F O 10324 C CB . ASP F 19 ? 1.1847 1.6644 1.3773 -0.0600 0.0129 -0.2702 19 ASP F CB 10325 C CG . ASP F 19 ? 1.3227 1.8064 1.5177 -0.0590 0.0129 -0.2762 19 ASP F CG 10326 O OD1 . ASP F 19 ? 1.5035 1.9767 1.7033 -0.0640 0.0139 -0.2768 19 ASP F OD1 10327 O OD2 . ASP F 19 ? 1.2895 1.7870 1.4814 -0.0528 0.0117 -0.2806 19 ASP F OD2 10328 N N . GLY F 20 ? 0.8319 1.2582 1.0226 -0.0559 0.0111 -0.2583 20 GLY F N 10329 C CA . GLY F 20 ? 0.7977 1.2111 0.9835 -0.0486 0.0091 -0.2548 20 GLY F CA 10330 C C . GLY F 20 ? 0.7662 1.1623 0.9554 -0.0511 0.0095 -0.2527 20 GLY F C 10331 O O . GLY F 20 ? 0.7798 1.1714 0.9751 -0.0586 0.0111 -0.2534 20 GLY F O 10332 N N . TRP F 21 ? 0.7537 1.1403 0.9386 -0.0449 0.0077 -0.2500 21 TRP F N 10333 C CA . TRP F 21 ? 0.8623 1.2333 1.0497 -0.0464 0.0079 -0.2478 21 TRP F CA 10334 C C . TRP F 21 ? 0.7915 1.1650 0.9811 -0.0451 0.0077 -0.2526 21 TRP F C 10335 O O . TRP F 21 ? 0.6171 0.9837 0.8122 -0.0491 0.0087 -0.2543 21 TRP F O 10336 C CB . TRP F 21 ? 0.8709 1.2290 1.0525 -0.0414 0.0061 -0.2410 21 TRP F CB 10337 C CG . TRP F 21 ? 0.8688 1.2175 1.0508 -0.0447 0.0067 -0.2354 21 TRP F CG 10338 C CD1 . TRP F 21 ? 0.8994 1.2490 1.0864 -0.0520 0.0086 -0.2353 21 TRP F CD1 10339 C CD2 . TRP F 21 ? 0.8945 1.2315 1.0716 -0.0412 0.0053 -0.2289 21 TRP F CD2 10340 N NE1 . TRP F 21 ? 0.9097 1.2493 1.0952 -0.0531 0.0085 -0.2291 21 TRP F NE1 10341 C CE2 . TRP F 21 ? 0.9080 1.2399 1.0877 -0.0464 0.0066 -0.2253 21 TRP F CE2 10342 C CE3 . TRP F 21 ? 0.9151 1.2455 1.0859 -0.0347 0.0029 -0.2257 21 TRP F CE3 10343 C CZ2 . TRP F 21 ? 1.0159 1.3368 1.1921 -0.0447 0.0058 -0.2189 21 TRP F CZ2 10344 C CZ3 . TRP F 21 ? 1.0392 1.3584 1.2066 -0.0332 0.0020 -0.2193 21 TRP F CZ3 10345 C CH2 . TRP F 21 ? 1.0585 1.3732 1.2286 -0.0380 0.0035 -0.2161 21 TRP F CH2 10346 N N . TYR F 22 ? 0.7504 1.1335 0.9352 -0.0393 0.0061 -0.2549 22 TYR F N 10347 C CA . TYR F 22 ? 0.8339 1.2224 1.0200 -0.0378 0.0059 -0.2597 22 TYR F CA 10348 C C . TYR F 22 ? 0.9207 1.3269 1.1066 -0.0368 0.0059 -0.2655 22 TYR F C 10349 O O . TYR F 22 ? 0.9577 1.3713 1.1389 -0.0333 0.0047 -0.2648 22 TYR F O 10350 C CB . TYR F 22 ? 0.8010 1.1839 0.9806 -0.0314 0.0034 -0.2562 22 TYR F CB 10351 C CG . TYR F 22 ? 0.7839 1.1512 0.9605 -0.0302 0.0025 -0.2492 22 TYR F CG 10352 C CD1 . TYR F 22 ? 0.7155 1.0715 0.8971 -0.0344 0.0039 -0.2477 22 TYR F CD1 10353 C CD2 . TYR F 22 ? 0.7441 1.1079 0.9126 -0.0247 -0.0001 -0.2442 22 TYR F CD2 10354 C CE1 . TYR F 22 ? 0.6345 0.9771 0.8134 -0.0332 0.0031 -0.2413 22 TYR F CE1 10355 C CE2 . TYR F 22 ? 0.6669 1.0169 0.8325 -0.0237 -0.0011 -0.2379 22 TYR F CE2 10356 C CZ . TYR F 22 ? 0.6656 1.0056 0.8365 -0.0280 0.0007 -0.2364 22 TYR F CZ 10357 O OH . TYR F 22 ? 0.6432 0.9703 0.8108 -0.0267 -0.0002 -0.2301 22 TYR F OH 10358 N N . GLY F 23 ? 1.0189 1.4324 1.2098 -0.0395 0.0070 -0.2716 23 GLY F N 10359 C CA . GLY F 23 ? 1.0506 1.4816 1.2414 -0.0384 0.0070 -0.2774 23 GLY F CA 10360 C C . GLY F 23 ? 0.9682 1.4069 1.1644 -0.0409 0.0080 -0.2843 23 GLY F C 10361 O O . GLY F 23 ? 0.8448 1.2768 1.0428 -0.0409 0.0080 -0.2849 23 GLY F O 10362 N N . TYR F 24 ? 0.9536 1.4073 1.1522 -0.0430 0.0090 -0.2898 24 TYR F N 10363 C CA . TYR F 24 ? 0.8794 1.3437 1.0820 -0.0444 0.0096 -0.2969 24 TYR F CA 10364 C C . TYR F 24 ? 0.8720 1.3434 1.0820 -0.0524 0.0118 -0.3022 24 TYR F C 10365 O O . TYR F 24 ? 0.9244 1.4011 1.1346 -0.0553 0.0125 -0.3015 24 TYR F O 10366 C CB . TYR F 24 ? 0.7704 1.2491 0.9675 -0.0382 0.0079 -0.2991 24 TYR F CB 10367 C CG . TYR F 24 ? 0.7643 1.2372 0.9528 -0.0303 0.0049 -0.2936 24 TYR F CG 10368 C CD1 . TYR F 24 ? 0.7979 1.2656 0.9839 -0.0272 0.0035 -0.2924 24 TYR F CD1 10369 C CD2 . TYR F 24 ? 0.7930 1.2660 0.9754 -0.0260 0.0031 -0.2897 24 TYR F CD2 10370 C CE1 . TYR F 24 ? 0.8267 1.2887 1.0043 -0.0207 0.0002 -0.2869 24 TYR F CE1 10371 C CE2 . TYR F 24 ? 0.7638 1.2305 0.9378 -0.0188 -0.0002 -0.2847 24 TYR F CE2 10372 C CZ . TYR F 24 ? 0.7728 1.2335 0.9443 -0.0165 -0.0017 -0.2831 24 TYR F CZ 10373 O OH . TYR F 24 ? 0.7354 1.1889 0.8983 -0.0103 -0.0055 -0.2777 24 TYR F OH 10374 N N . HIS F 25 ? 0.9217 1.3933 1.1377 -0.0560 0.0127 -0.3075 25 HIS F N 10375 C CA . HIS F 25 ? 0.9785 1.4593 1.2011 -0.0631 0.0142 -0.3139 25 HIS F CA 10376 C C . HIS F 25 ? 0.9450 1.4408 1.1678 -0.0604 0.0140 -0.3206 25 HIS F C 10377 O O . HIS F 25 ? 0.8841 1.3778 1.1068 -0.0570 0.0133 -0.3222 25 HIS F O 10378 C CB . HIS F 25 ? 1.0444 1.5124 1.2739 -0.0699 0.0149 -0.3154 25 HIS F CB 10379 C CG . HIS F 25 ? 1.1271 1.6021 1.3630 -0.0782 0.0159 -0.3210 25 HIS F CG 10380 N ND1 . HIS F 25 ? 1.2058 1.6776 1.4481 -0.0824 0.0158 -0.3270 25 HIS F ND1 10381 C CD2 . HIS F 25 ? 1.1296 1.6146 1.3663 -0.0834 0.0167 -0.3216 25 HIS F CD2 10382 C CE1 . HIS F 25 ? 1.1998 1.6784 1.4464 -0.0900 0.0164 -0.3308 25 HIS F CE1 10383 N NE2 . HIS F 25 ? 1.1928 1.6800 1.4361 -0.0910 0.0171 -0.3274 25 HIS F NE2 10384 N N . HIS F 26 ? 1.0394 1.5516 1.2627 -0.0619 0.0146 -0.3244 26 HIS F N 10385 C CA . HIS F 26 ? 1.0865 1.6147 1.3098 -0.0593 0.0144 -0.3308 26 HIS F CA 10386 C C . HIS F 26 ? 1.1234 1.6604 1.3541 -0.0672 0.0159 -0.3380 26 HIS F C 10387 O O . HIS F 26 ? 1.2396 1.7796 1.4728 -0.0734 0.0169 -0.3380 26 HIS F O 10388 C CB . HIS F 26 ? 1.0329 1.5745 1.2495 -0.0529 0.0131 -0.3299 26 HIS F CB 10389 C CG . HIS F 26 ? 1.0918 1.6457 1.3096 -0.0566 0.0141 -0.3314 26 HIS F CG 10390 N ND1 . HIS F 26 ? 1.1385 1.6891 1.3530 -0.0563 0.0139 -0.3260 26 HIS F ND1 10391 C CD2 . HIS F 26 ? 1.0921 1.6623 1.3137 -0.0611 0.0153 -0.3377 26 HIS F CD2 10392 C CE1 . HIS F 26 ? 1.1587 1.7240 1.3751 -0.0603 0.0150 -0.3290 26 HIS F CE1 10393 N NE2 . HIS F 26 ? 1.1175 1.6948 1.3383 -0.0635 0.0159 -0.3360 26 HIS F NE2 10394 N N . SER F 27 ? 1.1063 1.6476 1.3403 -0.0670 0.0159 -0.3441 27 SER F N 10395 C CA . SER F 27 ? 1.0520 1.5996 1.2933 -0.0743 0.0169 -0.3515 27 SER F CA 10396 C C . SER F 27 ? 0.9653 1.5326 1.2063 -0.0713 0.0169 -0.3582 27 SER F C 10397 O O . SER F 27 ? 0.9522 1.5208 1.1933 -0.0676 0.0163 -0.3612 27 SER F O 10398 C CB . SER F 27 ? 1.0781 1.6105 1.3247 -0.0774 0.0167 -0.3533 27 SER F CB 10399 O OG . SER F 27 ? 1.0457 1.5748 1.2988 -0.0865 0.0171 -0.3569 27 SER F OG 10400 N N . ASN F 28 ? 0.9911 1.5744 1.2314 -0.0727 0.0174 -0.3604 28 ASN F N 10401 C CA . ASN F 28 ? 0.9829 1.5862 1.2229 -0.0702 0.0174 -0.3669 28 ASN F CA 10402 C C . ASN F 28 ? 1.0097 1.6272 1.2547 -0.0779 0.0187 -0.3728 28 ASN F C 10403 O O . ASN F 28 ? 0.9414 1.5517 1.1910 -0.0864 0.0195 -0.3725 28 ASN F O 10404 C CB . ASN F 28 ? 0.8741 1.4861 1.1058 -0.0608 0.0158 -0.3636 28 ASN F CB 10405 C CG . ASN F 28 ? 0.8479 1.4685 1.0767 -0.0606 0.0159 -0.3612 28 ASN F CG 10406 O OD1 . ASN F 28 ? 0.8685 1.4879 1.1008 -0.0679 0.0173 -0.3607 28 ASN F OD1 10407 N ND2 . ASN F 28 ? 0.7570 1.3855 0.9787 -0.0520 0.0140 -0.3593 28 ASN F ND2 10408 N N . GLU F 29 ? 1.1818 1.8194 1.4258 -0.0753 0.0186 -0.3778 29 GLU F N 10409 C CA . GLU F 29 ? 1.3573 2.0104 1.6062 -0.0828 0.0199 -0.3842 29 GLU F CA 10410 C C . GLU F 29 ? 1.3390 1.9960 1.5877 -0.0880 0.0207 -0.3810 29 GLU F C 10411 O O . GLU F 29 ? 1.2724 1.9313 1.5265 -0.0979 0.0217 -0.3837 29 GLU F O 10412 C CB . GLU F 29 ? 1.4793 2.1546 1.7265 -0.0780 0.0195 -0.3901 29 GLU F CB 10413 C CG . GLU F 29 ? 1.5640 2.2502 1.8179 -0.0844 0.0204 -0.3989 29 GLU F CG 10414 C CD . GLU F 29 ? 1.6232 2.3063 1.8785 -0.0809 0.0198 -0.4029 29 GLU F CD 10415 O OE1 . GLU F 29 ? 1.5500 2.2394 1.8001 -0.0722 0.0187 -0.4022 29 GLU F OE1 10416 O OE2 . GLU F 29 ? 1.7558 2.4303 2.0171 -0.0868 0.0201 -0.4067 29 GLU F OE2 10417 N N . GLN F 30 ? 1.2784 1.9364 1.5207 -0.0816 0.0200 -0.3753 30 GLN F N 10418 C CA . GLN F 30 ? 1.2596 1.9261 1.5008 -0.0850 0.0207 -0.3729 30 GLN F CA 10419 C C . GLN F 30 ? 1.2813 1.9311 1.5250 -0.0929 0.0214 -0.3675 30 GLN F C 10420 O O . GLN F 30 ? 1.3338 1.9892 1.5767 -0.0966 0.0220 -0.3646 30 GLN F O 10421 C CB . GLN F 30 ? 1.2113 1.8846 1.4447 -0.0747 0.0192 -0.3692 30 GLN F CB 10422 C CG . GLN F 30 ? 1.1440 1.8363 1.3741 -0.0669 0.0180 -0.3741 30 GLN F CG 10423 C CD . GLN F 30 ? 1.1650 1.8487 1.3910 -0.0583 0.0161 -0.3730 30 GLN F CD 10424 O OE1 . GLN F 30 ? 1.1018 1.7827 1.3208 -0.0493 0.0138 -0.3689 30 GLN F OE1 10425 N NE2 . GLN F 30 ? 1.2272 1.9072 1.4575 -0.0611 0.0167 -0.3769 30 GLN F NE2 10426 N N . GLY F 31 ? 1.2950 1.9250 1.5416 -0.0953 0.0212 -0.3662 31 GLY F N 10427 C CA . GLY F 31 ? 1.2607 1.8723 1.5093 -0.1018 0.0214 -0.3606 31 GLY F CA 10428 C C . GLY F 31 ? 1.2243 1.8188 1.4682 -0.0940 0.0204 -0.3541 31 GLY F C 10429 O O . GLY F 31 ? 1.1302 1.7289 1.3688 -0.0843 0.0194 -0.3532 31 GLY F O 10430 N N . SER F 32 ? 1.2049 1.7799 1.4508 -0.0986 0.0203 -0.3495 32 SER F N 10431 C CA . SER F 32 ? 1.1078 1.6650 1.3501 -0.0925 0.0194 -0.3432 32 SER F CA 10432 C C . SER F 32 ? 1.0588 1.6111 1.2972 -0.0925 0.0195 -0.3356 32 SER F C 10433 O O . SER F 32 ? 1.0933 1.6565 1.3320 -0.0975 0.0203 -0.3353 32 SER F O 10434 C CB . SER F 32 ? 1.0789 1.6173 1.3260 -0.0963 0.0189 -0.3438 32 SER F CB 10435 O OG . SER F 32 ? 1.0340 1.5659 1.2859 -0.1068 0.0191 -0.3433 32 SER F OG 10436 N N . GLY F 33 ? 1.0233 1.5600 1.2580 -0.0871 0.0186 -0.3296 33 GLY F N 10437 C CA . GLY F 33 ? 1.0131 1.5445 1.2437 -0.0862 0.0185 -0.3224 33 GLY F CA 10438 C C . GLY F 33 ? 0.9869 1.5041 1.2122 -0.0779 0.0172 -0.3167 33 GLY F C 10439 O O . GLY F 33 ? 0.9878 1.5032 1.2111 -0.0714 0.0162 -0.3181 33 GLY F O 10440 N N . TYR F 34 ? 0.9745 1.4820 1.1975 -0.0785 0.0171 -0.3100 34 TYR F N 10441 C CA . TYR F 34 ? 0.9110 1.4036 1.1292 -0.0719 0.0159 -0.3039 34 TYR F CA 10442 C C . TYR F 34 ? 0.9152 1.4158 1.1261 -0.0642 0.0147 -0.3010 34 TYR F C 10443 O O . TYR F 34 ? 1.0897 1.6026 1.2998 -0.0659 0.0152 -0.3014 34 TYR F O 10444 C CB . TYR F 34 ? 0.8717 1.3468 1.0921 -0.0775 0.0163 -0.2982 34 TYR F CB 10445 C CG . TYR F 34 ? 0.8558 1.3203 1.0832 -0.0847 0.0167 -0.3007 34 TYR F CG 10446 C CD1 . TYR F 34 ? 0.9037 1.3715 1.1363 -0.0947 0.0176 -0.3030 34 TYR F CD1 10447 C CD2 . TYR F 34 ? 0.8643 1.3154 1.0928 -0.0818 0.0159 -0.3007 34 TYR F CD2 10448 C CE1 . TYR F 34 ? 0.8827 1.3393 1.1215 -0.1011 0.0172 -0.3054 34 TYR F CE1 10449 C CE2 . TYR F 34 ? 0.9371 1.3780 1.1718 -0.0876 0.0158 -0.3036 34 TYR F CE2 10450 C CZ . TYR F 34 ? 0.9272 1.3703 1.1671 -0.0971 0.0163 -0.3060 34 TYR F CZ 10451 O OH . TYR F 34 ? 0.8912 1.3228 1.1369 -0.1023 0.0154 -0.3091 34 TYR F OH 10452 N N . ALA F 35 ? 0.9260 1.4196 1.1313 -0.0557 0.0128 -0.2982 35 ALA F N 10453 C CA . ALA F 35 ? 0.9211 1.4177 1.1188 -0.0480 0.0108 -0.2946 35 ALA F CA 10454 C C . ALA F 35 ? 0.9054 1.3838 1.0985 -0.0432 0.0092 -0.2879 35 ALA F C 10455 O O . ALA F 35 ? 0.9114 1.3819 1.1034 -0.0402 0.0082 -0.2875 35 ALA F O 10456 C CB . ALA F 35 ? 0.9013 1.4136 1.0951 -0.0412 0.0091 -0.2992 35 ALA F CB 10457 N N . ALA F 36 ? 0.8678 1.3401 1.0581 -0.0428 0.0088 -0.2826 36 ALA F N 10458 C CA . ALA F 36 ? 0.8745 1.3296 1.0605 -0.0388 0.0073 -0.2761 36 ALA F CA 10459 C C . ALA F 36 ? 0.7967 1.2532 0.9746 -0.0289 0.0039 -0.2751 36 ALA F C 10460 O O . ALA F 36 ? 0.7674 1.2373 0.9418 -0.0245 0.0024 -0.2778 36 ALA F O 10461 C CB . ALA F 36 ? 0.9501 1.3992 1.1354 -0.0413 0.0079 -0.2709 36 ALA F CB 10462 N N . ASP F 37 ? 0.7690 1.2118 0.9438 -0.0256 0.0023 -0.2713 37 ASP F N 10463 C CA . ASP F 37 ? 0.7722 1.2124 0.9382 -0.0170 -0.0015 -0.2686 37 ASP F CA 10464 C C . ASP F 37 ? 0.8278 1.2605 0.9891 -0.0141 -0.0030 -0.2631 37 ASP F C 10465 O O . ASP F 37 ? 0.8767 1.2951 1.0384 -0.0161 -0.0025 -0.2580 37 ASP F O 10466 C CB . ASP F 37 ? 0.7684 1.1979 0.9327 -0.0154 -0.0028 -0.2662 37 ASP F CB 10467 C CG . ASP F 37 ? 0.8476 1.2764 1.0029 -0.0073 -0.0073 -0.2641 37 ASP F CG 10468 O OD1 . ASP F 37 ? 0.9939 1.4352 1.1472 -0.0039 -0.0088 -0.2684 37 ASP F OD1 10469 O OD2 . ASP F 37 ? 0.8577 1.2733 1.0076 -0.0043 -0.0096 -0.2581 37 ASP F OD2 10470 N N . LYS F 38 ? 0.9206 1.3636 1.0775 -0.0091 -0.0051 -0.2646 38 LYS F N 10471 C CA . LYS F 38 ? 0.9469 1.3857 1.0992 -0.0057 -0.0067 -0.2606 38 LYS F CA 10472 C C . LYS F 38 ? 0.8846 1.3062 1.0300 -0.0005 -0.0102 -0.2544 38 LYS F C 10473 O O . LYS F 38 ? 0.7148 1.1248 0.8599 -0.0021 -0.0096 -0.2494 38 LYS F O 10474 C CB . LYS F 38 ? 1.0956 1.5505 1.2439 0.0003 -0.0090 -0.2647 38 LYS F CB 10475 C CG . LYS F 38 ? 1.2579 1.7107 1.4008 0.0053 -0.0114 -0.2617 38 LYS F CG 10476 C CD . LYS F 38 ? 1.3193 1.7791 1.4670 -0.0006 -0.0080 -0.2617 38 LYS F CD 10477 C CE . LYS F 38 ? 1.3147 1.7631 1.4584 0.0016 -0.0094 -0.2559 38 LYS F CE 10478 N NZ . LYS F 38 ? 1.2530 1.7079 1.4016 -0.0052 -0.0059 -0.2552 38 LYS F NZ 10479 N N . GLU F 39 ? 0.8623 1.2828 1.0018 0.0055 -0.0139 -0.2546 39 GLU F N 10480 C CA . GLU F 39 ? 0.9007 1.3065 1.0322 0.0109 -0.0181 -0.2488 39 GLU F CA 10481 C C . GLU F 39 ? 0.9410 1.3309 1.0749 0.0061 -0.0163 -0.2434 39 GLU F C 10482 O O . GLU F 39 ? 0.9690 1.3475 1.0999 0.0071 -0.0173 -0.2383 39 GLU F O 10483 C CB . GLU F 39 ? 1.0159 1.4228 1.1409 0.0169 -0.0226 -0.2496 39 GLU F CB 10484 C CG . GLU F 39 ? 1.1515 1.5425 1.2675 0.0219 -0.0277 -0.2431 39 GLU F CG 10485 C CD . GLU F 39 ? 1.2131 1.6045 1.3220 0.0271 -0.0326 -0.2432 39 GLU F CD 10486 O OE1 . GLU F 39 ? 1.2932 1.6972 1.4005 0.0314 -0.0346 -0.2481 39 GLU F OE1 10487 O OE2 . GLU F 39 ? 1.1689 1.5485 1.2738 0.0268 -0.0348 -0.2382 39 GLU F OE2 10488 N N . SER F 40 ? 0.8799 1.2695 1.0191 0.0012 -0.0137 -0.2449 40 SER F N 10489 C CA . SER F 40 ? 0.7815 1.1570 0.9227 -0.0024 -0.0124 -0.2403 40 SER F CA 10490 C C . SER F 40 ? 0.7342 1.1042 0.8815 -0.0082 -0.0087 -0.2386 40 SER F C 10491 O O . SER F 40 ? 0.6858 1.0425 0.8327 -0.0095 -0.0086 -0.2335 40 SER F O 10492 C CB . SER F 40 ? 0.7372 1.1151 0.8823 -0.0053 -0.0109 -0.2430 40 SER F CB 10493 O OG . SER F 40 ? 0.7005 1.0864 0.8546 -0.0112 -0.0068 -0.2483 40 SER F OG 10494 N N . THR F 41 ? 0.6626 1.0430 0.8152 -0.0119 -0.0060 -0.2426 41 THR F N 10495 C CA . THR F 41 ? 0.6927 1.0690 0.8499 -0.0173 -0.0032 -0.2405 41 THR F CA 10496 C C . THR F 41 ? 0.7546 1.1242 0.9059 -0.0134 -0.0054 -0.2353 41 THR F C 10497 O O . THR F 41 ? 0.7761 1.1342 0.9285 -0.0161 -0.0044 -0.2305 41 THR F O 10498 C CB . THR F 41 ? 0.6938 1.0846 0.8567 -0.0221 -0.0005 -0.2456 41 THR F CB 10499 O OG1 . THR F 41 ? 0.7324 1.1255 0.9024 -0.0278 0.0019 -0.2497 41 THR F OG1 10500 C CG2 . THR F 41 ? 0.6768 1.0658 0.8420 -0.0266 0.0012 -0.2427 41 THR F CG2 10501 N N . GLN F 42 ? 0.7577 1.1345 0.9026 -0.0067 -0.0085 -0.2364 42 GLN F N 10502 C CA . GLN F 42 ? 0.7328 1.1039 0.8714 -0.0018 -0.0113 -0.2323 42 GLN F CA 10503 C C . GLN F 42 ? 0.7729 1.1265 0.9063 0.0007 -0.0139 -0.2262 42 GLN F C 10504 O O . GLN F 42 ? 0.6970 1.0413 0.8285 0.0009 -0.0143 -0.2215 42 GLN F O 10505 C CB . GLN F 42 ? 0.7255 1.1077 0.8579 0.0059 -0.0150 -0.2357 42 GLN F CB 10506 C CG . GLN F 42 ? 0.7946 1.1765 0.9225 0.0100 -0.0170 -0.2336 42 GLN F CG 10507 C CD . GLN F 42 ? 0.8274 1.2164 0.9614 0.0036 -0.0128 -0.2339 42 GLN F CD 10508 O OE1 . GLN F 42 ? 0.8475 1.2523 0.9859 0.0005 -0.0105 -0.2387 42 GLN F OE1 10509 N NE2 . GLN F 42 ? 0.7968 1.1741 0.9310 0.0011 -0.0120 -0.2284 42 GLN F NE2 10510 N N . LYS F 43 ? 0.8496 1.1998 0.9809 0.0023 -0.0156 -0.2263 43 LYS F N 10511 C CA . LYS F 43 ? 0.8783 1.2134 1.0047 0.0041 -0.0181 -0.2205 43 LYS F CA 10512 C C . LYS F 43 ? 0.8223 1.1467 0.9539 -0.0017 -0.0148 -0.2167 43 LYS F C 10513 O O . LYS F 43 ? 0.9769 1.2892 1.1048 -0.0005 -0.0164 -0.2112 43 LYS F O 10514 C CB . LYS F 43 ? 1.0193 1.3557 1.1439 0.0051 -0.0197 -0.2218 43 LYS F CB 10515 C CG . LYS F 43 ? 1.2108 1.5342 1.3280 0.0080 -0.0237 -0.2159 43 LYS F CG 10516 C CD . LYS F 43 ? 1.3822 1.7038 1.4893 0.0157 -0.0298 -0.2145 43 LYS F CD 10517 C CE . LYS F 43 ? 1.4325 1.7468 1.5318 0.0183 -0.0346 -0.2108 43 LYS F CE 10518 N NZ . LYS F 43 ? 1.4402 1.7649 1.5364 0.0219 -0.0373 -0.2150 43 LYS F NZ 10519 N N . ALA F 44 ? 0.7174 1.0463 0.8575 -0.0078 -0.0106 -0.2199 44 ALA F N 10520 C CA . ALA F 44 ? 0.6869 1.0062 0.8326 -0.0134 -0.0077 -0.2171 44 ALA F CA 10521 C C . ALA F 44 ? 0.6313 0.9473 0.7780 -0.0153 -0.0065 -0.2141 44 ALA F C 10522 O O . ALA F 44 ? 0.6294 0.9337 0.7764 -0.0169 -0.0061 -0.2093 44 ALA F O 10523 C CB . ALA F 44 ? 0.7036 1.0285 0.8579 -0.0191 -0.0043 -0.2220 44 ALA F CB 10524 N N . ILE F 45 ? 0.5935 0.9207 0.7410 -0.0155 -0.0058 -0.2171 45 ILE F N 10525 C CA . ILE F 45 ? 0.6279 0.9541 0.7757 -0.0174 -0.0049 -0.2142 45 ILE F CA 10526 C C . ILE F 45 ? 0.6155 0.9328 0.7556 -0.0115 -0.0082 -0.2092 45 ILE F C 10527 O O . ILE F 45 ? 0.4982 0.8065 0.6386 -0.0135 -0.0076 -0.2045 45 ILE F O 10528 C CB . ILE F 45 ? 0.6861 1.0291 0.8358 -0.0185 -0.0037 -0.2188 45 ILE F CB 10529 C CG1 . ILE F 45 ? 0.7844 1.1325 0.9429 -0.0270 0.0001 -0.2217 45 ILE F CG1 10530 C CG2 . ILE F 45 ? 0.6227 0.9672 0.7695 -0.0173 -0.0042 -0.2159 45 ILE F CG2 10531 C CD1 . ILE F 45 ? 0.7942 1.1606 0.9548 -0.0289 0.0013 -0.2269 45 ILE F CD1 10532 N N . ASP F 46 ? 0.6219 0.9413 0.7548 -0.0044 -0.0122 -0.2102 46 ASP F N 10533 C CA . ASP F 46 ? 0.6448 0.9547 0.7698 0.0011 -0.0161 -0.2056 46 ASP F CA 10534 C C . ASP F 46 ? 0.6973 0.9910 0.8218 -0.0006 -0.0162 -0.1999 46 ASP F C 10535 O O . ASP F 46 ? 0.7042 0.9888 0.8261 0.0000 -0.0171 -0.1952 46 ASP F O 10536 C CB . ASP F 46 ? 0.6775 0.9903 0.7946 0.0090 -0.0211 -0.2076 46 ASP F CB 10537 C CG . ASP F 46 ? 0.7498 1.0785 0.8661 0.0126 -0.0220 -0.2131 46 ASP F CG 10538 O OD1 . ASP F 46 ? 0.7371 1.0754 0.8589 0.0085 -0.0184 -0.2152 46 ASP F OD1 10539 O OD2 . ASP F 46 ? 0.8407 1.1725 0.9507 0.0193 -0.0263 -0.2154 46 ASP F OD2 10540 N N . GLY F 47 ? 0.6906 0.9818 0.8175 -0.0029 -0.0154 -0.2005 47 GLY F N 10541 C CA . GLY F 47 ? 0.6110 0.8892 0.7367 -0.0039 -0.0160 -0.1957 47 GLY F CA 10542 C C . GLY F 47 ? 0.6421 0.9132 0.7739 -0.0094 -0.0125 -0.1929 47 GLY F C 10543 O O . GLY F 47 ? 0.6467 0.9067 0.7759 -0.0090 -0.0135 -0.1876 47 GLY F O 10544 N N . VAL F 48 ? 0.6068 0.8842 0.7465 -0.0145 -0.0088 -0.1964 48 VAL F N 10545 C CA . VAL F 48 ? 0.5624 0.8331 0.7081 -0.0200 -0.0058 -0.1942 48 VAL F CA 10546 C C . VAL F 48 ? 0.5478 0.8161 0.6914 -0.0198 -0.0060 -0.1904 48 VAL F C 10547 O O . VAL F 48 ? 0.5923 0.8504 0.7370 -0.0220 -0.0053 -0.1858 48 VAL F O 10548 C CB . VAL F 48 ? 0.5616 0.8395 0.7157 -0.0257 -0.0025 -0.1991 48 VAL F CB 10549 C CG1 . VAL F 48 ? 0.5456 0.8186 0.7054 -0.0317 0.0000 -0.1970 48 VAL F CG1 10550 C CG2 . VAL F 48 ? 0.5370 0.8135 0.6942 -0.0264 -0.0022 -0.2017 48 VAL F CG2 10551 N N . THR F 49 ? 0.5381 0.8162 0.6785 -0.0169 -0.0071 -0.1925 49 THR F N 10552 C CA . THR F 49 ? 0.6233 0.9013 0.7610 -0.0159 -0.0076 -0.1895 49 THR F CA 10553 C C . THR F 49 ? 0.6658 0.9320 0.7962 -0.0109 -0.0110 -0.1843 49 THR F C 10554 O O . THR F 49 ? 0.6297 0.8888 0.7598 -0.0122 -0.0106 -0.1799 49 THR F O 10555 C CB . THR F 49 ? 0.6687 0.9621 0.8046 -0.0133 -0.0082 -0.1939 49 THR F CB 10556 O OG1 . THR F 49 ? 0.7184 1.0222 0.8615 -0.0195 -0.0048 -0.1976 49 THR F OG1 10557 C CG2 . THR F 49 ? 0.6833 0.9776 0.8151 -0.0107 -0.0095 -0.1912 49 THR F CG2 10558 N N . ASN F 50 ? 0.6516 0.9153 0.7761 -0.0057 -0.0145 -0.1847 50 ASN F N 10559 C CA . ASN F 50 ? 0.6668 0.9185 0.7844 -0.0018 -0.0180 -0.1797 50 ASN F CA 10560 C C . ASN F 50 ? 0.6216 0.8611 0.7419 -0.0057 -0.0164 -0.1749 50 ASN F C 10561 O O . ASN F 50 ? 0.6401 0.8702 0.7566 -0.0043 -0.0180 -0.1701 50 ASN F O 10562 C CB . ASN F 50 ? 0.7816 1.0324 0.8927 0.0031 -0.0221 -0.1806 50 ASN F CB 10563 C CG . ASN F 50 ? 0.9560 1.2060 1.0586 0.0100 -0.0270 -0.1802 50 ASN F CG 10564 O OD1 . ASN F 50 ? 0.9883 1.2269 1.0846 0.0127 -0.0305 -0.1756 50 ASN F OD1 10565 N ND2 . ASN F 50 ? 0.9946 1.2570 1.0969 0.0129 -0.0275 -0.1850 50 ASN F ND2 10566 N N . LYS F 51 ? 0.5652 0.8053 0.6920 -0.0102 -0.0135 -0.1767 51 LYS F N 10567 C CA . LYS F 51 ? 0.5577 0.7877 0.6875 -0.0134 -0.0122 -0.1731 51 LYS F CA 10568 C C . LYS F 51 ? 0.5414 0.7660 0.6745 -0.0167 -0.0101 -0.1697 51 LYS F C 10569 O O . LYS F 51 ? 0.5195 0.7340 0.6503 -0.0163 -0.0110 -0.1646 51 LYS F O 10570 C CB . LYS F 51 ? 0.5637 0.7970 0.7002 -0.0171 -0.0097 -0.1768 51 LYS F CB 10571 C CG . LYS F 51 ? 0.5680 0.7920 0.7092 -0.0206 -0.0079 -0.1741 51 LYS F CG 10572 C CD . LYS F 51 ? 0.6055 0.8332 0.7535 -0.0236 -0.0058 -0.1787 51 LYS F CD 10573 C CE . LYS F 51 ? 0.6374 0.8701 0.7823 -0.0209 -0.0076 -0.1810 51 LYS F CE 10574 N NZ . LYS F 51 ? 0.6667 0.8997 0.8175 -0.0233 -0.0059 -0.1838 51 LYS F NZ 10575 N N . VAL F 52 ? 0.4916 0.7235 0.6299 -0.0202 -0.0075 -0.1723 52 VAL F N 10576 C CA . VAL F 52 ? 0.5087 0.7368 0.6502 -0.0241 -0.0056 -0.1690 52 VAL F CA 10577 C C . VAL F 52 ? 0.4988 0.7238 0.6338 -0.0205 -0.0077 -0.1648 52 VAL F C 10578 O O . VAL F 52 ? 0.4203 0.6358 0.5550 -0.0215 -0.0076 -0.1599 52 VAL F O 10579 C CB . VAL F 52 ? 0.5267 0.7652 0.6738 -0.0288 -0.0030 -0.1726 52 VAL F CB 10580 C CG1 . VAL F 52 ? 0.5123 0.7483 0.6614 -0.0329 -0.0015 -0.1686 52 VAL F CG1 10581 C CG2 . VAL F 52 ? 0.5548 0.7937 0.7088 -0.0332 -0.0009 -0.1762 52 VAL F CG2 10582 N N . ASN F 53 ? 0.4724 0.7055 0.6022 -0.0158 -0.0099 -0.1672 53 ASN F N 10583 C CA . ASN F 53 ? 0.5065 0.7375 0.6300 -0.0115 -0.0125 -0.1643 53 ASN F CA 10584 C C . ASN F 53 ? 0.5006 0.7181 0.6185 -0.0083 -0.0154 -0.1596 53 ASN F C 10585 O O . ASN F 53 ? 0.5199 0.7316 0.6347 -0.0071 -0.0165 -0.1556 53 ASN F O 10586 C CB . ASN F 53 ? 0.5248 0.7671 0.6433 -0.0059 -0.0151 -0.1686 53 ASN F CB 10587 C CG . ASN F 53 ? 0.5212 0.7784 0.6444 -0.0090 -0.0123 -0.1725 53 ASN F CG 10588 O OD1 . ASN F 53 ? 0.5543 0.8124 0.6830 -0.0152 -0.0090 -0.1708 53 ASN F OD1 10589 N ND2 . ASN F 53 ? 0.5419 0.8109 0.6626 -0.0050 -0.0139 -0.1776 53 ASN F ND2 10590 N N . SER F 54 ? 0.4735 0.6870 0.5900 -0.0072 -0.0168 -0.1600 54 SER F N 10591 C CA . SER F 54 ? 0.4696 0.6714 0.5805 -0.0049 -0.0198 -0.1555 54 SER F CA 10592 C C . SER F 54 ? 0.4782 0.6712 0.5933 -0.0092 -0.0173 -0.1511 54 SER F C 10593 O O . SER F 54 ? 0.5764 0.7609 0.6877 -0.0080 -0.0190 -0.1464 54 SER F O 10594 C CB . SER F 54 ? 0.4935 0.6953 0.6029 -0.0040 -0.0213 -0.1571 54 SER F CB 10595 O OG . SER F 54 ? 0.4564 0.6636 0.5598 0.0008 -0.0248 -0.1601 54 SER F OG 10596 N N . ILE F 55 ? 0.4590 0.6541 0.5822 -0.0141 -0.0136 -0.1527 55 ILE F N 10597 C CA . ILE F 55 ? 0.4401 0.6269 0.5679 -0.0180 -0.0115 -0.1491 55 ILE F CA 10598 C C . ILE F 55 ? 0.4480 0.6324 0.5757 -0.0192 -0.0108 -0.1455 55 ILE F C 10599 O O . ILE F 55 ? 0.4696 0.6450 0.5974 -0.0202 -0.0107 -0.1408 55 ILE F O 10600 C CB . ILE F 55 ? 0.4158 0.6052 0.5520 -0.0227 -0.0083 -0.1524 55 ILE F CB 10601 C CG1 . ILE F 55 ? 0.3973 0.5873 0.5335 -0.0215 -0.0091 -0.1548 55 ILE F CG1 10602 C CG2 . ILE F 55 ? 0.4286 0.6100 0.5701 -0.0267 -0.0063 -0.1492 55 ILE F CG2 10603 C CD1 . ILE F 55 ? 0.3833 0.5781 0.5269 -0.0249 -0.0066 -0.1598 55 ILE F CD1 10604 N N . ILE F 56 ? 0.4519 0.6454 0.5793 -0.0189 -0.0104 -0.1478 56 ILE F N 10605 C CA . ILE F 56 ? 0.4473 0.6416 0.5743 -0.0200 -0.0098 -0.1449 56 ILE F CA 10606 C C . ILE F 56 ? 0.4518 0.6430 0.5706 -0.0144 -0.0133 -0.1425 56 ILE F C 10607 O O . ILE F 56 ? 0.4541 0.6385 0.5715 -0.0147 -0.0136 -0.1378 56 ILE F O 10608 C CB . ILE F 56 ? 0.4675 0.6753 0.5976 -0.0223 -0.0080 -0.1489 56 ILE F CB 10609 C CG1 . ILE F 56 ? 0.4969 0.7059 0.6353 -0.0289 -0.0047 -0.1505 56 ILE F CG1 10610 C CG2 . ILE F 56 ? 0.4379 0.6502 0.5663 -0.0226 -0.0078 -0.1466 56 ILE F CG2 10611 C CD1 . ILE F 56 ? 0.4976 0.7204 0.6392 -0.0320 -0.0029 -0.1547 56 ILE F CD1 10612 N N . ASP F 57 ? 0.5163 0.7120 0.6296 -0.0091 -0.0164 -0.1457 57 ASP F N 10613 C CA . ASP F 57 ? 0.5359 0.7305 0.6411 -0.0030 -0.0204 -0.1447 57 ASP F CA 10614 C C . ASP F 57 ? 0.5377 0.7188 0.6375 -0.0009 -0.0234 -0.1400 57 ASP F C 10615 O O . ASP F 57 ? 0.5739 0.7512 0.6680 0.0026 -0.0263 -0.1378 57 ASP F O 10616 C CB . ASP F 57 ? 0.5178 0.7209 0.6183 0.0024 -0.0235 -0.1500 57 ASP F CB 10617 C CG . ASP F 57 ? 0.5837 0.8026 0.6884 0.0012 -0.0211 -0.1550 57 ASP F CG 10618 O OD1 . ASP F 57 ? 0.6347 0.8582 0.7446 -0.0036 -0.0175 -0.1540 57 ASP F OD1 10619 O OD2 . ASP F 57 ? 0.6167 0.8436 0.7192 0.0049 -0.0229 -0.1599 57 ASP F OD2 10620 N N . LYS F 58 ? 0.5489 0.7236 0.6503 -0.0030 -0.0230 -0.1386 58 LYS F N 10621 C CA . LYS F 58 ? 0.5442 0.7070 0.6403 -0.0016 -0.0260 -0.1341 58 LYS F CA 10622 C C . LYS F 58 ? 0.5664 0.7213 0.6646 -0.0044 -0.0244 -0.1288 58 LYS F C 10623 O O . LYS F 58 ? 0.5200 0.6657 0.6135 -0.0033 -0.0269 -0.1247 58 LYS F O 10624 C CB . LYS F 58 ? 0.5557 0.7169 0.6531 -0.0032 -0.0259 -0.1347 58 LYS F CB 10625 C CG . LYS F 58 ? 0.5389 0.6982 0.6283 0.0008 -0.0308 -0.1352 58 LYS F CG 10626 C CD . LYS F 58 ? 0.5020 0.6684 0.5874 0.0054 -0.0334 -0.1394 58 LYS F CD 10627 C CE . LYS F 58 ? 0.4985 0.6575 0.5735 0.0107 -0.0398 -0.1375 58 LYS F CE 10628 N NZ . LYS F 58 ? 0.5166 0.6740 0.5870 0.0119 -0.0432 -0.1379 58 LYS F NZ 10629 N N . MET F 59 ? 0.5338 0.6920 0.6388 -0.0084 -0.0204 -0.1287 59 MET F N 10630 C CA . MET F 59 ? 0.4920 0.6432 0.5989 -0.0110 -0.0190 -0.1236 59 MET F CA 10631 C C . MET F 59 ? 0.5115 0.6606 0.6121 -0.0075 -0.0217 -0.1211 59 MET F C 10632 O O . MET F 59 ? 0.5467 0.7036 0.6460 -0.0057 -0.0220 -0.1234 59 MET F O 10633 C CB . MET F 59 ? 0.4964 0.6519 0.6114 -0.0162 -0.0148 -0.1241 59 MET F CB 10634 C CG . MET F 59 ? 0.4799 0.6277 0.5977 -0.0194 -0.0133 -0.1189 59 MET F CG 10635 S SD . MET F 59 ? 0.4713 0.6073 0.5893 -0.0197 -0.0140 -0.1154 59 MET F SD 10636 C CE . MET F 59 ? 0.4678 0.6064 0.5944 -0.0235 -0.0111 -0.1194 59 MET F CE 10637 N N . ASN F 60 ? 0.5690 0.7083 0.6658 -0.0066 -0.0237 -0.1167 60 ASN F N 10638 C CA . ASN F 60 ? 0.6082 0.7443 0.6999 -0.0039 -0.0260 -0.1139 60 ASN F CA 10639 C C . ASN F 60 ? 0.6040 0.7392 0.7007 -0.0079 -0.0227 -0.1103 60 ASN F C 10640 O O . ASN F 60 ? 0.6650 0.7943 0.7660 -0.0115 -0.0206 -0.1073 60 ASN F O 10641 C CB . ASN F 60 ? 0.6958 0.8214 0.7806 -0.0014 -0.0300 -0.1105 60 ASN F CB 10642 C CG . ASN F 60 ? 0.6756 0.7979 0.7539 0.0022 -0.0333 -0.1086 60 ASN F CG 10643 O OD1 . ASN F 60 ? 0.7198 0.8471 0.7939 0.0065 -0.0359 -0.1118 60 ASN F OD1 10644 N ND2 . ASN F 60 ? 0.7565 0.8708 0.8340 0.0007 -0.0335 -0.1035 60 ASN F ND2 10645 N N . THR F 61 ? 0.6024 0.7439 0.6981 -0.0069 -0.0225 -0.1108 61 THR F N 10646 C CA . THR F 61 ? 0.6312 0.7741 0.7313 -0.0109 -0.0196 -0.1077 61 THR F CA 10647 C C . THR F 61 ? 0.5512 0.6907 0.6455 -0.0077 -0.0221 -0.1045 61 THR F C 10648 O O . THR F 61 ? 0.5021 0.6447 0.5903 -0.0026 -0.0254 -0.1070 61 THR F O 10649 C CB . THR F 61 ? 0.6864 0.8425 0.7906 -0.0132 -0.0170 -0.1112 61 THR F CB 10650 O OG1 . THR F 61 ? 0.7467 0.9021 0.8585 -0.0196 -0.0133 -0.1097 61 THR F OG1 10651 C CG2 . THR F 61 ? 0.7507 0.9151 0.8518 -0.0114 -0.0177 -0.1111 61 THR F CG2 10652 N N . GLN F 62 ? 0.5578 0.6905 0.6536 -0.0104 -0.0210 -0.0994 62 GLN F N 10653 C CA . GLN F 62 ? 0.4919 0.6233 0.5829 -0.0078 -0.0230 -0.0967 62 GLN F CA 10654 C C . GLN F 62 ? 0.4309 0.5632 0.5258 -0.0120 -0.0203 -0.0924 62 GLN F C 10655 O O . GLN F 62 ? 0.4024 0.5320 0.5034 -0.0171 -0.0173 -0.0901 62 GLN F O 10656 C CB . GLN F 62 ? 0.5663 0.6865 0.6509 -0.0043 -0.0269 -0.0943 62 GLN F CB 10657 C CG . GLN F 62 ? 0.5624 0.6737 0.6483 -0.0062 -0.0268 -0.0925 62 GLN F CG 10658 C CD . GLN F 62 ? 0.6283 0.7306 0.7066 -0.0028 -0.0313 -0.0905 62 GLN F CD 10659 O OE1 . GLN F 62 ? 0.6877 0.7881 0.7604 0.0002 -0.0342 -0.0894 62 GLN F OE1 10660 N NE2 . GLN F 62 ? 0.6958 0.7927 0.7735 -0.0036 -0.0322 -0.0900 62 GLN F NE2 10661 N N . PHE F 63 ? 0.4049 0.5409 0.4957 -0.0096 -0.0217 -0.0914 63 PHE F N 10662 C CA . PHE F 63 ? 0.4047 0.5425 0.4982 -0.0134 -0.0195 -0.0871 63 PHE F CA 10663 C C . PHE F 63 ? 0.4142 0.5395 0.5092 -0.0157 -0.0191 -0.0815 63 PHE F C 10664 O O . PHE F 63 ? 0.3954 0.5125 0.4857 -0.0124 -0.0219 -0.0802 63 PHE F O 10665 C CB . PHE F 63 ? 0.4151 0.5594 0.5034 -0.0097 -0.0216 -0.0874 63 PHE F CB 10666 C CG . PHE F 63 ? 0.4442 0.5915 0.5352 -0.0139 -0.0193 -0.0826 63 PHE F CG 10667 C CD1 . PHE F 63 ? 0.4642 0.6242 0.5588 -0.0180 -0.0166 -0.0831 63 PHE F CD1 10668 C CD2 . PHE F 63 ? 0.4676 0.6052 0.5572 -0.0143 -0.0200 -0.0773 63 PHE F CD2 10669 C CE1 . PHE F 63 ? 0.4881 0.6510 0.5849 -0.0224 -0.0148 -0.0781 63 PHE F CE1 10670 C CE2 . PHE F 63 ? 0.4713 0.6113 0.5632 -0.0182 -0.0181 -0.0726 63 PHE F CE2 10671 C CZ . PHE F 63 ? 0.4983 0.6509 0.5936 -0.0224 -0.0155 -0.0729 63 PHE F CZ 10672 N N . GLU F 64 ? 0.4067 0.5306 0.5081 -0.0215 -0.0159 -0.0782 64 GLU F N 10673 C CA . GLU F 64 ? 0.3904 0.5041 0.4932 -0.0235 -0.0156 -0.0726 64 GLU F CA 10674 C C . GLU F 64 ? 0.3761 0.4925 0.4833 -0.0288 -0.0131 -0.0686 64 GLU F C 10675 O O . GLU F 64 ? 0.3894 0.5133 0.5004 -0.0326 -0.0111 -0.0700 64 GLU F O 10676 C CB . GLU F 64 ? 0.3934 0.4982 0.4997 -0.0246 -0.0150 -0.0725 64 GLU F CB 10677 C CG . GLU F 64 ? 0.4372 0.5398 0.5398 -0.0206 -0.0173 -0.0762 64 GLU F CG 10678 C CD . GLU F 64 ? 0.4275 0.5245 0.5227 -0.0164 -0.0208 -0.0745 64 GLU F CD 10679 O OE1 . GLU F 64 ? 0.4100 0.5036 0.5035 -0.0163 -0.0214 -0.0703 64 GLU F OE1 10680 O OE2 . GLU F 64 ? 0.4037 0.4998 0.4947 -0.0131 -0.0233 -0.0775 64 GLU F OE2 10681 N N . ALA F 65 ? 0.3349 0.4451 0.4414 -0.0294 -0.0134 -0.0633 65 ALA F N 10682 C CA . ALA F 65 ? 0.3572 0.4682 0.4673 -0.0344 -0.0117 -0.0586 65 ALA F CA 10683 C C . ALA F 65 ? 0.3995 0.4984 0.5137 -0.0366 -0.0112 -0.0548 65 ALA F C 10684 O O . ALA F 65 ? 0.4040 0.4956 0.5156 -0.0340 -0.0126 -0.0523 65 ALA F O 10685 C CB . ALA F 65 ? 0.3583 0.4737 0.4639 -0.0330 -0.0126 -0.0556 65 ALA F CB 10686 N N . VAL F 66 ? 0.3638 0.4608 0.4840 -0.0412 -0.0095 -0.0547 66 VAL F N 10687 C CA . VAL F 66 ? 0.3915 0.4775 0.5162 -0.0427 -0.0094 -0.0525 66 VAL F CA 10688 C C . VAL F 66 ? 0.4265 0.5091 0.5544 -0.0477 -0.0088 -0.0469 66 VAL F C 10689 O O . VAL F 66 ? 0.4233 0.5106 0.5539 -0.0526 -0.0078 -0.0465 66 VAL F O 10690 C CB . VAL F 66 ? 0.3800 0.4644 0.5095 -0.0440 -0.0087 -0.0569 66 VAL F CB 10691 C CG1 . VAL F 66 ? 0.3918 0.4653 0.5255 -0.0445 -0.0090 -0.0552 66 VAL F CG1 10692 C CG2 . VAL F 66 ? 0.3883 0.4766 0.5149 -0.0397 -0.0093 -0.0626 66 VAL F CG2 10693 N N . GLY F 67 ? 0.4419 0.5168 0.5692 -0.0467 -0.0098 -0.0424 67 GLY F N 10694 C CA . GLY F 67 ? 0.4705 0.5412 0.6003 -0.0510 -0.0097 -0.0364 67 GLY F CA 10695 C C . GLY F 67 ? 0.4352 0.4943 0.5673 -0.0496 -0.0108 -0.0337 67 GLY F C 10696 O O . GLY F 67 ? 0.4800 0.5346 0.6136 -0.0466 -0.0112 -0.0370 67 GLY F O 10697 N N . ARG F 68 ? 0.4027 0.4579 0.5349 -0.0517 -0.0114 -0.0277 68 ARG F N 10698 C CA . ARG F 68 ? 0.4214 0.4663 0.5557 -0.0503 -0.0126 -0.0247 68 ARG F CA 10699 C C . ARG F 68 ? 0.4363 0.4820 0.5667 -0.0497 -0.0132 -0.0191 68 ARG F C 10700 O O . ARG F 68 ? 0.4348 0.4784 0.5662 -0.0533 -0.0136 -0.0139 68 ARG F O 10701 C CB . ARG F 68 ? 0.4274 0.4647 0.5675 -0.0547 -0.0133 -0.0229 68 ARG F CB 10702 C CG . ARG F 68 ? 0.4458 0.4815 0.5901 -0.0550 -0.0130 -0.0289 68 ARG F CG 10703 C CD . ARG F 68 ? 0.4450 0.4770 0.5903 -0.0495 -0.0135 -0.0330 68 ARG F CD 10704 N NE . ARG F 68 ? 0.4753 0.5059 0.6248 -0.0492 -0.0133 -0.0389 68 ARG F NE 10705 C CZ . ARG F 68 ? 0.4723 0.5092 0.6208 -0.0471 -0.0123 -0.0445 68 ARG F CZ 10706 N NH1 . ARG F 68 ? 0.4606 0.5053 0.6037 -0.0452 -0.0115 -0.0451 68 ARG F NH1 10707 N NH2 . ARG F 68 ? 0.4665 0.5018 0.6193 -0.0471 -0.0123 -0.0496 68 ARG F NH2 10708 N N . GLU F 69 ? 0.4599 0.5085 0.5855 -0.0452 -0.0135 -0.0203 69 GLU F N 10709 C CA . GLU F 69 ? 0.4657 0.5173 0.5867 -0.0443 -0.0140 -0.0161 69 GLU F CA 10710 C C . GLU F 69 ? 0.4361 0.4798 0.5571 -0.0421 -0.0153 -0.0124 69 GLU F C 10711 O O . GLU F 69 ? 0.4256 0.4710 0.5430 -0.0414 -0.0158 -0.0086 69 GLU F O 10712 C CB . GLU F 69 ? 0.5145 0.5734 0.6295 -0.0406 -0.0143 -0.0197 69 GLU F CB 10713 C CG . GLU F 69 ? 0.6121 0.6818 0.7255 -0.0420 -0.0134 -0.0224 69 GLU F CG 10714 C CD . GLU F 69 ? 0.7436 0.8220 0.8526 -0.0424 -0.0135 -0.0196 69 GLU F CD 10715 O OE1 . GLU F 69 ? 0.6376 0.7142 0.7458 -0.0436 -0.0139 -0.0140 69 GLU F OE1 10716 O OE2 . GLU F 69 ? 0.6108 0.6987 0.7172 -0.0413 -0.0133 -0.0236 69 GLU F OE2 10717 N N . PHE F 70 ? 0.4031 0.4392 0.5280 -0.0409 -0.0158 -0.0137 70 PHE F N 10718 C CA . PHE F 70 ? 0.4227 0.4525 0.5480 -0.0385 -0.0170 -0.0109 70 PHE F CA 10719 C C . PHE F 70 ? 0.4539 0.4768 0.5831 -0.0409 -0.0179 -0.0058 70 PHE F C 10720 O O . PHE F 70 ? 0.4716 0.4907 0.6051 -0.0439 -0.0180 -0.0060 70 PHE F O 10721 C CB . PHE F 70 ? 0.4052 0.4326 0.5320 -0.0350 -0.0174 -0.0155 70 PHE F CB 10722 C CG . PHE F 70 ? 0.4179 0.4509 0.5397 -0.0326 -0.0173 -0.0193 70 PHE F CG 10723 C CD1 . PHE F 70 ? 0.4383 0.4746 0.5610 -0.0327 -0.0165 -0.0246 70 PHE F CD1 10724 C CD2 . PHE F 70 ? 0.3973 0.4322 0.5134 -0.0305 -0.0183 -0.0175 70 PHE F CD2 10725 C CE1 . PHE F 70 ? 0.4231 0.4639 0.5408 -0.0305 -0.0169 -0.0279 70 PHE F CE1 10726 C CE2 . PHE F 70 ? 0.4254 0.4641 0.5364 -0.0284 -0.0189 -0.0209 70 PHE F CE2 10727 C CZ . PHE F 70 ? 0.4070 0.4486 0.5187 -0.0284 -0.0183 -0.0260 70 PHE F CZ 10728 N N . ASN F 71 ? 0.4529 0.4736 0.5802 -0.0395 -0.0188 -0.0013 71 ASN F N 10729 C CA . ASN F 71 ? 0.4706 0.4847 0.6009 -0.0417 -0.0200 0.0041 71 ASN F CA 10730 C C . ASN F 71 ? 0.4558 0.4613 0.5907 -0.0389 -0.0216 0.0030 71 ASN F C 10731 O O . ASN F 71 ? 0.4673 0.4728 0.6036 -0.0357 -0.0215 -0.0020 71 ASN F O 10732 C CB . ASN F 71 ? 0.4499 0.4666 0.5760 -0.0421 -0.0204 0.0100 71 ASN F CB 10733 C CG . ASN F 71 ? 0.4667 0.4830 0.5903 -0.0375 -0.0211 0.0101 71 ASN F CG 10734 O OD1 . ASN F 71 ? 0.4683 0.4800 0.5944 -0.0344 -0.0219 0.0080 71 ASN F OD1 10735 N ND2 . ASN F 71 ? 0.4227 0.4446 0.5410 -0.0370 -0.0210 0.0124 71 ASN F ND2 10736 N N . ASN F 72 ? 0.5052 0.5037 0.6423 -0.0400 -0.0233 0.0080 72 ASN F N 10737 C CA . ASN F 72 ? 0.5024 0.4921 0.6443 -0.0374 -0.0254 0.0070 72 ASN F CA 10738 C C . ASN F 72 ? 0.5016 0.4925 0.6428 -0.0319 -0.0259 0.0054 72 ASN F C 10739 O O . ASN F 72 ? 0.5229 0.5093 0.6681 -0.0286 -0.0273 0.0027 72 ASN F O 10740 C CB . ASN F 72 ? 0.5492 0.5308 0.6930 -0.0402 -0.0277 0.0132 72 ASN F CB 10741 C CG . ASN F 72 ? 0.6613 0.6324 0.8105 -0.0375 -0.0306 0.0115 72 ASN F CG 10742 O OD1 . ASN F 72 ? 0.7122 0.6804 0.8651 -0.0369 -0.0310 0.0061 72 ASN F OD1 10743 N ND2 . ASN F 72 ? 0.6931 0.6587 0.8426 -0.0353 -0.0329 0.0158 72 ASN F ND2 10744 N N . LEU F 73 ? 0.4674 0.4647 0.6035 -0.0309 -0.0249 0.0070 73 LEU F N 10745 C CA . LEU F 73 ? 0.4458 0.4457 0.5805 -0.0265 -0.0252 0.0053 73 LEU F CA 10746 C C . LEU F 73 ? 0.4332 0.4401 0.5645 -0.0256 -0.0237 0.0005 73 LEU F C 10747 O O . LEU F 73 ? 0.3837 0.3945 0.5110 -0.0237 -0.0239 0.0008 73 LEU F O 10748 C CB . LEU F 73 ? 0.4431 0.4438 0.5744 -0.0260 -0.0259 0.0111 73 LEU F CB 10749 C CG . LEU F 73 ? 0.4758 0.4689 0.6106 -0.0256 -0.0280 0.0153 73 LEU F CG 10750 C CD1 . LEU F 73 ? 0.4305 0.4248 0.5619 -0.0256 -0.0287 0.0216 73 LEU F CD1 10751 C CD2 . LEU F 73 ? 0.5018 0.4912 0.6414 -0.0213 -0.0296 0.0115 73 LEU F CD2 10752 N N . GLU F 74 ? 0.4059 0.4141 0.5384 -0.0273 -0.0226 -0.0034 74 GLU F N 10753 C CA . GLU F 74 ? 0.3979 0.4118 0.5277 -0.0264 -0.0216 -0.0082 74 GLU F CA 10754 C C . GLU F 74 ? 0.3760 0.3889 0.5105 -0.0263 -0.0212 -0.0137 74 GLU F C 10755 O O . GLU F 74 ? 0.3356 0.3523 0.4690 -0.0273 -0.0201 -0.0173 74 GLU F O 10756 C CB . GLU F 74 ? 0.4238 0.4426 0.5486 -0.0286 -0.0206 -0.0073 74 GLU F CB 10757 C CG . GLU F 74 ? 0.4405 0.4615 0.5599 -0.0283 -0.0212 -0.0028 74 GLU F CG 10758 C CD . GLU F 74 ? 0.4838 0.5102 0.5988 -0.0301 -0.0205 -0.0023 74 GLU F CD 10759 O OE1 . GLU F 74 ? 0.4290 0.4568 0.5461 -0.0329 -0.0195 -0.0027 74 GLU F OE1 10760 O OE2 . GLU F 74 ? 0.4689 0.4986 0.5782 -0.0286 -0.0212 -0.0017 74 GLU F OE2 10761 N N . ARG F 75 ? 0.4023 0.4101 0.5422 -0.0248 -0.0223 -0.0145 75 ARG F N 10762 C CA . ARG F 75 ? 0.3898 0.3960 0.5346 -0.0244 -0.0223 -0.0200 75 ARG F CA 10763 C C . ARG F 75 ? 0.3598 0.3722 0.5040 -0.0219 -0.0217 -0.0254 75 ARG F C 10764 O O . ARG F 75 ? 0.3594 0.3733 0.5059 -0.0221 -0.0211 -0.0304 75 ARG F O 10765 C CB . ARG F 75 ? 0.4522 0.4507 0.6028 -0.0227 -0.0244 -0.0198 75 ARG F CB 10766 C CG . ARG F 75 ? 0.5592 0.5500 0.7112 -0.0259 -0.0256 -0.0147 75 ARG F CG 10767 C CD . ARG F 75 ? 0.6925 0.6832 0.8452 -0.0304 -0.0245 -0.0157 75 ARG F CD 10768 N NE . ARG F 75 ? 0.8762 0.8595 1.0305 -0.0343 -0.0260 -0.0109 75 ARG F NE 10769 C CZ . ARG F 75 ? 1.0099 0.9952 1.1622 -0.0396 -0.0249 -0.0081 75 ARG F CZ 10770 N NH1 . ARG F 75 ? 1.1009 1.0954 1.2496 -0.0409 -0.0224 -0.0099 75 ARG F NH1 10771 N NH2 . ARG F 75 ? 0.9946 0.9731 1.1483 -0.0438 -0.0266 -0.0032 75 ARG F NH2 10772 N N . ARG F 76 ? 0.3607 0.3769 0.5015 -0.0197 -0.0221 -0.0244 76 ARG F N 10773 C CA . ARG F 76 ? 0.3416 0.3644 0.4811 -0.0182 -0.0217 -0.0290 76 ARG F CA 10774 C C . ARG F 76 ? 0.3599 0.3863 0.4952 -0.0202 -0.0206 -0.0308 76 ARG F C 10775 O O . ARG F 76 ? 0.3418 0.3715 0.4785 -0.0200 -0.0201 -0.0358 76 ARG F O 10776 C CB . ARG F 76 ? 0.3260 0.3525 0.4620 -0.0165 -0.0226 -0.0270 76 ARG F CB 10777 C CG . ARG F 76 ? 0.3357 0.3605 0.4763 -0.0136 -0.0238 -0.0266 76 ARG F CG 10778 C CD . ARG F 76 ? 0.3406 0.3691 0.4776 -0.0125 -0.0246 -0.0234 76 ARG F CD 10779 N NE . ARG F 76 ? 0.3351 0.3611 0.4669 -0.0145 -0.0246 -0.0179 76 ARG F NE 10780 C CZ . ARG F 76 ? 0.3366 0.3662 0.4624 -0.0151 -0.0251 -0.0154 76 ARG F CZ 10781 N NH1 . ARG F 76 ? 0.3493 0.3850 0.4732 -0.0145 -0.0256 -0.0173 76 ARG F NH1 10782 N NH2 . ARG F 76 ? 0.3488 0.3761 0.4705 -0.0166 -0.0252 -0.0109 76 ARG F NH2 10783 N N . ILE F 77 ? 0.3734 0.3997 0.5038 -0.0219 -0.0204 -0.0271 77 ILE F N 10784 C CA . ILE F 77 ? 0.4128 0.4426 0.5392 -0.0232 -0.0198 -0.0289 77 ILE F CA 10785 C C . ILE F 77 ? 0.4046 0.4337 0.5352 -0.0250 -0.0186 -0.0320 77 ILE F C 10786 O O . ILE F 77 ? 0.4037 0.4365 0.5337 -0.0252 -0.0180 -0.0362 77 ILE F O 10787 C CB . ILE F 77 ? 0.4452 0.4754 0.5657 -0.0242 -0.0201 -0.0247 77 ILE F CB 10788 C CG1 . ILE F 77 ? 0.5222 0.5530 0.6379 -0.0227 -0.0215 -0.0222 77 ILE F CG1 10789 C CG2 . ILE F 77 ? 0.4528 0.4869 0.5694 -0.0248 -0.0198 -0.0273 77 ILE F CG2 10790 C CD1 . ILE F 77 ? 0.5844 0.6146 0.6957 -0.0232 -0.0221 -0.0174 77 ILE F CD1 10791 N N . GLU F 78 ? 0.4155 0.4400 0.5500 -0.0267 -0.0184 -0.0296 78 GLU F N 10792 C CA . GLU F 78 ? 0.4491 0.4725 0.5877 -0.0291 -0.0176 -0.0322 78 GLU F CA 10793 C C . GLU F 78 ? 0.4194 0.4436 0.5622 -0.0274 -0.0176 -0.0382 78 GLU F C 10794 O O . GLU F 78 ? 0.3956 0.4226 0.5393 -0.0285 -0.0166 -0.0423 78 GLU F O 10795 C CB . GLU F 78 ? 0.5502 0.5672 0.6924 -0.0314 -0.0182 -0.0282 78 GLU F CB 10796 C CG . GLU F 78 ? 0.6429 0.6577 0.7894 -0.0349 -0.0178 -0.0300 78 GLU F CG 10797 C CD . GLU F 78 ? 0.8184 0.8253 0.9677 -0.0377 -0.0191 -0.0249 78 GLU F CD 10798 O OE1 . GLU F 78 ? 0.7804 0.7803 0.9331 -0.0357 -0.0210 -0.0241 78 GLU F OE1 10799 O OE2 . GLU F 78 ? 0.9116 0.9198 1.0596 -0.0421 -0.0186 -0.0217 78 GLU F OE2 10800 N N . ASN F 79 ? 0.3789 0.4016 0.5240 -0.0245 -0.0186 -0.0391 79 ASN F N 10801 C CA . ASN F 79 ? 0.4060 0.4310 0.5550 -0.0227 -0.0186 -0.0453 79 ASN F CA 10802 C C . ASN F 79 ? 0.3803 0.4128 0.5254 -0.0224 -0.0177 -0.0487 79 ASN F C 10803 O O . ASN F 79 ? 0.3917 0.4273 0.5393 -0.0223 -0.0172 -0.0538 79 ASN F O 10804 C CB . ASN F 79 ? 0.4241 0.4481 0.5764 -0.0193 -0.0199 -0.0461 79 ASN F CB 10805 C CG . ASN F 79 ? 0.4279 0.4554 0.5846 -0.0171 -0.0200 -0.0529 79 ASN F CG 10806 O OD1 . ASN F 79 ? 0.6102 0.6438 0.7662 -0.0148 -0.0203 -0.0549 79 ASN F OD1 10807 N ND2 . ASN F 79 ? 0.4517 0.4760 0.6130 -0.0180 -0.0200 -0.0563 79 ASN F ND2 10808 N N . LEU F 80 ? 0.3960 0.4312 0.5348 -0.0223 -0.0180 -0.0456 80 LEU F N 10809 C CA . LEU F 80 ? 0.3994 0.4404 0.5334 -0.0221 -0.0179 -0.0480 80 LEU F CA 10810 C C . LEU F 80 ? 0.4132 0.4558 0.5467 -0.0238 -0.0169 -0.0503 80 LEU F C 10811 O O . LEU F 80 ? 0.4130 0.4596 0.5469 -0.0237 -0.0165 -0.0549 80 LEU F O 10812 C CB . LEU F 80 ? 0.4232 0.4649 0.5502 -0.0217 -0.0191 -0.0438 80 LEU F CB 10813 C CG . LEU F 80 ? 0.4803 0.5259 0.6005 -0.0218 -0.0201 -0.0447 80 LEU F CG 10814 C CD1 . LEU F 80 ? 0.5387 0.5892 0.6604 -0.0213 -0.0201 -0.0493 80 LEU F CD1 10815 C CD2 . LEU F 80 ? 0.5217 0.5667 0.6361 -0.0214 -0.0218 -0.0404 80 LEU F CD2 10816 N N . ASN F 81 ? 0.3893 0.4293 0.5224 -0.0257 -0.0165 -0.0474 81 ASN F N 10817 C CA . ASN F 81 ? 0.3875 0.4302 0.5205 -0.0275 -0.0154 -0.0497 81 ASN F CA 10818 C C . ASN F 81 ? 0.4067 0.4489 0.5461 -0.0286 -0.0146 -0.0541 81 ASN F C 10819 O O . ASN F 81 ? 0.4890 0.5355 0.6286 -0.0292 -0.0138 -0.0582 81 ASN F O 10820 C CB . ASN F 81 ? 0.4015 0.4428 0.5331 -0.0297 -0.0151 -0.0454 81 ASN F CB 10821 C CG . ASN F 81 ? 0.4184 0.4640 0.5503 -0.0320 -0.0140 -0.0477 81 ASN F CG 10822 O OD1 . ASN F 81 ? 0.3907 0.4415 0.5183 -0.0310 -0.0140 -0.0498 81 ASN F OD1 10823 N ND2 . ASN F 81 ? 0.4763 0.5195 0.6133 -0.0350 -0.0132 -0.0475 81 ASN F ND2 10824 N N . LYS F 82 ? 0.4309 0.4677 0.5759 -0.0288 -0.0149 -0.0535 82 LYS F N 10825 C CA . LYS F 82 ? 0.4514 0.4868 0.6024 -0.0295 -0.0147 -0.0581 82 LYS F CA 10826 C C . LYS F 82 ? 0.4641 0.5052 0.6157 -0.0272 -0.0144 -0.0640 82 LYS F C 10827 O O . LYS F 82 ? 0.3830 0.4267 0.5371 -0.0281 -0.0137 -0.0686 82 LYS F O 10828 C CB . LYS F 82 ? 0.5117 0.5396 0.6680 -0.0289 -0.0160 -0.0570 82 LYS F CB 10829 C CG . LYS F 82 ? 0.5384 0.5634 0.7013 -0.0292 -0.0164 -0.0622 82 LYS F CG 10830 C CD . LYS F 82 ? 0.5981 0.6148 0.7655 -0.0275 -0.0185 -0.0610 82 LYS F CD 10831 C CE . LYS F 82 ? 0.5988 0.6115 0.7729 -0.0265 -0.0199 -0.0667 82 LYS F CE 10832 N NZ . LYS F 82 ? 0.6168 0.6339 0.7928 -0.0278 -0.0188 -0.0727 82 LYS F NZ 10833 N N . LYS F 83 ? 0.4440 0.4875 0.5935 -0.0245 -0.0152 -0.0638 83 LYS F N 10834 C CA . LYS F 83 ? 0.4857 0.5353 0.6360 -0.0227 -0.0151 -0.0690 83 LYS F CA 10835 C C . LYS F 83 ? 0.4775 0.5326 0.6231 -0.0237 -0.0145 -0.0708 83 LYS F C 10836 O O . LYS F 83 ? 0.4350 0.4947 0.5823 -0.0236 -0.0140 -0.0758 83 LYS F O 10837 C CB . LYS F 83 ? 0.4962 0.5485 0.6445 -0.0204 -0.0161 -0.0679 83 LYS F CB 10838 C CG . LYS F 83 ? 0.5086 0.5576 0.6622 -0.0183 -0.0169 -0.0679 83 LYS F CG 10839 C CD . LYS F 83 ? 0.4716 0.5262 0.6232 -0.0162 -0.0177 -0.0676 83 LYS F CD 10840 C CE . LYS F 83 ? 0.4813 0.5337 0.6272 -0.0169 -0.0183 -0.0611 83 LYS F CE 10841 N NZ . LYS F 83 ? 0.4699 0.5285 0.6125 -0.0159 -0.0192 -0.0602 83 LYS F NZ 10842 N N . MET F 84 ? 0.4871 0.5417 0.6268 -0.0245 -0.0147 -0.0668 84 MET F N 10843 C CA . MET F 84 ? 0.4685 0.5277 0.6033 -0.0249 -0.0147 -0.0683 84 MET F CA 10844 C C . MET F 84 ? 0.4483 0.5090 0.5864 -0.0267 -0.0133 -0.0717 84 MET F C 10845 O O . MET F 84 ? 0.4055 0.4711 0.5438 -0.0265 -0.0130 -0.0762 84 MET F O 10846 C CB . MET F 84 ? 0.5101 0.5680 0.6380 -0.0248 -0.0157 -0.0637 84 MET F CB 10847 C CG . MET F 84 ? 0.5682 0.6302 0.6900 -0.0241 -0.0166 -0.0654 84 MET F CG 10848 S SD . MET F 84 ? 0.5968 0.6578 0.7129 -0.0240 -0.0174 -0.0618 84 MET F SD 10849 C CE . MET F 84 ? 0.6022 0.6654 0.7240 -0.0265 -0.0150 -0.0635 84 MET F CE 10850 N N . GLU F 85 ? 0.4310 0.4881 0.5716 -0.0288 -0.0127 -0.0693 85 GLU F N 10851 C CA . GLU F 85 ? 0.4623 0.5210 0.6064 -0.0315 -0.0115 -0.0720 85 GLU F CA 10852 C C . GLU F 85 ? 0.4383 0.4978 0.5882 -0.0315 -0.0110 -0.0776 85 GLU F C 10853 O O . GLU F 85 ? 0.4847 0.5492 0.6350 -0.0321 -0.0103 -0.0818 85 GLU F O 10854 C CB . GLU F 85 ? 0.4795 0.5331 0.6263 -0.0345 -0.0112 -0.0681 85 GLU F CB 10855 C CG . GLU F 85 ? 0.5525 0.6084 0.6947 -0.0358 -0.0110 -0.0640 85 GLU F CG 10856 C CD . GLU F 85 ? 0.5668 0.6192 0.7119 -0.0398 -0.0106 -0.0603 85 GLU F CD 10857 O OE1 . GLU F 85 ? 0.6943 0.7426 0.8450 -0.0423 -0.0106 -0.0616 85 GLU F OE1 10858 O OE2 . GLU F 85 ? 0.4839 0.5377 0.6255 -0.0407 -0.0107 -0.0560 85 GLU F OE2 10859 N N . ASP F 86 ? 0.4334 0.4881 0.5879 -0.0306 -0.0117 -0.0778 86 ASP F N 10860 C CA . ASP F 86 ? 0.4129 0.4680 0.5733 -0.0300 -0.0117 -0.0837 86 ASP F CA 10861 C C . ASP F 86 ? 0.3800 0.4430 0.5385 -0.0279 -0.0114 -0.0881 86 ASP F C 10862 O O . ASP F 86 ? 0.3816 0.4485 0.5429 -0.0282 -0.0108 -0.0934 86 ASP F O 10863 C CB . ASP F 86 ? 0.4109 0.4597 0.5758 -0.0282 -0.0130 -0.0832 86 ASP F CB 10864 C CG . ASP F 86 ? 0.4545 0.4944 0.6216 -0.0306 -0.0137 -0.0787 86 ASP F CG 10865 O OD1 . ASP F 86 ? 0.4703 0.5094 0.6363 -0.0343 -0.0130 -0.0765 86 ASP F OD1 10866 O OD2 . ASP F 86 ? 0.4806 0.5145 0.6504 -0.0289 -0.0151 -0.0773 86 ASP F OD2 10867 N N . GLY F 87 ? 0.3908 0.4564 0.5440 -0.0260 -0.0120 -0.0857 87 GLY F N 10868 C CA . GLY F 87 ? 0.3772 0.4501 0.5271 -0.0246 -0.0123 -0.0886 87 GLY F CA 10869 C C . GLY F 87 ? 0.3847 0.4624 0.5321 -0.0256 -0.0117 -0.0912 87 GLY F C 10870 O O . GLY F 87 ? 0.3848 0.4679 0.5339 -0.0253 -0.0113 -0.0961 87 GLY F O 10871 N N . PHE F 88 ? 0.3727 0.4490 0.5163 -0.0267 -0.0116 -0.0882 88 PHE F N 10872 C CA . PHE F 88 ? 0.3962 0.4777 0.5374 -0.0273 -0.0112 -0.0907 88 PHE F CA 10873 C C . PHE F 88 ? 0.4087 0.4917 0.5562 -0.0294 -0.0097 -0.0950 88 PHE F C 10874 O O . PHE F 88 ? 0.4364 0.5253 0.5839 -0.0294 -0.0093 -0.0995 88 PHE F O 10875 C CB . PHE F 88 ? 0.4033 0.4843 0.5388 -0.0274 -0.0117 -0.0870 88 PHE F CB 10876 C CG . PHE F 88 ? 0.3916 0.4721 0.5195 -0.0252 -0.0138 -0.0841 88 PHE F CG 10877 C CD1 . PHE F 88 ? 0.4045 0.4890 0.5282 -0.0237 -0.0152 -0.0864 88 PHE F CD1 10878 C CD2 . PHE F 88 ? 0.4160 0.4919 0.5407 -0.0248 -0.0147 -0.0789 88 PHE F CD2 10879 C CE1 . PHE F 88 ? 0.4042 0.4871 0.5204 -0.0221 -0.0177 -0.0835 88 PHE F CE1 10880 C CE2 . PHE F 88 ? 0.3968 0.4715 0.5142 -0.0230 -0.0171 -0.0763 88 PHE F CE2 10881 C CZ . PHE F 88 ? 0.3905 0.4683 0.5037 -0.0218 -0.0187 -0.0785 88 PHE F CZ 10882 N N . LEU F 89 ? 0.4448 0.5222 0.5972 -0.0314 -0.0092 -0.0937 89 LEU F N 10883 C CA . LEU F 89 ? 0.4803 0.5580 0.6388 -0.0339 -0.0083 -0.0978 89 LEU F CA 10884 C C . LEU F 89 ? 0.4544 0.5353 0.6168 -0.0323 -0.0083 -0.1040 89 LEU F C 10885 O O . LEU F 89 ? 0.4283 0.5140 0.5930 -0.0334 -0.0076 -0.1087 89 LEU F O 10886 C CB . LEU F 89 ? 0.4730 0.5425 0.6358 -0.0364 -0.0085 -0.0948 89 LEU F CB 10887 C CG . LEU F 89 ? 0.5344 0.6027 0.7033 -0.0396 -0.0082 -0.0988 89 LEU F CG 10888 C CD1 . LEU F 89 ? 0.5472 0.6127 0.7165 -0.0443 -0.0079 -0.0950 89 LEU F CD1 10889 C CD2 . LEU F 89 ? 0.5212 0.5831 0.6960 -0.0383 -0.0094 -0.1013 89 LEU F CD2 10890 N N . ASP F 90 ? 0.4719 0.5516 0.6349 -0.0297 -0.0091 -0.1040 90 ASP F N 10891 C CA . ASP F 90 ? 0.4824 0.5669 0.6489 -0.0279 -0.0092 -0.1098 90 ASP F CA 10892 C C . ASP F 90 ? 0.4648 0.5584 0.6268 -0.0272 -0.0089 -0.1124 90 ASP F C 10893 O O . ASP F 90 ? 0.3846 0.4835 0.5495 -0.0274 -0.0083 -0.1179 90 ASP F O 10894 C CB . ASP F 90 ? 0.5110 0.5939 0.6785 -0.0251 -0.0103 -0.1090 90 ASP F CB 10895 C CG . ASP F 90 ? 0.5583 0.6322 0.7312 -0.0251 -0.0111 -0.1078 90 ASP F CG 10896 O OD1 . ASP F 90 ? 0.5722 0.6407 0.7486 -0.0276 -0.0110 -0.1083 90 ASP F OD1 10897 O OD2 . ASP F 90 ? 0.5834 0.6555 0.7569 -0.0227 -0.0121 -0.1063 90 ASP F OD2 10898 N N . VAL F 91 ? 0.4350 0.5299 0.5898 -0.0263 -0.0096 -0.1083 91 VAL F N 10899 C CA . VAL F 91 ? 0.4024 0.5044 0.5520 -0.0257 -0.0100 -0.1100 91 VAL F CA 10900 C C . VAL F 91 ? 0.4115 0.5171 0.5620 -0.0271 -0.0090 -0.1133 91 VAL F C 10901 O O . VAL F 91 ? 0.4182 0.5303 0.5697 -0.0268 -0.0087 -0.1181 91 VAL F O 10902 C CB . VAL F 91 ? 0.4005 0.5012 0.5418 -0.0247 -0.0116 -0.1047 91 VAL F CB 10903 C CG1 . VAL F 91 ? 0.3921 0.4983 0.5276 -0.0240 -0.0127 -0.1062 91 VAL F CG1 10904 C CG2 . VAL F 91 ? 0.4018 0.5016 0.5416 -0.0237 -0.0127 -0.1022 91 VAL F CG2 10905 N N . TRP F 92 ? 0.4112 0.5136 0.5614 -0.0287 -0.0085 -0.1108 92 TRP F N 10906 C CA . TRP F 92 ? 0.3934 0.5008 0.5439 -0.0302 -0.0076 -0.1139 92 TRP F CA 10907 C C . TRP F 92 ? 0.4373 0.5462 0.5954 -0.0322 -0.0063 -0.1191 92 TRP F C 10908 O O . TRP F 92 ? 0.4180 0.5336 0.5768 -0.0328 -0.0057 -0.1236 92 TRP F O 10909 C CB . TRP F 92 ? 0.3628 0.4684 0.5111 -0.0317 -0.0074 -0.1101 92 TRP F CB 10910 C CG . TRP F 92 ? 0.3588 0.4648 0.4993 -0.0293 -0.0089 -0.1065 92 TRP F CG 10911 C CD1 . TRP F 92 ? 0.3936 0.4942 0.5310 -0.0289 -0.0097 -0.1010 92 TRP F CD1 10912 C CD2 . TRP F 92 ? 0.3564 0.4678 0.4910 -0.0268 -0.0103 -0.1082 92 TRP F CD2 10913 N NE1 . TRP F 92 ? 0.3798 0.4819 0.5097 -0.0263 -0.0115 -0.0995 92 TRP F NE1 10914 C CE2 . TRP F 92 ? 0.3819 0.4902 0.5098 -0.0249 -0.0121 -0.1038 92 TRP F CE2 10915 C CE3 . TRP F 92 ? 0.3653 0.4837 0.4994 -0.0260 -0.0104 -0.1130 92 TRP F CE3 10916 C CZ2 . TRP F 92 ? 0.3882 0.4992 0.5090 -0.0220 -0.0144 -0.1042 92 TRP F CZ2 10917 C CZ3 . TRP F 92 ? 0.3492 0.4705 0.4761 -0.0231 -0.0126 -0.1131 92 TRP F CZ3 10918 C CH2 . TRP F 92 ? 0.3610 0.4783 0.4814 -0.0211 -0.0147 -0.1089 92 TRP F CH2 10919 N N . THR F 93 ? 0.4447 0.5472 0.6083 -0.0333 -0.0062 -0.1189 93 THR F N 10920 C CA . THR F 93 ? 0.4514 0.5540 0.6220 -0.0352 -0.0057 -0.1241 93 THR F CA 10921 C C . THR F 93 ? 0.4599 0.5697 0.6319 -0.0331 -0.0056 -0.1302 93 THR F C 10922 O O . THR F 93 ? 0.4309 0.5462 0.6051 -0.0344 -0.0049 -0.1350 93 THR F O 10923 C CB . THR F 93 ? 0.4485 0.5417 0.6244 -0.0360 -0.0064 -0.1230 93 THR F CB 10924 O OG1 . THR F 93 ? 0.4605 0.5476 0.6350 -0.0386 -0.0065 -0.1171 93 THR F OG1 10925 C CG2 . THR F 93 ? 0.4588 0.5510 0.6415 -0.0379 -0.0065 -0.1288 93 THR F CG2 10926 N N . TYR F 94 ? 0.4645 0.5752 0.6349 -0.0302 -0.0064 -0.1298 94 TYR F N 10927 C CA . TYR F 94 ? 0.4824 0.6011 0.6539 -0.0283 -0.0065 -0.1351 94 TYR F CA 10928 C C . TYR F 94 ? 0.4967 0.6237 0.6634 -0.0282 -0.0062 -0.1366 94 TYR F C 10929 O O . TYR F 94 ? 0.5129 0.6466 0.6823 -0.0284 -0.0057 -0.1422 94 TYR F O 10930 C CB . TYR F 94 ? 0.4782 0.5975 0.6478 -0.0257 -0.0074 -0.1332 94 TYR F CB 10931 C CG . TYR F 94 ? 0.4710 0.5990 0.6432 -0.0240 -0.0075 -0.1390 94 TYR F CG 10932 C CD1 . TYR F 94 ? 0.4183 0.5463 0.5981 -0.0234 -0.0074 -0.1448 94 TYR F CD1 10933 C CD2 . TYR F 94 ? 0.4505 0.5866 0.6173 -0.0231 -0.0081 -0.1385 94 TYR F CD2 10934 C CE1 . TYR F 94 ? 0.4047 0.5416 0.5870 -0.0215 -0.0076 -0.1503 94 TYR F CE1 10935 C CE2 . TYR F 94 ? 0.4521 0.5974 0.6213 -0.0218 -0.0082 -0.1434 94 TYR F CE2 10936 C CZ . TYR F 94 ? 0.4311 0.5774 0.6082 -0.0209 -0.0077 -0.1496 94 TYR F CZ 10937 O OH . TYR F 94 ? 0.4603 0.6170 0.6398 -0.0194 -0.0078 -0.1552 94 TYR F OH 10938 N N . ASN F 95 ? 0.5221 0.6485 0.6818 -0.0278 -0.0069 -0.1318 95 ASN F N 10939 C CA . ASN F 95 ? 0.5179 0.6511 0.6724 -0.0271 -0.0074 -0.1329 95 ASN F CA 10940 C C . ASN F 95 ? 0.5104 0.6473 0.6675 -0.0288 -0.0061 -0.1366 95 ASN F C 10941 O O . ASN F 95 ? 0.4411 0.5857 0.5979 -0.0284 -0.0060 -0.1409 95 ASN F O 10942 C CB . ASN F 95 ? 0.5718 0.7024 0.7179 -0.0258 -0.0091 -0.1272 95 ASN F CB 10943 C CG . ASN F 95 ? 0.7528 0.8819 0.8950 -0.0244 -0.0107 -0.1239 95 ASN F CG 10944 O OD1 . ASN F 95 ? 0.7167 0.8490 0.8623 -0.0242 -0.0104 -0.1263 95 ASN F OD1 10945 N ND2 . ASN F 95 ? 0.8631 0.9881 0.9985 -0.0235 -0.0125 -0.1186 95 ASN F ND2 10946 N N . ALA F 96 ? 0.4738 0.6059 0.6336 -0.0312 -0.0053 -0.1349 96 ALA F N 10947 C CA . ALA F 96 ? 0.4519 0.5882 0.6138 -0.0335 -0.0042 -0.1378 96 ALA F CA 10948 C C . ALA F 96 ? 0.4757 0.6151 0.6444 -0.0349 -0.0033 -0.1441 96 ALA F C 10949 O O . ALA F 96 ? 0.4069 0.5540 0.5760 -0.0354 -0.0027 -0.1485 96 ALA F O 10950 C CB . ALA F 96 ? 0.4692 0.6002 0.6323 -0.0365 -0.0036 -0.1340 96 ALA F CB 10951 N N . GLU F 97 ? 0.4699 0.6034 0.6437 -0.0352 -0.0034 -0.1449 97 GLU F N 10952 C CA . GLU F 97 ? 0.4768 0.6118 0.6575 -0.0364 -0.0030 -0.1513 97 GLU F CA 10953 C C . GLU F 97 ? 0.5041 0.6488 0.6840 -0.0340 -0.0030 -0.1563 97 GLU F C 10954 O O . GLU F 97 ? 0.5085 0.6594 0.6913 -0.0351 -0.0024 -0.1618 97 GLU F O 10955 C CB . GLU F 97 ? 0.4897 0.6160 0.6757 -0.0362 -0.0039 -0.1514 97 GLU F CB 10956 C CG . GLU F 97 ? 0.5065 0.6226 0.6940 -0.0393 -0.0042 -0.1468 97 GLU F CG 10957 C CD . GLU F 97 ? 0.5214 0.6347 0.7142 -0.0437 -0.0042 -0.1496 97 GLU F CD 10958 O OE1 . GLU F 97 ? 0.5782 0.6969 0.7744 -0.0442 -0.0039 -0.1560 97 GLU F OE1 10959 O OE2 . GLU F 97 ? 0.5655 0.6712 0.7590 -0.0470 -0.0046 -0.1453 97 GLU F OE2 10960 N N . LEU F 98 ? 0.4937 0.6403 0.6694 -0.0310 -0.0038 -0.1542 98 LEU F N 10961 C CA . LEU F 98 ? 0.4928 0.6490 0.6672 -0.0291 -0.0041 -0.1582 98 LEU F CA 10962 C C . LEU F 98 ? 0.5569 0.7204 0.7264 -0.0291 -0.0040 -0.1589 98 LEU F C 10963 O O . LEU F 98 ? 0.5228 0.6950 0.6932 -0.0287 -0.0038 -0.1639 98 LEU F O 10964 C CB . LEU F 98 ? 0.4871 0.6438 0.6577 -0.0268 -0.0052 -0.1551 98 LEU F CB 10965 C CG . LEU F 98 ? 0.5084 0.6631 0.6846 -0.0257 -0.0053 -0.1573 98 LEU F CG 10966 C CD1 . LEU F 98 ? 0.5530 0.7145 0.7256 -0.0238 -0.0063 -0.1564 98 LEU F CD1 10967 C CD2 . LEU F 98 ? 0.5148 0.6726 0.6988 -0.0260 -0.0047 -0.1650 98 LEU F CD2 10968 N N . LEU F 99 ? 0.5681 0.7286 0.7321 -0.0290 -0.0046 -0.1540 99 LEU F N 10969 C CA . LEU F 99 ? 0.5592 0.7260 0.7184 -0.0284 -0.0050 -0.1546 99 LEU F CA 10970 C C . LEU F 99 ? 0.5694 0.7418 0.7335 -0.0306 -0.0034 -0.1602 99 LEU F C 10971 O O . LEU F 99 ? 0.5465 0.7275 0.7095 -0.0298 -0.0035 -0.1641 99 LEU F O 10972 C CB . LEU F 99 ? 0.5503 0.7122 0.7039 -0.0279 -0.0058 -0.1489 99 LEU F CB 10973 C CG . LEU F 99 ? 0.6132 0.7810 0.7628 -0.0271 -0.0063 -0.1500 99 LEU F CG 10974 C CD1 . LEU F 99 ? 0.6059 0.7783 0.7492 -0.0241 -0.0084 -0.1504 99 LEU F CD1 10975 C CD2 . LEU F 99 ? 0.6486 0.8121 0.7945 -0.0270 -0.0068 -0.1453 99 LEU F CD2 10976 N N . VAL F 100 ? 0.5243 0.6918 0.6938 -0.0337 -0.0022 -0.1603 100 VAL F N 10977 C CA . VAL F 100 ? 0.4767 0.6488 0.6512 -0.0367 -0.0009 -0.1652 100 VAL F CA 10978 C C . VAL F 100 ? 0.4945 0.6718 0.6739 -0.0365 -0.0006 -0.1721 100 VAL F C 10979 O O . VAL F 100 ? 0.4131 0.5990 0.5933 -0.0369 -0.0001 -0.1766 100 VAL F O 10980 C CB . VAL F 100 ? 0.4906 0.6547 0.6693 -0.0406 -0.0003 -0.1630 100 VAL F CB 10981 C CG1 . VAL F 100 ? 0.5397 0.7065 0.7247 -0.0445 0.0005 -0.1683 100 VAL F CG1 10982 C CG2 . VAL F 100 ? 0.5282 0.6916 0.7022 -0.0413 -0.0003 -0.1577 100 VAL F CG2 10983 N N . LEU F 101 ? 0.4974 0.6702 0.6802 -0.0355 -0.0010 -0.1728 101 LEU F N 10984 C CA . LEU F 101 ? 0.5316 0.7101 0.7186 -0.0345 -0.0010 -0.1794 101 LEU F CA 10985 C C . LEU F 101 ? 0.5319 0.7218 0.7147 -0.0322 -0.0012 -0.1816 101 LEU F C 10986 O O . LEU F 101 ? 0.6372 0.8349 0.8229 -0.0326 -0.0007 -0.1876 101 LEU F O 10987 C CB . LEU F 101 ? 0.5242 0.6972 0.7140 -0.0327 -0.0018 -0.1790 101 LEU F CB 10988 C CG . LEU F 101 ? 0.5452 0.7111 0.7428 -0.0339 -0.0021 -0.1826 101 LEU F CG 10989 C CD1 . LEU F 101 ? 0.5526 0.7111 0.7530 -0.0381 -0.0019 -0.1815 101 LEU F CD1 10990 C CD2 . LEU F 101 ? 0.5484 0.7078 0.7465 -0.0315 -0.0032 -0.1798 101 LEU F CD2 10991 N N . MET F 102 ? 0.5503 0.7406 0.7260 -0.0299 -0.0023 -0.1767 102 MET F N 10992 C CA . MET F 102 ? 0.5212 0.7207 0.6919 -0.0279 -0.0032 -0.1777 102 MET F CA 10993 C C . MET F 102 ? 0.5748 0.7805 0.7425 -0.0281 -0.0032 -0.1792 102 MET F C 10994 O O . MET F 102 ? 0.5746 0.7898 0.7420 -0.0274 -0.0033 -0.1835 102 MET F O 10995 C CB . MET F 102 ? 0.5375 0.7339 0.7008 -0.0261 -0.0050 -0.1712 102 MET F CB 10996 C CG . MET F 102 ? 0.6361 0.8298 0.8009 -0.0254 -0.0054 -0.1697 102 MET F CG 10997 S SD . MET F 102 ? 0.7430 0.9314 0.8982 -0.0242 -0.0077 -0.1610 102 MET F SD 10998 C CE . MET F 102 ? 0.7476 0.9367 0.9060 -0.0238 -0.0077 -0.1610 102 MET F CE 10999 N N . GLU F 103 ? 0.5582 0.7595 0.7234 -0.0287 -0.0032 -0.1757 103 GLU F N 11000 C CA . GLU F 103 ? 0.5924 0.8004 0.7547 -0.0283 -0.0034 -0.1773 103 GLU F CA 11001 C C . GLU F 103 ? 0.5294 0.7434 0.6984 -0.0311 -0.0015 -0.1837 103 GLU F C 11002 O O . GLU F 103 ? 0.5848 0.8081 0.7527 -0.0304 -0.0015 -0.1875 103 GLU F O 11003 C CB . GLU F 103 ? 0.6139 0.8172 0.7710 -0.0276 -0.0042 -0.1722 103 GLU F CB 11004 C CG . GLU F 103 ? 0.6420 0.8418 0.7907 -0.0242 -0.0069 -0.1670 103 GLU F CG 11005 C CD . GLU F 103 ? 0.6463 0.8537 0.7896 -0.0216 -0.0090 -0.1688 103 GLU F CD 11006 O OE1 . GLU F 103 ? 0.6200 0.8352 0.7637 -0.0213 -0.0087 -0.1729 103 GLU F OE1 11007 O OE2 . GLU F 103 ? 0.6844 0.8904 0.8229 -0.0202 -0.0111 -0.1660 103 GLU F OE2 11008 N N . ASN F 104 ? 0.4829 0.6916 0.6587 -0.0341 -0.0002 -0.1852 104 ASN F N 11009 C CA . ASN F 104 ? 0.5326 0.7465 0.7149 -0.0369 0.0010 -0.1916 104 ASN F CA 11010 C C . ASN F 104 ? 0.5686 0.7913 0.7528 -0.0353 0.0010 -0.1977 104 ASN F C 11011 O O . ASN F 104 ? 0.5115 0.7433 0.6971 -0.0362 0.0016 -0.2026 104 ASN F O 11012 C CB . ASN F 104 ? 0.5277 0.7325 0.7167 -0.0405 0.0016 -0.1918 104 ASN F CB 11013 C CG . ASN F 104 ? 0.4902 0.6900 0.6781 -0.0434 0.0020 -0.1872 104 ASN F CG 11014 O OD1 . ASN F 104 ? 0.4349 0.6398 0.6178 -0.0426 0.0020 -0.1851 104 ASN F OD1 11015 N ND2 . ASN F 104 ? 0.4823 0.6724 0.6749 -0.0467 0.0021 -0.1858 104 ASN F ND2 11016 N N . GLU F 105 ? 0.5683 0.7895 0.7524 -0.0332 0.0003 -0.1974 105 GLU F N 11017 C CA . GLU F 105 ? 0.6031 0.8340 0.7882 -0.0316 0.0001 -0.2025 105 GLU F CA 11018 C C . GLU F 105 ? 0.5914 0.8317 0.7706 -0.0302 -0.0004 -0.2027 105 GLU F C 11019 O O . GLU F 105 ? 0.7224 0.9724 0.9038 -0.0304 0.0000 -0.2084 105 GLU F O 11020 C CB . GLU F 105 ? 0.6687 0.8985 0.8525 -0.0294 -0.0007 -0.2006 105 GLU F CB 11021 C CG . GLU F 105 ? 0.8351 1.0756 1.0217 -0.0283 -0.0007 -0.2068 105 GLU F CG 11022 C CD . GLU F 105 ? 0.9952 1.2389 1.1779 -0.0262 -0.0019 -0.2041 105 GLU F CD 11023 O OE1 . GLU F 105 ? 1.2227 1.4639 1.4093 -0.0255 -0.0019 -0.2050 105 GLU F OE1 11024 O OE2 . GLU F 105 ? 1.1320 1.3813 1.3078 -0.0253 -0.0030 -0.2012 105 GLU F OE2 11025 N N . ARG F 106 ? 0.5474 0.7847 0.7191 -0.0284 -0.0018 -0.1965 106 ARG F N 11026 C CA . ARG F 106 ? 0.5723 0.8171 0.7372 -0.0262 -0.0034 -0.1961 106 ARG F CA 11027 C C . ARG F 106 ? 0.5336 0.7847 0.6992 -0.0268 -0.0027 -0.1995 106 ARG F C 11028 O O . ARG F 106 ? 0.4907 0.7512 0.6539 -0.0254 -0.0034 -0.2025 106 ARG F O 11029 C CB . ARG F 106 ? 0.6735 0.9120 0.8299 -0.0239 -0.0058 -0.1888 106 ARG F CB 11030 C CG . ARG F 106 ? 0.7952 1.0293 0.9498 -0.0234 -0.0068 -0.1852 106 ARG F CG 11031 C CD . ARG F 106 ? 0.9797 1.2124 1.1245 -0.0212 -0.0100 -0.1797 106 ARG F CD 11032 N NE . ARG F 106 ? 1.1728 1.4155 1.3142 -0.0201 -0.0115 -0.1822 106 ARG F NE 11033 C CZ . ARG F 106 ? 1.3958 1.6382 1.5283 -0.0183 -0.0149 -0.1782 106 ARG F CZ 11034 N NH1 . ARG F 106 ? 1.6059 1.8385 1.7322 -0.0172 -0.0172 -0.1718 106 ARG F NH1 11035 N NH2 . ARG F 106 ? 1.3533 1.6047 1.4828 -0.0176 -0.0165 -0.1803 106 ARG F NH2 11036 N N . THR F 107 ? 0.4901 0.7364 0.6586 -0.0291 -0.0014 -0.1986 107 THR F N 11037 C CA . THR F 107 ? 0.5204 0.7733 0.6898 -0.0303 -0.0006 -0.2015 107 THR F CA 11038 C C . THR F 107 ? 0.5957 0.8575 0.7713 -0.0323 0.0007 -0.2091 107 THR F C 11039 O O . THR F 107 ? 0.5531 0.8253 0.7273 -0.0314 0.0006 -0.2127 107 THR F O 11040 C CB . THR F 107 ? 0.5542 0.8004 0.7258 -0.0332 0.0004 -0.1987 107 THR F CB 11041 O OG1 . THR F 107 ? 0.5570 0.7975 0.7218 -0.0306 -0.0011 -0.1924 107 THR F OG1 11042 C CG2 . THR F 107 ? 0.5687 0.8236 0.7430 -0.0359 0.0017 -0.2027 107 THR F CG2 11043 N N . LEU F 108 ? 0.5811 0.8390 0.7634 -0.0347 0.0018 -0.2118 108 LEU F N 11044 C CA . LEU F 108 ? 0.5751 0.8407 0.7636 -0.0365 0.0028 -0.2194 108 LEU F CA 11045 C C . LEU F 108 ? 0.5596 0.8356 0.7454 -0.0334 0.0020 -0.2225 108 LEU F C 11046 O O . LEU F 108 ? 0.6041 0.8904 0.7917 -0.0339 0.0025 -0.2279 108 LEU F O 11047 C CB . LEU F 108 ? 0.5691 0.8271 0.7649 -0.0389 0.0034 -0.2217 108 LEU F CB 11048 C CG . LEU F 108 ? 0.6239 0.8716 0.8230 -0.0428 0.0040 -0.2190 108 LEU F CG 11049 C CD1 . LEU F 108 ? 0.6789 0.9201 0.8857 -0.0451 0.0039 -0.2232 108 LEU F CD1 11050 C CD2 . LEU F 108 ? 0.5925 0.8453 0.7916 -0.0461 0.0048 -0.2197 108 LEU F CD2 11051 N N . ASP F 109 ? 0.5647 0.8385 0.7460 -0.0306 0.0007 -0.2188 109 ASP F N 11052 C CA . ASP F 109 ? 0.5984 0.8821 0.7761 -0.0282 -0.0004 -0.2205 109 ASP F CA 11053 C C . ASP F 109 ? 0.6407 0.9307 0.8118 -0.0263 -0.0017 -0.2194 109 ASP F C 11054 O O . ASP F 109 ? 0.6784 0.9789 0.8480 -0.0251 -0.0023 -0.2228 109 ASP F O 11055 C CB . ASP F 109 ? 0.6046 0.8846 0.7782 -0.0263 -0.0019 -0.2158 109 ASP F CB 11056 C CG . ASP F 109 ? 0.6605 0.9385 0.8409 -0.0273 -0.0008 -0.2188 109 ASP F CG 11057 O OD1 . ASP F 109 ? 0.6676 0.9498 0.8552 -0.0287 0.0004 -0.2257 109 ASP F OD1 11058 O OD2 . ASP F 109 ? 0.7183 0.9906 0.8967 -0.0264 -0.0016 -0.2144 109 ASP F OD2 11059 N N . PHE F 110 ? 0.5845 0.8685 0.7516 -0.0256 -0.0024 -0.2148 110 PHE F N 11060 C CA . PHE F 110 ? 0.5708 0.8601 0.7315 -0.0230 -0.0042 -0.2139 110 PHE F CA 11061 C C . PHE F 110 ? 0.5812 0.8815 0.7462 -0.0244 -0.0026 -0.2205 110 PHE F C 11062 O O . PHE F 110 ? 0.4845 0.7938 0.6459 -0.0221 -0.0039 -0.2227 110 PHE F O 11063 C CB . PHE F 110 ? 0.5007 0.7813 0.6571 -0.0219 -0.0051 -0.2082 110 PHE F CB 11064 C CG . PHE F 110 ? 0.4509 0.7366 0.6013 -0.0187 -0.0071 -0.2079 110 PHE F CG 11065 C CD1 . PHE F 110 ? 0.4732 0.7621 0.6159 -0.0147 -0.0105 -0.2067 110 PHE F CD1 11066 C CD2 . PHE F 110 ? 0.3962 0.6832 0.5481 -0.0196 -0.0060 -0.2084 110 PHE F CD2 11067 C CE1 . PHE F 110 ? 0.4784 0.7714 0.6153 -0.0109 -0.0129 -0.2067 110 PHE F CE1 11068 C CE2 . PHE F 110 ? 0.4071 0.6997 0.5534 -0.0160 -0.0080 -0.2086 110 PHE F CE2 11069 C CZ . PHE F 110 ? 0.4064 0.7016 0.5453 -0.0112 -0.0116 -0.2079 110 PHE F CZ 11070 N N . HIS F 111 ? 0.5802 0.8792 0.7528 -0.0284 -0.0001 -0.2236 111 HIS F N 11071 C CA . HIS F 111 ? 0.6238 0.9328 0.8007 -0.0307 0.0013 -0.2298 111 HIS F CA 11072 C C . HIS F 111 ? 0.6839 1.0028 0.8634 -0.0303 0.0015 -0.2358 111 HIS F C 11073 O O . HIS F 111 ? 0.5789 0.9087 0.7563 -0.0288 0.0009 -0.2390 111 HIS F O 11074 C CB . HIS F 111 ? 0.6103 0.9144 0.7943 -0.0358 0.0034 -0.2310 111 HIS F CB 11075 C CG . HIS F 111 ? 0.5713 0.8714 0.7527 -0.0365 0.0034 -0.2265 111 HIS F CG 11076 N ND1 . HIS F 111 ? 0.6443 0.9337 0.8284 -0.0397 0.0042 -0.2228 111 HIS F ND1 11077 C CD2 . HIS F 111 ? 0.5831 0.8892 0.7592 -0.0341 0.0025 -0.2251 111 HIS F CD2 11078 C CE1 . HIS F 111 ? 0.6333 0.9230 0.8139 -0.0396 0.0040 -0.2193 111 HIS F CE1 11079 N NE2 . HIS F 111 ? 0.6663 0.9664 0.8423 -0.0360 0.0030 -0.2210 111 HIS F NE2 11080 N N . ASP F 112 ? 0.7091 1.0243 0.8929 -0.0314 0.0021 -0.2373 112 ASP F N 11081 C CA . ASP F 112 ? 0.7115 1.0355 0.8969 -0.0305 0.0020 -0.2422 112 ASP F CA 11082 C C . ASP F 112 ? 0.6992 1.0322 0.8773 -0.0269 0.0000 -0.2411 112 ASP F C 11083 O O . ASP F 112 ? 0.6912 1.0358 0.8703 -0.0267 0.0001 -0.2463 112 ASP F O 11084 C CB . ASP F 112 ? 0.7923 1.1098 0.9791 -0.0301 0.0018 -0.2405 112 ASP F CB 11085 C CG . ASP F 112 ? 0.8472 1.1690 1.0418 -0.0317 0.0029 -0.2477 112 ASP F CG 11086 O OD1 . ASP F 112 ? 0.9761 1.2926 1.1772 -0.0348 0.0041 -0.2506 112 ASP F OD1 11087 O OD2 . ASP F 112 ? 0.9577 1.2880 1.1518 -0.0301 0.0024 -0.2503 112 ASP F OD2 11088 N N . SER F 113 ? 0.6752 1.0020 0.8457 -0.0242 -0.0022 -0.2341 113 SER F N 11089 C CA . SER F 113 ? 0.7082 1.0406 0.8704 -0.0208 -0.0051 -0.2317 113 SER F CA 11090 C C . SER F 113 ? 0.7182 1.0580 0.8774 -0.0189 -0.0060 -0.2337 113 SER F C 11091 O O . SER F 113 ? 0.8089 1.1582 0.9648 -0.0171 -0.0075 -0.2358 113 SER F O 11092 C CB . SER F 113 ? 0.6695 0.9914 0.8241 -0.0188 -0.0077 -0.2234 113 SER F CB 11093 O OG . SER F 113 ? 0.6160 0.9400 0.7613 -0.0155 -0.0114 -0.2200 113 SER F OG 11094 N N . ASN F 114 ? 0.6483 0.9846 0.8087 -0.0196 -0.0051 -0.2332 114 ASN F N 11095 C CA . ASN F 114 ? 0.5962 0.9407 0.7544 -0.0178 -0.0057 -0.2357 114 ASN F CA 11096 C C . ASN F 114 ? 0.6068 0.9649 0.7711 -0.0199 -0.0037 -0.2437 114 ASN F C 11097 O O . ASN F 114 ? 0.4950 0.8635 0.6562 -0.0174 -0.0051 -0.2464 114 ASN F O 11098 C CB . ASN F 114 ? 0.5617 0.9007 0.7206 -0.0187 -0.0049 -0.2335 114 ASN F CB 11099 C CG . ASN F 114 ? 0.6046 0.9327 0.7563 -0.0156 -0.0075 -0.2262 114 ASN F CG 11100 O OD1 . ASN F 114 ? 0.7001 1.0253 0.8448 -0.0122 -0.0106 -0.2227 114 ASN F OD1 11101 N ND2 . ASN F 114 ? 0.6145 0.9363 0.7674 -0.0170 -0.0064 -0.2237 114 ASN F ND2 11102 N N . VAL F 115 ? 0.6173 0.9748 0.7900 -0.0244 -0.0008 -0.2476 115 VAL F N 11103 C CA . VAL F 115 ? 0.6136 0.9823 0.7928 -0.0270 0.0010 -0.2554 115 VAL F CA 11104 C C . VAL F 115 ? 0.6803 1.0579 0.8580 -0.0250 0.0000 -0.2583 115 VAL F C 11105 O O . VAL F 115 ? 0.6687 1.0585 0.8467 -0.0244 0.0000 -0.2631 115 VAL F O 11106 C CB . VAL F 115 ? 0.6501 1.0130 0.8382 -0.0322 0.0036 -0.2584 115 VAL F CB 11107 C CG1 . VAL F 115 ? 0.6799 1.0532 0.8746 -0.0347 0.0050 -0.2668 115 VAL F CG1 11108 C CG2 . VAL F 115 ? 0.6575 1.0151 0.8474 -0.0352 0.0047 -0.2564 115 VAL F CG2 11109 N N . LYS F 116 ? 0.7522 1.1245 0.9283 -0.0241 -0.0008 -0.2553 116 LYS F N 11110 C CA . LYS F 116 ? 0.7690 1.1502 0.9431 -0.0226 -0.0019 -0.2571 116 LYS F CA 11111 C C . LYS F 116 ? 0.7134 1.0998 0.8783 -0.0186 -0.0052 -0.2539 116 LYS F C 11112 O O . LYS F 116 ? 0.7094 1.1059 0.8724 -0.0176 -0.0062 -0.2561 116 LYS F O 11113 C CB . LYS F 116 ? 0.7957 1.1704 0.9699 -0.0229 -0.0021 -0.2541 116 LYS F CB 11114 C CG . LYS F 116 ? 0.9316 1.3168 1.1041 -0.0220 -0.0032 -0.2559 116 LYS F CG 11115 C CD . LYS F 116 ? 1.1598 1.5419 1.3356 -0.0231 -0.0024 -0.2557 116 LYS F CD 11116 C CE . LYS F 116 ? 1.2116 1.6074 1.3924 -0.0238 -0.0014 -0.2630 116 LYS F CE 11117 N NZ . LYS F 116 ? 1.2463 1.6540 1.4206 -0.0222 -0.0035 -0.2620 116 LYS F NZ 11118 N N . ASN F 117 ? 0.7006 1.0799 0.8594 -0.0162 -0.0071 -0.2486 117 ASN F N 11119 C CA . ASN F 117 ? 0.7517 1.1351 0.9017 -0.0120 -0.0109 -0.2462 117 ASN F CA 11120 C C . ASN F 117 ? 0.7545 1.1504 0.9066 -0.0112 -0.0102 -0.2524 117 ASN F C 11121 O O . ASN F 117 ? 0.6852 1.0895 0.8324 -0.0083 -0.0127 -0.2533 117 ASN F O 11122 C CB . ASN F 117 ? 0.7640 1.1357 0.9064 -0.0090 -0.0138 -0.2391 117 ASN F CB 11123 C CG . ASN F 117 ? 0.8805 1.2411 1.0186 -0.0091 -0.0156 -0.2322 117 ASN F CG 11124 O OD1 . ASN F 117 ? 0.8468 1.2104 0.9854 -0.0107 -0.0155 -0.2322 117 ASN F OD1 11125 N ND2 . ASN F 117 ? 0.9816 1.3302 1.1152 -0.0076 -0.0172 -0.2265 117 ASN F ND2 11126 N N . LEU F 118 ? 0.6760 1.0728 0.8347 -0.0139 -0.0072 -0.2560 118 LEU F N 11127 C CA . LEU F 118 ? 0.7335 1.1433 0.8949 -0.0140 -0.0062 -0.2622 118 LEU F CA 11128 C C . LEU F 118 ? 0.7147 1.1365 0.8803 -0.0156 -0.0050 -0.2685 118 LEU F C 11129 O O . LEU F 118 ? 0.6088 1.0413 0.7709 -0.0129 -0.0068 -0.2708 118 LEU F O 11130 C CB . LEU F 118 ? 0.7315 1.1400 0.8995 -0.0180 -0.0031 -0.2646 118 LEU F CB 11131 C CG . LEU F 118 ? 0.7480 1.1548 0.9127 -0.0162 -0.0039 -0.2620 118 LEU F CG 11132 C CD1 . LEU F 118 ? 0.8181 1.2314 0.9904 -0.0213 -0.0006 -0.2669 118 LEU F CD1 11133 C CD2 . LEU F 118 ? 0.7641 1.1780 0.9208 -0.0100 -0.0075 -0.2615 118 LEU F CD2 11134 N N . TYR F 119 ? 0.7412 1.1606 0.9139 -0.0196 -0.0024 -0.2712 119 TYR F N 11135 C CA . TYR F 119 ? 0.7300 1.1596 0.9075 -0.0213 -0.0012 -0.2774 119 TYR F CA 11136 C C . TYR F 119 ? 0.7073 1.1440 0.8782 -0.0178 -0.0040 -0.2758 119 TYR F C 11137 O O . TYR F 119 ? 0.8380 1.2879 1.0102 -0.0176 -0.0039 -0.2810 119 TYR F O 11138 C CB . TYR F 119 ? 0.7723 1.1949 0.9565 -0.0246 0.0007 -0.2787 119 TYR F CB 11139 C CG . TYR F 119 ? 0.7783 1.2117 0.9686 -0.0264 0.0021 -0.2864 119 TYR F CG 11140 C CD1 . TYR F 119 ? 0.7209 1.1589 0.9194 -0.0300 0.0044 -0.2939 119 TYR F CD1 11141 C CD2 . TYR F 119 ? 0.8333 1.2727 1.0212 -0.0247 0.0010 -0.2864 119 TYR F CD2 11142 C CE1 . TYR F 119 ? 0.7141 1.1619 0.9183 -0.0313 0.0054 -0.3015 119 TYR F CE1 11143 C CE2 . TYR F 119 ? 0.8676 1.3184 1.0613 -0.0260 0.0022 -0.2940 119 TYR F CE2 11144 C CZ . TYR F 119 ? 0.8131 1.2678 1.0151 -0.0290 0.0044 -0.3018 119 TYR F CZ 11145 O OH . TYR F 119 ? 0.8730 1.3387 1.0809 -0.0301 0.0054 -0.3101 119 TYR F OH 11146 N N . ASP F 120 ? 0.7233 1.1513 0.8869 -0.0155 -0.0066 -0.2684 120 ASP F N 11147 C CA . ASP F 120 ? 0.8295 1.2628 0.9859 -0.0131 -0.0098 -0.2655 120 ASP F CA 11148 C C . ASP F 120 ? 0.8059 1.2465 0.9559 -0.0093 -0.0128 -0.2655 120 ASP F C 11149 O O . ASP F 120 ? 0.8730 1.3246 1.0207 -0.0083 -0.0142 -0.2675 120 ASP F O 11150 C CB . ASP F 120 ? 0.8823 1.3033 1.0316 -0.0120 -0.0126 -0.2567 120 ASP F CB 11151 C CG . ASP F 120 ? 0.8838 1.3038 1.0363 -0.0147 -0.0112 -0.2563 120 ASP F CG 11152 O OD1 . ASP F 120 ? 0.9055 1.3300 1.0669 -0.0173 -0.0078 -0.2626 120 ASP F OD1 11153 O OD2 . ASP F 120 ? 0.8729 1.2873 1.0185 -0.0139 -0.0140 -0.2495 120 ASP F OD2 11154 N N . LYS F 121 ? 0.8858 1.3206 1.0325 -0.0069 -0.0140 -0.2633 121 LYS F N 11155 C CA . LYS F 121 ? 0.9397 1.3805 1.0796 -0.0022 -0.0176 -0.2631 121 LYS F CA 11156 C C . LYS F 121 ? 0.8574 1.3148 1.0029 -0.0030 -0.0154 -0.2716 121 LYS F C 11157 O O . LYS F 121 ? 0.6542 1.1208 0.7950 0.0002 -0.0182 -0.2729 121 LYS F O 11158 C CB . LYS F 121 ? 1.0258 1.4564 1.1605 0.0011 -0.0199 -0.2586 121 LYS F CB 11159 C CG . LYS F 121 ? 1.1679 1.6064 1.3037 0.0034 -0.0196 -0.2630 121 LYS F CG 11160 C CD . LYS F 121 ? 1.2422 1.6718 1.3705 0.0084 -0.0233 -0.2582 121 LYS F CD 11161 C CE . LYS F 121 ? 1.2312 1.6443 1.3584 0.0070 -0.0231 -0.2518 121 LYS F CE 11162 N NZ . LYS F 121 ? 1.2699 1.6803 1.4022 0.0052 -0.0201 -0.2528 121 LYS F NZ 11163 N N . VAL F 122 ? 0.8069 1.2675 0.9621 -0.0074 -0.0109 -0.2773 122 VAL F N 11164 C CA . VAL F 122 ? 0.7694 1.2453 0.9310 -0.0094 -0.0085 -0.2857 122 VAL F CA 11165 C C . VAL F 122 ? 0.8046 1.2893 0.9673 -0.0104 -0.0084 -0.2885 122 VAL F C 11166 O O . VAL F 122 ? 0.7172 1.2141 0.8774 -0.0083 -0.0100 -0.2913 122 VAL F O 11167 C CB . VAL F 122 ? 0.7061 1.1814 0.8775 -0.0146 -0.0042 -0.2905 122 VAL F CB 11168 C CG1 . VAL F 122 ? 0.7340 1.2234 0.9128 -0.0177 -0.0017 -0.2993 122 VAL F CG1 11169 C CG2 . VAL F 122 ? 0.6383 1.1120 0.8086 -0.0137 -0.0042 -0.2895 122 VAL F CG2 11170 N N . ARG F 123 ? 0.8568 1.3362 1.0235 -0.0134 -0.0067 -0.2881 123 ARG F N 11171 C CA . ARG F 123 ? 0.8116 1.2994 0.9788 -0.0141 -0.0069 -0.2901 123 ARG F CA 11172 C C . ARG F 123 ? 0.7619 1.2560 0.9196 -0.0104 -0.0111 -0.2863 123 ARG F C 11173 O O . ARG F 123 ? 0.8287 1.3367 0.9872 -0.0105 -0.0112 -0.2907 123 ARG F O 11174 C CB . ARG F 123 ? 0.8478 1.3259 1.0171 -0.0162 -0.0060 -0.2871 123 ARG F CB 11175 C CG . ARG F 123 ? 0.8711 1.3578 1.0408 -0.0170 -0.0062 -0.2885 123 ARG F CG 11176 C CD . ARG F 123 ? 0.9212 1.3969 1.0911 -0.0183 -0.0059 -0.2840 123 ARG F CD 11177 N NE . ARG F 123 ? 1.0107 1.4877 1.1728 -0.0173 -0.0088 -0.2777 123 ARG F NE 11178 C CZ . ARG F 123 ? 1.1330 1.6021 1.2853 -0.0152 -0.0125 -0.2691 123 ARG F CZ 11179 N NH1 . ARG F 123 ? 1.2560 1.7161 1.4050 -0.0131 -0.0138 -0.2663 123 ARG F NH1 11180 N NH2 . ARG F 123 ? 1.1760 1.6465 1.3215 -0.0154 -0.0154 -0.2635 123 ARG F NH2 11181 N N . LEU F 124 ? 0.7246 1.2086 0.8733 -0.0072 -0.0148 -0.2785 124 LEU F N 11182 C CA . LEU F 124 ? 0.7795 1.2672 0.9182 -0.0037 -0.0197 -0.2741 124 LEU F CA 11183 C C . LEU F 124 ? 0.7242 1.2237 0.8607 -0.0005 -0.0214 -0.2782 124 LEU F C 11184 O O . LEU F 124 ? 0.6563 1.1644 0.7876 0.0011 -0.0244 -0.2775 124 LEU F O 11185 C CB . LEU F 124 ? 0.8630 1.3354 0.9922 -0.0010 -0.0240 -0.2647 124 LEU F CB 11186 C CG . LEU F 124 ? 1.0287 1.4912 1.1552 -0.0033 -0.0248 -0.2582 124 LEU F CG 11187 C CD1 . LEU F 124 ? 1.0909 1.5414 1.2056 -0.0001 -0.0307 -0.2491 124 LEU F CD1 11188 C CD2 . LEU F 124 ? 1.0895 1.5633 1.2179 -0.0064 -0.0238 -0.2600 124 LEU F CD2 11189 N N . GLN F 125 ? 0.6529 1.1534 0.7932 0.0003 -0.0196 -0.2821 125 GLN F N 11190 C CA . GLN F 125 ? 0.6970 1.2101 0.8364 0.0033 -0.0207 -0.2868 125 GLN F CA 11191 C C . GLN F 125 ? 0.6638 1.1938 0.8104 0.0003 -0.0176 -0.2951 125 GLN F C 11192 O O . GLN F 125 ? 0.6568 1.1984 0.7999 0.0025 -0.0198 -0.2968 125 GLN F O 11193 C CB . GLN F 125 ? 0.7107 1.2214 0.8530 0.0042 -0.0193 -0.2889 125 GLN F CB 11194 C CG . GLN F 125 ? 0.6998 1.1964 0.8344 0.0083 -0.0229 -0.2818 125 GLN F CG 11195 C CD . GLN F 125 ? 0.7641 1.2630 0.9007 0.0100 -0.0219 -0.2847 125 GLN F CD 11196 O OE1 . GLN F 125 ? 0.7629 1.2583 0.9062 0.0061 -0.0180 -0.2862 125 GLN F OE1 11197 N NE2 . GLN F 125 ? 0.7945 1.3011 0.9255 0.0156 -0.0255 -0.2860 125 GLN F NE2 11198 N N . LEU F 126 ? 0.6208 1.1511 0.7771 -0.0046 -0.0129 -0.2999 126 LEU F N 11199 C CA . LEU F 126 ? 0.6189 1.1636 0.7834 -0.0078 -0.0097 -0.3086 126 LEU F CA 11200 C C . LEU F 126 ? 0.6622 1.2154 0.8260 -0.0085 -0.0102 -0.3096 126 LEU F C 11201 O O . LEU F 126 ? 0.7847 1.3530 0.9507 -0.0086 -0.0097 -0.3156 126 LEU F O 11202 C CB . LEU F 126 ? 0.5848 1.1247 0.7595 -0.0129 -0.0052 -0.3130 126 LEU F CB 11203 C CG . LEU F 126 ? 0.5854 1.1193 0.7622 -0.0136 -0.0039 -0.3131 126 LEU F CG 11204 C CD1 . LEU F 126 ? 0.6029 1.1369 0.7903 -0.0194 0.0001 -0.3194 126 LEU F CD1 11205 C CD2 . LEU F 126 ? 0.5580 1.1024 0.7308 -0.0100 -0.0058 -0.3147 126 LEU F CD2 11206 N N . ARG F 127 ? 0.7499 1.2945 0.9110 -0.0092 -0.0111 -0.3041 127 ARG F N 11207 C CA . ARG F 127 ? 0.7759 1.3296 0.9368 -0.0104 -0.0114 -0.3050 127 ARG F CA 11208 C C . ARG F 127 ? 0.8254 1.3925 0.9963 -0.0135 -0.0076 -0.3153 127 ARG F C 11209 O O . ARG F 127 ? 0.8715 1.4339 1.0508 -0.0164 -0.0043 -0.3198 127 ARG F O 11210 C CB . ARG F 127 ? 0.7652 1.3262 0.9163 -0.0071 -0.0159 -0.3010 127 ARG F CB 11211 C CG . ARG F 127 ? 0.8168 1.3645 0.9577 -0.0034 -0.0205 -0.2920 127 ARG F CG 11212 C CD . ARG F 127 ? 0.9376 1.4907 1.0689 -0.0016 -0.0253 -0.2869 127 ARG F CD 11213 N NE . ARG F 127 ? 1.0779 1.6288 1.2006 0.0033 -0.0302 -0.2836 127 ARG F NE 11214 C CZ . ARG F 127 ? 1.1682 1.7260 1.2827 0.0056 -0.0348 -0.2809 127 ARG F CZ 11215 N NH1 . ARG F 127 ? 1.1438 1.7121 1.2575 0.0029 -0.0351 -0.2807 127 ARG F NH1 11216 N NH2 . ARG F 127 ? 1.1949 1.7494 1.3019 0.0109 -0.0396 -0.2784 127 ARG F NH2 11217 N N . ASP F 128 ? 0.8586 1.4419 1.0285 -0.0129 -0.0084 -0.3189 128 ASP F N 11218 C CA . ASP F 128 ? 0.8355 1.4327 1.0144 -0.0156 -0.0053 -0.3290 128 ASP F CA 11219 C C . ASP F 128 ? 0.7508 1.3559 0.9348 -0.0160 -0.0036 -0.3364 128 ASP F C 11220 O O . ASP F 128 ? 0.7168 1.3324 0.9088 -0.0185 -0.0010 -0.3453 128 ASP F O 11221 C CB . ASP F 128 ? 0.8221 1.4346 0.9982 -0.0153 -0.0067 -0.3299 128 ASP F CB 11222 C CG . ASP F 128 ? 0.8654 1.4847 1.0317 -0.0120 -0.0107 -0.3253 128 ASP F CG 11223 O OD1 . ASP F 128 ? 0.7891 1.4036 0.9518 -0.0094 -0.0123 -0.3232 128 ASP F OD1 11224 O OD2 . ASP F 128 ? 0.8282 1.4583 0.9905 -0.0121 -0.0125 -0.3239 128 ASP F OD2 11225 N N . ASN F 129 ? 0.5874 1.1881 0.7671 -0.0136 -0.0051 -0.3332 129 ASN F N 11226 C CA . ASN F 129 ? 0.5630 1.1702 0.7479 -0.0146 -0.0032 -0.3397 129 ASN F CA 11227 C C . ASN F 129 ? 0.5677 1.1670 0.7619 -0.0192 0.0004 -0.3440 129 ASN F C 11228 O O . ASN F 129 ? 0.6450 1.2499 0.8445 -0.0214 0.0022 -0.3498 129 ASN F O 11229 C CB . ASN F 129 ? 0.5839 1.1887 0.7621 -0.0107 -0.0057 -0.3355 129 ASN F CB 11230 C CG . ASN F 129 ? 0.6208 1.2357 0.7906 -0.0061 -0.0096 -0.3333 129 ASN F CG 11231 O OD1 . ASN F 129 ? 0.7193 1.3432 0.8877 -0.0061 -0.0105 -0.3342 129 ASN F OD1 11232 N ND2 . ASN F 129 ? 0.6799 1.2944 0.8440 -0.0019 -0.0122 -0.3309 129 ASN F ND2 11233 N N . ALA F 130 ? 0.6371 1.2230 0.8329 -0.0207 0.0011 -0.3407 130 ALA F N 11234 C CA . ALA F 130 ? 0.7019 1.2795 0.9065 -0.0251 0.0040 -0.3447 130 ALA F CA 11235 C C . ALA F 130 ? 0.7246 1.2954 0.9323 -0.0264 0.0046 -0.3445 130 ALA F C 11236 O O . ALA F 130 ? 0.7001 1.2712 0.9025 -0.0240 0.0030 -0.3399 130 ALA F O 11237 C CB . ALA F 130 ? 0.7355 1.2999 0.9390 -0.0257 0.0042 -0.3399 130 ALA F CB 11238 N N . LYS F 131 ? 0.8062 1.3712 1.0225 -0.0302 0.0069 -0.3497 131 LYS F N 11239 C CA . LYS F 131 ? 0.9280 1.4886 1.1496 -0.0315 0.0076 -0.3527 131 LYS F CA 11240 C C . LYS F 131 ? 0.9190 1.4598 1.1418 -0.0329 0.0080 -0.3476 131 LYS F C 11241 O O . LYS F 131 ? 0.8242 1.3574 1.0511 -0.0360 0.0091 -0.3489 131 LYS F O 11242 C CB . LYS F 131 ? 0.9910 1.5605 1.2216 -0.0346 0.0092 -0.3638 131 LYS F CB 11243 C CG . LYS F 131 ? 1.1169 1.6862 1.3541 -0.0353 0.0097 -0.3700 131 LYS F CG 11244 C CD . LYS F 131 ? 1.2697 1.8451 1.5156 -0.0388 0.0108 -0.3808 131 LYS F CD 11245 C CE . LYS F 131 ? 1.3426 1.9293 1.5936 -0.0380 0.0107 -0.3897 131 LYS F CE 11246 N NZ . LYS F 131 ? 1.3880 1.9626 1.6460 -0.0392 0.0106 -0.3938 131 LYS F NZ 11247 N N . GLU F 132 ? 0.7412 1.2746 0.9603 -0.0309 0.0071 -0.3417 132 GLU F N 11248 C CA . GLU F 132 ? 0.7858 1.3013 1.0061 -0.0319 0.0073 -0.3371 132 GLU F CA 11249 C C . GLU F 132 ? 0.7790 1.2902 1.0091 -0.0349 0.0087 -0.3447 132 GLU F C 11250 O O . GLU F 132 ? 0.8399 1.3550 1.0731 -0.0340 0.0086 -0.3487 132 GLU F O 11251 C CB . GLU F 132 ? 0.8292 1.3399 1.0436 -0.0292 0.0059 -0.3297 132 GLU F CB 11252 C CG . GLU F 132 ? 0.7976 1.3067 1.0016 -0.0265 0.0038 -0.3206 132 GLU F CG 11253 C CD . GLU F 132 ? 0.8221 1.3226 1.0208 -0.0250 0.0023 -0.3128 132 GLU F CD 11254 O OE1 . GLU F 132 ? 0.9255 1.4109 1.1253 -0.0258 0.0028 -0.3089 132 GLU F OE1 11255 O OE2 . GLU F 132 ? 0.8269 1.3357 1.0204 -0.0234 0.0007 -0.3104 132 GLU F OE2 11256 N N . LEU F 133 ? 0.7466 1.2498 0.9812 -0.0385 0.0095 -0.3466 133 LEU F N 11257 C CA . LEU F 133 ? 0.8074 1.3036 1.0508 -0.0416 0.0100 -0.3533 133 LEU F CA 11258 C C . LEU F 133 ? 0.9202 1.4020 1.1648 -0.0406 0.0095 -0.3500 133 LEU F C 11259 O O . LEU F 133 ? 0.8974 1.3755 1.1488 -0.0416 0.0092 -0.3564 133 LEU F O 11260 C CB . LEU F 133 ? 0.8379 1.3281 1.0849 -0.0465 0.0107 -0.3547 133 LEU F CB 11261 C CG . LEU F 133 ? 0.8853 1.3898 1.1352 -0.0490 0.0114 -0.3621 133 LEU F CG 11262 C CD1 . LEU F 133 ? 0.8990 1.3976 1.1505 -0.0541 0.0120 -0.3609 133 LEU F CD1 11263 C CD2 . LEU F 133 ? 0.8350 1.3459 1.0923 -0.0501 0.0112 -0.3726 133 LEU F CD2 11264 N N . GLY F 134 ? 0.9600 1.4337 1.1980 -0.0386 0.0090 -0.3405 134 GLY F N 11265 C CA . GLY F 134 ? 0.9468 1.4078 1.1850 -0.0374 0.0085 -0.3365 134 GLY F CA 11266 C C . GLY F 134 ? 0.9415 1.3843 1.1829 -0.0403 0.0086 -0.3339 134 GLY F C 11267 O O . GLY F 134 ? 0.8530 1.2849 1.0966 -0.0397 0.0080 -0.3327 134 GLY F O 11268 N N . ASN F 135 ? 0.8831 1.3234 1.1247 -0.0437 0.0092 -0.3330 135 ASN F N 11269 C CA . ASN F 135 ? 0.8054 1.2296 1.0494 -0.0473 0.0092 -0.3298 135 ASN F CA 11270 C C . ASN F 135 ? 0.7595 1.1821 0.9973 -0.0478 0.0097 -0.3222 135 ASN F C 11271 O O . ASN F 135 ? 0.6859 1.1001 0.9251 -0.0518 0.0100 -0.3200 135 ASN F O 11272 C CB . ASN F 135 ? 0.8520 1.2745 1.1039 -0.0522 0.0091 -0.3377 135 ASN F CB 11273 C CG . ASN F 135 ? 0.8879 1.3242 1.1401 -0.0547 0.0100 -0.3420 135 ASN F CG 11274 O OD1 . ASN F 135 ? 0.9117 1.3602 1.1585 -0.0520 0.0106 -0.3400 135 ASN F OD1 11275 N ND2 . ASN F 135 ? 0.9410 1.3750 1.1994 -0.0599 0.0099 -0.3478 135 ASN F ND2 11276 N N . GLY F 136 ? 0.6706 1.1013 0.9012 -0.0438 0.0093 -0.3180 136 GLY F N 11277 C CA . GLY F 136 ? 0.7292 1.1595 0.9532 -0.0429 0.0092 -0.3114 136 GLY F CA 11278 C C . GLY F 136 ? 0.7970 1.2416 1.0202 -0.0433 0.0096 -0.3152 136 GLY F C 11279 O O . GLY F 136 ? 0.8905 1.3380 1.1078 -0.0415 0.0091 -0.3108 136 GLY F O 11280 N N . CYS F 137 ? 0.9121 1.3662 1.1411 -0.0455 0.0103 -0.3237 137 CYS F N 11281 C CA . CYS F 137 ? 0.9480 1.4169 1.1771 -0.0465 0.0108 -0.3282 137 CYS F CA 11282 C C . CYS F 137 ? 0.9038 1.3880 1.1300 -0.0425 0.0101 -0.3314 137 CYS F C 11283 O O . CYS F 137 ? 0.9067 1.3925 1.1339 -0.0407 0.0097 -0.3335 137 CYS F O 11284 C CB . CYS F 137 ? 0.9835 1.4533 1.2208 -0.0524 0.0118 -0.3355 137 CYS F CB 11285 S SG . CYS F 137 ? 0.9950 1.4480 1.2348 -0.0580 0.0122 -0.3309 137 CYS F SG 11286 N N . PHE F 138 ? 0.9103 1.4062 1.1328 -0.0412 0.0099 -0.3317 138 PHE F N 11287 C CA . PHE F 138 ? 0.9566 1.4684 1.1762 -0.0379 0.0091 -0.3349 138 PHE F CA 11288 C C . PHE F 138 ? 1.0329 1.5580 1.2579 -0.0411 0.0103 -0.3435 138 PHE F C 11289 O O . PHE F 138 ? 1.0290 1.5560 1.2548 -0.0436 0.0110 -0.3439 138 PHE F O 11290 C CB . PHE F 138 ? 0.8367 1.3517 1.0470 -0.0331 0.0072 -0.3286 138 PHE F CB 11291 C CG . PHE F 138 ? 0.8654 1.3693 1.0693 -0.0298 0.0055 -0.3204 138 PHE F CG 11292 C CD1 . PHE F 138 ? 0.8651 1.3735 1.0653 -0.0270 0.0040 -0.3192 138 PHE F CD1 11293 C CD2 . PHE F 138 ? 0.8153 1.3049 1.0170 -0.0299 0.0052 -0.3138 138 PHE F CD2 11294 C CE1 . PHE F 138 ? 0.8807 1.3793 1.0748 -0.0245 0.0022 -0.3113 138 PHE F CE1 11295 C CE2 . PHE F 138 ? 0.7862 1.2655 0.9819 -0.0270 0.0035 -0.3063 138 PHE F CE2 11296 C CZ . PHE F 138 ? 0.8904 1.3740 1.0823 -0.0245 0.0019 -0.3049 138 PHE F CZ 11297 N N . GLU F 139 ? 1.1576 1.6927 1.3865 -0.0413 0.0106 -0.3505 139 GLU F N 11298 C CA . GLU F 139 ? 1.1127 1.6621 1.3463 -0.0439 0.0115 -0.3591 139 GLU F CA 11299 C C . GLU F 139 ? 0.9528 1.5190 1.1810 -0.0397 0.0105 -0.3597 139 GLU F C 11300 O O . GLU F 139 ? 0.8533 1.4260 1.0794 -0.0367 0.0096 -0.3604 139 GLU F O 11301 C CB . GLU F 139 ? 1.0901 1.6404 1.3320 -0.0470 0.0122 -0.3676 139 GLU F CB 11302 C CG . GLU F 139 ? 1.0724 1.6326 1.3203 -0.0516 0.0132 -0.3760 139 GLU F CG 11303 C CD . GLU F 139 ? 0.9761 1.5385 1.2318 -0.0540 0.0133 -0.3853 139 GLU F CD 11304 O OE1 . GLU F 139 ? 0.9996 1.5648 1.2553 -0.0506 0.0127 -0.3870 139 GLU F OE1 11305 O OE2 . GLU F 139 ? 0.8920 1.4538 1.1537 -0.0595 0.0137 -0.3910 139 GLU F OE2 11306 N N . PHE F 140 ? 0.9551 1.5288 1.1808 -0.0395 0.0104 -0.3595 140 PHE F N 11307 C CA . PHE F 140 ? 0.9961 1.5853 1.2164 -0.0353 0.0091 -0.3601 140 PHE F CA 11308 C C . PHE F 140 ? 1.0388 1.6440 1.2635 -0.0362 0.0097 -0.3690 140 PHE F C 11309 O O . PHE F 140 ? 0.9729 1.5811 1.2054 -0.0410 0.0114 -0.3764 140 PHE F O 11310 C CB . PHE F 140 ? 0.9567 1.5517 1.1746 -0.0350 0.0089 -0.3593 140 PHE F CB 11311 C CG . PHE F 140 ? 0.9775 1.5615 1.1885 -0.0317 0.0074 -0.3505 140 PHE F CG 11312 C CD1 . PHE F 140 ? 0.9659 1.5377 1.1793 -0.0353 0.0086 -0.3476 140 PHE F CD1 11313 C CD2 . PHE F 140 ? 0.9375 1.5235 1.1394 -0.0252 0.0045 -0.3452 140 PHE F CD2 11314 C CE1 . PHE F 140 ? 0.9036 1.4663 1.1108 -0.0321 0.0072 -0.3400 140 PHE F CE1 11315 C CE2 . PHE F 140 ? 0.8608 1.4365 1.0563 -0.0219 0.0027 -0.3376 140 PHE F CE2 11316 C CZ . PHE F 140 ? 0.8622 1.4268 1.0605 -0.0252 0.0042 -0.3352 140 PHE F CZ 11317 N N . TYR F 141 ? 1.0681 1.6836 1.2873 -0.0317 0.0080 -0.3680 141 TYR F N 11318 C CA . TYR F 141 ? 0.9963 1.6295 1.2182 -0.0318 0.0083 -0.3758 141 TYR F CA 11319 C C . TYR F 141 ? 0.9958 1.6436 1.2158 -0.0307 0.0079 -0.3785 141 TYR F C 11320 O O . TYR F 141 ? 1.0283 1.6922 1.2478 -0.0292 0.0074 -0.3830 141 TYR F O 11321 C CB . TYR F 141 ? 0.9802 1.6181 1.1968 -0.0279 0.0065 -0.3729 141 TYR F CB 11322 C CG . TYR F 141 ? 0.8970 1.5265 1.1165 -0.0290 0.0070 -0.3726 141 TYR F CG 11323 C CD1 . TYR F 141 ? 0.9370 1.5638 1.1659 -0.0330 0.0090 -0.3800 141 TYR F CD1 11324 C CD2 . TYR F 141 ? 0.8073 1.4324 1.0201 -0.0259 0.0051 -0.3653 141 TYR F CD2 11325 C CE1 . TYR F 141 ? 0.8844 1.5049 1.1161 -0.0332 0.0092 -0.3805 141 TYR F CE1 11326 C CE2 . TYR F 141 ? 0.8489 1.4685 1.0646 -0.0267 0.0056 -0.3653 141 TYR F CE2 11327 C CZ . TYR F 141 ? 0.8938 1.5115 1.1190 -0.0300 0.0077 -0.3733 141 TYR F CZ 11328 O OH . TYR F 141 ? 0.9423 1.5551 1.1704 -0.0302 0.0080 -0.3740 141 TYR F OH 11329 N N . HIS F 142 ? 0.9751 1.6181 1.1940 -0.0313 0.0081 -0.3758 142 HIS F N 11330 C CA . HIS F 142 ? 0.9870 1.6438 1.2036 -0.0297 0.0075 -0.3778 142 HIS F CA 11331 C C . HIS F 142 ? 0.8928 1.5455 1.1122 -0.0334 0.0089 -0.3777 142 HIS F C 11332 O O . HIS F 142 ? 0.7552 1.3940 0.9786 -0.0376 0.0103 -0.3761 142 HIS F O 11333 C CB . HIS F 142 ? 1.0410 1.7009 1.2471 -0.0223 0.0040 -0.3715 142 HIS F CB 11334 C CG . HIS F 142 ? 1.0529 1.6982 1.2526 -0.0191 0.0022 -0.3627 142 HIS F CG 11335 N ND1 . HIS F 142 ? 1.1035 1.7350 1.2979 -0.0166 0.0004 -0.3552 142 HIS F ND1 11336 C CD2 . HIS F 142 ? 1.1299 1.7733 1.3276 -0.0180 0.0018 -0.3605 142 HIS F CD2 11337 C CE1 . HIS F 142 ? 1.0042 1.6249 1.1936 -0.0141 -0.0010 -0.3487 142 HIS F CE1 11338 N NE2 . HIS F 142 ? 1.0694 1.6974 1.2608 -0.0147 -0.0002 -0.3519 142 HIS F NE2 11339 N N . LYS F 143 ? 0.9580 1.6236 1.1752 -0.0316 0.0083 -0.3794 143 LYS F N 11340 C CA . LYS F 143 ? 1.0517 1.7183 1.2714 -0.0352 0.0097 -0.3800 143 LYS F CA 11341 C C . LYS F 143 ? 1.0033 1.6618 1.2155 -0.0302 0.0077 -0.3720 143 LYS F C 11342 O O . LYS F 143 ? 0.9143 1.5795 1.1193 -0.0232 0.0049 -0.3698 143 LYS F O 11343 C CB . LYS F 143 ? 1.0390 1.7267 1.2609 -0.0364 0.0103 -0.3872 143 LYS F CB 11344 C CG . LYS F 143 ? 1.1249 1.8160 1.3559 -0.0454 0.0131 -0.3936 143 LYS F CG 11345 C CD . LYS F 143 ? 1.2862 1.9985 1.5192 -0.0470 0.0137 -0.4002 143 LYS F CD 11346 C CE . LYS F 143 ? 1.3151 2.0428 1.5498 -0.0457 0.0135 -0.4073 143 LYS F CE 11347 N NZ . LYS F 143 ? 1.3477 2.0885 1.5749 -0.0373 0.0111 -0.4061 143 LYS F NZ 11348 N N . CYS F 144 ? 1.0242 1.6682 1.2382 -0.0337 0.0088 -0.3680 144 CYS F N 11349 C CA . CYS F 144 ? 0.9916 1.6254 1.1990 -0.0294 0.0071 -0.3602 144 CYS F CA 11350 C C . CYS F 144 ? 0.9566 1.5933 1.1667 -0.0334 0.0086 -0.3606 144 CYS F C 11351 O O . CYS F 144 ? 0.8963 1.5228 1.1113 -0.0399 0.0107 -0.3595 144 CYS F O 11352 C CB . CYS F 144 ? 0.9507 1.5643 1.1569 -0.0293 0.0068 -0.3539 144 CYS F CB 11353 S SG . CYS F 144 ? 1.0329 1.6321 1.2297 -0.0227 0.0038 -0.3437 144 CYS F SG 11354 N N . ASP F 145 ? 0.9845 1.6360 1.1912 -0.0296 0.0074 -0.3624 145 ASP F N 11355 C CA . ASP F 145 ? 0.9911 1.6501 1.2001 -0.0333 0.0089 -0.3636 145 ASP F CA 11356 C C . ASP F 145 ? 0.9419 1.5867 1.1468 -0.0313 0.0080 -0.3560 145 ASP F C 11357 O O . ASP F 145 ? 0.9366 1.5655 1.1373 -0.0277 0.0064 -0.3502 145 ASP F O 11358 C CB . ASP F 145 ? 0.9512 1.6327 1.1582 -0.0295 0.0078 -0.3687 145 ASP F CB 11359 C CG . ASP F 145 ? 0.9300 1.6130 1.1274 -0.0184 0.0037 -0.3651 145 ASP F CG 11360 O OD1 . ASP F 145 ? 0.9933 1.6919 1.1883 -0.0146 0.0024 -0.3679 145 ASP F OD1 11361 O OD2 . ASP F 145 ? 0.8460 1.5151 1.0382 -0.0136 0.0014 -0.3598 145 ASP F OD2 11362 N N . ASN F 146 ? 0.8885 1.5399 1.0946 -0.0342 0.0090 -0.3561 146 ASN F N 11363 C CA . ASN F 146 ? 0.8118 1.4518 1.0145 -0.0329 0.0085 -0.3495 146 ASN F CA 11364 C C . ASN F 146 ? 0.8214 1.4579 1.0146 -0.0219 0.0045 -0.3450 146 ASN F C 11365 O O . ASN F 146 ? 0.9421 1.5638 1.1318 -0.0199 0.0035 -0.3386 146 ASN F O 11366 C CB . ASN F 146 ? 0.7333 1.3846 0.9392 -0.0386 0.0104 -0.3512 146 ASN F CB 11367 C CG . ASN F 146 ? 0.7128 1.3588 0.9272 -0.0508 0.0138 -0.3522 146 ASN F CG 11368 O OD1 . ASN F 146 ? 0.8639 1.5197 1.0812 -0.0569 0.0154 -0.3536 146 ASN F OD1 11369 N ND2 . ASN F 146 ? 0.6061 1.2367 0.8238 -0.0543 0.0145 -0.3515 146 ASN F ND2 11370 N N . LYS F 147 ? 0.7982 1.4470 0.9871 -0.0149 0.0019 -0.3481 147 LYS F N 11371 C CA . LYS F 147 ? 0.8354 1.4793 1.0147 -0.0043 -0.0027 -0.3439 147 LYS F CA 11372 C C . LYS F 147 ? 0.7540 1.3824 0.9301 -0.0019 -0.0045 -0.3396 147 LYS F C 11373 O O . LYS F 147 ? 0.7390 1.3553 0.9077 0.0042 -0.0080 -0.3338 147 LYS F O 11374 C CB . LYS F 147 ? 0.8979 1.5611 1.0732 0.0028 -0.0055 -0.3488 147 LYS F CB 11375 C CG . LYS F 147 ? 1.0670 1.7514 1.2470 -0.0005 -0.0033 -0.3552 147 LYS F CG 11376 C CD . LYS F 147 ? 1.1574 1.8617 1.3343 0.0063 -0.0060 -0.3608 147 LYS F CD 11377 C CE . LYS F 147 ? 1.2234 1.9472 1.4081 -0.0010 -0.0023 -0.3685 147 LYS F CE 11378 N NZ . LYS F 147 ? 1.3530 2.0997 1.5353 0.0050 -0.0044 -0.3743 147 LYS F NZ 11379 N N . CYS F 148 ? 0.7922 1.4220 0.9735 -0.0069 -0.0023 -0.3429 148 CYS F N 11380 C CA . CYS F 148 ? 0.7594 1.3765 0.9386 -0.0059 -0.0034 -0.3394 148 CYS F CA 11381 C C . CYS F 148 ? 0.7337 1.3309 0.9141 -0.0093 -0.0021 -0.3333 148 CYS F C 11382 O O . CYS F 148 ? 0.6537 1.2377 0.8279 -0.0050 -0.0048 -0.3270 148 CYS F O 11383 C CB . CYS F 148 ? 0.7630 1.3884 0.9484 -0.0107 -0.0011 -0.3454 148 CYS F CB 11384 S SG . CYS F 148 ? 0.6996 1.3111 0.8852 -0.0118 -0.0011 -0.3422 148 CYS F SG 11385 N N . MET F 149 ? 0.7337 1.3290 0.9217 -0.0172 0.0016 -0.3353 149 MET F N 11386 C CA . MET F 149 ? 0.8113 1.3893 1.0010 -0.0210 0.0029 -0.3300 149 MET F CA 11387 C C . MET F 149 ? 0.8545 1.4238 1.0367 -0.0151 0.0002 -0.3233 149 MET F C 11388 O O . MET F 149 ? 0.8330 1.3865 1.0114 -0.0128 -0.0012 -0.3171 149 MET F O 11389 C CB . MET F 149 ? 0.8626 1.4436 1.0607 -0.0300 0.0066 -0.3333 149 MET F CB 11390 C CG . MET F 149 ? 0.8602 1.4389 1.0665 -0.0374 0.0092 -0.3377 149 MET F CG 11391 S SD . MET F 149 ? 0.9405 1.5088 1.1464 -0.0352 0.0084 -0.3368 149 MET F SD 11392 C CE . MET F 149 ? 0.9526 1.5196 1.1691 -0.0444 0.0114 -0.3433 149 MET F CE 11393 N N . GLU F 150 ? 0.8904 1.4706 1.0705 -0.0125 -0.0005 -0.3246 150 GLU F N 11394 C CA . GLU F 150 ? 0.8820 1.4556 1.0546 -0.0058 -0.0036 -0.3193 150 GLU F CA 11395 C C . GLU F 150 ? 0.7911 1.3554 0.9550 0.0021 -0.0082 -0.3149 150 GLU F C 11396 O O . GLU F 150 ? 0.8653 1.4156 1.0239 0.0055 -0.0105 -0.3087 150 GLU F O 11397 C CB . GLU F 150 ? 0.9387 1.5295 1.1097 -0.0025 -0.0045 -0.3230 150 GLU F CB 11398 C CG . GLU F 150 ? 1.0636 1.6504 1.2260 0.0063 -0.0088 -0.3190 150 GLU F CG 11399 C CD . GLU F 150 ? 1.1489 1.7184 1.3097 0.0054 -0.0087 -0.3122 150 GLU F CD 11400 O OE1 . GLU F 150 ? 1.2584 1.8246 1.4121 0.0129 -0.0125 -0.3094 150 GLU F OE1 11401 O OE2 . GLU F 150 ? 1.1083 1.6668 1.2743 -0.0019 -0.0054 -0.3096 150 GLU F OE2 11402 N N . SER F 151 ? 0.6873 1.2597 0.8496 0.0048 -0.0098 -0.3179 151 SER F N 11403 C CA . SER F 151 ? 0.6598 1.2247 0.8133 0.0118 -0.0146 -0.3136 151 SER F CA 11404 C C . SER F 151 ? 0.7015 1.2486 0.8544 0.0094 -0.0144 -0.3076 151 SER F C 11405 O O . SER F 151 ? 0.7123 1.2471 0.8575 0.0141 -0.0183 -0.3014 151 SER F O 11406 C CB . SER F 151 ? 0.6445 1.2237 0.7964 0.0149 -0.0165 -0.3181 151 SER F CB 11407 O OG . SER F 151 ? 0.5378 1.1203 0.6957 0.0091 -0.0134 -0.3213 151 SER F OG 11408 N N . VAL F 152 ? 0.7008 1.2461 0.8614 0.0021 -0.0103 -0.3096 152 VAL F N 11409 C CA . VAL F 152 ? 0.8182 1.3475 0.9787 0.0000 -0.0100 -0.3043 152 VAL F CA 11410 C C . VAL F 152 ? 0.8085 1.3227 0.9671 0.0000 -0.0102 -0.2983 152 VAL F C 11411 O O . VAL F 152 ? 0.7078 1.2083 0.8617 0.0018 -0.0122 -0.2920 152 VAL F O 11412 C CB . VAL F 152 ? 0.8921 1.4213 1.0616 -0.0073 -0.0058 -0.3080 152 VAL F CB 11413 C CG1 . VAL F 152 ? 0.9673 1.5047 1.1364 -0.0066 -0.0066 -0.3109 152 VAL F CG1 11414 C CG2 . VAL F 152 ? 0.8897 1.4274 1.0678 -0.0133 -0.0019 -0.3141 152 VAL F CG2 11415 N N . ARG F 153 ? 0.8385 1.3562 1.0010 -0.0024 -0.0079 -0.3002 153 ARG F N 11416 C CA . ARG F 153 ? 0.7976 1.3033 0.9591 -0.0030 -0.0077 -0.2951 153 ARG F CA 11417 C C . ARG F 153 ? 0.7565 1.2553 0.9080 0.0050 -0.0126 -0.2898 153 ARG F C 11418 O O . ARG F 153 ? 0.7741 1.2576 0.9228 0.0054 -0.0135 -0.2837 153 ARG F O 11419 C CB . ARG F 153 ? 0.8099 1.3240 0.9773 -0.0076 -0.0045 -0.2986 153 ARG F CB 11420 C CG . ARG F 153 ? 0.8264 1.3398 1.0034 -0.0167 -0.0001 -0.3017 153 ARG F CG 11421 C CD . ARG F 153 ? 0.9180 1.4358 1.0996 -0.0221 0.0024 -0.3029 153 ARG F CD 11422 N NE . ARG F 153 ? 1.1185 1.6497 1.3075 -0.0284 0.0052 -0.3099 153 ARG F NE 11423 C CZ . ARG F 153 ? 1.2420 1.7914 1.4317 -0.0282 0.0055 -0.3148 153 ARG F CZ 11424 N NH1 . ARG F 153 ? 1.3569 1.9140 1.5404 -0.0216 0.0030 -0.3140 153 ARG F NH1 11425 N NH2 . ARG F 153 ? 1.2850 1.8453 1.4815 -0.0347 0.0079 -0.3209 153 ARG F NH2 11426 N N . ASN F 154 ? 0.7745 1.2838 0.9206 0.0115 -0.0161 -0.2921 154 ASN F N 11427 C CA . ASN F 154 ? 0.8285 1.3303 0.9645 0.0198 -0.0217 -0.2875 154 ASN F CA 11428 C C . ASN F 154 ? 0.7606 1.2563 0.8890 0.0243 -0.0264 -0.2841 154 ASN F C 11429 O O . ASN F 154 ? 0.8415 1.3341 0.9611 0.0317 -0.0320 -0.2817 154 ASN F O 11430 C CB . ASN F 154 ? 0.9035 1.4182 1.0370 0.0254 -0.0237 -0.2913 154 ASN F CB 11431 C CG . ASN F 154 ? 0.9365 1.4705 1.0715 0.0269 -0.0238 -0.2984 154 ASN F CG 11432 O OD1 . ASN F 154 ? 0.9429 1.4798 1.0789 0.0254 -0.0236 -0.2998 154 ASN F OD1 11433 N ND2 . ASN F 154 ? 0.9722 1.5206 1.1076 0.0299 -0.0241 -0.3030 154 ASN F ND2 11434 N N . GLY F 155 ? 0.7236 1.2180 0.8554 0.0197 -0.0243 -0.2841 155 GLY F N 11435 C CA . GLY F 155 ? 0.7385 1.2269 0.8635 0.0223 -0.0283 -0.2800 155 GLY F CA 11436 C C . GLY F 155 ? 0.8326 1.3323 0.9522 0.0276 -0.0324 -0.2826 155 GLY F C 11437 O O . GLY F 155 ? 0.7773 1.2708 0.8895 0.0303 -0.0369 -0.2781 155 GLY F O 11438 N N . THR F 156 ? 0.8770 1.3935 1.0003 0.0285 -0.0310 -0.2898 156 THR F N 11439 C CA . THR F 156 ? 0.9353 1.4638 1.0537 0.0340 -0.0350 -0.2928 156 THR F CA 11440 C C . THR F 156 ? 0.9565 1.5000 1.0808 0.0299 -0.0318 -0.2987 156 THR F C 11441 O O . THR F 156 ? 0.8095 1.3639 0.9301 0.0341 -0.0349 -0.3013 156 THR F O 11442 C CB . THR F 156 ? 0.9732 1.5120 1.0896 0.0401 -0.0370 -0.2970 156 THR F CB 11443 O OG1 . THR F 156 ? 1.0116 1.5618 1.1376 0.0349 -0.0311 -0.3028 156 THR F OG1 11444 C CG2 . THR F 156 ? 0.9537 1.4790 1.0621 0.0464 -0.0419 -0.2917 156 THR F CG2 11445 N N . TYR F 157 ? 0.9674 1.5116 1.1008 0.0221 -0.0261 -0.3009 157 TYR F N 11446 C CA . TYR F 157 ? 0.9500 1.5074 1.0896 0.0179 -0.0230 -0.3068 157 TYR F CA 11447 C C . TYR F 157 ? 0.9298 1.4905 1.0626 0.0215 -0.0273 -0.3049 157 TYR F C 11448 O O . TYR F 157 ? 0.7604 1.3090 0.8869 0.0227 -0.0304 -0.2982 157 TYR F O 11449 C CB . TYR F 157 ? 0.8811 1.4324 1.0286 0.0103 -0.0182 -0.3070 157 TYR F CB 11450 C CG . TYR F 157 ? 0.8700 1.4324 1.0231 0.0063 -0.0157 -0.3124 157 TYR F CG 11451 C CD1 . TYR F 157 ? 0.9276 1.5028 1.0896 0.0018 -0.0116 -0.3204 157 TYR F CD1 11452 C CD2 . TYR F 157 ? 0.8467 1.4073 0.9962 0.0067 -0.0176 -0.3095 157 TYR F CD2 11453 C CE1 . TYR F 157 ? 0.8597 1.4449 1.0270 -0.0015 -0.0095 -0.3258 157 TYR F CE1 11454 C CE2 . TYR F 157 ? 0.8019 1.3737 0.9566 0.0033 -0.0153 -0.3148 157 TYR F CE2 11455 C CZ . TYR F 157 ? 0.8289 1.4128 0.9926 -0.0005 -0.0113 -0.3232 157 TYR F CZ 11456 O OH . TYR F 157 ? 0.8130 1.4082 0.9821 -0.0037 -0.0092 -0.3291 157 TYR F OH 11457 N N . ASP F 158 ? 1.1036 1.6811 1.2374 0.0229 -0.0276 -0.3108 158 ASP F N 11458 C CA . ASP F 158 ? 1.1508 1.7319 1.2772 0.0266 -0.0322 -0.3087 158 ASP F CA 11459 C C . ASP F 158 ? 1.0926 1.6848 1.2249 0.0213 -0.0288 -0.3131 158 ASP F C 11460 O O . ASP F 158 ? 0.9734 1.5801 1.1135 0.0184 -0.0250 -0.3209 158 ASP F O 11461 C CB . ASP F 158 ? 1.2037 1.7912 1.3224 0.0349 -0.0377 -0.3094 158 ASP F CB 11462 C CG . ASP F 158 ? 1.1714 1.7792 1.2927 0.0357 -0.0372 -0.3166 158 ASP F CG 11463 O OD1 . ASP F 158 ? 1.2197 1.8393 1.3473 0.0348 -0.0339 -0.3233 158 ASP F OD1 11464 O OD2 . ASP F 158 ? 1.1146 1.7268 1.2310 0.0374 -0.0404 -0.3154 158 ASP F OD2 11465 N N . TYR F 159 ? 1.0782 1.6627 1.2073 0.0196 -0.0301 -0.3078 159 TYR F N 11466 C CA . TYR F 159 ? 1.0461 1.6384 1.1806 0.0144 -0.0270 -0.3108 159 TYR F CA 11467 C C . TYR F 159 ? 1.0157 1.6266 1.1498 0.0157 -0.0280 -0.3159 159 TYR F C 11468 O O . TYR F 159 ? 1.0204 1.6434 1.1628 0.0116 -0.0238 -0.3232 159 TYR F O 11469 C CB . TYR F 159 ? 1.0425 1.6227 1.1722 0.0129 -0.0289 -0.3031 159 TYR F CB 11470 C CG . TYR F 159 ? 1.0634 1.6523 1.1970 0.0084 -0.0266 -0.3054 159 TYR F CG 11471 C CD1 . TYR F 159 ? 1.0789 1.6693 1.2229 0.0031 -0.0210 -0.3106 159 TYR F CD1 11472 C CD2 . TYR F 159 ? 1.0894 1.6848 1.2161 0.0096 -0.0304 -0.3023 159 TYR F CD2 11473 C CE1 . TYR F 159 ? 1.0359 1.6351 1.1838 -0.0003 -0.0191 -0.3135 159 TYR F CE1 11474 C CE2 . TYR F 159 ? 1.0686 1.6736 1.1990 0.0055 -0.0283 -0.3046 159 TYR F CE2 11475 C CZ . TYR F 159 ? 1.0190 1.6261 1.1601 0.0008 -0.0226 -0.3106 159 TYR F CZ 11476 O OH . TYR F 159 ? 0.9079 1.5251 1.0531 -0.0026 -0.0206 -0.3138 159 TYR F OH 11477 N N . PRO F 160 ? 0.8647 1.4775 0.9889 0.0215 -0.0340 -0.3123 160 PRO F N 11478 C CA . PRO F 160 ? 0.8843 1.5153 1.0079 0.0232 -0.0352 -0.3173 160 PRO F CA 11479 C C . PRO F 160 ? 0.8296 1.4766 0.9622 0.0220 -0.0308 -0.3274 160 PRO F C 11480 O O . PRO F 160 ? 0.7409 1.4018 0.8797 0.0184 -0.0277 -0.3336 160 PRO F O 11481 C CB . PRO F 160 ? 0.9109 1.5381 1.0225 0.0308 -0.0428 -0.3119 160 PRO F CB 11482 C CG . PRO F 160 ? 0.8841 1.4903 0.9893 0.0324 -0.0458 -0.3034 160 PRO F CG 11483 C CD . PRO F 160 ? 0.8195 1.4170 0.9324 0.0263 -0.0403 -0.3032 160 PRO F CD 11484 N N . GLN F 161 ? 0.7875 1.4328 0.9207 0.0247 -0.0308 -0.3290 161 GLN F N 11485 C CA . GLN F 161 ? 0.8730 1.5330 1.0146 0.0229 -0.0267 -0.3379 161 GLN F CA 11486 C C . GLN F 161 ? 0.8292 1.4976 0.9818 0.0152 -0.0207 -0.3447 161 GLN F C 11487 O O . GLN F 161 ? 0.7765 1.4618 0.9342 0.0139 -0.0186 -0.3524 161 GLN F O 11488 C CB . GLN F 161 ? 0.9752 1.6283 1.1183 0.0238 -0.0257 -0.3376 161 GLN F CB 11489 C CG . GLN F 161 ? 1.0607 1.7252 1.2008 0.0299 -0.0283 -0.3410 161 GLN F CG 11490 C CD . GLN F 161 ? 1.1646 1.8429 1.3143 0.0254 -0.0232 -0.3492 161 GLN F CD 11491 O OE1 . GLN F 161 ? 1.1901 1.8621 1.3448 0.0214 -0.0199 -0.3492 161 GLN F OE1 11492 N NE2 . GLN F 161 ? 1.1384 1.8360 1.2906 0.0257 -0.0226 -0.3561 161 GLN F NE2 11493 N N . TYR F 162 ? 0.7411 1.3982 0.8972 0.0104 -0.0181 -0.3422 162 TYR F N 11494 C CA . TYR F 162 ? 0.7017 1.3646 0.8686 0.0034 -0.0128 -0.3490 162 TYR F CA 11495 C C . TYR F 162 ? 0.6668 1.3326 0.8348 0.0009 -0.0123 -0.3494 162 TYR F C 11496 O O . TYR F 162 ? 0.6688 1.3402 0.8455 -0.0041 -0.0084 -0.3559 162 TYR F O 11497 C CB . TYR F 162 ? 0.7226 1.3717 0.8953 -0.0009 -0.0094 -0.3481 162 TYR F CB 11498 C CG . TYR F 162 ? 0.7177 1.3660 0.8904 0.0003 -0.0093 -0.3484 162 TYR F CG 11499 C CD1 . TYR F 162 ? 0.7605 1.3970 0.9256 0.0052 -0.0126 -0.3412 162 TYR F CD1 11500 C CD2 . TYR F 162 ? 0.7777 1.4382 0.9577 -0.0032 -0.0061 -0.3561 162 TYR F CD2 11501 C CE1 . TYR F 162 ? 0.8186 1.4562 0.9837 0.0067 -0.0126 -0.3420 162 TYR F CE1 11502 C CE2 . TYR F 162 ? 0.7951 1.4572 0.9751 -0.0023 -0.0060 -0.3564 162 TYR F CE2 11503 C CZ . TYR F 162 ? 0.8643 1.5155 1.0369 0.0028 -0.0091 -0.3495 162 TYR F CZ 11504 O OH . TYR F 162 ? 0.9205 1.5746 1.0931 0.0040 -0.0090 -0.3502 162 TYR F OH 11505 N N . SER F 163 ? 0.7177 1.3799 0.8769 0.0043 -0.0164 -0.3427 163 SER F N 11506 C CA . SER F 163 ? 0.7566 1.4194 0.9163 0.0015 -0.0160 -0.3414 163 SER F CA 11507 C C . SER F 163 ? 0.7644 1.4450 0.9316 -0.0016 -0.0129 -0.3507 163 SER F C 11508 O O . SER F 163 ? 0.7425 1.4238 0.9164 -0.0058 -0.0098 -0.3542 163 SER F O 11509 C CB . SER F 163 ? 0.7944 1.4552 0.9427 0.0051 -0.0214 -0.3332 163 SER F CB 11510 O OG . SER F 163 ? 0.8450 1.5098 0.9858 0.0107 -0.0258 -0.3314 163 SER F OG 11511 N N . GLU F 164 ? 0.8037 1.4992 0.9695 0.0008 -0.0141 -0.3548 164 GLU F N 11512 C CA . GLU F 164 ? 0.7435 1.4578 0.9142 -0.0011 -0.0124 -0.3627 164 GLU F CA 11513 C C . GLU F 164 ? 0.6518 1.3717 0.8342 -0.0060 -0.0074 -0.3723 164 GLU F C 11514 O O . GLU F 164 ? 0.6195 1.3457 0.8082 -0.0096 -0.0050 -0.3777 164 GLU F O 11515 C CB . GLU F 164 ? 0.7816 1.5094 0.9454 0.0036 -0.0162 -0.3625 164 GLU F CB 11516 C CG . GLU F 164 ? 0.8505 1.5777 1.0054 0.0054 -0.0204 -0.3551 164 GLU F CG 11517 C CD . GLU F 164 ? 0.9725 1.6821 1.1167 0.0091 -0.0253 -0.3439 164 GLU F CD 11518 O OE1 . GLU F 164 ? 1.1314 1.8403 1.2686 0.0144 -0.0294 -0.3413 164 GLU F OE1 11519 O OE2 . GLU F 164 ? 0.9321 1.6287 1.0743 0.0071 -0.0255 -0.3378 164 GLU F OE2 11520 N N . GLU F 165 ? 0.5772 1.2939 0.7627 -0.0065 -0.0060 -0.3744 165 GLU F N 11521 C CA . GLU F 165 ? 0.5861 1.3036 0.7825 -0.0123 -0.0016 -0.3821 165 GLU F CA 11522 C C . GLU F 165 ? 0.8036 1.5076 1.0053 -0.0165 0.0006 -0.3815 165 GLU F C 11523 O O . GLU F 165 ? 0.8757 1.5835 1.0862 -0.0212 0.0035 -0.3891 165 GLU F O 11524 C CB . GLU F 165 ? 0.5263 1.2395 0.7236 -0.0126 -0.0009 -0.3819 165 GLU F CB 11525 C CG . GLU F 165 ? 0.5214 1.2338 0.7291 -0.0194 0.0031 -0.3887 165 GLU F CG 11526 C CD . GLU F 165 ? 0.6395 1.3488 0.8477 -0.0202 0.0037 -0.3877 165 GLU F CD 11527 O OE1 . GLU F 165 ? 0.7880 1.4963 0.9887 -0.0148 0.0010 -0.3824 165 GLU F OE1 11528 O OE2 . GLU F 165 ? 0.7029 1.4103 0.9188 -0.0264 0.0066 -0.3921 165 GLU F OE2 11529 N N . ALA F 166 ? 0.9105 1.5990 1.1064 -0.0146 -0.0010 -0.3727 166 ALA F N 11530 C CA . ALA F 166 ? 0.9002 1.5764 1.0996 -0.0174 0.0004 -0.3711 166 ALA F CA 11531 C C . ALA F 166 ? 0.8375 1.5225 1.0366 -0.0173 0.0000 -0.3725 166 ALA F C 11532 O O . ALA F 166 ? 0.8684 1.5547 1.0750 -0.0206 0.0023 -0.3783 166 ALA F O 11533 C CB . ALA F 166 ? 0.8849 1.5423 1.0783 -0.0155 -0.0012 -0.3612 166 ALA F CB 11534 N N . ARG F 167 ? 0.8496 1.5406 1.0399 -0.0136 -0.0034 -0.3672 167 ARG F N 11535 C CA . ARG F 167 ? 0.9388 1.6406 1.1275 -0.0136 -0.0042 -0.3678 167 ARG F CA 11536 C C . ARG F 167 ? 0.9704 1.6895 1.1675 -0.0162 -0.0016 -0.3790 167 ARG F C 11537 O O . ARG F 167 ? 1.0530 1.7802 1.2516 -0.0172 -0.0012 -0.3813 167 ARG F O 11538 C CB . ARG F 167 ? 1.0133 1.7214 1.1909 -0.0097 -0.0087 -0.3610 167 ARG F CB 11539 C CG . ARG F 167 ? 1.0905 1.8017 1.2642 -0.0104 -0.0101 -0.3568 167 ARG F CG 11540 C CD . ARG F 167 ? 1.1369 1.8612 1.3020 -0.0081 -0.0140 -0.3533 167 ARG F CD 11541 N NE . ARG F 167 ? 1.2696 2.0112 1.4376 -0.0072 -0.0134 -0.3612 167 ARG F NE 11542 C CZ . ARG F 167 ? 1.3123 2.0584 1.4741 -0.0034 -0.0166 -0.3593 167 ARG F CZ 11543 N NH1 . ARG F 167 ? 1.2377 1.9718 1.3894 0.0001 -0.0211 -0.3498 167 ARG F NH1 11544 N NH2 . ARG F 167 ? 1.2989 2.0622 1.4645 -0.0030 -0.0155 -0.3675 167 ARG F NH2 11545 N N . LEU F 168 ? 1.0097 1.7353 1.2121 -0.0173 0.0000 -0.3860 168 LEU F N 11546 C CA . LEU F 168 ? 1.1689 1.9106 1.3790 -0.0198 0.0022 -0.3967 168 LEU F CA 11547 C C . LEU F 168 ? 1.1325 1.8677 1.3534 -0.0245 0.0055 -0.4044 168 LEU F C 11548 O O . LEU F 168 ? 1.1286 1.8729 1.3564 -0.0267 0.0071 -0.4129 168 LEU F O 11549 C CB . LEU F 168 ? 1.3428 2.1012 1.5503 -0.0177 0.0010 -0.3998 168 LEU F CB 11550 C CG . LEU F 168 ? 1.3877 2.1585 1.5860 -0.0137 -0.0024 -0.3954 168 LEU F CG 11551 C CD1 . LEU F 168 ? 1.4223 2.1963 1.6186 -0.0141 -0.0031 -0.3932 168 LEU F CD1 11552 C CD2 . LEU F 168 ? 1.3135 2.0764 1.5012 -0.0090 -0.0063 -0.3857 168 LEU F CD2 11553 N N . LYS F 169 ? 0.9887 1.7080 1.2109 -0.0259 0.0063 -0.4013 169 LYS F N 11554 C CA . LYS F 169 ? 0.9647 1.6727 1.1958 -0.0305 0.0087 -0.4061 169 LYS F CA 11555 C C . LYS F 169 ? 0.9513 1.6481 1.1834 -0.0304 0.0087 -0.4034 169 LYS F C 11556 O O . LYS F 169 ? 0.8807 1.5705 1.1204 -0.0335 0.0102 -0.4086 169 LYS F O 11557 C CB . LYS F 169 ? 0.8720 1.5674 1.1037 -0.0325 0.0094 -0.4030 169 LYS F CB 11558 C CG . LYS F 169 ? 0.8853 1.5647 1.1242 -0.0371 0.0111 -0.4048 169 LYS F CG 11559 C CD . LYS F 169 ? 0.9274 1.6126 1.1760 -0.0417 0.0126 -0.4159 169 LYS F CD 11560 C CE . LYS F 169 ? 0.9215 1.5937 1.1759 -0.0473 0.0138 -0.4175 169 LYS F CE 11561 N NZ . LYS F 169 ? 0.9102 1.5896 1.1639 -0.0492 0.0143 -0.4178 169 LYS F NZ 11562 N N . ARG F 170 ? 0.9753 1.6709 1.1994 -0.0270 0.0068 -0.3953 170 ARG F N 11563 C CA . ARG F 170 ? 1.0877 1.7749 1.3118 -0.0267 0.0066 -0.3922 170 ARG F CA 11564 C C . ARG F 170 ? 1.1640 1.8672 1.3912 -0.0267 0.0069 -0.3990 170 ARG F C 11565 O O . ARG F 170 ? 1.2224 1.9229 1.4560 -0.0280 0.0080 -0.4040 170 ARG F O 11566 C CB . ARG F 170 ? 1.0089 1.6878 1.2227 -0.0237 0.0041 -0.3804 170 ARG F CB 11567 C CG . ARG F 170 ? 0.9698 1.6363 1.1840 -0.0241 0.0043 -0.3763 170 ARG F CG 11568 C CD . ARG F 170 ? 0.9136 1.5766 1.1175 -0.0216 0.0014 -0.3654 170 ARG F CD 11569 N NE . ARG F 170 ? 0.8294 1.4856 1.0257 -0.0194 -0.0006 -0.3582 170 ARG F NE 11570 C CZ . ARG F 170 ? 0.7836 1.4473 0.9712 -0.0167 -0.0036 -0.3535 170 ARG F CZ 11571 N NH1 . ARG F 170 ? 0.7835 1.4621 0.9682 -0.0163 -0.0049 -0.3542 170 ARG F NH1 11572 N NH2 . ARG F 170 ? 0.8413 1.4976 1.0228 -0.0142 -0.0057 -0.3480 170 ARG F NH2 11573 N N . GLU F 171 ? 1.2629 1.9834 1.4855 -0.0249 0.0056 -0.3994 171 GLU F N 11574 C CA . GLU F 171 ? 1.3420 2.0808 1.5673 -0.0248 0.0059 -0.4060 171 GLU F CA 11575 C C . GLU F 171 ? 1.3653 2.1147 1.6004 -0.0271 0.0079 -0.4191 171 GLU F C 11576 O O . GLU F 171 ? 1.5064 2.2727 1.7445 -0.0270 0.0082 -0.4262 171 GLU F O 11577 C CB . GLU F 171 ? 1.3318 2.0846 1.5478 -0.0223 0.0034 -0.4006 171 GLU F CB 11578 C CG . GLU F 171 ? 1.3340 2.0755 1.5400 -0.0205 0.0008 -0.3878 171 GLU F CG 11579 C CD . GLU F 171 ? 1.3512 2.1053 1.5475 -0.0185 -0.0023 -0.3821 171 GLU F CD 11580 O OE1 . GLU F 171 ? 1.3955 2.1470 1.5850 -0.0182 -0.0045 -0.3740 171 GLU F OE1 11581 O OE2 . GLU F 171 ? 1.3375 2.1046 1.5330 -0.0175 -0.0029 -0.3856 171 GLU F OE2 11582 N N . GLU F 172 ? 1.2411 1.9806 1.4810 -0.0295 0.0091 -0.4221 172 GLU F N 11583 C CA . GLU F 172 ? 1.2327 1.9751 1.4828 -0.0328 0.0108 -0.4337 172 GLU F CA 11584 C C . GLU F 172 ? 1.3121 2.0421 1.5694 -0.0344 0.0115 -0.4379 172 GLU F C 11585 O O . GLU F 172 ? 1.2272 1.9586 1.4928 -0.0369 0.0122 -0.4478 172 GLU F O 11586 C CB . GLU F 172 ? 1.3057 2.0419 1.5570 -0.0353 0.0115 -0.4337 172 GLU F CB 11587 C CG . GLU F 172 ? 1.3194 2.0602 1.5799 -0.0395 0.0128 -0.4448 172 GLU F CG 11588 C CD . GLU F 172 ? 1.2885 2.0161 1.5506 -0.0431 0.0135 -0.4427 172 GLU F CD 11589 O OE1 . GLU F 172 ? 1.2019 1.9369 1.4610 -0.0433 0.0135 -0.4414 172 GLU F OE1 11590 O OE2 . GLU F 172 ? 1.2802 1.9903 1.5461 -0.0457 0.0137 -0.4419 172 GLU F OE2 11591 N N . ILE F 173 ? 1.5008 2.2176 1.7548 -0.0329 0.0110 -0.4304 173 ILE F N 11592 C CA . ILE F 173 ? 1.4683 2.1728 1.7283 -0.0336 0.0112 -0.4334 173 ILE F CA 11593 C C . ILE F 173 ? 1.3226 2.0286 1.5784 -0.0306 0.0104 -0.4283 173 ILE F C 11594 O O . ILE F 173 ? 1.2514 1.9752 1.5051 -0.0288 0.0100 -0.4302 173 ILE F O 11595 C CB . ILE F 173 ? 1.4656 2.1468 1.7269 -0.0359 0.0115 -0.4285 173 ILE F CB 11596 C CG1 . ILE F 173 ? 1.3781 2.0580 1.6373 -0.0381 0.0119 -0.4260 173 ILE F CG1 11597 C CG2 . ILE F 173 ? 1.4889 2.1598 1.7594 -0.0382 0.0116 -0.4367 173 ILE F CG2 11598 C CD1 . ILE F 173 ? 1.2444 1.9042 1.5013 -0.0395 0.0120 -0.4177 173 ILE F CD1 11599 C C1 . NAG G . ? 1.2001 1.3417 1.2432 0.0522 -0.0540 -0.1086 401 NAG A C1 11600 C C2 . NAG G . ? 1.3643 1.5174 1.4145 0.0513 -0.0536 -0.1129 401 NAG A C2 11601 C C3 . NAG G . ? 1.3579 1.5100 1.4069 0.0508 -0.0533 -0.1103 401 NAG A C3 11602 C C4 . NAG G . ? 1.3129 1.4559 1.3521 0.0562 -0.0573 -0.1089 401 NAG A C4 11603 C C5 . NAG G . ? 1.2881 1.4196 1.3218 0.0550 -0.0564 -0.1035 401 NAG A C5 11604 C C6 . NAG G . ? 1.2659 1.3861 1.2896 0.0584 -0.0594 -0.1000 401 NAG A C6 11605 C C7 . NAG G . ? 1.3087 1.4756 1.3728 0.0460 -0.0502 -0.1184 401 NAG A C7 11606 C C8 . NAG G . ? 1.2912 1.4634 1.3645 0.0396 -0.0463 -0.1181 401 NAG A C8 11607 N N2 . NAG G . ? 1.3446 1.5044 1.4038 0.0458 -0.0499 -0.1135 401 NAG A N2 11608 O O3 . NAG G . ? 1.4106 1.5741 1.4654 0.0506 -0.0532 -0.1146 401 NAG A O3 11609 O O4 . NAG G . ? 1.2101 1.3528 1.2480 0.0568 -0.0579 -0.1078 401 NAG A O4 11610 O O5 . NAG G . ? 1.2568 1.3899 1.2909 0.0562 -0.0571 -0.1063 401 NAG A O5 11611 O O6 . NAG G . ? 1.2929 1.4107 1.3107 0.0640 -0.0638 -0.1029 401 NAG A O6 11612 O O7 . NAG G . ? 1.1621 1.3311 1.2235 0.0510 -0.0537 -0.1231 401 NAG A O7 11613 C C1 . FUC H . ? 1.4280 1.5407 1.4388 0.0691 -0.0683 -0.1034 402 FUC A C1 11614 C C2 . FUC H . ? 1.4326 1.5545 1.4457 0.0739 -0.0718 -0.1107 402 FUC A C2 11615 C C3 . FUC H . ? 1.4190 1.5455 1.4331 0.0761 -0.0730 -0.1150 402 FUC A C3 11616 C C4 . FUC H . ? 1.3834 1.4985 1.3874 0.0794 -0.0760 -0.1123 402 FUC A C4 11617 C C5 . FUC H . ? 1.3110 1.4158 1.3112 0.0751 -0.0731 -0.1045 402 FUC A C5 11618 C C6 . FUC H . ? 1.1794 1.2725 1.1688 0.0782 -0.0763 -0.1012 402 FUC A C6 11619 O O2 . FUC H . ? 1.3918 1.5241 1.4129 0.0715 -0.0696 -0.1132 402 FUC A O2 11620 O O3 . FUC H . ? 1.4086 1.5450 1.4258 0.0802 -0.0758 -0.1223 402 FUC A O3 11621 O O4 . FUC H . ? 1.4352 1.5458 1.4324 0.0852 -0.0814 -0.1138 402 FUC A O4 11622 O O5 . FUC H . ? 1.3967 1.4991 1.3981 0.0723 -0.0714 -0.1011 402 FUC A O5 11623 C C1 . NAG I . ? 0.6288 0.7276 0.7276 -0.0209 -0.0041 -0.0090 403 NAG A C1 11624 C C2 . NAG I . ? 0.6575 0.7579 0.7589 -0.0163 -0.0057 -0.0109 403 NAG A C2 11625 C C3 . NAG I . ? 0.8113 0.9173 0.9153 -0.0164 -0.0046 -0.0138 403 NAG A C3 11626 C C4 . NAG I . ? 0.9238 1.0380 1.0303 -0.0197 -0.0031 -0.0162 403 NAG A C4 11627 C C5 . NAG I . ? 0.9765 1.0883 1.0801 -0.0246 -0.0016 -0.0135 403 NAG A C5 11628 C C6 . NAG I . ? 1.0842 1.2033 1.1901 -0.0286 -0.0003 -0.0152 403 NAG A C6 11629 C C7 . NAG I . ? 0.5811 0.6712 0.6796 -0.0105 -0.0087 -0.0077 403 NAG A C7 11630 C C8 . NAG I . ? 0.5258 0.6095 0.6220 -0.0087 -0.0092 -0.0054 403 NAG A C8 11631 N N2 . NAG I . ? 0.6257 0.7195 0.7248 -0.0137 -0.0066 -0.0088 403 NAG A N2 11632 O O3 . NAG I . ? 0.6825 0.7887 0.7885 -0.0119 -0.0062 -0.0156 403 NAG A O3 11633 O O4 . NAG I . ? 1.0146 1.1353 1.1235 -0.0201 -0.0018 -0.0190 403 NAG A O4 11634 O O5 . NAG I . ? 0.7609 0.8664 0.8622 -0.0240 -0.0031 -0.0110 403 NAG A O5 11635 O O6 . NAG I . ? 1.2988 1.4212 1.4077 -0.0271 -0.0019 -0.0171 403 NAG A O6 11636 O O7 . NAG I . ? 0.5171 0.6088 0.6167 -0.0090 -0.0101 -0.0083 403 NAG A O7 11637 C C1 . NAG J . ? 1.1703 1.2996 1.2836 -0.0196 -0.0022 -0.0228 404 NAG A C1 11638 C C2 . NAG J . ? 1.1978 1.3363 1.3137 -0.0214 -0.0002 -0.0260 404 NAG A C2 11639 C C3 . NAG J . ? 1.2970 1.4447 1.4181 -0.0185 -0.0012 -0.0310 404 NAG A C3 11640 C C4 . NAG J . ? 1.3588 1.5031 1.4812 -0.0132 -0.0044 -0.0318 404 NAG A C4 11641 C C5 . NAG J . ? 1.3367 1.4735 1.4561 -0.0141 -0.0053 -0.0280 404 NAG A C5 11642 C C6 . NAG J . ? 1.2811 1.4153 1.4013 -0.0097 -0.0082 -0.0284 404 NAG A C6 11643 C C7 . NAG J . ? 1.1627 1.3021 1.2744 -0.0309 0.0039 -0.0223 404 NAG A C7 11644 C C8 . NAG J . ? 1.1355 1.2781 1.2465 -0.0368 0.0057 -0.0210 404 NAG A C8 11645 N N2 . NAG J . ? 1.1917 1.3335 1.3068 -0.0271 0.0019 -0.0248 404 NAG A N2 11646 O O3 . NAG J . ? 1.2808 1.4341 1.4037 -0.0175 -0.0004 -0.0339 404 NAG A O3 11647 O O4 . NAG J . ? 1.4657 1.6191 1.5929 -0.0113 -0.0054 -0.0365 404 NAG A O4 11648 O O5 . NAG J . ? 1.2093 1.3375 1.3244 -0.0146 -0.0048 -0.0242 404 NAG A O5 11649 O O6 . NAG J . ? 1.1629 1.2973 1.2848 -0.0048 -0.0101 -0.0307 404 NAG A O6 11650 O O7 . NAG J . ? 1.0447 1.1795 1.1539 -0.0296 0.0041 -0.0210 404 NAG A O7 11651 C C1 . FUC K . ? 1.3378 1.4676 1.4495 -0.0308 -0.0009 -0.0191 405 FUC A C1 11652 C C2 . FUC K . ? 1.3375 1.4708 1.4526 -0.0283 -0.0029 -0.0215 405 FUC A C2 11653 C C3 . FUC K . ? 1.2629 1.3887 1.3754 -0.0275 -0.0047 -0.0189 405 FUC A C3 11654 C C4 . FUC K . ? 1.3194 1.4402 1.4285 -0.0322 -0.0038 -0.0158 405 FUC A C4 11655 C C5 . FUC K . ? 1.3968 1.5158 1.5032 -0.0353 -0.0016 -0.0139 405 FUC A C5 11656 C C6 . FUC K . ? 1.3382 1.4538 1.4418 -0.0406 -0.0008 -0.0113 405 FUC A C6 11657 O O2 . FUC K . ? 1.1507 1.2868 1.2683 -0.0233 -0.0042 -0.0242 405 FUC A O2 11658 O O3 . FUC K . ? 1.0726 1.2023 1.1883 -0.0256 -0.0065 -0.0213 405 FUC A O3 11659 O O4 . FUC K . ? 1.1974 1.3224 1.3088 -0.0356 -0.0039 -0.0170 405 FUC A O4 11660 O O5 . FUC K . ? 1.4374 1.5643 1.5466 -0.0358 0.0000 -0.0165 405 FUC A O5 11661 C C1 . NAG L . ? 1.1871 1.1686 1.1302 -0.0025 -0.0331 0.0103 406 NAG A C1 11662 C C2 . NAG L . ? 1.3618 1.3394 1.3014 -0.0071 -0.0319 0.0154 406 NAG A C2 11663 C C3 . NAG L . ? 1.3642 1.3318 1.2945 -0.0070 -0.0361 0.0188 406 NAG A C3 11664 C C4 . NAG L . ? 1.4295 1.3948 1.3538 -0.0032 -0.0394 0.0175 406 NAG A C4 11665 C C5 . NAG L . ? 1.4098 1.3843 1.3389 -0.0007 -0.0372 0.0131 406 NAG A C5 11666 C C6 . NAG L . ? 1.3677 1.3415 1.2915 0.0031 -0.0400 0.0112 406 NAG A C6 11667 C C7 . NAG L . ? 1.3794 1.3701 1.3269 -0.0124 -0.0239 0.0158 406 NAG A C7 11668 C C8 . NAG L . ? 1.2736 1.2703 1.2205 -0.0146 -0.0208 0.0165 406 NAG A C8 11669 N N2 . NAG L . ? 1.4738 1.4578 1.4145 -0.0100 -0.0279 0.0164 406 NAG A N2 11670 O O3 . NAG L . ? 1.3301 1.2922 1.2615 -0.0062 -0.0387 0.0187 406 NAG A O3 11671 O O4 . NAG L . ? 1.3634 1.3233 1.2787 -0.0049 -0.0409 0.0217 406 NAG A O4 11672 O O5 . NAG L . ? 1.2699 1.2482 1.2070 0.0008 -0.0365 0.0094 406 NAG A O5 11673 O O6 . NAG L . ? 1.2384 1.2087 1.1622 0.0072 -0.0439 0.0084 406 NAG A O6 11674 O O7 . NAG L . ? 1.2885 1.2811 1.2425 -0.0128 -0.0227 0.0145 406 NAG A O7 11675 C C1 . NAG M . ? 1.3757 1.5765 1.3927 0.0464 -0.0004 -0.0642 401 NAG C C1 11676 C C2 . NAG M . ? 1.5301 1.7290 1.5407 0.0432 -0.0013 -0.0545 401 NAG C C2 11677 C C3 . NAG M . ? 1.5614 1.7526 1.5723 0.0395 -0.0016 -0.0484 401 NAG C C3 11678 C C4 . NAG M . ? 1.6057 1.8056 1.6215 0.0405 -0.0003 -0.0509 401 NAG C C4 11679 C C5 . NAG M . ? 1.5910 1.7959 1.6125 0.0447 0.0005 -0.0611 401 NAG C C5 11680 C C6 . NAG M . ? 1.6557 1.8738 1.6810 0.0468 0.0016 -0.0639 401 NAG C C6 11681 C C7 . NAG M . ? 1.3958 1.5895 1.3968 0.0423 -0.0033 -0.0481 401 NAG C C7 11682 C C8 . NAG M . ? 1.2490 1.4345 1.2469 0.0429 -0.0044 -0.0489 401 NAG C C8 11683 N N2 . NAG M . ? 1.5017 1.6931 1.5085 0.0431 -0.0024 -0.0538 401 NAG C N2 11684 O O3 . NAG M . ? 1.4456 1.6372 1.4510 0.0366 -0.0026 -0.0395 401 NAG C O3 11685 O O4 . NAG M . ? 1.4114 1.6014 1.4283 0.0374 -0.0006 -0.0469 401 NAG C O4 11686 O O5 . NAG M . ? 1.3846 1.5955 1.4051 0.0475 0.0004 -0.0658 401 NAG C O5 11687 O O6 . NAG M . ? 1.7670 1.9948 1.7956 0.0514 0.0021 -0.0729 401 NAG C O6 11688 O O7 . NAG M . ? 1.3881 1.5900 1.3863 0.0411 -0.0034 -0.0421 401 NAG C O7 11689 C C1 . FUC N . ? 1.8729 2.1111 1.9058 0.0539 0.0030 -0.0768 402 FUC C C1 11690 C C2 . FUC N . ? 1.8705 2.1286 1.9017 0.0569 0.0036 -0.0775 402 FUC C C2 11691 C C3 . FUC N . ? 1.9698 2.2354 2.0021 0.0612 0.0034 -0.0860 402 FUC C C3 11692 C C4 . FUC N . ? 2.0490 2.3073 2.0874 0.0638 0.0030 -0.0958 402 FUC C C4 11693 C C5 . FUC N . ? 2.0912 2.3313 2.1325 0.0608 0.0026 -0.0946 402 FUC C C5 11694 C C6 . FUC N . ? 2.0290 2.2670 2.0772 0.0637 0.0024 -0.1030 402 FUC C C6 11695 O O2 . FUC N . ? 1.7120 1.9740 1.7374 0.0539 0.0035 -0.0684 402 FUC C O2 11696 O O3 . FUC N . ? 1.8807 2.1657 1.9123 0.0645 0.0041 -0.0875 402 FUC C O3 11697 O O4 . FUC N . ? 1.7771 2.0482 1.8195 0.0683 0.0033 -0.1029 402 FUC C O4 11698 O O5 . FUC N . ? 2.0160 2.2504 2.0549 0.0568 0.0029 -0.0857 402 FUC C O5 11699 C C1 . NAG O . ? 0.9157 0.8538 1.1410 0.0052 -0.0030 0.1227 403 NAG C C1 11700 C C2 . NAG O . ? 0.9403 0.8880 1.1644 0.0033 -0.0016 0.1305 403 NAG C C2 11701 C C3 . NAG O . ? 1.0293 0.9756 1.2612 -0.0011 -0.0025 0.1339 403 NAG C C3 11702 C C4 . NAG O . ? 1.1058 1.0420 1.3479 -0.0024 -0.0049 0.1366 403 NAG C C4 11703 C C5 . NAG O . ? 1.1850 1.1114 1.4274 0.0001 -0.0063 0.1279 403 NAG C C5 11704 C C6 . NAG O . ? 1.2355 1.1512 1.4876 -0.0002 -0.0090 0.1297 403 NAG C C6 11705 C C7 . NAG O . ? 0.9252 0.8887 1.1327 0.0066 0.0015 0.1284 403 NAG C C7 11706 C C8 . NAG O . ? 0.8965 0.8655 1.0952 0.0074 0.0027 0.1229 403 NAG C C8 11707 N N2 . NAG O . ? 0.9772 0.9322 1.1920 0.0044 0.0000 0.1263 403 NAG C N2 11708 O O3 . NAG O . ? 0.9442 0.9008 1.1748 -0.0029 -0.0011 0.1410 403 NAG C O3 11709 O O4 . NAG O . ? 1.2155 1.1494 1.4650 -0.0069 -0.0060 0.1389 403 NAG C O4 11710 O O5 . NAG O . ? 0.9615 0.8903 1.1961 0.0043 -0.0052 0.1242 403 NAG C O5 11711 O O6 . NAG O . ? 1.3611 1.2783 1.6146 0.0012 -0.0090 0.1373 403 NAG C O6 11712 O O7 . NAG O . ? 0.8834 0.8499 1.0911 0.0082 0.0017 0.1342 403 NAG C O7 11713 C C1 . NAG P . ? 1.3682 1.3039 1.6244 -0.0093 -0.0066 0.1493 404 NAG C C1 11714 C C2 . NAG P . ? 1.4116 1.3427 1.6769 -0.0144 -0.0085 0.1512 404 NAG C C2 11715 C C3 . NAG P . ? 1.5097 1.4479 1.7798 -0.0179 -0.0081 0.1627 404 NAG C C3 11716 C C4 . NAG P . ? 1.4800 1.4331 1.7421 -0.0170 -0.0051 0.1665 404 NAG C C4 11717 C C5 . NAG P . ? 1.4366 1.3933 1.6873 -0.0122 -0.0032 0.1592 404 NAG C C5 11718 C C6 . NAG P . ? 1.3560 1.3149 1.6011 -0.0125 -0.0023 0.1506 404 NAG C C6 11719 C C7 . NAG P . ? 1.2272 1.1367 1.5010 -0.0138 -0.0128 0.1390 404 NAG C C7 11720 C C8 . NAG P . ? 1.2494 1.1456 1.5321 -0.0138 -0.0163 0.1374 404 NAG C C8 11721 N N2 . NAG P . ? 1.3224 1.2401 1.5958 -0.0147 -0.0115 0.1486 404 NAG C N2 11722 O O3 . NAG P . ? 1.5555 1.4906 1.8335 -0.0230 -0.0097 0.1642 404 NAG C O3 11723 O O4 . NAG P . ? 1.3816 1.3398 1.6461 -0.0171 -0.0048 0.1769 404 NAG C O4 11724 O O5 . NAG P . ? 1.4254 1.3735 1.6762 -0.0088 -0.0043 0.1556 404 NAG C O5 11725 O O6 . NAG P . ? 1.1651 1.1323 1.3995 -0.0092 -0.0002 0.1472 404 NAG C O6 11726 O O7 . NAG P . ? 1.0034 0.9159 1.2706 -0.0126 -0.0115 0.1315 404 NAG C O7 11727 C C1 . FUC Q . ? 1.5652 1.4741 1.8290 -0.0004 -0.0116 0.1423 405 FUC C C1 11728 C C2 . FUC Q . ? 1.5658 1.4790 1.8308 0.0004 -0.0112 0.1523 405 FUC C C2 11729 C C3 . FUC Q . ? 1.5953 1.5065 1.8571 0.0054 -0.0112 0.1504 405 FUC C C3 11730 C C4 . FUC Q . ? 1.6552 1.5542 1.9216 0.0074 -0.0138 0.1435 405 FUC C C4 11731 C C5 . FUC Q . ? 1.7310 1.6272 1.9956 0.0063 -0.0139 0.1338 405 FUC C C5 11732 C C6 . FUC Q . ? 1.6263 1.5115 1.8948 0.0085 -0.0164 0.1259 405 FUC C C6 11733 O O2 . FUC Q . ? 1.4234 1.3490 1.6830 -0.0005 -0.0086 0.1573 405 FUC C O2 11734 O O3 . FUC Q . ? 1.4993 1.4140 1.7631 0.0062 -0.0111 0.1597 405 FUC C O3 11735 O O4 . FUC Q . ? 1.4462 1.3364 1.7225 0.0062 -0.0166 0.1486 405 FUC C O4 11736 O O5 . FUC Q . ? 1.7592 1.6569 2.0270 0.0015 -0.0139 0.1359 405 FUC C O5 11737 C C1 . NAG R . ? 1.0725 1.0995 1.2442 0.0608 -0.0196 -0.1493 406 NAG C C1 11738 C C2 . NAG R . ? 1.1869 1.2060 1.3663 0.0630 -0.0221 -0.1523 406 NAG C C2 11739 C C3 . NAG R . ? 1.2479 1.2650 1.4340 0.0654 -0.0256 -0.1616 406 NAG C C3 11740 C C4 . NAG R . ? 1.2636 1.2932 1.4464 0.0689 -0.0257 -0.1685 406 NAG C C4 11741 C C5 . NAG R . ? 1.2220 1.2562 1.3983 0.0651 -0.0231 -0.1638 406 NAG C C5 11742 C C6 . NAG R . ? 1.2073 1.2526 1.3802 0.0671 -0.0231 -0.1696 406 NAG C C6 11743 C C7 . NAG R . ? 1.2727 1.2769 1.4545 0.0588 -0.0209 -0.1400 406 NAG C C7 11744 C C8 . NAG R . ? 1.2361 1.2291 1.4204 0.0544 -0.0206 -0.1329 406 NAG C C8 11745 N N2 . NAG R . ? 1.2307 1.2384 1.4126 0.0588 -0.0218 -0.1453 406 NAG C N2 11746 O O3 . NAG R . ? 1.2896 1.3014 1.4820 0.0686 -0.0280 -0.1651 406 NAG C O3 11747 O O4 . NAG R . ? 1.2616 1.2895 1.4508 0.0717 -0.0292 -0.1778 406 NAG C O4 11748 O O5 . NAG R . ? 1.1192 1.1565 1.2893 0.0641 -0.0202 -0.1563 406 NAG C O5 11749 O O6 . NAG R . ? 1.2083 1.2650 1.3782 0.0720 -0.0227 -0.1731 406 NAG C O6 11750 O O7 . NAG R . ? 1.2056 1.2158 1.3854 0.0623 -0.0203 -0.1408 406 NAG C O7 11751 C C1 . NAG S . ? 1.2756 1.3449 1.5038 -0.0849 0.0104 -0.1663 401 NAG E C1 11752 C C2 . NAG S . ? 1.2289 1.2893 1.4585 -0.0825 0.0100 -0.1701 401 NAG E C2 11753 C C3 . NAG S . ? 1.2862 1.3317 1.5164 -0.0823 0.0113 -0.1652 401 NAG E C3 11754 C C4 . NAG S . ? 1.3884 1.4281 1.6227 -0.0881 0.0126 -0.1632 401 NAG E C4 11755 C C5 . NAG S . ? 1.5051 1.5541 1.7369 -0.0893 0.0131 -0.1582 401 NAG E C5 11756 C C6 . NAG S . ? 1.5611 1.6044 1.7957 -0.0941 0.0147 -0.1536 401 NAG E C6 11757 C C7 . NAG S . ? 1.2751 1.3516 1.4996 -0.0758 0.0074 -0.1765 401 NAG E C7 11758 C C8 . NAG S . ? 1.1769 1.2581 1.3964 -0.0702 0.0065 -0.1761 401 NAG E C8 11759 N N2 . NAG S . ? 1.2744 1.3401 1.4995 -0.0771 0.0089 -0.1708 401 NAG E N2 11760 O O3 . NAG S . ? 1.2204 1.2582 1.4519 -0.0798 0.0107 -0.1693 401 NAG E O3 11761 O O4 . NAG S . ? 1.3091 1.3349 1.5445 -0.0885 0.0138 -0.1587 401 NAG E O4 11762 O O5 . NAG S . ? 1.4672 1.5297 1.6990 -0.0897 0.0119 -0.1633 401 NAG E O5 11763 O O6 . NAG S . ? 1.7552 1.8086 1.9915 -0.0978 0.0146 -0.1554 401 NAG E O6 11764 O O7 . NAG S . ? 1.2903 1.3731 1.5180 -0.0790 0.0068 -0.1818 401 NAG E O7 11765 C C1 . FUC T . ? 1.8816 1.9297 2.1234 -0.1039 0.0156 -0.1562 402 FUC E C1 11766 C C2 . FUC T . ? 1.8369 1.8851 2.0835 -0.1066 0.0144 -0.1652 402 FUC E C2 11767 C C3 . FUC T . ? 1.7655 1.8292 2.0122 -0.1073 0.0133 -0.1701 402 FUC E C3 11768 C C4 . FUC T . ? 1.8047 1.8758 2.0519 -0.1109 0.0143 -0.1660 402 FUC E C4 11769 C C5 . FUC T . ? 1.7951 1.8651 2.0372 -0.1075 0.0153 -0.1572 402 FUC E C5 11770 C C6 . FUC T . ? 1.6174 1.6948 1.8594 -0.1103 0.0163 -0.1529 402 FUC E C6 11771 O O2 . FUC T . ? 1.7640 1.8058 2.0102 -0.1030 0.0135 -0.1690 402 FUC E O2 11772 O O3 . FUC T . ? 1.4370 1.5015 1.6881 -0.1099 0.0121 -0.1787 402 FUC E O3 11773 O O4 . FUC T . ? 1.7573 1.8222 2.0097 -0.1171 0.0153 -0.1660 402 FUC E O4 11774 O O5 . FUC T . ? 1.9491 2.0050 2.1911 -0.1070 0.0164 -0.1529 402 FUC E O5 11775 C C1 . NAG U . ? 0.7447 0.7942 0.6922 0.0047 0.0034 0.0094 403 NAG E C1 11776 C C2 . NAG U . ? 0.8241 0.8652 0.7636 0.0035 0.0001 0.0073 403 NAG E C2 11777 C C3 . NAG U . ? 0.8832 0.9156 0.8164 0.0060 -0.0031 0.0023 403 NAG E C3 11778 C C4 . NAG U . ? 0.9261 0.9638 0.8574 0.0111 -0.0028 -0.0004 403 NAG E C4 11779 C C5 . NAG U . ? 0.9484 0.9954 0.8883 0.0118 0.0006 0.0020 403 NAG E C5 11780 C C6 . NAG U . ? 1.1072 1.1604 1.0457 0.0169 0.0009 -0.0008 403 NAG E C6 11781 C C7 . NAG U . ? 0.8261 0.8656 0.7691 -0.0035 0.0010 0.0132 403 NAG E C7 11782 C C8 . NAG U . ? 0.7563 0.7904 0.7012 -0.0077 0.0004 0.0151 403 NAG E C8 11783 N N2 . NAG U . ? 0.8244 0.8606 0.7659 -0.0008 -0.0001 0.0097 403 NAG E N2 11784 O O3 . NAG U . ? 0.8779 0.9018 0.8038 0.0042 -0.0061 0.0008 403 NAG E O3 11785 O O4 . NAG U . ? 1.1371 1.1678 1.0636 0.0143 -0.0055 -0.0049 403 NAG E O4 11786 O O5 . NAG U . ? 0.7465 0.8007 0.6915 0.0091 0.0034 0.0067 403 NAG E O5 11787 O O6 . NAG U . ? 1.4879 1.5393 1.4181 0.0194 -0.0013 -0.0038 403 NAG E O6 11788 O O7 . NAG U . ? 0.8145 0.8615 0.7575 -0.0025 0.0023 0.0148 403 NAG E O7 11789 C C1 . NAG V . ? 1.2998 1.3235 1.2170 0.0156 -0.0087 -0.0084 404 NAG E C1 11790 C C2 . NAG V . ? 1.3491 1.3692 1.2606 0.0209 -0.0110 -0.0135 404 NAG E C2 11791 C C3 . NAG V . ? 1.4165 1.4352 1.3201 0.0224 -0.0130 -0.0159 404 NAG E C3 11792 C C4 . NAG V . ? 1.5057 1.5162 1.4055 0.0175 -0.0149 -0.0149 404 NAG E C4 11793 C C5 . NAG V . ? 1.5305 1.5393 1.4362 0.0119 -0.0137 -0.0105 404 NAG E C5 11794 C C6 . NAG V . ? 1.4878 1.4840 1.3886 0.0083 -0.0169 -0.0114 404 NAG E C6 11795 C C7 . NAG V . ? 1.3115 1.3401 1.2330 0.0245 -0.0080 -0.0132 404 NAG E C7 11796 C C8 . NAG V . ? 1.2566 1.2952 1.1826 0.0284 -0.0058 -0.0139 404 NAG E C8 11797 N N2 . NAG V . ? 1.3631 1.3918 1.2793 0.0247 -0.0089 -0.0139 404 NAG E N2 11798 O O3 . NAG V . ? 1.4120 1.4255 1.3085 0.0274 -0.0157 -0.0211 404 NAG E O3 11799 O O4 . NAG V . ? 1.3646 1.3809 1.2624 0.0171 -0.0143 -0.0142 404 NAG E O4 11800 O O5 . NAG V . ? 1.3413 1.3543 1.2549 0.0120 -0.0113 -0.0086 404 NAG E O5 11801 O O6 . NAG V . ? 1.3442 1.3418 1.2488 0.0030 -0.0157 -0.0073 404 NAG E O6 11802 O O7 . NAG V . ? 1.0644 1.0859 0.9874 0.0211 -0.0087 -0.0121 404 NAG E O7 11803 C C1 . FUC W . ? 1.6240 1.6865 1.5544 0.0232 0.0003 -0.0043 405 FUC E C1 11804 C C2 . FUC W . ? 1.6323 1.6962 1.5568 0.0236 -0.0006 -0.0049 405 FUC E C2 11805 C C3 . FUC W . ? 1.5888 1.6612 1.5191 0.0202 0.0025 0.0007 405 FUC E C3 11806 C C4 . FUC W . ? 1.6551 1.7392 1.5932 0.0211 0.0062 0.0036 405 FUC E C4 11807 C C5 . FUC W . ? 1.6290 1.7107 1.5721 0.0210 0.0067 0.0032 405 FUC E C5 11808 C C6 . FUC W . ? 1.5573 1.6505 1.5078 0.0219 0.0101 0.0056 405 FUC E C6 11809 O O2 . FUC W . ? 1.6341 1.6861 1.5516 0.0223 -0.0041 -0.0074 405 FUC E O2 11810 O O3 . FUC W . ? 1.3042 1.3798 1.2296 0.0207 0.0019 0.0003 405 FUC E O3 11811 O O4 . FUC W . ? 1.7866 1.8786 1.7216 0.0256 0.0063 0.0011 405 FUC E O4 11812 O O5 . FUC W . ? 1.6030 1.6775 1.5400 0.0246 0.0036 -0.0021 405 FUC E O5 11813 C C1 . NAG X . ? 1.2527 1.4013 1.4231 -0.0723 0.0301 -0.0503 406 NAG E C1 11814 C C2 . NAG X . ? 1.4022 1.5566 1.5707 -0.0709 0.0313 -0.0466 406 NAG E C2 11815 C C3 . NAG X . ? 1.3884 1.5532 1.5631 -0.0754 0.0331 -0.0469 406 NAG E C3 11816 C C4 . NAG X . ? 1.3564 1.5296 1.5359 -0.0780 0.0324 -0.0523 406 NAG E C4 11817 C C5 . NAG X . ? 1.3049 1.4736 1.4819 -0.0753 0.0301 -0.0561 406 NAG E C5 11818 C C6 . NAG X . ? 1.2328 1.4089 1.4146 -0.0779 0.0295 -0.0615 406 NAG E C6 11819 C C7 . NAG X . ? 1.6230 1.7751 1.7776 -0.0601 0.0286 -0.0444 406 NAG E C7 11820 C C8 . NAG X . ? 1.5748 1.7309 1.7228 -0.0540 0.0264 -0.0460 406 NAG E C8 11821 N N2 . NAG X . ? 1.5546 1.7124 1.7160 -0.0646 0.0294 -0.0473 406 NAG E N2 11822 O O3 . NAG X . ? 1.2791 1.4378 1.4582 -0.0805 0.0351 -0.0438 406 NAG E O3 11823 O O4 . NAG X . ? 1.0515 1.2387 1.2320 -0.0774 0.0327 -0.0535 406 NAG E O4 11824 O O5 . NAG X . ? 1.2413 1.3970 1.4178 -0.0762 0.0303 -0.0545 406 NAG E O5 11825 O O6 . NAG X . ? 1.0150 1.1827 1.2003 -0.0814 0.0295 -0.0633 406 NAG E O6 11826 O O7 . NAG X . ? 1.4907 1.6347 1.6441 -0.0607 0.0296 -0.0406 406 NAG E O7 # 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 ALA 1 -4 ? ? ? A . n A 1 2 ASP 2 -3 ? ? ? A . n A 1 3 LEU 3 -2 ? ? ? A . n A 1 4 GLY 4 -1 ? ? ? A . n A 1 5 SER 5 0 0 SER SER A . n A 1 6 ASP 6 1 1 ASP ASP A . n A 1 7 GLN 7 2 2 GLN GLN A . n A 1 8 ILE 8 3 3 ILE ILE A . n A 1 9 CYS 9 4 4 CYS CYS A . n A 1 10 ILE 10 5 5 ILE ILE A . n A 1 11 GLY 11 6 6 GLY GLY A . n A 1 12 TYR 12 7 7 TYR TYR A . n A 1 13 HIS 13 8 8 HIS HIS A . n A 1 14 ALA 14 9 9 ALA ALA A . n A 1 15 ASN 15 10 10 ASN ASN A . n A 1 16 ASN 16 11 11 ASN ASN A . n A 1 17 SER 17 12 12 SER SER A . n A 1 18 THR 18 13 13 THR THR A . n A 1 19 GLU 19 14 14 GLU GLU A . n A 1 20 GLN 20 15 15 GLN GLN A . n A 1 21 VAL 21 16 16 VAL VAL A . n A 1 22 ASP 22 17 17 ASP ASP A . n A 1 23 THR 23 18 18 THR THR A . n A 1 24 ILE 24 19 19 ILE ILE A . n A 1 25 MET 25 20 20 MET MET A . n A 1 26 GLU 26 21 21 GLU GLU A . n A 1 27 LYS 27 22 22 LYS LYS A . n A 1 28 ASN 28 23 23 ASN ASN A . n A 1 29 VAL 29 24 24 VAL VAL A . n A 1 30 THR 30 25 25 THR THR A . n A 1 31 VAL 31 26 26 VAL VAL A . n A 1 32 THR 32 27 27 THR THR A . n A 1 33 HIS 33 28 28 HIS HIS A . n A 1 34 ALA 34 29 29 ALA ALA A . n A 1 35 GLN 35 30 30 GLN GLN A . n A 1 36 ASP 36 31 31 ASP ASP A . n A 1 37 ILE 37 32 32 ILE ILE A . n A 1 38 LEU 38 33 33 LEU LEU A . n A 1 39 GLU 39 34 34 GLU GLU A . n A 1 40 LYS 40 35 35 LYS LYS A . n A 1 41 THR 41 36 36 THR THR A . n A 1 42 HIS 42 37 37 HIS HIS A . n A 1 43 ASN 43 38 38 ASN ASN A . n A 1 44 GLY 44 39 39 GLY GLY A . n A 1 45 LYS 45 40 40 LYS LYS A . n A 1 46 LEU 46 41 41 LEU LEU A . n A 1 47 CYS 47 42 42 CYS CYS A . n A 1 48 ASP 48 43 43 ASP ASP A . n A 1 49 LEU 49 44 44 LEU LEU A . n A 1 50 ASN 50 45 45 ASN ASN A . n A 1 51 GLY 51 46 46 GLY GLY A . n A 1 52 VAL 52 47 47 VAL VAL A . n A 1 53 LYS 53 48 48 LYS LYS A . n A 1 54 PRO 54 49 49 PRO PRO A . n A 1 55 LEU 55 50 50 LEU LEU A . n A 1 56 ILE 56 51 51 ILE ILE A . n A 1 57 LEU 57 52 52 LEU LEU A . n A 1 58 LYS 58 53 53 LYS LYS A . n A 1 59 ASP 59 54 54 ASP ASP A . n A 1 60 CYS 60 55 55 CYS CYS A . n A 1 61 SER 61 56 56 SER SER A . n A 1 62 VAL 62 57 57 VAL VAL A . n A 1 63 ALA 63 58 58 ALA ALA A . n A 1 64 GLY 64 59 59 GLY GLY A . n A 1 65 TRP 65 60 60 TRP TRP A . n A 1 66 LEU 66 61 61 LEU LEU A . n A 1 67 LEU 67 62 62 LEU LEU A . n A 1 68 GLY 68 63 63 GLY GLY A . n A 1 69 ASN 69 64 64 ASN ASN A . n A 1 70 PRO 70 65 65 PRO PRO A . n A 1 71 MET 71 66 66 MET MET A . n A 1 72 CYS 72 67 67 CYS CYS A . n A 1 73 ASP 73 68 68 ASP ASP A . n A 1 74 GLU 74 69 69 GLU GLU A . n A 1 75 PHE 75 70 70 PHE PHE A . n A 1 76 ILE 76 71 71 ILE ILE A . n A 1 77 ARG 77 72 72 ARG ARG A . n A 1 78 VAL 78 73 73 VAL VAL A . n A 1 79 PRO 79 74 74 PRO PRO A . n A 1 80 GLU 80 75 75 GLU GLU A . n A 1 81 TRP 81 76 76 TRP TRP A . n A 1 82 SER 82 77 77 SER SER A . n A 1 83 TYR 83 78 78 TYR TYR A . n A 1 84 ILE 84 79 79 ILE ILE A . n A 1 85 VAL 85 80 80 VAL VAL A . n A 1 86 GLU 86 81 81 GLU GLU A . n A 1 87 ARG 87 82 82 ARG ARG A . n A 1 88 ALA 88 83 83 ALA ALA A . n A 1 89 ASN 89 84 84 ASN ASN A . n A 1 90 PRO 90 85 85 PRO PRO A . n A 1 91 ALA 91 86 86 ALA ALA A . n A 1 92 ASN 92 87 87 ASN ASN A . n A 1 93 ASP 93 88 88 ASP ASP A . n A 1 94 LEU 94 89 89 LEU LEU A . n A 1 95 CYS 95 90 90 CYS CYS A . n A 1 96 TYR 96 91 91 TYR TYR A . n A 1 97 PRO 97 92 92 PRO PRO A . n A 1 98 GLY 98 93 93 GLY GLY A . n A 1 99 ASN 99 94 94 ASN ASN A . n A 1 100 LEU 100 95 95 LEU LEU A . n A 1 101 ASN 101 96 96 ASN ASN A . n A 1 102 ASP 102 97 97 ASP ASP A . n A 1 103 TYR 103 98 98 TYR TYR A . n A 1 104 GLU 104 99 99 GLU GLU A . n A 1 105 GLU 105 100 100 GLU GLU A . n A 1 106 LEU 106 101 101 LEU LEU A . n A 1 107 LYS 107 102 102 LYS LYS A . n A 1 108 HIS 108 103 103 HIS HIS A . n A 1 109 LEU 109 104 104 LEU LEU A . n A 1 110 LEU 110 105 105 LEU LEU A . n A 1 111 SER 111 106 106 SER SER A . n A 1 112 ARG 112 107 107 ARG ARG A . n A 1 113 ILE 113 108 108 ILE ILE A . n A 1 114 ASN 114 109 109 ASN ASN A . n A 1 115 HIS 115 110 110 HIS HIS A . n A 1 116 PHE 116 111 111 PHE PHE A . n A 1 117 GLU 117 112 112 GLU GLU A . n A 1 118 LYS 118 113 113 LYS LYS A . n A 1 119 ILE 119 114 114 ILE ILE A . n A 1 120 LEU 120 115 115 LEU LEU A . n A 1 121 ILE 121 116 116 ILE ILE A . n A 1 122 ILE 122 117 117 ILE ILE A . n A 1 123 PRO 123 118 118 PRO PRO A . n A 1 124 LYS 124 119 119 LYS LYS A . n A 1 125 SER 125 120 120 SER SER A . n A 1 126 SER 126 121 121 SER SER A . n A 1 127 TRP 127 122 122 TRP TRP A . n A 1 128 THR 128 123 123 THR THR A . n A 1 129 ASN 129 124 124 ASN ASN A . n A 1 130 HIS 130 125 125 HIS HIS A . n A 1 131 GLU 131 126 126 GLU GLU A . n A 1 132 THR 132 127 127 THR THR A . n A 1 133 SER 133 128 128 SER SER A . n A 1 134 LEU 134 129 129 LEU LEU A . n A 1 135 GLY 135 130 130 GLY GLY A . n A 1 136 VAL 136 131 131 VAL VAL A . n A 1 137 SER 137 132 132 SER SER A . n A 1 138 ALA 138 133 133 ALA ALA A . n A 1 139 ALA 139 134 134 ALA ALA A . n A 1 140 CYS 140 135 135 CYS CYS A . n A 1 141 PRO 141 136 136 PRO PRO A . n A 1 142 TYR 142 137 137 TYR TYR A . n A 1 143 GLN 143 138 138 GLN GLN A . n A 1 144 GLY 144 139 139 GLY GLY A . n A 1 145 THR 145 140 140 THR THR A . n A 1 146 PRO 146 141 141 PRO PRO A . n A 1 147 SER 147 142 142 SER SER A . n A 1 148 PHE 148 143 143 PHE PHE A . n A 1 149 PHE 149 144 144 PHE PHE A . n A 1 150 ARG 150 145 145 ARG ARG A . n A 1 151 ASN 151 146 146 ASN ASN A . n A 1 152 VAL 152 147 147 VAL VAL A . n A 1 153 VAL 153 148 148 VAL VAL A . n A 1 154 TRP 154 149 149 TRP TRP A . n A 1 155 LEU 155 150 150 LEU LEU A . n A 1 156 ILE 156 151 151 ILE ILE A . n A 1 157 LYS 157 152 152 LYS LYS A . n A 1 158 LYS 158 153 153 LYS LYS A . n A 1 159 ASN 159 154 154 ASN ASN A . n A 1 160 ASP 160 155 155 ASP ASP A . n A 1 161 ALA 161 156 156 ALA ALA A . n A 1 162 TYR 162 157 157 TYR TYR A . n A 1 163 PRO 163 158 158 PRO PRO A . n A 1 164 THR 164 159 159 THR THR A . n A 1 165 ILE 165 160 160 ILE ILE A . n A 1 166 LYS 166 161 161 LYS LYS A . n A 1 167 ILE 167 162 162 ILE ILE A . n A 1 168 SER 168 163 163 SER SER A . n A 1 169 TYR 169 164 164 TYR TYR A . n A 1 170 ASN 170 165 165 ASN ASN A . n A 1 171 ASN 171 166 166 ASN ASN A . n A 1 172 THR 172 167 167 THR THR A . n A 1 173 ASN 173 168 168 ASN ASN A . n A 1 174 GLN 174 169 169 GLN GLN A . n A 1 175 GLU 175 170 170 GLU GLU A . n A 1 176 ASP 176 171 171 ASP ASP A . n A 1 177 LEU 177 172 172 LEU LEU A . n A 1 178 LEU 178 173 173 LEU LEU A . n A 1 179 ILE 179 174 174 ILE ILE A . n A 1 180 LEU 180 175 175 LEU LEU A . n A 1 181 TRP 181 176 176 TRP TRP A . n A 1 182 GLY 182 177 177 GLY GLY A . n A 1 183 VAL 183 178 178 VAL VAL A . n A 1 184 HIS 184 179 179 HIS HIS A . n A 1 185 HIS 185 180 180 HIS HIS A . n A 1 186 SER 186 181 181 SER SER A . n A 1 187 ASN 187 182 182 ASN ASN A . n A 1 188 ASN 188 183 183 ASN ASN A . n A 1 189 ALA 189 184 184 ALA ALA A . n A 1 190 ALA 190 185 185 ALA ALA A . n A 1 191 GLU 191 186 186 GLU GLU A . n A 1 192 GLN 192 187 187 GLN GLN A . n A 1 193 THR 193 188 188 THR THR A . n A 1 194 ASN 194 189 189 ASN ASN A . n A 1 195 LEU 195 190 190 LEU LEU A . n A 1 196 TYR 196 191 191 TYR TYR A . n A 1 197 LYS 197 192 192 LYS LYS A . n A 1 198 ASN 198 193 193 ASN ASN A . n A 1 199 PRO 199 194 194 PRO PRO A . n A 1 200 THR 200 195 195 THR THR A . n A 1 201 THR 201 196 196 THR THR A . n A 1 202 TYR 202 197 197 TYR TYR A . n A 1 203 ILE 203 198 198 ILE ILE A . n A 1 204 SER 204 199 199 SER SER A . n A 1 205 VAL 205 200 200 VAL VAL A . n A 1 206 GLY 206 201 201 GLY GLY A . n A 1 207 THR 207 202 202 THR THR A . n A 1 208 SER 208 203 203 SER SER A . n A 1 209 THR 209 204 204 THR THR A . n A 1 210 LEU 210 205 205 LEU LEU A . n A 1 211 ASN 211 206 206 ASN ASN A . n A 1 212 GLN 212 207 207 GLN GLN A . n A 1 213 ARG 213 208 208 ARG ARG A . n A 1 214 LEU 214 209 209 LEU LEU A . n A 1 215 VAL 215 210 210 VAL VAL A . n A 1 216 PRO 216 211 211 PRO PRO A . n A 1 217 LYS 217 212 212 LYS LYS A . n A 1 218 ILE 218 213 213 ILE ILE A . n A 1 219 ALA 219 214 214 ALA ALA A . n A 1 220 THR 220 215 215 THR THR A . n A 1 221 ARG 221 216 216 ARG ARG A . n A 1 222 SER 222 217 217 SER SER A . n A 1 223 GLN 223 218 218 GLN GLN A . n A 1 224 VAL 224 219 219 VAL VAL A . n A 1 225 ASN 225 220 220 ASN ASN A . n A 1 226 GLY 226 221 221 GLY GLY A . n A 1 227 GLN 227 222 222 GLN GLN A . n A 1 228 ARG 228 223 223 ARG ARG A . n A 1 229 GLY 229 224 224 GLY GLY A . n A 1 230 ARG 230 225 225 ARG ARG A . n A 1 231 MET 231 226 226 MET MET A . n A 1 232 ASP 232 227 227 ASP ASP A . n A 1 233 PHE 233 228 228 PHE PHE A . n A 1 234 PHE 234 229 229 PHE PHE A . n A 1 235 TRP 235 230 230 TRP TRP A . n A 1 236 THR 236 231 231 THR THR A . n A 1 237 ILE 237 232 232 ILE ILE A . n A 1 238 LEU 238 233 233 LEU LEU A . n A 1 239 LYS 239 234 234 LYS LYS A . n A 1 240 PRO 240 235 235 PRO PRO A . n A 1 241 ASN 241 236 236 ASN ASN A . n A 1 242 ASP 242 237 237 ASP ASP A . n A 1 243 ALA 243 238 238 ALA ALA A . n A 1 244 ILE 244 239 239 ILE ILE A . n A 1 245 HIS 245 240 240 HIS HIS A . n A 1 246 PHE 246 241 241 PHE PHE A . n A 1 247 GLU 247 242 242 GLU GLU A . n A 1 248 SER 248 243 243 SER SER A . n A 1 249 ASN 249 244 244 ASN ASN A . n A 1 250 GLY 250 245 245 GLY GLY A . n A 1 251 ASN 251 246 246 ASN ASN A . n A 1 252 PHE 252 247 247 PHE PHE A . n A 1 253 ILE 253 248 248 ILE ILE A . n A 1 254 ALA 254 249 249 ALA ALA A . n A 1 255 PRO 255 250 250 PRO PRO A . n A 1 256 GLU 256 251 251 GLU GLU A . n A 1 257 TYR 257 252 252 TYR TYR A . n A 1 258 ALA 258 253 253 ALA ALA A . n A 1 259 TYR 259 254 254 TYR TYR A . n A 1 260 LYS 260 255 255 LYS LYS A . n A 1 261 ILE 261 256 256 ILE ILE A . n A 1 262 VAL 262 257 257 VAL VAL A . n A 1 263 LYS 263 258 258 LYS LYS A . n A 1 264 LYS 264 259 259 LYS LYS A . n A 1 265 GLY 265 260 260 GLY GLY A . n A 1 266 ASP 266 261 261 ASP ASP A . n A 1 267 SER 267 262 262 SER SER A . n A 1 268 THR 268 263 263 THR THR A . n A 1 269 ILE 269 264 264 ILE ILE A . n A 1 270 MET 270 265 265 MET MET A . n A 1 271 LYS 271 266 266 LYS LYS A . n A 1 272 SER 272 267 267 SER SER A . n A 1 273 GLU 273 268 268 GLU GLU A . n A 1 274 MET 274 269 269 MET MET A . n A 1 275 GLU 275 270 270 GLU GLU A . n A 1 276 TYR 276 271 271 TYR TYR A . n A 1 277 GLY 277 272 272 GLY GLY A . n A 1 278 HIS 278 273 273 HIS HIS A . n A 1 279 CYS 279 274 274 CYS CYS A . n A 1 280 ASN 280 275 275 ASN ASN A . n A 1 281 THR 281 276 276 THR THR A . n A 1 282 LYS 282 277 277 LYS LYS A . n A 1 283 CYS 283 278 278 CYS CYS A . n A 1 284 GLN 284 279 279 GLN GLN A . n A 1 285 THR 285 280 280 THR THR A . n A 1 286 PRO 286 281 281 PRO PRO A . n A 1 287 ILE 287 282 282 ILE ILE A . n A 1 288 GLY 288 283 283 GLY GLY A . n A 1 289 ALA 289 284 284 ALA ALA A . n A 1 290 ILE 290 285 285 ILE ILE A . n A 1 291 ASN 291 286 286 ASN ASN A . n A 1 292 SER 292 287 287 SER SER A . n A 1 293 SER 293 288 288 SER SER A . n A 1 294 MET 294 289 289 MET MET A . n A 1 295 PRO 295 290 290 PRO PRO A . n A 1 296 PHE 296 291 291 PHE PHE A . n A 1 297 HIS 297 292 292 HIS HIS A . n A 1 298 ASN 298 293 293 ASN ASN A . n A 1 299 ILE 299 294 294 ILE ILE A . n A 1 300 HIS 300 295 295 HIS HIS A . n A 1 301 PRO 301 296 296 PRO PRO A . n A 1 302 LEU 302 297 297 LEU LEU A . n A 1 303 THR 303 298 298 THR THR A . n A 1 304 ILE 304 299 299 ILE ILE A . n A 1 305 GLY 305 300 300 GLY GLY A . n A 1 306 GLU 306 301 301 GLU GLU A . n A 1 307 CYS 307 302 302 CYS CYS A . n A 1 308 PRO 308 303 303 PRO PRO A . n A 1 309 LYS 309 304 304 LYS LYS A . n A 1 310 TYR 310 305 305 TYR TYR A . n A 1 311 VAL 311 306 306 VAL VAL A . n A 1 312 LYS 312 307 307 LYS LYS A . n A 1 313 SER 313 308 308 SER SER A . n A 1 314 ASN 314 309 309 ASN ASN A . n A 1 315 LYS 315 310 310 LYS LYS A . n A 1 316 LEU 316 311 311 LEU LEU A . n A 1 317 VAL 317 312 312 VAL VAL A . n A 1 318 LEU 318 313 313 LEU LEU A . n A 1 319 ALA 319 314 314 ALA ALA A . n A 1 320 THR 320 315 315 THR THR A . n A 1 321 GLY 321 316 316 GLY GLY A . n A 1 322 LEU 322 317 317 LEU LEU A . n A 1 323 ARG 323 318 318 ARG ARG A . n A 1 324 ASN 324 319 319 ASN ASN A . n A 1 325 SER 325 320 ? ? ? A . n A 1 326 PRO 326 321 ? ? ? A . n A 1 327 LEU 327 322 ? ? ? A . n A 1 328 ARG 328 323 ? ? ? A . n A 1 329 GLU 329 324 ? ? ? A . n A 1 330 LYS 330 325 ? ? ? A . n A 1 331 ARG 331 326 ? ? ? A . n A 1 332 ARG 332 327 ? ? ? A . n A 1 333 LYS 333 328 ? ? ? A . n A 1 334 ARG 334 329 ? ? ? A . n B 1 1 ALA 1 -4 ? ? ? C . n B 1 2 ASP 2 -3 ? ? ? C . n B 1 3 LEU 3 -2 ? ? ? C . n B 1 4 GLY 4 -1 ? ? ? C . n B 1 5 SER 5 0 0 SER SER C . n B 1 6 ASP 6 1 1 ASP ASP C . n B 1 7 GLN 7 2 2 GLN GLN C . n B 1 8 ILE 8 3 3 ILE ILE C . n B 1 9 CYS 9 4 4 CYS CYS C . n B 1 10 ILE 10 5 5 ILE ILE C . n B 1 11 GLY 11 6 6 GLY GLY C . n B 1 12 TYR 12 7 7 TYR TYR C . n B 1 13 HIS 13 8 8 HIS HIS C . n B 1 14 ALA 14 9 9 ALA ALA C . n B 1 15 ASN 15 10 10 ASN ASN C . n B 1 16 ASN 16 11 11 ASN ASN C . n B 1 17 SER 17 12 12 SER SER C . n B 1 18 THR 18 13 13 THR THR C . n B 1 19 GLU 19 14 14 GLU GLU C . n B 1 20 GLN 20 15 15 GLN GLN C . n B 1 21 VAL 21 16 16 VAL VAL C . n B 1 22 ASP 22 17 17 ASP ASP C . n B 1 23 THR 23 18 18 THR THR C . n B 1 24 ILE 24 19 19 ILE ILE C . n B 1 25 MET 25 20 20 MET MET C . n B 1 26 GLU 26 21 21 GLU GLU C . n B 1 27 LYS 27 22 22 LYS LYS C . n B 1 28 ASN 28 23 23 ASN ASN C . n B 1 29 VAL 29 24 24 VAL VAL C . n B 1 30 THR 30 25 25 THR THR C . n B 1 31 VAL 31 26 26 VAL VAL C . n B 1 32 THR 32 27 27 THR THR C . n B 1 33 HIS 33 28 28 HIS HIS C . n B 1 34 ALA 34 29 29 ALA ALA C . n B 1 35 GLN 35 30 30 GLN GLN C . n B 1 36 ASP 36 31 31 ASP ASP C . n B 1 37 ILE 37 32 32 ILE ILE C . n B 1 38 LEU 38 33 33 LEU LEU C . n B 1 39 GLU 39 34 34 GLU GLU C . n B 1 40 LYS 40 35 35 LYS LYS C . n B 1 41 THR 41 36 36 THR THR C . n B 1 42 HIS 42 37 37 HIS HIS C . n B 1 43 ASN 43 38 38 ASN ASN C . n B 1 44 GLY 44 39 39 GLY GLY C . n B 1 45 LYS 45 40 40 LYS LYS C . n B 1 46 LEU 46 41 41 LEU LEU C . n B 1 47 CYS 47 42 42 CYS CYS C . n B 1 48 ASP 48 43 43 ASP ASP C . n B 1 49 LEU 49 44 44 LEU LEU C . n B 1 50 ASN 50 45 45 ASN ASN C . n B 1 51 GLY 51 46 46 GLY GLY C . n B 1 52 VAL 52 47 47 VAL VAL C . n B 1 53 LYS 53 48 48 LYS LYS C . n B 1 54 PRO 54 49 49 PRO PRO C . n B 1 55 LEU 55 50 50 LEU LEU C . n B 1 56 ILE 56 51 51 ILE ILE C . n B 1 57 LEU 57 52 52 LEU LEU C . n B 1 58 LYS 58 53 53 LYS LYS C . n B 1 59 ASP 59 54 54 ASP ASP C . n B 1 60 CYS 60 55 55 CYS CYS C . n B 1 61 SER 61 56 56 SER SER C . n B 1 62 VAL 62 57 57 VAL VAL C . n B 1 63 ALA 63 58 58 ALA ALA C . n B 1 64 GLY 64 59 59 GLY GLY C . n B 1 65 TRP 65 60 60 TRP TRP C . n B 1 66 LEU 66 61 61 LEU LEU C . n B 1 67 LEU 67 62 62 LEU LEU C . n B 1 68 GLY 68 63 63 GLY GLY C . n B 1 69 ASN 69 64 64 ASN ASN C . n B 1 70 PRO 70 65 65 PRO PRO C . n B 1 71 MET 71 66 66 MET MET C . n B 1 72 CYS 72 67 67 CYS CYS C . n B 1 73 ASP 73 68 68 ASP ASP C . n B 1 74 GLU 74 69 69 GLU GLU C . n B 1 75 PHE 75 70 70 PHE PHE C . n B 1 76 ILE 76 71 71 ILE ILE C . n B 1 77 ARG 77 72 72 ARG ARG C . n B 1 78 VAL 78 73 73 VAL VAL C . n B 1 79 PRO 79 74 74 PRO PRO C . n B 1 80 GLU 80 75 75 GLU GLU C . n B 1 81 TRP 81 76 76 TRP TRP C . n B 1 82 SER 82 77 77 SER SER C . n B 1 83 TYR 83 78 78 TYR TYR C . n B 1 84 ILE 84 79 79 ILE ILE C . n B 1 85 VAL 85 80 80 VAL VAL C . n B 1 86 GLU 86 81 81 GLU GLU C . n B 1 87 ARG 87 82 82 ARG ARG C . n B 1 88 ALA 88 83 83 ALA ALA C . n B 1 89 ASN 89 84 84 ASN ASN C . n B 1 90 PRO 90 85 85 PRO PRO C . n B 1 91 ALA 91 86 86 ALA ALA C . n B 1 92 ASN 92 87 87 ASN ASN C . n B 1 93 ASP 93 88 88 ASP ASP C . n B 1 94 LEU 94 89 89 LEU LEU C . n B 1 95 CYS 95 90 90 CYS CYS C . n B 1 96 TYR 96 91 91 TYR TYR C . n B 1 97 PRO 97 92 92 PRO PRO C . n B 1 98 GLY 98 93 93 GLY GLY C . n B 1 99 ASN 99 94 94 ASN ASN C . n B 1 100 LEU 100 95 95 LEU LEU C . n B 1 101 ASN 101 96 96 ASN ASN C . n B 1 102 ASP 102 97 97 ASP ASP C . n B 1 103 TYR 103 98 98 TYR TYR C . n B 1 104 GLU 104 99 99 GLU GLU C . n B 1 105 GLU 105 100 100 GLU GLU C . n B 1 106 LEU 106 101 101 LEU LEU C . n B 1 107 LYS 107 102 102 LYS LYS C . n B 1 108 HIS 108 103 103 HIS HIS C . n B 1 109 LEU 109 104 104 LEU LEU C . n B 1 110 LEU 110 105 105 LEU LEU C . n B 1 111 SER 111 106 106 SER SER C . n B 1 112 ARG 112 107 107 ARG ARG C . n B 1 113 ILE 113 108 108 ILE ILE C . n B 1 114 ASN 114 109 109 ASN ASN C . n B 1 115 HIS 115 110 110 HIS HIS C . n B 1 116 PHE 116 111 111 PHE PHE C . n B 1 117 GLU 117 112 112 GLU GLU C . n B 1 118 LYS 118 113 113 LYS LYS C . n B 1 119 ILE 119 114 114 ILE ILE C . n B 1 120 LEU 120 115 115 LEU LEU C . n B 1 121 ILE 121 116 116 ILE ILE C . n B 1 122 ILE 122 117 117 ILE ILE C . n B 1 123 PRO 123 118 118 PRO PRO C . n B 1 124 LYS 124 119 119 LYS LYS C . n B 1 125 SER 125 120 120 SER SER C . n B 1 126 SER 126 121 121 SER SER C . n B 1 127 TRP 127 122 122 TRP TRP C . n B 1 128 THR 128 123 123 THR THR C . n B 1 129 ASN 129 124 124 ASN ASN C . n B 1 130 HIS 130 125 125 HIS HIS C . n B 1 131 GLU 131 126 126 GLU GLU C . n B 1 132 THR 132 127 127 THR THR C . n B 1 133 SER 133 128 128 SER SER C . n B 1 134 LEU 134 129 129 LEU LEU C . n B 1 135 GLY 135 130 130 GLY GLY C . n B 1 136 VAL 136 131 131 VAL VAL C . n B 1 137 SER 137 132 132 SER SER C . n B 1 138 ALA 138 133 133 ALA ALA C . n B 1 139 ALA 139 134 134 ALA ALA C . n B 1 140 CYS 140 135 135 CYS CYS C . n B 1 141 PRO 141 136 136 PRO PRO C . n B 1 142 TYR 142 137 137 TYR TYR C . n B 1 143 GLN 143 138 138 GLN GLN C . n B 1 144 GLY 144 139 139 GLY GLY C . n B 1 145 THR 145 140 140 THR THR C . n B 1 146 PRO 146 141 141 PRO PRO C . n B 1 147 SER 147 142 142 SER SER C . n B 1 148 PHE 148 143 143 PHE PHE C . n B 1 149 PHE 149 144 144 PHE PHE C . n B 1 150 ARG 150 145 145 ARG ARG C . n B 1 151 ASN 151 146 146 ASN ASN C . n B 1 152 VAL 152 147 147 VAL VAL C . n B 1 153 VAL 153 148 148 VAL VAL C . n B 1 154 TRP 154 149 149 TRP TRP C . n B 1 155 LEU 155 150 150 LEU LEU C . n B 1 156 ILE 156 151 151 ILE ILE C . n B 1 157 LYS 157 152 152 LYS LYS C . n B 1 158 LYS 158 153 153 LYS LYS C . n B 1 159 ASN 159 154 154 ASN ASN C . n B 1 160 ASP 160 155 155 ASP ASP C . n B 1 161 ALA 161 156 156 ALA ALA C . n B 1 162 TYR 162 157 157 TYR TYR C . n B 1 163 PRO 163 158 158 PRO PRO C . n B 1 164 THR 164 159 159 THR THR C . n B 1 165 ILE 165 160 160 ILE ILE C . n B 1 166 LYS 166 161 161 LYS LYS C . n B 1 167 ILE 167 162 162 ILE ILE C . n B 1 168 SER 168 163 163 SER SER C . n B 1 169 TYR 169 164 164 TYR TYR C . n B 1 170 ASN 170 165 165 ASN ASN C . n B 1 171 ASN 171 166 166 ASN ASN C . n B 1 172 THR 172 167 167 THR THR C . n B 1 173 ASN 173 168 168 ASN ASN C . n B 1 174 GLN 174 169 169 GLN GLN C . n B 1 175 GLU 175 170 170 GLU GLU C . n B 1 176 ASP 176 171 171 ASP ASP C . n B 1 177 LEU 177 172 172 LEU LEU C . n B 1 178 LEU 178 173 173 LEU LEU C . n B 1 179 ILE 179 174 174 ILE ILE C . n B 1 180 LEU 180 175 175 LEU LEU C . n B 1 181 TRP 181 176 176 TRP TRP C . n B 1 182 GLY 182 177 177 GLY GLY C . n B 1 183 VAL 183 178 178 VAL VAL C . n B 1 184 HIS 184 179 179 HIS HIS C . n B 1 185 HIS 185 180 180 HIS HIS C . n B 1 186 SER 186 181 181 SER SER C . n B 1 187 ASN 187 182 182 ASN ASN C . n B 1 188 ASN 188 183 183 ASN ASN C . n B 1 189 ALA 189 184 184 ALA ALA C . n B 1 190 ALA 190 185 185 ALA ALA C . n B 1 191 GLU 191 186 186 GLU GLU C . n B 1 192 GLN 192 187 187 GLN GLN C . n B 1 193 THR 193 188 188 THR THR C . n B 1 194 ASN 194 189 189 ASN ASN C . n B 1 195 LEU 195 190 190 LEU LEU C . n B 1 196 TYR 196 191 191 TYR TYR C . n B 1 197 LYS 197 192 192 LYS LYS C . n B 1 198 ASN 198 193 193 ASN ASN C . n B 1 199 PRO 199 194 194 PRO PRO C . n B 1 200 THR 200 195 195 THR THR C . n B 1 201 THR 201 196 196 THR THR C . n B 1 202 TYR 202 197 197 TYR TYR C . n B 1 203 ILE 203 198 198 ILE ILE C . n B 1 204 SER 204 199 199 SER SER C . n B 1 205 VAL 205 200 200 VAL VAL C . n B 1 206 GLY 206 201 201 GLY GLY C . n B 1 207 THR 207 202 202 THR THR C . n B 1 208 SER 208 203 203 SER SER C . n B 1 209 THR 209 204 204 THR THR C . n B 1 210 LEU 210 205 205 LEU LEU C . n B 1 211 ASN 211 206 206 ASN ASN C . n B 1 212 GLN 212 207 207 GLN GLN C . n B 1 213 ARG 213 208 208 ARG ARG C . n B 1 214 LEU 214 209 209 LEU LEU C . n B 1 215 VAL 215 210 210 VAL VAL C . n B 1 216 PRO 216 211 211 PRO PRO C . n B 1 217 LYS 217 212 212 LYS LYS C . n B 1 218 ILE 218 213 213 ILE ILE C . n B 1 219 ALA 219 214 214 ALA ALA C . n B 1 220 THR 220 215 215 THR THR C . n B 1 221 ARG 221 216 216 ARG ARG C . n B 1 222 SER 222 217 217 SER SER C . n B 1 223 GLN 223 218 218 GLN GLN C . n B 1 224 VAL 224 219 219 VAL VAL C . n B 1 225 ASN 225 220 220 ASN ASN C . n B 1 226 GLY 226 221 221 GLY GLY C . n B 1 227 GLN 227 222 222 GLN GLN C . n B 1 228 ARG 228 223 223 ARG ARG C . n B 1 229 GLY 229 224 224 GLY GLY C . n B 1 230 ARG 230 225 225 ARG ARG C . n B 1 231 MET 231 226 226 MET MET C . n B 1 232 ASP 232 227 227 ASP ASP C . n B 1 233 PHE 233 228 228 PHE PHE C . n B 1 234 PHE 234 229 229 PHE PHE C . n B 1 235 TRP 235 230 230 TRP TRP C . n B 1 236 THR 236 231 231 THR THR C . n B 1 237 ILE 237 232 232 ILE ILE C . n B 1 238 LEU 238 233 233 LEU LEU C . n B 1 239 LYS 239 234 234 LYS LYS C . n B 1 240 PRO 240 235 235 PRO PRO C . n B 1 241 ASN 241 236 236 ASN ASN C . n B 1 242 ASP 242 237 237 ASP ASP C . n B 1 243 ALA 243 238 238 ALA ALA C . n B 1 244 ILE 244 239 239 ILE ILE C . n B 1 245 HIS 245 240 240 HIS HIS C . n B 1 246 PHE 246 241 241 PHE PHE C . n B 1 247 GLU 247 242 242 GLU GLU C . n B 1 248 SER 248 243 243 SER SER C . n B 1 249 ASN 249 244 244 ASN ASN C . n B 1 250 GLY 250 245 245 GLY GLY C . n B 1 251 ASN 251 246 246 ASN ASN C . n B 1 252 PHE 252 247 247 PHE PHE C . n B 1 253 ILE 253 248 248 ILE ILE C . n B 1 254 ALA 254 249 249 ALA ALA C . n B 1 255 PRO 255 250 250 PRO PRO C . n B 1 256 GLU 256 251 251 GLU GLU C . n B 1 257 TYR 257 252 252 TYR TYR C . n B 1 258 ALA 258 253 253 ALA ALA C . n B 1 259 TYR 259 254 254 TYR TYR C . n B 1 260 LYS 260 255 255 LYS LYS C . n B 1 261 ILE 261 256 256 ILE ILE C . n B 1 262 VAL 262 257 257 VAL VAL C . n B 1 263 LYS 263 258 258 LYS LYS C . n B 1 264 LYS 264 259 259 LYS LYS C . n B 1 265 GLY 265 260 260 GLY GLY C . n B 1 266 ASP 266 261 261 ASP ASP C . n B 1 267 SER 267 262 262 SER SER C . n B 1 268 THR 268 263 263 THR THR C . n B 1 269 ILE 269 264 264 ILE ILE C . n B 1 270 MET 270 265 265 MET MET C . n B 1 271 LYS 271 266 266 LYS LYS C . n B 1 272 SER 272 267 267 SER SER C . n B 1 273 GLU 273 268 268 GLU GLU C . n B 1 274 MET 274 269 269 MET MET C . n B 1 275 GLU 275 270 270 GLU GLU C . n B 1 276 TYR 276 271 271 TYR TYR C . n B 1 277 GLY 277 272 272 GLY GLY C . n B 1 278 HIS 278 273 273 HIS HIS C . n B 1 279 CYS 279 274 274 CYS CYS C . n B 1 280 ASN 280 275 275 ASN ASN C . n B 1 281 THR 281 276 276 THR THR C . n B 1 282 LYS 282 277 277 LYS LYS C . n B 1 283 CYS 283 278 278 CYS CYS C . n B 1 284 GLN 284 279 279 GLN GLN C . n B 1 285 THR 285 280 280 THR THR C . n B 1 286 PRO 286 281 281 PRO PRO C . n B 1 287 ILE 287 282 282 ILE ILE C . n B 1 288 GLY 288 283 283 GLY GLY C . n B 1 289 ALA 289 284 284 ALA ALA C . n B 1 290 ILE 290 285 285 ILE ILE C . n B 1 291 ASN 291 286 286 ASN ASN C . n B 1 292 SER 292 287 287 SER SER C . n B 1 293 SER 293 288 288 SER SER C . n B 1 294 MET 294 289 289 MET MET C . n B 1 295 PRO 295 290 290 PRO PRO C . n B 1 296 PHE 296 291 291 PHE PHE C . n B 1 297 HIS 297 292 292 HIS HIS C . n B 1 298 ASN 298 293 293 ASN ASN C . n B 1 299 ILE 299 294 294 ILE ILE C . n B 1 300 HIS 300 295 295 HIS HIS C . n B 1 301 PRO 301 296 296 PRO PRO C . n B 1 302 LEU 302 297 297 LEU LEU C . n B 1 303 THR 303 298 298 THR THR C . n B 1 304 ILE 304 299 299 ILE ILE C . n B 1 305 GLY 305 300 300 GLY GLY C . n B 1 306 GLU 306 301 301 GLU GLU C . n B 1 307 CYS 307 302 302 CYS CYS C . n B 1 308 PRO 308 303 303 PRO PRO C . n B 1 309 LYS 309 304 304 LYS LYS C . n B 1 310 TYR 310 305 305 TYR TYR C . n B 1 311 VAL 311 306 306 VAL VAL C . n B 1 312 LYS 312 307 307 LYS LYS C . n B 1 313 SER 313 308 308 SER SER C . n B 1 314 ASN 314 309 309 ASN ASN C . n B 1 315 LYS 315 310 310 LYS LYS C . n B 1 316 LEU 316 311 311 LEU LEU C . n B 1 317 VAL 317 312 312 VAL VAL C . n B 1 318 LEU 318 313 313 LEU LEU C . n B 1 319 ALA 319 314 314 ALA ALA C . n B 1 320 THR 320 315 315 THR THR C . n B 1 321 GLY 321 316 316 GLY GLY C . n B 1 322 LEU 322 317 317 LEU LEU C . n B 1 323 ARG 323 318 318 ARG ARG C . n B 1 324 ASN 324 319 319 ASN ASN C . n B 1 325 SER 325 320 ? ? ? C . n B 1 326 PRO 326 321 ? ? ? C . n B 1 327 LEU 327 322 ? ? ? C . n B 1 328 ARG 328 323 ? ? ? C . n B 1 329 GLU 329 324 ? ? ? C . n B 1 330 LYS 330 325 ? ? ? C . n B 1 331 ARG 331 326 ? ? ? C . n B 1 332 ARG 332 327 ? ? ? C . n B 1 333 LYS 333 328 ? ? ? C . n B 1 334 ARG 334 329 ? ? ? C . n C 1 1 ALA 1 -4 ? ? ? E . n C 1 2 ASP 2 -3 ? ? ? E . n C 1 3 LEU 3 -2 ? ? ? E . n C 1 4 GLY 4 -1 ? ? ? E . n C 1 5 SER 5 0 0 SER SER E . n C 1 6 ASP 6 1 1 ASP ASP E . n C 1 7 GLN 7 2 2 GLN GLN E . n C 1 8 ILE 8 3 3 ILE ILE E . n C 1 9 CYS 9 4 4 CYS CYS E . n C 1 10 ILE 10 5 5 ILE ILE E . n C 1 11 GLY 11 6 6 GLY GLY E . n C 1 12 TYR 12 7 7 TYR TYR E . n C 1 13 HIS 13 8 8 HIS HIS E . n C 1 14 ALA 14 9 9 ALA ALA E . n C 1 15 ASN 15 10 10 ASN ASN E . n C 1 16 ASN 16 11 11 ASN ASN E . n C 1 17 SER 17 12 12 SER SER E . n C 1 18 THR 18 13 13 THR THR E . n C 1 19 GLU 19 14 14 GLU GLU E . n C 1 20 GLN 20 15 15 GLN GLN E . n C 1 21 VAL 21 16 16 VAL VAL E . n C 1 22 ASP 22 17 17 ASP ASP E . n C 1 23 THR 23 18 18 THR THR E . n C 1 24 ILE 24 19 19 ILE ILE E . n C 1 25 MET 25 20 20 MET MET E . n C 1 26 GLU 26 21 21 GLU GLU E . n C 1 27 LYS 27 22 22 LYS LYS E . n C 1 28 ASN 28 23 23 ASN ASN E . n C 1 29 VAL 29 24 24 VAL VAL E . n C 1 30 THR 30 25 25 THR THR E . n C 1 31 VAL 31 26 26 VAL VAL E . n C 1 32 THR 32 27 27 THR THR E . n C 1 33 HIS 33 28 28 HIS HIS E . n C 1 34 ALA 34 29 29 ALA ALA E . n C 1 35 GLN 35 30 30 GLN GLN E . n C 1 36 ASP 36 31 31 ASP ASP E . n C 1 37 ILE 37 32 32 ILE ILE E . n C 1 38 LEU 38 33 33 LEU LEU E . n C 1 39 GLU 39 34 34 GLU GLU E . n C 1 40 LYS 40 35 35 LYS LYS E . n C 1 41 THR 41 36 36 THR THR E . n C 1 42 HIS 42 37 37 HIS HIS E . n C 1 43 ASN 43 38 38 ASN ASN E . n C 1 44 GLY 44 39 39 GLY GLY E . n C 1 45 LYS 45 40 40 LYS LYS E . n C 1 46 LEU 46 41 41 LEU LEU E . n C 1 47 CYS 47 42 42 CYS CYS E . n C 1 48 ASP 48 43 43 ASP ASP E . n C 1 49 LEU 49 44 44 LEU LEU E . n C 1 50 ASN 50 45 45 ASN ASN E . n C 1 51 GLY 51 46 46 GLY GLY E . n C 1 52 VAL 52 47 47 VAL VAL E . n C 1 53 LYS 53 48 48 LYS LYS E . n C 1 54 PRO 54 49 49 PRO PRO E . n C 1 55 LEU 55 50 50 LEU LEU E . n C 1 56 ILE 56 51 51 ILE ILE E . n C 1 57 LEU 57 52 52 LEU LEU E . n C 1 58 LYS 58 53 53 LYS LYS E . n C 1 59 ASP 59 54 54 ASP ASP E . n C 1 60 CYS 60 55 55 CYS CYS E . n C 1 61 SER 61 56 56 SER SER E . n C 1 62 VAL 62 57 57 VAL VAL E . n C 1 63 ALA 63 58 58 ALA ALA E . n C 1 64 GLY 64 59 59 GLY GLY E . n C 1 65 TRP 65 60 60 TRP TRP E . n C 1 66 LEU 66 61 61 LEU LEU E . n C 1 67 LEU 67 62 62 LEU LEU E . n C 1 68 GLY 68 63 63 GLY GLY E . n C 1 69 ASN 69 64 64 ASN ASN E . n C 1 70 PRO 70 65 65 PRO PRO E . n C 1 71 MET 71 66 66 MET MET E . n C 1 72 CYS 72 67 67 CYS CYS E . n C 1 73 ASP 73 68 68 ASP ASP E . n C 1 74 GLU 74 69 69 GLU GLU E . n C 1 75 PHE 75 70 70 PHE PHE E . n C 1 76 ILE 76 71 71 ILE ILE E . n C 1 77 ARG 77 72 72 ARG ARG E . n C 1 78 VAL 78 73 73 VAL VAL E . n C 1 79 PRO 79 74 74 PRO PRO E . n C 1 80 GLU 80 75 75 GLU GLU E . n C 1 81 TRP 81 76 76 TRP TRP E . n C 1 82 SER 82 77 77 SER SER E . n C 1 83 TYR 83 78 78 TYR TYR E . n C 1 84 ILE 84 79 79 ILE ILE E . n C 1 85 VAL 85 80 80 VAL VAL E . n C 1 86 GLU 86 81 81 GLU GLU E . n C 1 87 ARG 87 82 82 ARG ARG E . n C 1 88 ALA 88 83 83 ALA ALA E . n C 1 89 ASN 89 84 84 ASN ASN E . n C 1 90 PRO 90 85 85 PRO PRO E . n C 1 91 ALA 91 86 86 ALA ALA E . n C 1 92 ASN 92 87 87 ASN ASN E . n C 1 93 ASP 93 88 88 ASP ASP E . n C 1 94 LEU 94 89 89 LEU LEU E . n C 1 95 CYS 95 90 90 CYS CYS E . n C 1 96 TYR 96 91 91 TYR TYR E . n C 1 97 PRO 97 92 92 PRO PRO E . n C 1 98 GLY 98 93 93 GLY GLY E . n C 1 99 ASN 99 94 94 ASN ASN E . n C 1 100 LEU 100 95 95 LEU LEU E . n C 1 101 ASN 101 96 96 ASN ASN E . n C 1 102 ASP 102 97 97 ASP ASP E . n C 1 103 TYR 103 98 98 TYR TYR E . n C 1 104 GLU 104 99 99 GLU GLU E . n C 1 105 GLU 105 100 100 GLU GLU E . n C 1 106 LEU 106 101 101 LEU LEU E . n C 1 107 LYS 107 102 102 LYS LYS E . n C 1 108 HIS 108 103 103 HIS HIS E . n C 1 109 LEU 109 104 104 LEU LEU E . n C 1 110 LEU 110 105 105 LEU LEU E . n C 1 111 SER 111 106 106 SER SER E . n C 1 112 ARG 112 107 107 ARG ARG E . n C 1 113 ILE 113 108 108 ILE ILE E . n C 1 114 ASN 114 109 109 ASN ASN E . n C 1 115 HIS 115 110 110 HIS HIS E . n C 1 116 PHE 116 111 111 PHE PHE E . n C 1 117 GLU 117 112 112 GLU GLU E . n C 1 118 LYS 118 113 113 LYS LYS E . n C 1 119 ILE 119 114 114 ILE ILE E . n C 1 120 LEU 120 115 115 LEU LEU E . n C 1 121 ILE 121 116 116 ILE ILE E . n C 1 122 ILE 122 117 117 ILE ILE E . n C 1 123 PRO 123 118 118 PRO PRO E . n C 1 124 LYS 124 119 119 LYS LYS E . n C 1 125 SER 125 120 120 SER SER E . n C 1 126 SER 126 121 121 SER SER E . n C 1 127 TRP 127 122 122 TRP TRP E . n C 1 128 THR 128 123 123 THR THR E . n C 1 129 ASN 129 124 124 ASN ASN E . n C 1 130 HIS 130 125 125 HIS HIS E . n C 1 131 GLU 131 126 126 GLU GLU E . n C 1 132 THR 132 127 127 THR THR E . n C 1 133 SER 133 128 128 SER SER E . n C 1 134 LEU 134 129 129 LEU LEU E . n C 1 135 GLY 135 130 130 GLY GLY E . n C 1 136 VAL 136 131 131 VAL VAL E . n C 1 137 SER 137 132 132 SER SER E . n C 1 138 ALA 138 133 133 ALA ALA E . n C 1 139 ALA 139 134 134 ALA ALA E . n C 1 140 CYS 140 135 135 CYS CYS E . n C 1 141 PRO 141 136 136 PRO PRO E . n C 1 142 TYR 142 137 137 TYR TYR E . n C 1 143 GLN 143 138 138 GLN GLN E . n C 1 144 GLY 144 139 139 GLY GLY E . n C 1 145 THR 145 140 140 THR THR E . n C 1 146 PRO 146 141 141 PRO PRO E . n C 1 147 SER 147 142 142 SER SER E . n C 1 148 PHE 148 143 143 PHE PHE E . n C 1 149 PHE 149 144 144 PHE PHE E . n C 1 150 ARG 150 145 145 ARG ARG E . n C 1 151 ASN 151 146 146 ASN ASN E . n C 1 152 VAL 152 147 147 VAL VAL E . n C 1 153 VAL 153 148 148 VAL VAL E . n C 1 154 TRP 154 149 149 TRP TRP E . n C 1 155 LEU 155 150 150 LEU LEU E . n C 1 156 ILE 156 151 151 ILE ILE E . n C 1 157 LYS 157 152 152 LYS LYS E . n C 1 158 LYS 158 153 153 LYS LYS E . n C 1 159 ASN 159 154 154 ASN ASN E . n C 1 160 ASP 160 155 155 ASP ASP E . n C 1 161 ALA 161 156 156 ALA ALA E . n C 1 162 TYR 162 157 157 TYR TYR E . n C 1 163 PRO 163 158 158 PRO PRO E . n C 1 164 THR 164 159 159 THR THR E . n C 1 165 ILE 165 160 160 ILE ILE E . n C 1 166 LYS 166 161 161 LYS LYS E . n C 1 167 ILE 167 162 162 ILE ILE E . n C 1 168 SER 168 163 163 SER SER E . n C 1 169 TYR 169 164 164 TYR TYR E . n C 1 170 ASN 170 165 165 ASN ASN E . n C 1 171 ASN 171 166 166 ASN ASN E . n C 1 172 THR 172 167 167 THR THR E . n C 1 173 ASN 173 168 168 ASN ASN E . n C 1 174 GLN 174 169 169 GLN GLN E . n C 1 175 GLU 175 170 170 GLU GLU E . n C 1 176 ASP 176 171 171 ASP ASP E . n C 1 177 LEU 177 172 172 LEU LEU E . n C 1 178 LEU 178 173 173 LEU LEU E . n C 1 179 ILE 179 174 174 ILE ILE E . n C 1 180 LEU 180 175 175 LEU LEU E . n C 1 181 TRP 181 176 176 TRP TRP E . n C 1 182 GLY 182 177 177 GLY GLY E . n C 1 183 VAL 183 178 178 VAL VAL E . n C 1 184 HIS 184 179 179 HIS HIS E . n C 1 185 HIS 185 180 180 HIS HIS E . n C 1 186 SER 186 181 181 SER SER E . n C 1 187 ASN 187 182 182 ASN ASN E . n C 1 188 ASN 188 183 183 ASN ASN E . n C 1 189 ALA 189 184 184 ALA ALA E . n C 1 190 ALA 190 185 185 ALA ALA E . n C 1 191 GLU 191 186 186 GLU GLU E . n C 1 192 GLN 192 187 187 GLN GLN E . n C 1 193 THR 193 188 188 THR THR E . n C 1 194 ASN 194 189 189 ASN ASN E . n C 1 195 LEU 195 190 190 LEU LEU E . n C 1 196 TYR 196 191 191 TYR TYR E . n C 1 197 LYS 197 192 192 LYS LYS E . n C 1 198 ASN 198 193 193 ASN ASN E . n C 1 199 PRO 199 194 194 PRO PRO E . n C 1 200 THR 200 195 195 THR THR E . n C 1 201 THR 201 196 196 THR THR E . n C 1 202 TYR 202 197 197 TYR TYR E . n C 1 203 ILE 203 198 198 ILE ILE E . n C 1 204 SER 204 199 199 SER SER E . n C 1 205 VAL 205 200 200 VAL VAL E . n C 1 206 GLY 206 201 201 GLY GLY E . n C 1 207 THR 207 202 202 THR THR E . n C 1 208 SER 208 203 203 SER SER E . n C 1 209 THR 209 204 204 THR THR E . n C 1 210 LEU 210 205 205 LEU LEU E . n C 1 211 ASN 211 206 206 ASN ASN E . n C 1 212 GLN 212 207 207 GLN GLN E . n C 1 213 ARG 213 208 208 ARG ARG E . n C 1 214 LEU 214 209 209 LEU LEU E . n C 1 215 VAL 215 210 210 VAL VAL E . n C 1 216 PRO 216 211 211 PRO PRO E . n C 1 217 LYS 217 212 212 LYS LYS E . n C 1 218 ILE 218 213 213 ILE ILE E . n C 1 219 ALA 219 214 214 ALA ALA E . n C 1 220 THR 220 215 215 THR THR E . n C 1 221 ARG 221 216 216 ARG ARG E . n C 1 222 SER 222 217 217 SER SER E . n C 1 223 GLN 223 218 218 GLN GLN E . n C 1 224 VAL 224 219 219 VAL VAL E . n C 1 225 ASN 225 220 220 ASN ASN E . n C 1 226 GLY 226 221 221 GLY GLY E . n C 1 227 GLN 227 222 222 GLN GLN E . n C 1 228 ARG 228 223 223 ARG ARG E . n C 1 229 GLY 229 224 224 GLY GLY E . n C 1 230 ARG 230 225 225 ARG ARG E . n C 1 231 MET 231 226 226 MET MET E . n C 1 232 ASP 232 227 227 ASP ASP E . n C 1 233 PHE 233 228 228 PHE PHE E . n C 1 234 PHE 234 229 229 PHE PHE E . n C 1 235 TRP 235 230 230 TRP TRP E . n C 1 236 THR 236 231 231 THR THR E . n C 1 237 ILE 237 232 232 ILE ILE E . n C 1 238 LEU 238 233 233 LEU LEU E . n C 1 239 LYS 239 234 234 LYS LYS E . n C 1 240 PRO 240 235 235 PRO PRO E . n C 1 241 ASN 241 236 236 ASN ASN E . n C 1 242 ASP 242 237 237 ASP ASP E . n C 1 243 ALA 243 238 238 ALA ALA E . n C 1 244 ILE 244 239 239 ILE ILE E . n C 1 245 HIS 245 240 240 HIS HIS E . n C 1 246 PHE 246 241 241 PHE PHE E . n C 1 247 GLU 247 242 242 GLU GLU E . n C 1 248 SER 248 243 243 SER SER E . n C 1 249 ASN 249 244 244 ASN ASN E . n C 1 250 GLY 250 245 245 GLY GLY E . n C 1 251 ASN 251 246 246 ASN ASN E . n C 1 252 PHE 252 247 247 PHE PHE E . n C 1 253 ILE 253 248 248 ILE ILE E . n C 1 254 ALA 254 249 249 ALA ALA E . n C 1 255 PRO 255 250 250 PRO PRO E . n C 1 256 GLU 256 251 251 GLU GLU E . n C 1 257 TYR 257 252 252 TYR TYR E . n C 1 258 ALA 258 253 253 ALA ALA E . n C 1 259 TYR 259 254 254 TYR TYR E . n C 1 260 LYS 260 255 255 LYS LYS E . n C 1 261 ILE 261 256 256 ILE ILE E . n C 1 262 VAL 262 257 257 VAL VAL E . n C 1 263 LYS 263 258 258 LYS LYS E . n C 1 264 LYS 264 259 259 LYS LYS E . n C 1 265 GLY 265 260 260 GLY GLY E . n C 1 266 ASP 266 261 261 ASP ASP E . n C 1 267 SER 267 262 262 SER SER E . n C 1 268 THR 268 263 263 THR THR E . n C 1 269 ILE 269 264 264 ILE ILE E . n C 1 270 MET 270 265 265 MET MET E . n C 1 271 LYS 271 266 266 LYS LYS E . n C 1 272 SER 272 267 267 SER SER E . n C 1 273 GLU 273 268 268 GLU GLU E . n C 1 274 MET 274 269 269 MET MET E . n C 1 275 GLU 275 270 270 GLU GLU E . n C 1 276 TYR 276 271 271 TYR TYR E . n C 1 277 GLY 277 272 272 GLY GLY E . n C 1 278 HIS 278 273 273 HIS HIS E . n C 1 279 CYS 279 274 274 CYS CYS E . n C 1 280 ASN 280 275 275 ASN ASN E . n C 1 281 THR 281 276 276 THR THR E . n C 1 282 LYS 282 277 277 LYS LYS E . n C 1 283 CYS 283 278 278 CYS CYS E . n C 1 284 GLN 284 279 279 GLN GLN E . n C 1 285 THR 285 280 280 THR THR E . n C 1 286 PRO 286 281 281 PRO PRO E . n C 1 287 ILE 287 282 282 ILE ILE E . n C 1 288 GLY 288 283 283 GLY GLY E . n C 1 289 ALA 289 284 284 ALA ALA E . n C 1 290 ILE 290 285 285 ILE ILE E . n C 1 291 ASN 291 286 286 ASN ASN E . n C 1 292 SER 292 287 287 SER SER E . n C 1 293 SER 293 288 288 SER SER E . n C 1 294 MET 294 289 289 MET MET E . n C 1 295 PRO 295 290 290 PRO PRO E . n C 1 296 PHE 296 291 291 PHE PHE E . n C 1 297 HIS 297 292 292 HIS HIS E . n C 1 298 ASN 298 293 293 ASN ASN E . n C 1 299 ILE 299 294 294 ILE ILE E . n C 1 300 HIS 300 295 295 HIS HIS E . n C 1 301 PRO 301 296 296 PRO PRO E . n C 1 302 LEU 302 297 297 LEU LEU E . n C 1 303 THR 303 298 298 THR THR E . n C 1 304 ILE 304 299 299 ILE ILE E . n C 1 305 GLY 305 300 300 GLY GLY E . n C 1 306 GLU 306 301 301 GLU GLU E . n C 1 307 CYS 307 302 302 CYS CYS E . n C 1 308 PRO 308 303 303 PRO PRO E . n C 1 309 LYS 309 304 304 LYS LYS E . n C 1 310 TYR 310 305 305 TYR TYR E . n C 1 311 VAL 311 306 306 VAL VAL E . n C 1 312 LYS 312 307 307 LYS LYS E . n C 1 313 SER 313 308 308 SER SER E . n C 1 314 ASN 314 309 309 ASN ASN E . n C 1 315 LYS 315 310 310 LYS LYS E . n C 1 316 LEU 316 311 311 LEU LEU E . n C 1 317 VAL 317 312 312 VAL VAL E . n C 1 318 LEU 318 313 313 LEU LEU E . n C 1 319 ALA 319 314 314 ALA ALA E . n C 1 320 THR 320 315 315 THR THR E . n C 1 321 GLY 321 316 316 GLY GLY E . n C 1 322 LEU 322 317 317 LEU LEU E . n C 1 323 ARG 323 318 318 ARG ARG E . n C 1 324 ASN 324 319 319 ASN ASN E . n C 1 325 SER 325 320 ? ? ? E . n C 1 326 PRO 326 321 ? ? ? E . n C 1 327 LEU 327 322 ? ? ? E . n C 1 328 ARG 328 323 ? ? ? E . n C 1 329 GLU 329 324 ? ? ? E . n C 1 330 LYS 330 325 ? ? ? E . n C 1 331 ARG 331 326 ? ? ? E . n C 1 332 ARG 332 327 ? ? ? E . n C 1 333 LYS 333 328 ? ? ? E . n C 1 334 ARG 334 329 ? ? ? E . n D 2 1 GLY 1 1 ? ? ? B . n D 2 2 LEU 2 2 ? ? ? B . n D 2 3 PHE 3 3 ? ? ? B . n D 2 4 GLY 4 4 ? ? ? B . n D 2 5 ALA 5 5 ? ? ? B . n D 2 6 ILE 6 6 ? ? ? B . n D 2 7 ALA 7 7 ? ? ? B . n D 2 8 GLY 8 8 ? ? ? B . n D 2 9 PHE 9 9 ? ? ? B . n D 2 10 ILE 10 10 ? ? ? B . n D 2 11 GLU 11 11 ? ? ? B . n D 2 12 GLY 12 12 12 GLY GLY B . n D 2 13 GLY 13 13 13 GLY GLY B . n D 2 14 TRP 14 14 14 TRP TRP B . n D 2 15 GLN 15 15 15 GLN GLN B . n D 2 16 GLY 16 16 16 GLY GLY B . n D 2 17 MET 17 17 17 MET MET B . n D 2 18 VAL 18 18 18 VAL VAL B . n D 2 19 ASP 19 19 19 ASP ASP B . n D 2 20 GLY 20 20 20 GLY GLY B . n D 2 21 TRP 21 21 21 TRP TRP B . n D 2 22 TYR 22 22 22 TYR TYR B . n D 2 23 GLY 23 23 23 GLY GLY B . n D 2 24 TYR 24 24 24 TYR TYR B . n D 2 25 HIS 25 25 25 HIS HIS B . n D 2 26 HIS 26 26 26 HIS HIS B . n D 2 27 SER 27 27 27 SER SER B . n D 2 28 ASN 28 28 28 ASN ASN B . n D 2 29 GLU 29 29 29 GLU GLU B . n D 2 30 GLN 30 30 30 GLN GLN B . n D 2 31 GLY 31 31 31 GLY GLY B . n D 2 32 SER 32 32 32 SER SER B . n D 2 33 GLY 33 33 33 GLY GLY B . n D 2 34 TYR 34 34 34 TYR TYR B . n D 2 35 ALA 35 35 35 ALA ALA B . n D 2 36 ALA 36 36 36 ALA ALA B . n D 2 37 ASP 37 37 37 ASP ASP B . n D 2 38 LYS 38 38 38 LYS LYS B . n D 2 39 GLU 39 39 39 GLU GLU B . n D 2 40 SER 40 40 40 SER SER B . n D 2 41 THR 41 41 41 THR THR B . n D 2 42 GLN 42 42 42 GLN GLN B . n D 2 43 LYS 43 43 43 LYS LYS B . n D 2 44 ALA 44 44 44 ALA ALA B . n D 2 45 ILE 45 45 45 ILE ILE B . n D 2 46 ASP 46 46 46 ASP ASP B . n D 2 47 GLY 47 47 47 GLY GLY B . n D 2 48 VAL 48 48 48 VAL VAL B . n D 2 49 THR 49 49 49 THR THR B . n D 2 50 ASN 50 50 50 ASN ASN B . n D 2 51 LYS 51 51 51 LYS LYS B . n D 2 52 VAL 52 52 52 VAL VAL B . n D 2 53 ASN 53 53 53 ASN ASN B . n D 2 54 SER 54 54 54 SER SER B . n D 2 55 ILE 55 55 55 ILE ILE B . n D 2 56 ILE 56 56 56 ILE ILE B . n D 2 57 ASP 57 57 57 ASP ASP B . n D 2 58 LYS 58 58 58 LYS LYS B . n D 2 59 MET 59 59 59 MET MET B . n D 2 60 ASN 60 60 60 ASN ASN B . n D 2 61 THR 61 61 61 THR THR B . n D 2 62 GLN 62 62 62 GLN GLN B . n D 2 63 PHE 63 63 63 PHE PHE B . n D 2 64 GLU 64 64 64 GLU GLU B . n D 2 65 ALA 65 65 65 ALA ALA B . n D 2 66 VAL 66 66 66 VAL VAL B . n D 2 67 GLY 67 67 67 GLY GLY B . n D 2 68 ARG 68 68 68 ARG ARG B . n D 2 69 GLU 69 69 69 GLU GLU B . n D 2 70 PHE 70 70 70 PHE PHE B . n D 2 71 ASN 71 71 71 ASN ASN B . n D 2 72 ASN 72 72 72 ASN ASN B . n D 2 73 LEU 73 73 73 LEU LEU B . n D 2 74 GLU 74 74 74 GLU GLU B . n D 2 75 ARG 75 75 75 ARG ARG B . n D 2 76 ARG 76 76 76 ARG ARG B . n D 2 77 ILE 77 77 77 ILE ILE B . n D 2 78 GLU 78 78 78 GLU GLU B . n D 2 79 ASN 79 79 79 ASN ASN B . n D 2 80 LEU 80 80 80 LEU LEU B . n D 2 81 ASN 81 81 81 ASN ASN B . n D 2 82 LYS 82 82 82 LYS LYS B . n D 2 83 LYS 83 83 83 LYS LYS B . n D 2 84 MET 84 84 84 MET MET B . n D 2 85 GLU 85 85 85 GLU GLU B . n D 2 86 ASP 86 86 86 ASP ASP B . n D 2 87 GLY 87 87 87 GLY GLY B . n D 2 88 PHE 88 88 88 PHE PHE B . n D 2 89 LEU 89 89 89 LEU LEU B . n D 2 90 ASP 90 90 90 ASP ASP B . n D 2 91 VAL 91 91 91 VAL VAL B . n D 2 92 TRP 92 92 92 TRP TRP B . n D 2 93 THR 93 93 93 THR THR B . n D 2 94 TYR 94 94 94 TYR TYR B . n D 2 95 ASN 95 95 95 ASN ASN B . n D 2 96 ALA 96 96 96 ALA ALA B . n D 2 97 GLU 97 97 97 GLU GLU B . n D 2 98 LEU 98 98 98 LEU LEU B . n D 2 99 LEU 99 99 99 LEU LEU B . n D 2 100 VAL 100 100 100 VAL VAL B . n D 2 101 LEU 101 101 101 LEU LEU B . n D 2 102 MET 102 102 102 MET MET B . n D 2 103 GLU 103 103 103 GLU GLU B . n D 2 104 ASN 104 104 104 ASN ASN B . n D 2 105 GLU 105 105 105 GLU GLU B . n D 2 106 ARG 106 106 106 ARG ARG B . n D 2 107 THR 107 107 107 THR THR B . n D 2 108 LEU 108 108 108 LEU LEU B . n D 2 109 ASP 109 109 109 ASP ASP B . n D 2 110 PHE 110 110 110 PHE PHE B . n D 2 111 HIS 111 111 111 HIS HIS B . n D 2 112 ASP 112 112 112 ASP ASP B . n D 2 113 SER 113 113 113 SER SER B . n D 2 114 ASN 114 114 114 ASN ASN B . n D 2 115 VAL 115 115 115 VAL VAL B . n D 2 116 LYS 116 116 116 LYS LYS B . n D 2 117 ASN 117 117 117 ASN ASN B . n D 2 118 LEU 118 118 118 LEU LEU B . n D 2 119 TYR 119 119 119 TYR TYR B . n D 2 120 ASP 120 120 120 ASP ASP B . n D 2 121 LYS 121 121 121 LYS LYS B . n D 2 122 VAL 122 122 122 VAL VAL B . n D 2 123 ARG 123 123 123 ARG ARG B . n D 2 124 LEU 124 124 124 LEU LEU B . n D 2 125 GLN 125 125 125 GLN GLN B . n D 2 126 LEU 126 126 126 LEU LEU B . n D 2 127 ARG 127 127 127 ARG ARG B . n D 2 128 ASP 128 128 128 ASP ASP B . n D 2 129 ASN 129 129 129 ASN ASN B . n D 2 130 ALA 130 130 130 ALA ALA B . n D 2 131 LYS 131 131 131 LYS LYS B . n D 2 132 GLU 132 132 132 GLU GLU B . n D 2 133 LEU 133 133 133 LEU LEU B . n D 2 134 GLY 134 134 134 GLY GLY B . n D 2 135 ASN 135 135 135 ASN ASN B . n D 2 136 GLY 136 136 136 GLY GLY B . n D 2 137 CYS 137 137 137 CYS CYS B . n D 2 138 PHE 138 138 138 PHE PHE B . n D 2 139 GLU 139 139 139 GLU GLU B . n D 2 140 PHE 140 140 140 PHE PHE B . n D 2 141 TYR 141 141 141 TYR TYR B . n D 2 142 HIS 142 142 142 HIS HIS B . n D 2 143 LYS 143 143 143 LYS LYS B . n D 2 144 CYS 144 144 144 CYS CYS B . n D 2 145 ASP 145 145 145 ASP ASP B . n D 2 146 ASN 146 146 146 ASN ASN B . n D 2 147 LYS 147 147 147 LYS LYS B . n D 2 148 CYS 148 148 148 CYS CYS B . n D 2 149 MET 149 149 149 MET MET B . n D 2 150 GLU 150 150 150 GLU GLU B . n D 2 151 SER 151 151 151 SER SER B . n D 2 152 VAL 152 152 152 VAL VAL B . n D 2 153 ARG 153 153 153 ARG ARG B . n D 2 154 ASN 154 154 154 ASN ASN B . n D 2 155 GLY 155 155 155 GLY GLY B . n D 2 156 THR 156 156 156 THR THR B . n D 2 157 TYR 157 157 157 TYR TYR B . n D 2 158 ASP 158 158 158 ASP ASP B . n D 2 159 TYR 159 159 159 TYR TYR B . n D 2 160 PRO 160 160 160 PRO PRO B . n D 2 161 GLN 161 161 161 GLN GLN B . n D 2 162 TYR 162 162 162 TYR TYR B . n D 2 163 SER 163 163 163 SER SER B . n D 2 164 GLU 164 164 164 GLU GLU B . n D 2 165 GLU 165 165 165 GLU GLU B . n D 2 166 ALA 166 166 166 ALA ALA B . n D 2 167 ARG 167 167 167 ARG ARG B . n D 2 168 LEU 168 168 168 LEU LEU B . n D 2 169 LYS 169 169 169 LYS LYS B . n D 2 170 ARG 170 170 170 ARG ARG B . n D 2 171 GLU 171 171 171 GLU GLU B . n D 2 172 GLU 172 172 172 GLU GLU B . n D 2 173 ILE 173 173 173 ILE ILE B . n D 2 174 SER 174 174 ? ? ? B . n D 2 175 SER 175 175 ? ? ? B . n D 2 176 GLY 176 176 ? ? ? B . n D 2 177 ARG 177 177 ? ? ? B . n D 2 178 LEU 178 178 ? ? ? B . n D 2 179 VAL 179 179 ? ? ? B . n D 2 180 PRO 180 180 ? ? ? B . n D 2 181 ARG 181 181 ? ? ? B . n E 2 1 GLY 1 1 ? ? ? D . n E 2 2 LEU 2 2 ? ? ? D . n E 2 3 PHE 3 3 ? ? ? D . n E 2 4 GLY 4 4 ? ? ? D . n E 2 5 ALA 5 5 ? ? ? D . n E 2 6 ILE 6 6 ? ? ? D . n E 2 7 ALA 7 7 ? ? ? D . n E 2 8 GLY 8 8 ? ? ? D . n E 2 9 PHE 9 9 ? ? ? D . n E 2 10 ILE 10 10 ? ? ? D . n E 2 11 GLU 11 11 ? ? ? D . n E 2 12 GLY 12 12 12 GLY GLY D . n E 2 13 GLY 13 13 13 GLY GLY D . n E 2 14 TRP 14 14 14 TRP TRP D . n E 2 15 GLN 15 15 15 GLN GLN D . n E 2 16 GLY 16 16 16 GLY GLY D . n E 2 17 MET 17 17 17 MET MET D . n E 2 18 VAL 18 18 18 VAL VAL D . n E 2 19 ASP 19 19 19 ASP ASP D . n E 2 20 GLY 20 20 20 GLY GLY D . n E 2 21 TRP 21 21 21 TRP TRP D . n E 2 22 TYR 22 22 22 TYR TYR D . n E 2 23 GLY 23 23 23 GLY GLY D . n E 2 24 TYR 24 24 24 TYR TYR D . n E 2 25 HIS 25 25 25 HIS HIS D . n E 2 26 HIS 26 26 26 HIS HIS D . n E 2 27 SER 27 27 27 SER SER D . n E 2 28 ASN 28 28 28 ASN ASN D . n E 2 29 GLU 29 29 29 GLU GLU D . n E 2 30 GLN 30 30 30 GLN GLN D . n E 2 31 GLY 31 31 31 GLY GLY D . n E 2 32 SER 32 32 32 SER SER D . n E 2 33 GLY 33 33 33 GLY GLY D . n E 2 34 TYR 34 34 34 TYR TYR D . n E 2 35 ALA 35 35 35 ALA ALA D . n E 2 36 ALA 36 36 36 ALA ALA D . n E 2 37 ASP 37 37 37 ASP ASP D . n E 2 38 LYS 38 38 38 LYS LYS D . n E 2 39 GLU 39 39 39 GLU GLU D . n E 2 40 SER 40 40 40 SER SER D . n E 2 41 THR 41 41 41 THR THR D . n E 2 42 GLN 42 42 42 GLN GLN D . n E 2 43 LYS 43 43 43 LYS LYS D . n E 2 44 ALA 44 44 44 ALA ALA D . n E 2 45 ILE 45 45 45 ILE ILE D . n E 2 46 ASP 46 46 46 ASP ASP D . n E 2 47 GLY 47 47 47 GLY GLY D . n E 2 48 VAL 48 48 48 VAL VAL D . n E 2 49 THR 49 49 49 THR THR D . n E 2 50 ASN 50 50 50 ASN ASN D . n E 2 51 LYS 51 51 51 LYS LYS D . n E 2 52 VAL 52 52 52 VAL VAL D . n E 2 53 ASN 53 53 53 ASN ASN D . n E 2 54 SER 54 54 54 SER SER D . n E 2 55 ILE 55 55 55 ILE ILE D . n E 2 56 ILE 56 56 56 ILE ILE D . n E 2 57 ASP 57 57 57 ASP ASP D . n E 2 58 LYS 58 58 58 LYS LYS D . n E 2 59 MET 59 59 59 MET MET D . n E 2 60 ASN 60 60 60 ASN ASN D . n E 2 61 THR 61 61 61 THR THR D . n E 2 62 GLN 62 62 62 GLN GLN D . n E 2 63 PHE 63 63 63 PHE PHE D . n E 2 64 GLU 64 64 64 GLU GLU D . n E 2 65 ALA 65 65 65 ALA ALA D . n E 2 66 VAL 66 66 66 VAL VAL D . n E 2 67 GLY 67 67 67 GLY GLY D . n E 2 68 ARG 68 68 68 ARG ARG D . n E 2 69 GLU 69 69 69 GLU GLU D . n E 2 70 PHE 70 70 70 PHE PHE D . n E 2 71 ASN 71 71 71 ASN ASN D . n E 2 72 ASN 72 72 72 ASN ASN D . n E 2 73 LEU 73 73 73 LEU LEU D . n E 2 74 GLU 74 74 74 GLU GLU D . n E 2 75 ARG 75 75 75 ARG ARG D . n E 2 76 ARG 76 76 76 ARG ARG D . n E 2 77 ILE 77 77 77 ILE ILE D . n E 2 78 GLU 78 78 78 GLU GLU D . n E 2 79 ASN 79 79 79 ASN ASN D . n E 2 80 LEU 80 80 80 LEU LEU D . n E 2 81 ASN 81 81 81 ASN ASN D . n E 2 82 LYS 82 82 82 LYS LYS D . n E 2 83 LYS 83 83 83 LYS LYS D . n E 2 84 MET 84 84 84 MET MET D . n E 2 85 GLU 85 85 85 GLU GLU D . n E 2 86 ASP 86 86 86 ASP ASP D . n E 2 87 GLY 87 87 87 GLY GLY D . n E 2 88 PHE 88 88 88 PHE PHE D . n E 2 89 LEU 89 89 89 LEU LEU D . n E 2 90 ASP 90 90 90 ASP ASP D . n E 2 91 VAL 91 91 91 VAL VAL D . n E 2 92 TRP 92 92 92 TRP TRP D . n E 2 93 THR 93 93 93 THR THR D . n E 2 94 TYR 94 94 94 TYR TYR D . n E 2 95 ASN 95 95 95 ASN ASN D . n E 2 96 ALA 96 96 96 ALA ALA D . n E 2 97 GLU 97 97 97 GLU GLU D . n E 2 98 LEU 98 98 98 LEU LEU D . n E 2 99 LEU 99 99 99 LEU LEU D . n E 2 100 VAL 100 100 100 VAL VAL D . n E 2 101 LEU 101 101 101 LEU LEU D . n E 2 102 MET 102 102 102 MET MET D . n E 2 103 GLU 103 103 103 GLU GLU D . n E 2 104 ASN 104 104 104 ASN ASN D . n E 2 105 GLU 105 105 105 GLU GLU D . n E 2 106 ARG 106 106 106 ARG ARG D . n E 2 107 THR 107 107 107 THR THR D . n E 2 108 LEU 108 108 108 LEU LEU D . n E 2 109 ASP 109 109 109 ASP ASP D . n E 2 110 PHE 110 110 110 PHE PHE D . n E 2 111 HIS 111 111 111 HIS HIS D . n E 2 112 ASP 112 112 112 ASP ASP D . n E 2 113 SER 113 113 113 SER SER D . n E 2 114 ASN 114 114 114 ASN ASN D . n E 2 115 VAL 115 115 115 VAL VAL D . n E 2 116 LYS 116 116 116 LYS LYS D . n E 2 117 ASN 117 117 117 ASN ASN D . n E 2 118 LEU 118 118 118 LEU LEU D . n E 2 119 TYR 119 119 119 TYR TYR D . n E 2 120 ASP 120 120 120 ASP ASP D . n E 2 121 LYS 121 121 121 LYS LYS D . n E 2 122 VAL 122 122 122 VAL VAL D . n E 2 123 ARG 123 123 123 ARG ARG D . n E 2 124 LEU 124 124 124 LEU LEU D . n E 2 125 GLN 125 125 125 GLN GLN D . n E 2 126 LEU 126 126 126 LEU LEU D . n E 2 127 ARG 127 127 127 ARG ARG D . n E 2 128 ASP 128 128 128 ASP ASP D . n E 2 129 ASN 129 129 129 ASN ASN D . n E 2 130 ALA 130 130 130 ALA ALA D . n E 2 131 LYS 131 131 131 LYS LYS D . n E 2 132 GLU 132 132 132 GLU GLU D . n E 2 133 LEU 133 133 133 LEU LEU D . n E 2 134 GLY 134 134 134 GLY GLY D . n E 2 135 ASN 135 135 135 ASN ASN D . n E 2 136 GLY 136 136 136 GLY GLY D . n E 2 137 CYS 137 137 137 CYS CYS D . n E 2 138 PHE 138 138 138 PHE PHE D . n E 2 139 GLU 139 139 139 GLU GLU D . n E 2 140 PHE 140 140 140 PHE PHE D . n E 2 141 TYR 141 141 141 TYR TYR D . n E 2 142 HIS 142 142 142 HIS HIS D . n E 2 143 LYS 143 143 143 LYS LYS D . n E 2 144 CYS 144 144 144 CYS CYS D . n E 2 145 ASP 145 145 145 ASP ASP D . n E 2 146 ASN 146 146 146 ASN ASN D . n E 2 147 LYS 147 147 147 LYS LYS D . n E 2 148 CYS 148 148 148 CYS CYS D . n E 2 149 MET 149 149 149 MET MET D . n E 2 150 GLU 150 150 150 GLU GLU D . n E 2 151 SER 151 151 151 SER SER D . n E 2 152 VAL 152 152 152 VAL VAL D . n E 2 153 ARG 153 153 153 ARG ARG D . n E 2 154 ASN 154 154 154 ASN ASN D . n E 2 155 GLY 155 155 155 GLY GLY D . n E 2 156 THR 156 156 156 THR THR D . n E 2 157 TYR 157 157 157 TYR TYR D . n E 2 158 ASP 158 158 158 ASP ASP D . n E 2 159 TYR 159 159 159 TYR TYR D . n E 2 160 PRO 160 160 160 PRO PRO D . n E 2 161 GLN 161 161 161 GLN GLN D . n E 2 162 TYR 162 162 162 TYR TYR D . n E 2 163 SER 163 163 163 SER SER D . n E 2 164 GLU 164 164 164 GLU GLU D . n E 2 165 GLU 165 165 165 GLU GLU D . n E 2 166 ALA 166 166 166 ALA ALA D . n E 2 167 ARG 167 167 167 ARG ARG D . n E 2 168 LEU 168 168 168 LEU LEU D . n E 2 169 LYS 169 169 169 LYS LYS D . n E 2 170 ARG 170 170 170 ARG ARG D . n E 2 171 GLU 171 171 171 GLU GLU D . n E 2 172 GLU 172 172 172 GLU GLU D . n E 2 173 ILE 173 173 173 ILE ILE D . n E 2 174 SER 174 174 ? ? ? D . n E 2 175 SER 175 175 ? ? ? D . n E 2 176 GLY 176 176 ? ? ? D . n E 2 177 ARG 177 177 ? ? ? D . n E 2 178 LEU 178 178 ? ? ? D . n E 2 179 VAL 179 179 ? ? ? D . n E 2 180 PRO 180 180 ? ? ? D . n E 2 181 ARG 181 181 ? ? ? D . n F 2 1 GLY 1 1 ? ? ? F . n F 2 2 LEU 2 2 ? ? ? F . n F 2 3 PHE 3 3 ? ? ? F . n F 2 4 GLY 4 4 ? ? ? F . n F 2 5 ALA 5 5 ? ? ? F . n F 2 6 ILE 6 6 ? ? ? F . n F 2 7 ALA 7 7 ? ? ? F . n F 2 8 GLY 8 8 ? ? ? F . n F 2 9 PHE 9 9 ? ? ? F . n F 2 10 ILE 10 10 ? ? ? F . n F 2 11 GLU 11 11 ? ? ? F . n F 2 12 GLY 12 12 12 GLY GLY F . n F 2 13 GLY 13 13 13 GLY GLY F . n F 2 14 TRP 14 14 14 TRP TRP F . n F 2 15 GLN 15 15 15 GLN GLN F . n F 2 16 GLY 16 16 16 GLY GLY F . n F 2 17 MET 17 17 17 MET MET F . n F 2 18 VAL 18 18 18 VAL VAL F . n F 2 19 ASP 19 19 19 ASP ASP F . n F 2 20 GLY 20 20 20 GLY GLY F . n F 2 21 TRP 21 21 21 TRP TRP F . n F 2 22 TYR 22 22 22 TYR TYR F . n F 2 23 GLY 23 23 23 GLY GLY F . n F 2 24 TYR 24 24 24 TYR TYR F . n F 2 25 HIS 25 25 25 HIS HIS F . n F 2 26 HIS 26 26 26 HIS HIS F . n F 2 27 SER 27 27 27 SER SER F . n F 2 28 ASN 28 28 28 ASN ASN F . n F 2 29 GLU 29 29 29 GLU GLU F . n F 2 30 GLN 30 30 30 GLN GLN F . n F 2 31 GLY 31 31 31 GLY GLY F . n F 2 32 SER 32 32 32 SER SER F . n F 2 33 GLY 33 33 33 GLY GLY F . n F 2 34 TYR 34 34 34 TYR TYR F . n F 2 35 ALA 35 35 35 ALA ALA F . n F 2 36 ALA 36 36 36 ALA ALA F . n F 2 37 ASP 37 37 37 ASP ASP F . n F 2 38 LYS 38 38 38 LYS LYS F . n F 2 39 GLU 39 39 39 GLU GLU F . n F 2 40 SER 40 40 40 SER SER F . n F 2 41 THR 41 41 41 THR THR F . n F 2 42 GLN 42 42 42 GLN GLN F . n F 2 43 LYS 43 43 43 LYS LYS F . n F 2 44 ALA 44 44 44 ALA ALA F . n F 2 45 ILE 45 45 45 ILE ILE F . n F 2 46 ASP 46 46 46 ASP ASP F . n F 2 47 GLY 47 47 47 GLY GLY F . n F 2 48 VAL 48 48 48 VAL VAL F . n F 2 49 THR 49 49 49 THR THR F . n F 2 50 ASN 50 50 50 ASN ASN F . n F 2 51 LYS 51 51 51 LYS LYS F . n F 2 52 VAL 52 52 52 VAL VAL F . n F 2 53 ASN 53 53 53 ASN ASN F . n F 2 54 SER 54 54 54 SER SER F . n F 2 55 ILE 55 55 55 ILE ILE F . n F 2 56 ILE 56 56 56 ILE ILE F . n F 2 57 ASP 57 57 57 ASP ASP F . n F 2 58 LYS 58 58 58 LYS LYS F . n F 2 59 MET 59 59 59 MET MET F . n F 2 60 ASN 60 60 60 ASN ASN F . n F 2 61 THR 61 61 61 THR THR F . n F 2 62 GLN 62 62 62 GLN GLN F . n F 2 63 PHE 63 63 63 PHE PHE F . n F 2 64 GLU 64 64 64 GLU GLU F . n F 2 65 ALA 65 65 65 ALA ALA F . n F 2 66 VAL 66 66 66 VAL VAL F . n F 2 67 GLY 67 67 67 GLY GLY F . n F 2 68 ARG 68 68 68 ARG ARG F . n F 2 69 GLU 69 69 69 GLU GLU F . n F 2 70 PHE 70 70 70 PHE PHE F . n F 2 71 ASN 71 71 71 ASN ASN F . n F 2 72 ASN 72 72 72 ASN ASN F . n F 2 73 LEU 73 73 73 LEU LEU F . n F 2 74 GLU 74 74 74 GLU GLU F . n F 2 75 ARG 75 75 75 ARG ARG F . n F 2 76 ARG 76 76 76 ARG ARG F . n F 2 77 ILE 77 77 77 ILE ILE F . n F 2 78 GLU 78 78 78 GLU GLU F . n F 2 79 ASN 79 79 79 ASN ASN F . n F 2 80 LEU 80 80 80 LEU LEU F . n F 2 81 ASN 81 81 81 ASN ASN F . n F 2 82 LYS 82 82 82 LYS LYS F . n F 2 83 LYS 83 83 83 LYS LYS F . n F 2 84 MET 84 84 84 MET MET F . n F 2 85 GLU 85 85 85 GLU GLU F . n F 2 86 ASP 86 86 86 ASP ASP F . n F 2 87 GLY 87 87 87 GLY GLY F . n F 2 88 PHE 88 88 88 PHE PHE F . n F 2 89 LEU 89 89 89 LEU LEU F . n F 2 90 ASP 90 90 90 ASP ASP F . n F 2 91 VAL 91 91 91 VAL VAL F . n F 2 92 TRP 92 92 92 TRP TRP F . n F 2 93 THR 93 93 93 THR THR F . n F 2 94 TYR 94 94 94 TYR TYR F . n F 2 95 ASN 95 95 95 ASN ASN F . n F 2 96 ALA 96 96 96 ALA ALA F . n F 2 97 GLU 97 97 97 GLU GLU F . n F 2 98 LEU 98 98 98 LEU LEU F . n F 2 99 LEU 99 99 99 LEU LEU F . n F 2 100 VAL 100 100 100 VAL VAL F . n F 2 101 LEU 101 101 101 LEU LEU F . n F 2 102 MET 102 102 102 MET MET F . n F 2 103 GLU 103 103 103 GLU GLU F . n F 2 104 ASN 104 104 104 ASN ASN F . n F 2 105 GLU 105 105 105 GLU GLU F . n F 2 106 ARG 106 106 106 ARG ARG F . n F 2 107 THR 107 107 107 THR THR F . n F 2 108 LEU 108 108 108 LEU LEU F . n F 2 109 ASP 109 109 109 ASP ASP F . n F 2 110 PHE 110 110 110 PHE PHE F . n F 2 111 HIS 111 111 111 HIS HIS F . n F 2 112 ASP 112 112 112 ASP ASP F . n F 2 113 SER 113 113 113 SER SER F . n F 2 114 ASN 114 114 114 ASN ASN F . n F 2 115 VAL 115 115 115 VAL VAL F . n F 2 116 LYS 116 116 116 LYS LYS F . n F 2 117 ASN 117 117 117 ASN ASN F . n F 2 118 LEU 118 118 118 LEU LEU F . n F 2 119 TYR 119 119 119 TYR TYR F . n F 2 120 ASP 120 120 120 ASP ASP F . n F 2 121 LYS 121 121 121 LYS LYS F . n F 2 122 VAL 122 122 122 VAL VAL F . n F 2 123 ARG 123 123 123 ARG ARG F . n F 2 124 LEU 124 124 124 LEU LEU F . n F 2 125 GLN 125 125 125 GLN GLN F . n F 2 126 LEU 126 126 126 LEU LEU F . n F 2 127 ARG 127 127 127 ARG ARG F . n F 2 128 ASP 128 128 128 ASP ASP F . n F 2 129 ASN 129 129 129 ASN ASN F . n F 2 130 ALA 130 130 130 ALA ALA F . n F 2 131 LYS 131 131 131 LYS LYS F . n F 2 132 GLU 132 132 132 GLU GLU F . n F 2 133 LEU 133 133 133 LEU LEU F . n F 2 134 GLY 134 134 134 GLY GLY F . n F 2 135 ASN 135 135 135 ASN ASN F . n F 2 136 GLY 136 136 136 GLY GLY F . n F 2 137 CYS 137 137 137 CYS CYS F . n F 2 138 PHE 138 138 138 PHE PHE F . n F 2 139 GLU 139 139 139 GLU GLU F . n F 2 140 PHE 140 140 140 PHE PHE F . n F 2 141 TYR 141 141 141 TYR TYR F . n F 2 142 HIS 142 142 142 HIS HIS F . n F 2 143 LYS 143 143 143 LYS LYS F . n F 2 144 CYS 144 144 144 CYS CYS F . n F 2 145 ASP 145 145 145 ASP ASP F . n F 2 146 ASN 146 146 146 ASN ASN F . n F 2 147 LYS 147 147 147 LYS LYS F . n F 2 148 CYS 148 148 148 CYS CYS F . n F 2 149 MET 149 149 149 MET MET F . n F 2 150 GLU 150 150 150 GLU GLU F . n F 2 151 SER 151 151 151 SER SER F . n F 2 152 VAL 152 152 152 VAL VAL F . n F 2 153 ARG 153 153 153 ARG ARG F . n F 2 154 ASN 154 154 154 ASN ASN F . n F 2 155 GLY 155 155 155 GLY GLY F . n F 2 156 THR 156 156 156 THR THR F . n F 2 157 TYR 157 157 157 TYR TYR F . n F 2 158 ASP 158 158 158 ASP ASP F . n F 2 159 TYR 159 159 159 TYR TYR F . n F 2 160 PRO 160 160 160 PRO PRO F . n F 2 161 GLN 161 161 161 GLN GLN F . n F 2 162 TYR 162 162 162 TYR TYR F . n F 2 163 SER 163 163 163 SER SER F . n F 2 164 GLU 164 164 164 GLU GLU F . n F 2 165 GLU 165 165 165 GLU GLU F . n F 2 166 ALA 166 166 166 ALA ALA F . n F 2 167 ARG 167 167 167 ARG ARG F . n F 2 168 LEU 168 168 168 LEU LEU F . n F 2 169 LYS 169 169 169 LYS LYS F . n F 2 170 ARG 170 170 170 ARG ARG F . n F 2 171 GLU 171 171 171 GLU GLU F . n F 2 172 GLU 172 172 172 GLU GLU F . n F 2 173 ILE 173 173 173 ILE ILE F . n F 2 174 SER 174 174 ? ? ? F . n F 2 175 SER 175 175 ? ? ? F . n F 2 176 GLY 176 176 ? ? ? F . n F 2 177 ARG 177 177 ? ? ? F . n F 2 178 LEU 178 178 ? ? ? F . n F 2 179 VAL 179 179 ? ? ? F . n F 2 180 PRO 180 180 ? ? ? F . n F 2 181 ARG 181 181 ? ? ? F . n # 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 G 3 NAG 1 401 400 NAG NAG A . H 4 FUC 2 402 401 FUC FUC A . I 3 NAG 1 403 500 NAG NAG A . J 3 NAG 2 404 501 NAG NAG A . K 4 FUC 3 405 502 FUC FUC A . L 3 NAG 1 406 600 NAG NAG A . M 3 NAG 1 401 400 NAG NAG C . N 4 FUC 2 402 401 FUC FUC C . O 3 NAG 1 403 500 NAG NAG C . P 3 NAG 2 404 501 NAG NAG C . Q 4 FUC 3 405 502 FUC FUC C . R 3 NAG 1 406 600 NAG NAG C . S 3 NAG 1 401 400 NAG NAG E . T 4 FUC 2 402 401 FUC FUC E . U 3 NAG 1 403 500 NAG NAG E . V 3 NAG 2 404 501 NAG NAG E . W 4 FUC 3 405 502 FUC FUC E . X 3 NAG 1 406 600 NAG NAG E . Y 5 HOH 1 501 855 HOH HOH A . Y 5 HOH 2 502 492 HOH HOH A . Y 5 HOH 3 503 287 HOH HOH A . Y 5 HOH 4 504 250 HOH HOH A . Y 5 HOH 5 505 325 HOH HOH A . Y 5 HOH 6 506 13 HOH HOH A . Y 5 HOH 7 507 330 HOH HOH A . Y 5 HOH 8 508 825 HOH HOH A . Y 5 HOH 9 509 627 HOH HOH A . Y 5 HOH 10 510 198 HOH HOH A . Y 5 HOH 11 511 243 HOH HOH A . Y 5 HOH 12 512 337 HOH HOH A . Y 5 HOH 13 513 382 HOH HOH A . Y 5 HOH 14 514 876 HOH HOH A . Y 5 HOH 15 515 2 HOH HOH A . Y 5 HOH 16 516 296 HOH HOH A . Y 5 HOH 17 517 7 HOH HOH A . Y 5 HOH 18 518 248 HOH HOH A . Y 5 HOH 19 519 3 HOH HOH A . Y 5 HOH 20 520 462 HOH HOH A . Y 5 HOH 21 521 204 HOH HOH A . Y 5 HOH 22 522 872 HOH HOH A . Y 5 HOH 23 523 37 HOH HOH A . Y 5 HOH 24 524 195 HOH HOH A . Y 5 HOH 25 525 211 HOH HOH A . Y 5 HOH 26 526 657 HOH HOH A . Y 5 HOH 27 527 223 HOH HOH A . Y 5 HOH 28 528 5 HOH HOH A . Y 5 HOH 29 529 57 HOH HOH A . Y 5 HOH 30 530 294 HOH HOH A . Y 5 HOH 31 531 68 HOH HOH A . Y 5 HOH 32 532 295 HOH HOH A . Y 5 HOH 33 533 570 HOH HOH A . Y 5 HOH 34 534 180 HOH HOH A . Y 5 HOH 35 535 157 HOH HOH A . Y 5 HOH 36 536 609 HOH HOH A . Y 5 HOH 37 537 124 HOH HOH A . Y 5 HOH 38 538 264 HOH HOH A . Y 5 HOH 39 539 218 HOH HOH A . Y 5 HOH 40 540 184 HOH HOH A . Y 5 HOH 41 541 32 HOH HOH A . Y 5 HOH 42 542 471 HOH HOH A . Y 5 HOH 43 543 247 HOH HOH A . Y 5 HOH 44 544 451 HOH HOH A . Y 5 HOH 45 545 446 HOH HOH A . Y 5 HOH 46 546 283 HOH HOH A . Y 5 HOH 47 547 913 HOH HOH A . Y 5 HOH 48 548 168 HOH HOH A . Y 5 HOH 49 549 674 HOH HOH A . Y 5 HOH 50 550 432 HOH HOH A . Y 5 HOH 51 551 394 HOH HOH A . Y 5 HOH 52 552 580 HOH HOH A . Y 5 HOH 53 553 455 HOH HOH A . Y 5 HOH 54 554 103 HOH HOH A . Y 5 HOH 55 555 23 HOH HOH A . Y 5 HOH 56 556 34 HOH HOH A . Y 5 HOH 57 557 28 HOH HOH A . Y 5 HOH 58 558 316 HOH HOH A . Y 5 HOH 59 559 873 HOH HOH A . Y 5 HOH 60 560 50 HOH HOH A . Y 5 HOH 61 561 219 HOH HOH A . Y 5 HOH 62 562 304 HOH HOH A . Y 5 HOH 63 563 288 HOH HOH A . Y 5 HOH 64 564 845 HOH HOH A . Y 5 HOH 65 565 422 HOH HOH A . Y 5 HOH 66 566 466 HOH HOH A . Y 5 HOH 67 567 42 HOH HOH A . Y 5 HOH 68 568 72 HOH HOH A . Y 5 HOH 69 569 181 HOH HOH A . Y 5 HOH 70 570 249 HOH HOH A . Y 5 HOH 71 571 343 HOH HOH A . Y 5 HOH 72 572 197 HOH HOH A . Y 5 HOH 73 573 112 HOH HOH A . Y 5 HOH 74 574 44 HOH HOH A . Y 5 HOH 75 575 767 HOH HOH A . Y 5 HOH 76 576 134 HOH HOH A . Y 5 HOH 77 577 504 HOH HOH A . Y 5 HOH 78 578 205 HOH HOH A . Y 5 HOH 79 579 584 HOH HOH A . Y 5 HOH 80 580 920 HOH HOH A . Y 5 HOH 81 581 652 HOH HOH A . Y 5 HOH 82 582 60 HOH HOH A . Y 5 HOH 83 583 442 HOH HOH A . Y 5 HOH 84 584 132 HOH HOH A . Y 5 HOH 85 585 182 HOH HOH A . Y 5 HOH 86 586 903 HOH HOH A . Y 5 HOH 87 587 733 HOH HOH A . Y 5 HOH 88 588 593 HOH HOH A . Y 5 HOH 89 589 355 HOH HOH A . Y 5 HOH 90 590 299 HOH HOH A . Y 5 HOH 91 591 165 HOH HOH A . Y 5 HOH 92 592 1 HOH HOH A . Y 5 HOH 93 593 106 HOH HOH A . Y 5 HOH 94 594 519 HOH HOH A . Y 5 HOH 95 595 385 HOH HOH A . Y 5 HOH 96 596 401 HOH HOH A . Y 5 HOH 97 597 538 HOH HOH A . Y 5 HOH 98 598 438 HOH HOH A . Y 5 HOH 99 599 464 HOH HOH A . Y 5 HOH 100 600 436 HOH HOH A . Y 5 HOH 101 601 871 HOH HOH A . Y 5 HOH 102 602 638 HOH HOH A . Y 5 HOH 103 603 857 HOH HOH A . Y 5 HOH 104 604 549 HOH HOH A . Y 5 HOH 105 605 970 HOH HOH A . Y 5 HOH 106 606 120 HOH HOH A . Y 5 HOH 107 607 273 HOH HOH A . Y 5 HOH 108 608 83 HOH HOH A . Y 5 HOH 109 609 750 HOH HOH A . Y 5 HOH 110 610 626 HOH HOH A . Y 5 HOH 111 611 93 HOH HOH A . Y 5 HOH 112 612 811 HOH HOH A . Y 5 HOH 113 613 354 HOH HOH A . Y 5 HOH 114 614 666 HOH HOH A . Y 5 HOH 115 615 119 HOH HOH A . Y 5 HOH 116 616 147 HOH HOH A . Y 5 HOH 117 617 272 HOH HOH A . Y 5 HOH 118 618 685 HOH HOH A . Y 5 HOH 119 619 40 HOH HOH A . Y 5 HOH 120 620 746 HOH HOH A . Y 5 HOH 121 621 795 HOH HOH A . Y 5 HOH 122 622 510 HOH HOH A . Y 5 HOH 123 623 721 HOH HOH A . Y 5 HOH 124 624 444 HOH HOH A . Y 5 HOH 125 625 610 HOH HOH A . Y 5 HOH 126 626 396 HOH HOH A . Y 5 HOH 127 627 9 HOH HOH A . Y 5 HOH 128 628 169 HOH HOH A . Y 5 HOH 129 629 62 HOH HOH A . Y 5 HOH 130 630 297 HOH HOH A . Y 5 HOH 131 631 301 HOH HOH A . Y 5 HOH 132 632 508 HOH HOH A . Y 5 HOH 133 633 686 HOH HOH A . Y 5 HOH 134 634 897 HOH HOH A . Y 5 HOH 135 635 868 HOH HOH A . Y 5 HOH 136 636 357 HOH HOH A . Y 5 HOH 137 637 309 HOH HOH A . Y 5 HOH 138 638 585 HOH HOH A . Y 5 HOH 139 639 527 HOH HOH A . Y 5 HOH 140 640 153 HOH HOH A . Y 5 HOH 141 641 620 HOH HOH A . Y 5 HOH 142 642 645 HOH HOH A . Y 5 HOH 143 643 115 HOH HOH A . Y 5 HOH 144 644 917 HOH HOH A . Y 5 HOH 145 645 543 HOH HOH A . Y 5 HOH 146 646 799 HOH HOH A . Y 5 HOH 147 647 338 HOH HOH A . Y 5 HOH 148 648 737 HOH HOH A . Y 5 HOH 149 649 176 HOH HOH A . Y 5 HOH 150 650 951 HOH HOH A . Y 5 HOH 151 651 660 HOH HOH A . Y 5 HOH 152 652 818 HOH HOH A . Y 5 HOH 153 653 841 HOH HOH A . Y 5 HOH 154 654 689 HOH HOH A . Y 5 HOH 155 655 308 HOH HOH A . Y 5 HOH 156 656 484 HOH HOH A . Y 5 HOH 157 657 300 HOH HOH A . Y 5 HOH 158 658 511 HOH HOH A . Y 5 HOH 159 659 843 HOH HOH A . Y 5 HOH 160 660 713 HOH HOH A . Y 5 HOH 161 661 269 HOH HOH A . Y 5 HOH 162 662 712 HOH HOH A . Y 5 HOH 163 663 282 HOH HOH A . Y 5 HOH 164 664 427 HOH HOH A . Y 5 HOH 165 665 756 HOH HOH A . Y 5 HOH 166 666 418 HOH HOH A . Y 5 HOH 167 667 490 HOH HOH A . Y 5 HOH 168 668 669 HOH HOH A . Y 5 HOH 169 669 433 HOH HOH A . Y 5 HOH 170 670 724 HOH HOH A . Y 5 HOH 171 671 912 HOH HOH A . Y 5 HOH 172 672 360 HOH HOH A . Y 5 HOH 173 673 768 HOH HOH A . Y 5 HOH 174 674 369 HOH HOH A . Y 5 HOH 175 675 771 HOH HOH A . Y 5 HOH 176 676 512 HOH HOH A . Y 5 HOH 177 677 497 HOH HOH A . Z 5 HOH 1 501 506 HOH HOH C . Z 5 HOH 2 502 430 HOH HOH C . Z 5 HOH 3 503 424 HOH HOH C . Z 5 HOH 4 504 121 HOH HOH C . Z 5 HOH 5 505 166 HOH HOH C . Z 5 HOH 6 506 89 HOH HOH C . Z 5 HOH 7 507 333 HOH HOH C . Z 5 HOH 8 508 118 HOH HOH C . Z 5 HOH 9 509 523 HOH HOH C . Z 5 HOH 10 510 407 HOH HOH C . Z 5 HOH 11 511 340 HOH HOH C . Z 5 HOH 12 512 493 HOH HOH C . Z 5 HOH 13 513 596 HOH HOH C . Z 5 HOH 14 514 322 HOH HOH C . Z 5 HOH 15 515 831 HOH HOH C . Z 5 HOH 16 516 791 HOH HOH C . Z 5 HOH 17 517 690 HOH HOH C . Z 5 HOH 18 518 189 HOH HOH C . Z 5 HOH 19 519 654 HOH HOH C . Z 5 HOH 20 520 900 HOH HOH C . Z 5 HOH 21 521 448 HOH HOH C . Z 5 HOH 22 522 238 HOH HOH C . Z 5 HOH 23 523 606 HOH HOH C . Z 5 HOH 24 524 704 HOH HOH C . Z 5 HOH 25 525 445 HOH HOH C . Z 5 HOH 26 526 757 HOH HOH C . Z 5 HOH 27 527 336 HOH HOH C . Z 5 HOH 28 528 35 HOH HOH C . Z 5 HOH 29 529 164 HOH HOH C . Z 5 HOH 30 530 293 HOH HOH C . Z 5 HOH 31 531 79 HOH HOH C . Z 5 HOH 32 532 11 HOH HOH C . Z 5 HOH 33 533 125 HOH HOH C . Z 5 HOH 34 534 138 HOH HOH C . Z 5 HOH 35 535 639 HOH HOH C . Z 5 HOH 36 536 101 HOH HOH C . Z 5 HOH 37 537 509 HOH HOH C . Z 5 HOH 38 538 688 HOH HOH C . Z 5 HOH 39 539 15 HOH HOH C . Z 5 HOH 40 540 310 HOH HOH C . Z 5 HOH 41 541 443 HOH HOH C . Z 5 HOH 42 542 641 HOH HOH C . Z 5 HOH 43 543 342 HOH HOH C . Z 5 HOH 44 544 908 HOH HOH C . Z 5 HOH 45 545 788 HOH HOH C . Z 5 HOH 46 546 573 HOH HOH C . Z 5 HOH 47 547 289 HOH HOH C . Z 5 HOH 48 548 188 HOH HOH C . Z 5 HOH 49 549 178 HOH HOH C . Z 5 HOH 50 550 47 HOH HOH C . Z 5 HOH 51 551 515 HOH HOH C . Z 5 HOH 52 552 743 HOH HOH C . Z 5 HOH 53 553 303 HOH HOH C . Z 5 HOH 54 554 75 HOH HOH C . Z 5 HOH 55 555 630 HOH HOH C . Z 5 HOH 56 556 108 HOH HOH C . Z 5 HOH 57 557 628 HOH HOH C . Z 5 HOH 58 558 258 HOH HOH C . Z 5 HOH 59 559 621 HOH HOH C . Z 5 HOH 60 560 850 HOH HOH C . Z 5 HOH 61 561 143 HOH HOH C . Z 5 HOH 62 562 175 HOH HOH C . Z 5 HOH 63 563 924 HOH HOH C . Z 5 HOH 64 564 576 HOH HOH C . Z 5 HOH 65 565 102 HOH HOH C . Z 5 HOH 66 566 738 HOH HOH C . Z 5 HOH 67 567 81 HOH HOH C . Z 5 HOH 68 568 812 HOH HOH C . Z 5 HOH 69 569 136 HOH HOH C . Z 5 HOH 70 570 314 HOH HOH C . Z 5 HOH 71 571 583 HOH HOH C . Z 5 HOH 72 572 317 HOH HOH C . Z 5 HOH 73 573 334 HOH HOH C . Z 5 HOH 74 574 588 HOH HOH C . Z 5 HOH 75 575 151 HOH HOH C . Z 5 HOH 76 576 561 HOH HOH C . Z 5 HOH 77 577 346 HOH HOH C . Z 5 HOH 78 578 513 HOH HOH C . Z 5 HOH 79 579 123 HOH HOH C . Z 5 HOH 80 580 139 HOH HOH C . Z 5 HOH 81 581 379 HOH HOH C . Z 5 HOH 82 582 201 HOH HOH C . Z 5 HOH 83 583 110 HOH HOH C . Z 5 HOH 84 584 255 HOH HOH C . Z 5 HOH 85 585 525 HOH HOH C . Z 5 HOH 86 586 82 HOH HOH C . Z 5 HOH 87 587 196 HOH HOH C . Z 5 HOH 88 588 146 HOH HOH C . Z 5 HOH 89 589 302 HOH HOH C . Z 5 HOH 90 590 170 HOH HOH C . Z 5 HOH 91 591 575 HOH HOH C . Z 5 HOH 92 592 117 HOH HOH C . Z 5 HOH 93 593 326 HOH HOH C . Z 5 HOH 94 594 160 HOH HOH C . Z 5 HOH 95 595 616 HOH HOH C . Z 5 HOH 96 596 260 HOH HOH C . Z 5 HOH 97 597 313 HOH HOH C . Z 5 HOH 98 598 179 HOH HOH C . Z 5 HOH 99 599 895 HOH HOH C . Z 5 HOH 100 600 228 HOH HOH C . Z 5 HOH 101 601 786 HOH HOH C . Z 5 HOH 102 602 22 HOH HOH C . Z 5 HOH 103 603 156 HOH HOH C . Z 5 HOH 104 604 730 HOH HOH C . Z 5 HOH 105 605 348 HOH HOH C . Z 5 HOH 106 606 111 HOH HOH C . Z 5 HOH 107 607 395 HOH HOH C . Z 5 HOH 108 608 589 HOH HOH C . Z 5 HOH 109 609 127 HOH HOH C . Z 5 HOH 110 610 429 HOH HOH C . Z 5 HOH 111 611 409 HOH HOH C . Z 5 HOH 112 612 836 HOH HOH C . Z 5 HOH 113 613 95 HOH HOH C . Z 5 HOH 114 614 728 HOH HOH C . Z 5 HOH 115 615 682 HOH HOH C . Z 5 HOH 116 616 891 HOH HOH C . Z 5 HOH 117 617 174 HOH HOH C . Z 5 HOH 118 618 752 HOH HOH C . Z 5 HOH 119 619 470 HOH HOH C . Z 5 HOH 120 620 759 HOH HOH C . Z 5 HOH 121 621 251 HOH HOH C . Z 5 HOH 122 622 875 HOH HOH C . Z 5 HOH 123 623 518 HOH HOH C . Z 5 HOH 124 624 63 HOH HOH C . Z 5 HOH 125 625 531 HOH HOH C . Z 5 HOH 126 626 763 HOH HOH C . Z 5 HOH 127 627 503 HOH HOH C . Z 5 HOH 128 628 452 HOH HOH C . Z 5 HOH 129 629 421 HOH HOH C . Z 5 HOH 130 630 349 HOH HOH C . Z 5 HOH 131 631 597 HOH HOH C . Z 5 HOH 132 632 722 HOH HOH C . Z 5 HOH 133 633 817 HOH HOH C . Z 5 HOH 134 634 840 HOH HOH C . Z 5 HOH 135 635 533 HOH HOH C . Z 5 HOH 136 636 923 HOH HOH C . Z 5 HOH 137 637 762 HOH HOH C . Z 5 HOH 138 638 558 HOH HOH C . Z 5 HOH 139 639 327 HOH HOH C . Z 5 HOH 140 640 387 HOH HOH C . Z 5 HOH 141 641 276 HOH HOH C . Z 5 HOH 142 642 889 HOH HOH C . Z 5 HOH 143 643 870 HOH HOH C . Z 5 HOH 144 644 877 HOH HOH C . Z 5 HOH 145 645 423 HOH HOH C . Z 5 HOH 146 646 486 HOH HOH C . Z 5 HOH 147 647 785 HOH HOH C . Z 5 HOH 148 648 813 HOH HOH C . Z 5 HOH 149 649 291 HOH HOH C . Z 5 HOH 150 650 496 HOH HOH C . Z 5 HOH 151 651 541 HOH HOH C . Z 5 HOH 152 652 499 HOH HOH C . Z 5 HOH 153 653 823 HOH HOH C . Z 5 HOH 154 654 883 HOH HOH C . AA 5 HOH 1 501 602 HOH HOH E . AA 5 HOH 2 502 827 HOH HOH E . AA 5 HOH 3 503 242 HOH HOH E . AA 5 HOH 4 504 797 HOH HOH E . AA 5 HOH 5 505 849 HOH HOH E . AA 5 HOH 6 506 431 HOH HOH E . AA 5 HOH 7 507 375 HOH HOH E . AA 5 HOH 8 508 266 HOH HOH E . AA 5 HOH 9 509 709 HOH HOH E . AA 5 HOH 10 510 14 HOH HOH E . AA 5 HOH 11 511 864 HOH HOH E . AA 5 HOH 12 512 449 HOH HOH E . AA 5 HOH 13 513 411 HOH HOH E . AA 5 HOH 14 514 383 HOH HOH E . AA 5 HOH 15 515 847 HOH HOH E . AA 5 HOH 16 516 162 HOH HOH E . AA 5 HOH 17 517 351 HOH HOH E . AA 5 HOH 18 518 814 HOH HOH E . AA 5 HOH 19 519 16 HOH HOH E . AA 5 HOH 20 520 130 HOH HOH E . AA 5 HOH 21 521 61 HOH HOH E . AA 5 HOH 22 522 434 HOH HOH E . AA 5 HOH 23 523 78 HOH HOH E . AA 5 HOH 24 524 362 HOH HOH E . AA 5 HOH 25 525 532 HOH HOH E . AA 5 HOH 26 526 25 HOH HOH E . AA 5 HOH 27 527 911 HOH HOH E . AA 5 HOH 28 528 227 HOH HOH E . AA 5 HOH 29 529 648 HOH HOH E . AA 5 HOH 30 530 190 HOH HOH E . AA 5 HOH 31 531 463 HOH HOH E . AA 5 HOH 32 532 459 HOH HOH E . AA 5 HOH 33 533 167 HOH HOH E . AA 5 HOH 34 534 384 HOH HOH E . AA 5 HOH 35 535 274 HOH HOH E . AA 5 HOH 36 536 683 HOH HOH E . AA 5 HOH 37 537 18 HOH HOH E . AA 5 HOH 38 538 615 HOH HOH E . AA 5 HOH 39 539 919 HOH HOH E . AA 5 HOH 40 540 644 HOH HOH E . AA 5 HOH 41 541 890 HOH HOH E . AA 5 HOH 42 542 113 HOH HOH E . AA 5 HOH 43 543 107 HOH HOH E . AA 5 HOH 44 544 144 HOH HOH E . AA 5 HOH 45 545 782 HOH HOH E . AA 5 HOH 46 546 556 HOH HOH E . AA 5 HOH 47 547 84 HOH HOH E . AA 5 HOH 48 548 907 HOH HOH E . AA 5 HOH 49 549 254 HOH HOH E . AA 5 HOH 50 550 662 HOH HOH E . AA 5 HOH 51 551 191 HOH HOH E . AA 5 HOH 52 552 614 HOH HOH E . AA 5 HOH 53 553 128 HOH HOH E . AA 5 HOH 54 554 46 HOH HOH E . AA 5 HOH 55 555 770 HOH HOH E . AA 5 HOH 56 556 150 HOH HOH E . AA 5 HOH 57 557 320 HOH HOH E . AA 5 HOH 58 558 257 HOH HOH E . AA 5 HOH 59 559 734 HOH HOH E . AA 5 HOH 60 560 73 HOH HOH E . AA 5 HOH 61 561 43 HOH HOH E . AA 5 HOH 62 562 163 HOH HOH E . AA 5 HOH 63 563 896 HOH HOH E . AA 5 HOH 64 564 56 HOH HOH E . AA 5 HOH 65 565 222 HOH HOH E . AA 5 HOH 66 566 271 HOH HOH E . AA 5 HOH 67 567 408 HOH HOH E . AA 5 HOH 68 568 624 HOH HOH E . AA 5 HOH 69 569 70 HOH HOH E . AA 5 HOH 70 570 48 HOH HOH E . AA 5 HOH 71 571 24 HOH HOH E . AA 5 HOH 72 572 94 HOH HOH E . AA 5 HOH 73 573 99 HOH HOH E . AA 5 HOH 74 574 279 HOH HOH E . AA 5 HOH 75 575 356 HOH HOH E . AA 5 HOH 76 576 467 HOH HOH E . AA 5 HOH 77 577 528 HOH HOH E . AA 5 HOH 78 578 441 HOH HOH E . AA 5 HOH 79 579 456 HOH HOH E . AA 5 HOH 80 580 104 HOH HOH E . AA 5 HOH 81 581 158 HOH HOH E . AA 5 HOH 82 582 461 HOH HOH E . AA 5 HOH 83 583 33 HOH HOH E . AA 5 HOH 84 584 643 HOH HOH E . AA 5 HOH 85 585 74 HOH HOH E . AA 5 HOH 86 586 126 HOH HOH E . AA 5 HOH 87 587 21 HOH HOH E . AA 5 HOH 88 588 193 HOH HOH E . AA 5 HOH 89 589 265 HOH HOH E . AA 5 HOH 90 590 231 HOH HOH E . AA 5 HOH 91 591 582 HOH HOH E . AA 5 HOH 92 592 481 HOH HOH E . AA 5 HOH 93 593 529 HOH HOH E . AA 5 HOH 94 594 520 HOH HOH E . AA 5 HOH 95 595 199 HOH HOH E . AA 5 HOH 96 596 66 HOH HOH E . AA 5 HOH 97 597 902 HOH HOH E . AA 5 HOH 98 598 331 HOH HOH E . AA 5 HOH 99 599 859 HOH HOH E . AA 5 HOH 100 600 474 HOH HOH E . AA 5 HOH 101 601 632 HOH HOH E . AA 5 HOH 102 602 751 HOH HOH E . AA 5 HOH 103 603 390 HOH HOH E . AA 5 HOH 104 604 676 HOH HOH E . AA 5 HOH 105 605 839 HOH HOH E . AA 5 HOH 106 606 552 HOH HOH E . AA 5 HOH 107 607 244 HOH HOH E . AA 5 HOH 108 608 926 HOH HOH E . AA 5 HOH 109 609 364 HOH HOH E . AA 5 HOH 110 610 586 HOH HOH E . AA 5 HOH 111 611 748 HOH HOH E . AA 5 HOH 112 612 962 HOH HOH E . AA 5 HOH 113 613 232 HOH HOH E . AA 5 HOH 114 614 957 HOH HOH E . AA 5 HOH 115 615 516 HOH HOH E . AA 5 HOH 116 616 480 HOH HOH E . AA 5 HOH 117 617 483 HOH HOH E . AA 5 HOH 118 618 623 HOH HOH E . AA 5 HOH 119 619 653 HOH HOH E . AA 5 HOH 120 620 650 HOH HOH E . AA 5 HOH 121 621 736 HOH HOH E . AA 5 HOH 122 622 353 HOH HOH E . AA 5 HOH 123 623 598 HOH HOH E . AA 5 HOH 124 624 381 HOH HOH E . AA 5 HOH 125 625 393 HOH HOH E . AA 5 HOH 126 626 460 HOH HOH E . AA 5 HOH 127 627 97 HOH HOH E . AA 5 HOH 128 628 152 HOH HOH E . AA 5 HOH 129 629 959 HOH HOH E . AA 5 HOH 130 630 915 HOH HOH E . AA 5 HOH 131 631 578 HOH HOH E . AA 5 HOH 132 632 819 HOH HOH E . AA 5 HOH 133 633 521 HOH HOH E . AA 5 HOH 134 634 892 HOH HOH E . AA 5 HOH 135 635 437 HOH HOH E . AA 5 HOH 136 636 540 HOH HOH E . AA 5 HOH 137 637 489 HOH HOH E . AA 5 HOH 138 638 977 HOH HOH E . AA 5 HOH 139 639 965 HOH HOH E . AA 5 HOH 140 640 778 HOH HOH E . AA 5 HOH 141 641 253 HOH HOH E . AA 5 HOH 142 642 729 HOH HOH E . AA 5 HOH 143 643 281 HOH HOH E . AA 5 HOH 144 644 214 HOH HOH E . AA 5 HOH 145 645 792 HOH HOH E . AA 5 HOH 146 646 473 HOH HOH E . AA 5 HOH 147 647 465 HOH HOH E . AA 5 HOH 148 648 566 HOH HOH E . BA 5 HOH 1 201 717 HOH HOH B . BA 5 HOH 2 202 404 HOH HOH B . BA 5 HOH 3 203 820 HOH HOH B . BA 5 HOH 4 204 727 HOH HOH B . BA 5 HOH 5 205 286 HOH HOH B . BA 5 HOH 6 206 731 HOH HOH B . BA 5 HOH 7 207 571 HOH HOH B . BA 5 HOH 8 208 753 HOH HOH B . BA 5 HOH 9 209 298 HOH HOH B . BA 5 HOH 10 210 637 HOH HOH B . BA 5 HOH 11 211 747 HOH HOH B . BA 5 HOH 12 212 816 HOH HOH B . BA 5 HOH 13 213 54 HOH HOH B . BA 5 HOH 14 214 833 HOH HOH B . BA 5 HOH 15 215 58 HOH HOH B . BA 5 HOH 16 216 405 HOH HOH B . BA 5 HOH 17 217 285 HOH HOH B . BA 5 HOH 18 218 171 HOH HOH B . BA 5 HOH 19 219 55 HOH HOH B . BA 5 HOH 20 220 92 HOH HOH B . BA 5 HOH 21 221 114 HOH HOH B . BA 5 HOH 22 222 663 HOH HOH B . BA 5 HOH 23 223 341 HOH HOH B . BA 5 HOH 24 224 230 HOH HOH B . BA 5 HOH 25 225 479 HOH HOH B . BA 5 HOH 26 226 122 HOH HOH B . BA 5 HOH 27 227 6 HOH HOH B . BA 5 HOH 28 228 100 HOH HOH B . BA 5 HOH 29 229 135 HOH HOH B . BA 5 HOH 30 230 413 HOH HOH B . BA 5 HOH 31 231 109 HOH HOH B . BA 5 HOH 32 232 339 HOH HOH B . BA 5 HOH 33 233 454 HOH HOH B . BA 5 HOH 34 234 239 HOH HOH B . BA 5 HOH 35 235 714 HOH HOH B . BA 5 HOH 36 236 26 HOH HOH B . BA 5 HOH 37 237 267 HOH HOH B . BA 5 HOH 38 238 647 HOH HOH B . BA 5 HOH 39 239 681 HOH HOH B . BA 5 HOH 40 240 692 HOH HOH B . BA 5 HOH 41 241 52 HOH HOH B . BA 5 HOH 42 242 161 HOH HOH B . BA 5 HOH 43 243 87 HOH HOH B . BA 5 HOH 44 244 603 HOH HOH B . BA 5 HOH 45 245 410 HOH HOH B . BA 5 HOH 46 246 261 HOH HOH B . BA 5 HOH 47 247 420 HOH HOH B . BA 5 HOH 48 248 39 HOH HOH B . BA 5 HOH 49 249 412 HOH HOH B . BA 5 HOH 50 250 960 HOH HOH B . BA 5 HOH 51 251 270 HOH HOH B . BA 5 HOH 52 252 881 HOH HOH B . BA 5 HOH 53 253 600 HOH HOH B . BA 5 HOH 54 254 350 HOH HOH B . BA 5 HOH 55 255 574 HOH HOH B . BA 5 HOH 56 256 91 HOH HOH B . BA 5 HOH 57 257 186 HOH HOH B . BA 5 HOH 58 258 810 HOH HOH B . BA 5 HOH 59 259 213 HOH HOH B . BA 5 HOH 60 260 694 HOH HOH B . BA 5 HOH 61 261 494 HOH HOH B . BA 5 HOH 62 262 636 HOH HOH B . BA 5 HOH 63 263 321 HOH HOH B . BA 5 HOH 64 264 765 HOH HOH B . BA 5 HOH 65 265 416 HOH HOH B . BA 5 HOH 66 266 292 HOH HOH B . BA 5 HOH 67 267 806 HOH HOH B . BA 5 HOH 68 268 335 HOH HOH B . BA 5 HOH 69 269 631 HOH HOH B . BA 5 HOH 70 270 235 HOH HOH B . BA 5 HOH 71 271 234 HOH HOH B . BA 5 HOH 72 272 542 HOH HOH B . BA 5 HOH 73 273 678 HOH HOH B . BA 5 HOH 74 274 595 HOH HOH B . BA 5 HOH 75 275 221 HOH HOH B . BA 5 HOH 76 276 209 HOH HOH B . CA 5 HOH 1 201 435 HOH HOH D . CA 5 HOH 2 202 880 HOH HOH D . CA 5 HOH 3 203 324 HOH HOH D . CA 5 HOH 4 204 514 HOH HOH D . CA 5 HOH 5 205 905 HOH HOH D . CA 5 HOH 6 206 741 HOH HOH D . CA 5 HOH 7 207 129 HOH HOH D . CA 5 HOH 8 208 145 HOH HOH D . CA 5 HOH 9 209 612 HOH HOH D . CA 5 HOH 10 210 20 HOH HOH D . CA 5 HOH 11 211 760 HOH HOH D . CA 5 HOH 12 212 80 HOH HOH D . CA 5 HOH 13 213 12 HOH HOH D . CA 5 HOH 14 214 17 HOH HOH D . CA 5 HOH 15 215 524 HOH HOH D . CA 5 HOH 16 216 172 HOH HOH D . CA 5 HOH 17 217 388 HOH HOH D . CA 5 HOH 18 218 29 HOH HOH D . CA 5 HOH 19 219 698 HOH HOH D . CA 5 HOH 20 220 149 HOH HOH D . CA 5 HOH 21 221 718 HOH HOH D . CA 5 HOH 22 222 392 HOH HOH D . CA 5 HOH 23 223 400 HOH HOH D . CA 5 HOH 24 224 725 HOH HOH D . CA 5 HOH 25 225 69 HOH HOH D . CA 5 HOH 26 226 702 HOH HOH D . CA 5 HOH 27 227 229 HOH HOH D . CA 5 HOH 28 228 545 HOH HOH D . CA 5 HOH 29 229 259 HOH HOH D . CA 5 HOH 30 230 8 HOH HOH D . CA 5 HOH 31 231 534 HOH HOH D . CA 5 HOH 32 232 183 HOH HOH D . CA 5 HOH 33 233 587 HOH HOH D . CA 5 HOH 34 234 245 HOH HOH D . CA 5 HOH 35 235 76 HOH HOH D . CA 5 HOH 36 236 740 HOH HOH D . CA 5 HOH 37 237 368 HOH HOH D . CA 5 HOH 38 238 367 HOH HOH D . CA 5 HOH 39 239 472 HOH HOH D . CA 5 HOH 40 240 116 HOH HOH D . CA 5 HOH 41 241 468 HOH HOH D . CA 5 HOH 42 242 801 HOH HOH D . CA 5 HOH 43 243 59 HOH HOH D . CA 5 HOH 44 244 659 HOH HOH D . CA 5 HOH 45 245 667 HOH HOH D . CA 5 HOH 46 246 611 HOH HOH D . CA 5 HOH 47 247 140 HOH HOH D . CA 5 HOH 48 248 640 HOH HOH D . CA 5 HOH 49 249 779 HOH HOH D . CA 5 HOH 50 250 10 HOH HOH D . CA 5 HOH 51 251 696 HOH HOH D . CA 5 HOH 52 252 417 HOH HOH D . CA 5 HOH 53 253 212 HOH HOH D . CA 5 HOH 54 254 391 HOH HOH D . CA 5 HOH 55 255 776 HOH HOH D . CA 5 HOH 56 256 633 HOH HOH D . CA 5 HOH 57 257 622 HOH HOH D . CA 5 HOH 58 258 842 HOH HOH D . CA 5 HOH 59 259 693 HOH HOH D . CA 5 HOH 60 260 591 HOH HOH D . CA 5 HOH 61 261 594 HOH HOH D . CA 5 HOH 62 262 374 HOH HOH D . CA 5 HOH 63 263 777 HOH HOH D . CA 5 HOH 64 264 224 HOH HOH D . CA 5 HOH 65 265 237 HOH HOH D . CA 5 HOH 66 266 215 HOH HOH D . CA 5 HOH 67 267 601 HOH HOH D . CA 5 HOH 68 268 805 HOH HOH D . CA 5 HOH 69 269 732 HOH HOH D . CA 5 HOH 70 270 306 HOH HOH D . CA 5 HOH 71 271 226 HOH HOH D . DA 5 HOH 1 201 49 HOH HOH F . DA 5 HOH 2 202 567 HOH HOH F . DA 5 HOH 3 203 200 HOH HOH F . DA 5 HOH 4 204 475 HOH HOH F . DA 5 HOH 5 205 491 HOH HOH F . DA 5 HOH 6 206 403 HOH HOH F . DA 5 HOH 7 207 697 HOH HOH F . DA 5 HOH 8 208 275 HOH HOH F . DA 5 HOH 9 209 187 HOH HOH F . DA 5 HOH 10 210 699 HOH HOH F . DA 5 HOH 11 211 956 HOH HOH F . DA 5 HOH 12 212 290 HOH HOH F . DA 5 HOH 13 213 71 HOH HOH F . DA 5 HOH 14 214 458 HOH HOH F . DA 5 HOH 15 215 555 HOH HOH F . DA 5 HOH 16 216 252 HOH HOH F . DA 5 HOH 17 217 241 HOH HOH F . DA 5 HOH 18 218 77 HOH HOH F . DA 5 HOH 19 219 502 HOH HOH F . DA 5 HOH 20 220 347 HOH HOH F . DA 5 HOH 21 221 45 HOH HOH F . DA 5 HOH 22 222 154 HOH HOH F . DA 5 HOH 23 223 560 HOH HOH F . DA 5 HOH 24 224 30 HOH HOH F . DA 5 HOH 25 225 329 HOH HOH F . DA 5 HOH 26 226 38 HOH HOH F . DA 5 HOH 27 227 469 HOH HOH F . DA 5 HOH 28 228 88 HOH HOH F . DA 5 HOH 29 229 141 HOH HOH F . DA 5 HOH 30 230 203 HOH HOH F . DA 5 HOH 31 231 159 HOH HOH F . DA 5 HOH 32 232 85 HOH HOH F . DA 5 HOH 33 233 131 HOH HOH F . DA 5 HOH 34 234 530 HOH HOH F . DA 5 HOH 35 235 96 HOH HOH F . DA 5 HOH 36 236 380 HOH HOH F . DA 5 HOH 37 237 723 HOH HOH F . DA 5 HOH 38 238 318 HOH HOH F . DA 5 HOH 39 239 815 HOH HOH F . DA 5 HOH 40 240 649 HOH HOH F . DA 5 HOH 41 241 592 HOH HOH F . DA 5 HOH 42 242 225 HOH HOH F . DA 5 HOH 43 243 618 HOH HOH F . DA 5 HOH 44 244 345 HOH HOH F . DA 5 HOH 45 245 625 HOH HOH F . DA 5 HOH 46 246 31 HOH HOH F . DA 5 HOH 47 247 386 HOH HOH F . DA 5 HOH 48 248 365 HOH HOH F . DA 5 HOH 49 249 439 HOH HOH F . DA 5 HOH 50 250 501 HOH HOH F . DA 5 HOH 51 251 216 HOH HOH F . DA 5 HOH 52 252 64 HOH HOH F . DA 5 HOH 53 253 220 HOH HOH F . DA 5 HOH 54 254 478 HOH HOH F . DA 5 HOH 55 255 344 HOH HOH F . DA 5 HOH 56 256 312 HOH HOH F . DA 5 HOH 57 257 500 HOH HOH F . DA 5 HOH 58 258 352 HOH HOH F . DA 5 HOH 59 259 233 HOH HOH F . DA 5 HOH 60 260 319 HOH HOH F . DA 5 HOH 61 261 679 HOH HOH F . DA 5 HOH 62 262 284 HOH HOH F . DA 5 HOH 63 263 278 HOH HOH F . DA 5 HOH 64 264 425 HOH HOH F . DA 5 HOH 65 265 761 HOH HOH F . DA 5 HOH 66 266 426 HOH HOH F . DA 5 HOH 67 267 579 HOH HOH F . DA 5 HOH 68 268 550 HOH HOH F . DA 5 HOH 69 269 671 HOH HOH F . DA 5 HOH 70 270 684 HOH HOH F . DA 5 HOH 71 271 548 HOH HOH F . DA 5 HOH 72 272 783 HOH HOH F . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 G NAG ? A NAG 401 ? NAG -D 2 H FUC ? A FUC 402 ? FUC -L 3 I NAG ? A NAG 403 ? NAG -D 4 J NAG ? A NAG 404 ? NAG -D 5 K FUC ? A FUC 405 ? FUC -L 6 L NAG ? A NAG 406 ? NAG -D 7 M NAG ? C NAG 401 ? NAG -D 8 N FUC ? C FUC 402 ? FUC -L 9 O NAG ? C NAG 403 ? NAG -D 10 P NAG ? C NAG 404 ? NAG -D 11 Q FUC ? C FUC 405 ? FUC -L 12 R NAG ? C NAG 406 ? NAG -D 13 S NAG ? E NAG 401 ? NAG -D 14 T FUC ? E FUC 402 ? FUC -L 15 U NAG ? E NAG 403 ? NAG -D 16 V NAG ? E NAG 404 ? NAG -D 17 W FUC ? E FUC 405 ? FUC -L 18 X NAG ? E NAG 406 ? NAG -D # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details hexameric _pdbx_struct_assembly.oligomeric_count 6 # _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,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA,DA # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 33750 ? 1 MORE -95 ? 1 'SSA (A^2)' 61410 ? # _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 2016-04-13 2 'Structure model' 1 1 2016-04-20 3 'Structure model' 1 2 2016-06-08 # _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 ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Database references' # loop_ _pdbx_refine_tls.id _pdbx_refine_tls.pdbx_refine_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[1][1]_esd _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][2]_esd _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[1][3]_esd _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[2][2]_esd _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.T[2][3]_esd _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[3][3]_esd _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[1][1]_esd _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][2]_esd _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[1][3]_esd _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[2][2]_esd _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.L[2][3]_esd _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[3][3]_esd _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][1]_esd _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][2]_esd _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[1][3]_esd _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][1]_esd _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][2]_esd _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][3]_esd _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][1]_esd _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][2]_esd _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[3][3]_esd 1 'X-RAY DIFFRACTION' ? refined -19.8968 31.3088 -48.0075 0.0739 ? -0.0161 ? -0.0113 ? 0.0998 ? 0.0122 ? 0.1088 ? 0.3884 ? -0.0436 ? 0.2052 ? 0.1379 ? 0.1552 ? 0.3956 ? 0.0445 ? 0.0246 ? -0.0014 ? 0.0291 ? 0.0039 ? 0.0176 ? 0.0653 ? 0.0291 ? -0.0483 ? 2 'X-RAY DIFFRACTION' ? refined -28.7299 64.3588 -44.4090 0.0664 ? 0.0247 ? -0.0006 ? 0.0279 ? -0.0107 ? 0.1949 ? 0.4581 ? -0.1036 ? 0.1876 ? 0.0524 ? -0.0344 ? 0.3843 ? -0.0144 ? -0.0598 ? 0.2071 ? -0.0019 ? 0.0182 ? -0.0028 ? -0.0559 ? -0.0626 ? -0.0038 ? 3 'X-RAY DIFFRACTION' ? refined 0.7667 56.1254 -59.9221 0.0610 ? -0.0448 ? 0.0373 ? 0.0981 ? 0.0329 ? 0.1636 ? 0.3487 ? -0.0264 ? 0.0680 ? 0.0353 ? 0.0145 ? 0.4665 ? 0.0315 ? 0.0867 ? 0.1814 ? -0.0333 ? 0.0107 ? -0.0522 ? -0.0530 ? 0.0939 ? -0.0423 ? 4 'X-RAY DIFFRACTION' ? refined 7.4711 40.1455 -2.8537 0.0600 ? 0.0784 ? -0.0365 ? 0.2548 ? -0.0986 ? 0.0611 ? 0.5149 ? -0.0839 ? 0.8454 ? 0.0854 ? -0.2122 ? 1.5816 ? -0.0127 ? -0.0772 ? 0.0472 ? 0.0024 ? 0.0396 ? 0.0199 ? 0.0474 ? 0.0034 ? -0.0269 ? 5 'X-RAY DIFFRACTION' ? refined 1.1960 60.0459 -0.1327 0.0313 ? 0.0538 ? -0.0315 ? 0.2988 ? -0.1774 ? 0.1867 ? 0.4670 ? 0.1426 ? 0.6313 ? 0.2408 ? 0.4882 ? 1.5290 ? 0.0031 ? -0.1769 ? 0.1174 ? 0.0276 ? 0.1288 ? -0.0531 ? 0.0714 ? 0.0805 ? -0.1320 ? 6 'X-RAY DIFFRACTION' ? refined 18.9310 56.5740 -9.5159 0.0301 ? -0.0299 ? 0.0005 ? 0.3306 ? -0.2224 ? 0.2018 ? 0.5507 ? 0.0540 ? 0.3920 ? 0.0329 ? 0.1109 ? 0.7608 ? 0.0212 ? -0.1420 ? 0.1952 ? -0.0216 ? 0.0617 ? -0.0076 ? -0.0227 ? 0.2080 ? -0.0829 ? # loop_ _pdbx_refine_tls_group.id _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 1 'X-RAY DIFFRACTION' 1 ? ? A 0 ? ? A 600 ? ? 2 'X-RAY DIFFRACTION' 2 ? ? C 0 ? ? C 600 ? ? 3 'X-RAY DIFFRACTION' 3 ? ? E 0 ? ? E 600 ? ? 4 'X-RAY DIFFRACTION' 4 ? ? B 12 ? ? B 173 ? ? 5 'X-RAY DIFFRACTION' 5 ? ? D 12 ? ? D 173 ? ? 6 'X-RAY DIFFRACTION' 6 ? ? F 12 ? ? F 173 ? ? # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0049 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 ND2 E ASN 165 ? ? O5 E NAG 403 ? ? 2.16 2 1 O E ASN 166 ? ? O E PRO 235 ? ? 2.16 3 1 O C ASN 166 ? ? O C PRO 235 ? ? 2.16 4 1 O A ASN 166 ? ? O A PRO 235 ? ? 2.17 5 1 O C CYS 67 ? ? N C GLU 69 ? ? 2.18 6 1 O C ASP 68 ? ? N C PHE 70 ? ? 2.18 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 OG E SER 120 ? ? 1_555 OE1 F GLU 165 ? ? 2_564 1.81 2 1 OE2 A GLU 251 ? ? 1_555 OE1 C GLN 138 ? ? 3_444 2.19 # loop_ _pdbx_validate_rmsd_bond.id _pdbx_validate_rmsd_bond.PDB_model_num _pdbx_validate_rmsd_bond.auth_atom_id_1 _pdbx_validate_rmsd_bond.auth_asym_id_1 _pdbx_validate_rmsd_bond.auth_comp_id_1 _pdbx_validate_rmsd_bond.auth_seq_id_1 _pdbx_validate_rmsd_bond.PDB_ins_code_1 _pdbx_validate_rmsd_bond.label_alt_id_1 _pdbx_validate_rmsd_bond.auth_atom_id_2 _pdbx_validate_rmsd_bond.auth_asym_id_2 _pdbx_validate_rmsd_bond.auth_comp_id_2 _pdbx_validate_rmsd_bond.auth_seq_id_2 _pdbx_validate_rmsd_bond.PDB_ins_code_2 _pdbx_validate_rmsd_bond.label_alt_id_2 _pdbx_validate_rmsd_bond.bond_value _pdbx_validate_rmsd_bond.bond_target_value _pdbx_validate_rmsd_bond.bond_deviation _pdbx_validate_rmsd_bond.bond_standard_deviation _pdbx_validate_rmsd_bond.linker_flag 1 1 CB C TRP 60 ? ? CG C TRP 60 ? ? 1.384 1.498 -0.114 0.018 N 2 1 CD B GLU 69 ? ? OE1 B GLU 69 ? ? 1.347 1.252 0.095 0.011 N 3 1 CD F GLU 69 ? ? OE1 F GLU 69 ? ? 1.329 1.252 0.077 0.011 N # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 C A PRO 235 ? ? N A ASN 236 ? ? CA A ASN 236 ? ? 105.41 121.70 -16.29 2.50 Y 2 1 C E PRO 235 ? ? N E ASN 236 ? ? CA E ASN 236 ? ? 106.62 121.70 -15.08 2.50 Y # 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 LYS A 53 ? ? 68.06 -118.17 2 1 ASP A 68 ? ? -59.60 29.02 3 1 PHE A 70 ? ? -61.02 85.33 4 1 ASP A 88 ? ? -137.12 -111.35 5 1 SER A 142 ? ? -148.28 -149.19 6 1 ASN A 154 ? ? 55.39 -129.45 7 1 LYS A 192 ? ? 69.80 -62.55 8 1 THR A 202 ? ? -128.92 -151.04 9 1 GLU A 251 ? ? -126.55 -60.75 10 1 LYS A 258 ? ? -92.85 -72.10 11 1 LYS A 259 ? ? 63.69 -10.19 12 1 SER A 262 ? ? -149.80 -142.77 13 1 LYS A 310 ? ? -174.44 118.34 14 1 LYS C 53 ? ? 67.72 -118.80 15 1 ASP C 68 ? ? -28.35 -23.30 16 1 GLU C 69 ? ? -65.51 19.55 17 1 PHE C 70 ? ? -54.73 76.65 18 1 ASP C 88 ? ? -137.26 -114.91 19 1 SER C 142 ? ? -148.69 -150.89 20 1 ASN C 154 ? ? 56.62 -132.06 21 1 LYS C 192 ? ? 69.48 -62.38 22 1 THR C 202 ? ? -132.35 -152.13 23 1 GLU C 251 ? ? -122.87 -62.64 24 1 LYS C 258 ? ? -92.79 -72.39 25 1 LYS C 259 ? ? 70.69 -119.51 26 1 SER C 262 ? ? -150.56 -142.93 27 1 HIS C 295 ? ? -170.87 142.52 28 1 LYS C 310 ? ? -170.98 117.92 29 1 LYS E 53 ? ? 69.91 -116.79 30 1 ASP E 68 ? ? -71.59 25.70 31 1 PHE E 70 ? ? -69.70 72.26 32 1 ASP E 88 ? ? -137.74 -114.02 33 1 SER E 142 ? ? -148.49 -150.86 34 1 ASN E 154 ? ? 56.72 -130.40 35 1 LYS E 192 ? ? 69.08 -60.98 36 1 THR E 202 ? ? -130.81 -152.92 37 1 GLU E 251 ? ? -126.46 -62.55 38 1 LYS E 258 ? ? -93.81 -71.62 39 1 LYS E 259 ? ? 72.14 -50.93 40 1 SER E 262 ? ? -151.13 -143.94 41 1 HIS E 295 ? ? -171.66 145.97 42 1 LYS E 310 ? ? -171.52 120.35 43 1 ARG B 127 ? ? 44.10 -122.27 44 1 TYR B 157 ? ? -38.41 127.44 45 1 GLN B 161 ? ? -36.93 -38.25 46 1 ARG D 127 ? ? 51.70 -128.48 47 1 GLN D 161 ? ? -34.82 -36.68 48 1 ARG D 170 ? ? -72.20 -72.90 49 1 GLU D 171 ? ? -68.08 17.13 50 1 ARG F 127 ? ? 49.12 -126.98 51 1 GLN F 161 ? ? -35.11 -36.11 # loop_ _pdbx_validate_peptide_omega.id _pdbx_validate_peptide_omega.PDB_model_num _pdbx_validate_peptide_omega.auth_comp_id_1 _pdbx_validate_peptide_omega.auth_asym_id_1 _pdbx_validate_peptide_omega.auth_seq_id_1 _pdbx_validate_peptide_omega.PDB_ins_code_1 _pdbx_validate_peptide_omega.label_alt_id_1 _pdbx_validate_peptide_omega.auth_comp_id_2 _pdbx_validate_peptide_omega.auth_asym_id_2 _pdbx_validate_peptide_omega.auth_seq_id_2 _pdbx_validate_peptide_omega.PDB_ins_code_2 _pdbx_validate_peptide_omega.label_alt_id_2 _pdbx_validate_peptide_omega.omega 1 1 ARG A 72 ? ? VAL A 73 ? ? 148.30 2 1 ASP C 68 ? ? GLU C 69 ? ? -134.65 3 1 ARG C 72 ? ? VAL C 73 ? ? 141.22 4 1 ASN C 309 ? ? LYS C 310 ? ? -149.15 # loop_ _pdbx_distant_solvent_atoms.id _pdbx_distant_solvent_atoms.PDB_model_num _pdbx_distant_solvent_atoms.auth_atom_id _pdbx_distant_solvent_atoms.label_alt_id _pdbx_distant_solvent_atoms.auth_asym_id _pdbx_distant_solvent_atoms.auth_comp_id _pdbx_distant_solvent_atoms.auth_seq_id _pdbx_distant_solvent_atoms.PDB_ins_code _pdbx_distant_solvent_atoms.neighbor_macromolecule_distance _pdbx_distant_solvent_atoms.neighbor_ligand_distance 1 1 O ? F HOH 270 ? 6.03 . 2 1 O ? F HOH 271 ? 6.14 . 3 1 O ? F HOH 272 ? 7.20 . # 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 1 A VAL 73 ? CG1 ? A VAL 78 CG1 2 1 Y 1 A VAL 73 ? CG2 ? A VAL 78 CG2 3 1 Y 1 C VAL 73 ? CG1 ? B VAL 78 CG1 4 1 Y 1 C VAL 73 ? CG2 ? B VAL 78 CG2 5 1 Y 1 E VAL 73 ? CG1 ? C VAL 78 CG1 6 1 Y 1 E VAL 73 ? CG2 ? C VAL 78 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 A ALA -4 ? A ALA 1 2 1 Y 1 A ASP -3 ? A ASP 2 3 1 Y 1 A LEU -2 ? A LEU 3 4 1 Y 1 A GLY -1 ? A GLY 4 5 1 Y 1 A SER 320 ? A SER 325 6 1 Y 1 A PRO 321 ? A PRO 326 7 1 Y 1 A LEU 322 ? A LEU 327 8 1 Y 1 A ARG 323 ? A ARG 328 9 1 Y 1 A GLU 324 ? A GLU 329 10 1 Y 1 A LYS 325 ? A LYS 330 11 1 Y 1 A ARG 326 ? A ARG 331 12 1 Y 1 A ARG 327 ? A ARG 332 13 1 Y 1 A LYS 328 ? A LYS 333 14 1 Y 1 A ARG 329 ? A ARG 334 15 1 Y 1 C ALA -4 ? B ALA 1 16 1 Y 1 C ASP -3 ? B ASP 2 17 1 Y 1 C LEU -2 ? B LEU 3 18 1 Y 1 C GLY -1 ? B GLY 4 19 1 Y 1 C SER 320 ? B SER 325 20 1 Y 1 C PRO 321 ? B PRO 326 21 1 Y 1 C LEU 322 ? B LEU 327 22 1 Y 1 C ARG 323 ? B ARG 328 23 1 Y 1 C GLU 324 ? B GLU 329 24 1 Y 1 C LYS 325 ? B LYS 330 25 1 Y 1 C ARG 326 ? B ARG 331 26 1 Y 1 C ARG 327 ? B ARG 332 27 1 Y 1 C LYS 328 ? B LYS 333 28 1 Y 1 C ARG 329 ? B ARG 334 29 1 Y 1 E ALA -4 ? C ALA 1 30 1 Y 1 E ASP -3 ? C ASP 2 31 1 Y 1 E LEU -2 ? C LEU 3 32 1 Y 1 E GLY -1 ? C GLY 4 33 1 Y 1 E SER 320 ? C SER 325 34 1 Y 1 E PRO 321 ? C PRO 326 35 1 Y 1 E LEU 322 ? C LEU 327 36 1 Y 1 E ARG 323 ? C ARG 328 37 1 Y 1 E GLU 324 ? C GLU 329 38 1 Y 1 E LYS 325 ? C LYS 330 39 1 Y 1 E ARG 326 ? C ARG 331 40 1 Y 1 E ARG 327 ? C ARG 332 41 1 Y 1 E LYS 328 ? C LYS 333 42 1 Y 1 E ARG 329 ? C ARG 334 43 1 Y 1 B GLY 1 ? D GLY 1 44 1 Y 1 B LEU 2 ? D LEU 2 45 1 Y 1 B PHE 3 ? D PHE 3 46 1 Y 1 B GLY 4 ? D GLY 4 47 1 Y 1 B ALA 5 ? D ALA 5 48 1 Y 1 B ILE 6 ? D ILE 6 49 1 Y 1 B ALA 7 ? D ALA 7 50 1 Y 1 B GLY 8 ? D GLY 8 51 1 Y 1 B PHE 9 ? D PHE 9 52 1 Y 1 B ILE 10 ? D ILE 10 53 1 Y 1 B GLU 11 ? D GLU 11 54 1 Y 1 B SER 174 ? D SER 174 55 1 Y 1 B SER 175 ? D SER 175 56 1 Y 1 B GLY 176 ? D GLY 176 57 1 Y 1 B ARG 177 ? D ARG 177 58 1 Y 1 B LEU 178 ? D LEU 178 59 1 Y 1 B VAL 179 ? D VAL 179 60 1 Y 1 B PRO 180 ? D PRO 180 61 1 Y 1 B ARG 181 ? D ARG 181 62 1 Y 1 D GLY 1 ? E GLY 1 63 1 Y 1 D LEU 2 ? E LEU 2 64 1 Y 1 D PHE 3 ? E PHE 3 65 1 Y 1 D GLY 4 ? E GLY 4 66 1 Y 1 D ALA 5 ? E ALA 5 67 1 Y 1 D ILE 6 ? E ILE 6 68 1 Y 1 D ALA 7 ? E ALA 7 69 1 Y 1 D GLY 8 ? E GLY 8 70 1 Y 1 D PHE 9 ? E PHE 9 71 1 Y 1 D ILE 10 ? E ILE 10 72 1 Y 1 D GLU 11 ? E GLU 11 73 1 Y 1 D SER 174 ? E SER 174 74 1 Y 1 D SER 175 ? E SER 175 75 1 Y 1 D GLY 176 ? E GLY 176 76 1 Y 1 D ARG 177 ? E ARG 177 77 1 Y 1 D LEU 178 ? E LEU 178 78 1 Y 1 D VAL 179 ? E VAL 179 79 1 Y 1 D PRO 180 ? E PRO 180 80 1 Y 1 D ARG 181 ? E ARG 181 81 1 Y 1 F GLY 1 ? F GLY 1 82 1 Y 1 F LEU 2 ? F LEU 2 83 1 Y 1 F PHE 3 ? F PHE 3 84 1 Y 1 F GLY 4 ? F GLY 4 85 1 Y 1 F ALA 5 ? F ALA 5 86 1 Y 1 F ILE 6 ? F ILE 6 87 1 Y 1 F ALA 7 ? F ALA 7 88 1 Y 1 F GLY 8 ? F GLY 8 89 1 Y 1 F PHE 9 ? F PHE 9 90 1 Y 1 F ILE 10 ? F ILE 10 91 1 Y 1 F GLU 11 ? F GLU 11 92 1 Y 1 F SER 174 ? F SER 174 93 1 Y 1 F SER 175 ? F SER 175 94 1 Y 1 F GLY 176 ? F GLY 176 95 1 Y 1 F ARG 177 ? F ARG 177 96 1 Y 1 F LEU 178 ? F LEU 178 97 1 Y 1 F VAL 179 ? F VAL 179 98 1 Y 1 F PRO 180 ? F PRO 180 99 1 Y 1 F ARG 181 ? F ARG 181 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 N-ACETYL-D-GLUCOSAMINE NAG 4 ALPHA-L-FUCOSE FUC 5 water HOH #